Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:55:59 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: ./NiSn.save/ file Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D renormalized file Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 28 21 6 908 599 96 Max 29 22 7 912 621 101 Sum 1015 769 235 32731 22063 3557 bravais-lattice index = 14 lattice parameter (alat) = 7.6496 a.u. unit-cell volume = 490.6056 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 250.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.649611 celldm(2)= 1.000000 celldm(3)= 1.265563 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500000 0.866025 0.000000 ) a(3) = ( 0.000000 0.000000 1.265563 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 0.790162 ) PseudoPot. # 1 for Sn read from file: /users/gautes/Pseudo/Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 9499e19b89e678f7f9f46ad7de03aa82 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ni read from file: /users/gautes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Sn 14.00 118.71000 Sn( 1.00) Ni 10.00 58.69340 Ni( 1.00) 24 Sym. Ops., with inversion, found (12 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 =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.6327816 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6327816 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 60 deg rotation - cryst. axis [0,0,1] cryst. s( 5) = ( 1 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 5) = ( 0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.6327816 ) isym = 6 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 6) = ( 0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.6327816 ) isym = 7 120 deg rotation - cryst. axis [0,0,1] cryst. s( 7) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 8) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 9) = ( 0 -1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 9) = ( 0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6327816 ) isym = 10 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( 1 1 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(10) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6327816 ) isym = 11 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(11) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 12 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(12) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) 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 =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(14) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6327816 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(15) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.6327816 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s(16) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 17 inv. 60 deg rotation - cryst. axis [0,0,1] cryst. s(17) = ( -1 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(17) = ( -0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6327816 ) isym = 18 inv. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(18) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(18) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6327816 ) isym = 19 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s(19) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s(19) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 20 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(20) = ( 1 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(20) = ( 0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 21 inv. 180 deg rotation - cryst. axis [1,-1,0] cryst. s(21) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(21) = ( -0.5000000 0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.6327816 ) isym = 22 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(22) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(22) = ( -0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.6327816 ) isym = 23 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(23) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(23) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 24 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(24) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(24) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_6h(6/mmm) there are 18 classes and 6 irreducible representations the character table: E -E 2C6 -2C6 2C3 -2C3 C2 3C2' 3C2'' i -i 2S3 -C2 -3C2' -3C2' G_7+ 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 1.73 G_8+ 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 -1.73 G_9+ 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 2.00 -2.00 0.00 G_7- 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 -1.73 G_8- 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 1.73 G_9- 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 -2.00 2.00 0.00 -2S3 2S6 -2S6 s_h 3s_v 3s_d -s_h -3s_v -3s_d G_7+ -1.73 1.00 -1.00 0.00 0.00 0.00 G_8+ 1.73 1.00 -1.00 0.00 0.00 0.00 G_9+ 0.00 -2.00 2.00 0.00 0.00 0.00 G_7- 1.73 -1.00 1.00 0.00 0.00 0.00 G_8- -1.73 -1.00 1.00 0.00 0.00 0.00 G_9- 0.00 2.00 -2.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C6 5 6 60 deg rotation - cryst. axis [0,0,1] -2C6 -5 -6 60 deg rotation - cryst. axis [0,0,1] E 2C3 7 8 120 deg rotation - cryst. axis [0,0,1] -2C3 -7 -8 120 deg rotation - cryst. axis [0,0,1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 3C2'-3C2' 4 -4 12 -11 11 -12 180 deg rotation - cart. axis [1,0,0] 3C2''-3C2' 3 -3 9 10 -10 -9 180 deg rotation - cart. axis [0,1,0] i 13 inversion -i -13 inversion E 2S3 17 18 inv. 60 deg rotation - cryst. axis [0,0,1] -2S3 -17 -18 inv. 60 deg rotation - cryst. axis [0,0,1] E 2S6 19 20 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -19 -20 inv. 120 deg rotation - cryst. axis [0,0,1] E s_h -s_h 14 -14 inv. 180 deg rotation - cart. axis [0,0,1] 3s_v-3s_v 16 -16 24 -23 23 -24 inv. 180 deg rotation - cart. axis [1,0,0] 3s_d-3s_d 15 -15 21 22 -22 -21 inv. 180 deg rotation - cart. axis [0,1,0] Cartesian axes number of k points= 348 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028736 k( 2) = ( 0.0111111 0.0064150 -0.0000000), wk = 0.0028736 k( 3) = ( 0.0222222 0.0128300 -0.0000000), wk = 0.0028736 k( 4) = ( 0.0333333 0.0192450 -0.0000000), wk = 0.0028736 k( 5) = ( 0.0444444 0.0256600 -0.0000000), wk = 0.0028736 k( 6) = ( 0.0555556 0.0320750 -0.0000000), wk = 0.0028736 k( 7) = ( 0.0666667 0.0384900 -0.0000000), wk = 0.0028736 k( 8) = ( 0.0777778 0.0449050 -0.0000000), wk = 0.0028736 k( 9) = ( 0.0888889 0.0513200 -0.0000000), wk = 0.0028736 k( 10) = ( 0.1000000 0.0577350 -0.0000000), wk = 0.0028736 k( 11) = ( 0.1111111 0.0641500 -0.0000000), wk = 0.0028736 k( 12) = ( 0.1222222 0.0705650 -0.0000000), wk = 0.0028736 k( 13) = ( 0.1333333 0.0769800 -0.0000000), wk = 0.0028736 k( 14) = ( 0.1444444 0.0833950 -0.0000000), wk = 0.0028736 k( 15) = ( 0.1555556 0.0898100 -0.0000000), wk = 0.0028736 k( 16) = ( 0.1666667 0.0962250 -0.0000000), wk = 0.0028736 k( 17) = ( 0.1777778 0.1026400 -0.0000000), wk = 0.0028736 k( 18) = ( 0.1888889 0.1090551 -0.0000000), wk = 0.0028736 k( 19) = ( 0.2000000 0.1154701 -0.0000000), wk = 0.0028736 k( 20) = ( 0.2111111 0.1218851 -0.0000000), wk = 0.0028736 k( 21) = ( 0.2222222 0.1283001 -0.0000000), wk = 0.0028736 k( 22) = ( 0.2333333 0.1347151 -0.0000000), wk = 0.0028736 k( 23) = ( 0.2444444 0.1411301 -0.0000000), wk = 0.0028736 k( 24) = ( 0.2555556 0.1475451 -0.0000000), wk = 0.0028736 k( 25) = ( 0.2666667 0.1539601 -0.0000000), wk = 0.0028736 k( 26) = ( 0.2777778 0.1603751 -0.0000000), wk = 0.0028736 k( 27) = ( 0.2888889 0.1667901 -0.0000000), wk = 0.0028736 k( 28) = ( 0.3000000 0.1732051 -0.0000000), wk = 0.0028736 k( 29) = ( 0.3111111 0.1796201 -0.0000000), wk = 0.0028736 k( 30) = ( 0.3222222 0.1860351 -0.0000000), wk = 0.0028736 k( 31) = ( 0.3333333 0.1924501 -0.0000000), wk = 0.0028736 k( 32) = ( 0.3444444 0.1988651 -0.0000000), wk = 0.0028736 k( 33) = ( 0.3555556 0.2052801 -0.0000000), wk = 0.0028736 k( 34) = ( 0.3666667 0.2116951 -0.0000000), wk = 0.0028736 k( 35) = ( 0.3777778 0.2181101 -0.0000000), wk = 0.0028736 k( 36) = ( 0.3888889 0.2245251 -0.0000000), wk = 0.0028736 k( 37) = ( 0.4000000 0.2309401 -0.0000000), wk = 0.0028736 k( 38) = ( 0.4111111 0.2373551 -0.0000000), wk = 0.0028736 k( 39) = ( 0.4222222 0.2437701 -0.0000000), wk = 0.0028736 k( 40) = ( 0.4333333 0.2501851 -0.0000000), wk = 0.0028736 k( 41) = ( 0.4444444 0.2566001 -0.0000000), wk = 0.0028736 k( 42) = ( 0.4555556 0.2630151 -0.0000000), wk = 0.0028736 k( 43) = ( 0.4666667 0.2694301 -0.0000000), wk = 0.0028736 k( 44) = ( 0.4777778 0.2758451 -0.0000000), wk = 0.0028736 k( 45) = ( 0.4888889 0.2822601 -0.0000000), wk = 0.0028736 k( 46) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0028736 k( 47) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0028736 k( 48) = ( 0.4935897 0.2997780 -0.0000000), wk = 0.0028736 k( 49) = ( 0.4871795 0.3108809 -0.0000000), wk = 0.0028736 k( 50) = ( 0.4807692 0.3219838 -0.0000000), wk = 0.0028736 k( 51) = ( 0.4743590 0.3330867 -0.0000000), wk = 0.0028736 k( 52) = ( 0.4679487 0.3441896 -0.0000000), wk = 0.0028736 k( 53) = ( 0.4615385 0.3552925 -0.0000000), wk = 0.0028736 k( 54) = ( 0.4551282 0.3663954 -0.0000000), wk = 0.0028736 k( 55) = ( 0.4487179 0.3774983 -0.0000000), wk = 0.0028736 k( 56) = ( 0.4423077 0.3886011 -0.0000000), wk = 0.0028736 k( 57) = ( 0.4358974 0.3997040 -0.0000000), wk = 0.0028736 k( 58) = ( 0.4294872 0.4108069 -0.0000000), wk = 0.0028736 k( 59) = ( 0.4230769 0.4219098 -0.0000000), wk = 0.0028736 k( 60) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0028736 k( 61) = ( 0.4102564 0.4441156 -0.0000000), wk = 0.0028736 k( 62) = ( 0.4038462 0.4552185 -0.0000000), wk = 0.0028736 k( 63) = ( 0.3974359 0.4663214 -0.0000000), wk = 0.0028736 k( 64) = ( 0.3910256 0.4774243 -0.0000000), wk = 0.0028736 k( 65) = ( 0.3846154 0.4885271 -0.0000000), wk = 0.0028736 k( 66) = ( 0.3782051 0.4996300 -0.0000000), wk = 0.0028736 k( 67) = ( 0.3717949 0.5107329 -0.0000000), wk = 0.0028736 k( 68) = ( 0.3653846 0.5218358 -0.0000000), wk = 0.0028736 k( 69) = ( 0.3589744 0.5329387 -0.0000000), wk = 0.0028736 k( 70) = ( 0.3525641 0.5440416 -0.0000000), wk = 0.0028736 k( 71) = ( 0.3461538 0.5551445 -0.0000000), wk = 0.0028736 k( 72) = ( 0.3397436 0.5662474 -0.0000000), wk = 0.0028736 k( 73) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0028736 k( 74) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0028736 k( 75) = ( 0.3269231 0.5662474 -0.0000000), wk = 0.0028736 k( 76) = ( 0.3205128 0.5551445 -0.0000000), wk = 0.0028736 k( 77) = ( 0.3141026 0.5440416 -0.0000000), wk = 0.0028736 k( 78) = ( 0.3076923 0.5329387 -0.0000000), wk = 0.0028736 k( 79) = ( 0.3012821 0.5218358 -0.0000000), wk = 0.0028736 k( 80) = ( 0.2948718 0.5107329 -0.0000000), wk = 0.0028736 k( 81) = ( 0.2884615 0.4996300 -0.0000000), wk = 0.0028736 k( 82) = ( 0.2820513 0.4885271 -0.0000000), wk = 0.0028736 k( 83) = ( 0.2756410 0.4774243 -0.0000000), wk = 0.0028736 k( 84) = ( 0.2692308 0.4663214 -0.0000000), wk = 0.0028736 k( 85) = ( 0.2628205 0.4552185 -0.0000000), wk = 0.0028736 k( 86) = ( 0.2564103 0.4441156 -0.0000000), wk = 0.0028736 k( 87) = ( 0.2500000 0.4330127 -0.0000000), wk = 0.0028736 k( 88) = ( 0.2435897 0.4219098 -0.0000000), wk = 0.0028736 k( 89) = ( 0.2371795 0.4108069 -0.0000000), wk = 0.0028736 k( 90) = ( 0.2307692 0.3997040 -0.0000000), wk = 0.0028736 k( 91) = ( 0.2243590 0.3886011 -0.0000000), wk = 0.0028736 k( 92) = ( 0.2179487 0.3774983 -0.0000000), wk = 0.0028736 k( 93) = ( 0.2115385 0.3663954 -0.0000000), wk = 0.0028736 k( 94) = ( 0.2051282 0.3552925 -0.0000000), wk = 0.0028736 k( 95) = ( 0.1987180 0.3441896 -0.0000000), wk = 0.0028736 k( 96) = ( 0.1923077 0.3330867 -0.0000000), wk = 0.0028736 k( 97) = ( 0.1858974 0.3219838 -0.0000000), wk = 0.0028736 k( 98) = ( 0.1794872 0.3108809 -0.0000000), wk = 0.0028736 k( 99) = ( 0.1730769 0.2997780 -0.0000000), wk = 0.0028736 k( 100) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0028736 k( 101) = ( 0.1602564 0.2775722 -0.0000000), wk = 0.0028736 k( 102) = ( 0.1538461 0.2664693 -0.0000000), wk = 0.0028736 k( 103) = ( 0.1474359 0.2553665 -0.0000000), wk = 0.0028736 k( 104) = ( 0.1410256 0.2442636 -0.0000000), wk = 0.0028736 k( 105) = ( 0.1346154 0.2331607 -0.0000000), wk = 0.0028736 k( 106) = ( 0.1282051 0.2220578 -0.0000000), wk = 0.0028736 k( 107) = ( 0.1217949 0.2109549 -0.0000000), wk = 0.0028736 k( 108) = ( 0.1153846 0.1998520 -0.0000000), wk = 0.0028736 k( 109) = ( 0.1089744 0.1887491 -0.0000000), wk = 0.0028736 k( 110) = ( 0.1025641 0.1776462 -0.0000000), wk = 0.0028736 k( 111) = ( 0.0961538 0.1665434 -0.0000000), wk = 0.0028736 k( 112) = ( 0.0897436 0.1554405 -0.0000000), wk = 0.0028736 k( 113) = ( 0.0833333 0.1443376 -0.0000000), wk = 0.0028736 k( 114) = ( 0.0769231 0.1332347 -0.0000000), wk = 0.0028736 k( 115) = ( 0.0705128 0.1221318 -0.0000000), wk = 0.0028736 k( 116) = ( 0.0641026 0.1110289 -0.0000000), wk = 0.0028736 k( 117) = ( 0.0576923 0.0999260 -0.0000000), wk = 0.0028736 k( 118) = ( 0.0512821 0.0888231 -0.0000000), wk = 0.0028736 k( 119) = ( 0.0448718 0.0777202 -0.0000000), wk = 0.0028736 k( 120) = ( 0.0384615 0.0666173 -0.0000000), wk = 0.0028736 k( 121) = ( 0.0320513 0.0555144 -0.0000000), wk = 0.0028736 k( 122) = ( 0.0256410 0.0444116 -0.0000000), wk = 0.0028736 k( 123) = ( 0.0192308 0.0333087 -0.0000000), wk = 0.0028736 k( 124) = ( 0.0128205 0.0222058 -0.0000000), wk = 0.0028736 k( 125) = ( 0.0064103 0.0111029 -0.0000000), wk = 0.0028736 k( 126) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028736 k( 127) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028736 k( 128) = ( 0.0000000 0.0000000 0.0127445), wk = 0.0028736 k( 129) = ( 0.0000000 0.0000000 0.0254891), wk = 0.0028736 k( 130) = ( 0.0000000 0.0000000 0.0382336), wk = 0.0028736 k( 131) = ( 0.0000000 0.0000000 0.0509782), wk = 0.0028736 k( 132) = ( 0.0000000 0.0000000 0.0637227), wk = 0.0028736 k( 133) = ( 0.0000000 0.0000000 0.0764673), wk = 0.0028736 k( 134) = ( 0.0000000 0.0000000 0.0892118), wk = 0.0028736 k( 135) = ( 0.0000000 0.0000000 0.1019564), wk = 0.0028736 k( 136) = ( 0.0000000 0.0000000 0.1147009), wk = 0.0028736 k( 137) = ( 0.0000000 0.0000000 0.1274455), wk = 0.0028736 k( 138) = ( 0.0000000 0.0000000 0.1401900), wk = 0.0028736 k( 139) = ( 0.0000000 0.0000000 0.1529346), wk = 0.0028736 k( 140) = ( 0.0000000 0.0000000 0.1656791), wk = 0.0028736 k( 141) = ( 0.0000000 0.0000000 0.1784237), wk = 0.0028736 k( 142) = ( 0.0000000 0.0000000 0.1911682), wk = 0.0028736 k( 143) = ( 0.0000000 0.0000000 0.2039128), wk = 0.0028736 k( 144) = ( 0.0000000 0.0000000 0.2166573), wk = 0.0028736 k( 145) = ( 0.0000000 0.0000000 0.2294019), wk = 0.0028736 k( 146) = ( 0.0000000 0.0000000 0.2421464), wk = 0.0028736 k( 147) = ( 0.0000000 0.0000000 0.2548910), wk = 0.0028736 k( 148) = ( 0.0000000 0.0000000 0.2676355), wk = 0.0028736 k( 149) = ( 0.0000000 0.0000000 0.2803801), wk = 0.0028736 k( 150) = ( 0.0000000 0.0000000 0.2931246), wk = 0.0028736 k( 151) = ( 0.0000000 0.0000000 0.3058692), wk = 0.0028736 k( 152) = ( 0.0000000 0.0000000 0.3186137), wk = 0.0028736 k( 153) = ( 0.0000000 0.0000000 0.3313583), wk = 0.0028736 k( 154) = ( 0.0000000 0.0000000 0.3441028), wk = 0.0028736 k( 155) = ( 0.0000000 0.0000000 0.3568474), wk = 0.0028736 k( 156) = ( 0.0000000 0.0000000 0.3695919), wk = 0.0028736 k( 157) = ( 0.0000000 0.0000000 0.3823365), wk = 0.0028736 k( 158) = ( 0.0000000 0.0000000 0.3950810), wk = 0.0028736 k( 159) = ( 0.0000000 0.0000000 0.3950810), wk = 0.0028736 k( 160) = ( 0.0111111 0.0064150 0.3950810), wk = 0.0028736 k( 161) = ( 0.0222222 0.0128300 0.3950810), wk = 0.0028736 k( 162) = ( 0.0333333 0.0192450 0.3950810), wk = 0.0028736 k( 163) = ( 0.0444444 0.0256600 0.3950810), wk = 0.0028736 k( 164) = ( 0.0555556 0.0320750 0.3950810), wk = 0.0028736 k( 165) = ( 0.0666667 0.0384900 0.3950810), wk = 0.0028736 k( 166) = ( 0.0777778 0.0449050 0.3950810), wk = 0.0028736 k( 167) = ( 0.0888889 0.0513200 0.3950810), wk = 0.0028736 k( 168) = ( 0.1000000 0.0577350 0.3950810), wk = 0.0028736 k( 169) = ( 0.1111111 0.0641500 0.3950810), wk = 0.0028736 k( 170) = ( 0.1222222 0.0705650 0.3950810), wk = 0.0028736 k( 171) = ( 0.1333333 0.0769800 0.3950810), wk = 0.0028736 k( 172) = ( 0.1444444 0.0833950 0.3950810), wk = 0.0028736 k( 173) = ( 0.1555556 0.0898100 0.3950810), wk = 0.0028736 k( 174) = ( 0.1666667 0.0962250 0.3950810), wk = 0.0028736 k( 175) = ( 0.1777778 0.1026400 0.3950810), wk = 0.0028736 k( 176) = ( 0.1888889 0.1090551 0.3950810), wk = 0.0028736 k( 177) = ( 0.2000000 0.1154701 0.3950810), wk = 0.0028736 k( 178) = ( 0.2111111 0.1218851 0.3950810), wk = 0.0028736 k( 179) = ( 0.2222222 0.1283001 0.3950810), wk = 0.0028736 k( 180) = ( 0.2333333 0.1347151 0.3950810), wk = 0.0028736 k( 181) = ( 0.2444444 0.1411301 0.3950810), wk = 0.0028736 k( 182) = ( 0.2555556 0.1475451 0.3950810), wk = 0.0028736 k( 183) = ( 0.2666667 0.1539601 0.3950810), wk = 0.0028736 k( 184) = ( 0.2777778 0.1603751 0.3950810), wk = 0.0028736 k( 185) = ( 0.2888889 0.1667901 0.3950810), wk = 0.0028736 k( 186) = ( 0.3000000 0.1732051 0.3950810), wk = 0.0028736 k( 187) = ( 0.3111111 0.1796201 0.3950810), wk = 0.0028736 k( 188) = ( 0.3222222 0.1860351 0.3950810), wk = 0.0028736 k( 189) = ( 0.3333333 0.1924501 0.3950810), wk = 0.0028736 k( 190) = ( 0.3444444 0.1988651 0.3950810), wk = 0.0028736 k( 191) = ( 0.3555556 0.2052801 0.3950810), wk = 0.0028736 k( 192) = ( 0.3666667 0.2116951 0.3950810), wk = 0.0028736 k( 193) = ( 0.3777778 0.2181101 0.3950810), wk = 0.0028736 k( 194) = ( 0.3888889 0.2245251 0.3950810), wk = 0.0028736 k( 195) = ( 0.4000000 0.2309401 0.3950810), wk = 0.0028736 k( 196) = ( 0.4111111 0.2373551 0.3950810), wk = 0.0028736 k( 197) = ( 0.4222222 0.2437701 0.3950810), wk = 0.0028736 k( 198) = ( 0.4333333 0.2501851 0.3950810), wk = 0.0028736 k( 199) = ( 0.4444444 0.2566001 0.3950810), wk = 0.0028736 k( 200) = ( 0.4555556 0.2630151 0.3950810), wk = 0.0028736 k( 201) = ( 0.4666667 0.2694301 0.3950810), wk = 0.0028736 k( 202) = ( 0.4777778 0.2758451 0.3950810), wk = 0.0028736 k( 203) = ( 0.4888889 0.2822601 0.3950810), wk = 0.0028736 k( 204) = ( 0.5000000 0.2886751 0.3950810), wk = 0.0028736 k( 205) = ( 0.5000000 0.2886751 0.3950810), wk = 0.0028736 k( 206) = ( 0.4935897 0.2997780 0.3950810), wk = 0.0028736 k( 207) = ( 0.4871795 0.3108809 0.3950810), wk = 0.0028736 k( 208) = ( 0.4807692 0.3219838 0.3950810), wk = 0.0028736 k( 209) = ( 0.4743590 0.3330867 0.3950810), wk = 0.0028736 k( 210) = ( 0.4679487 0.3441896 0.3950810), wk = 0.0028736 k( 211) = ( 0.4615385 0.3552925 0.3950810), wk = 0.0028736 k( 212) = ( 0.4551282 0.3663954 0.3950810), wk = 0.0028736 k( 213) = ( 0.4487179 0.3774983 0.3950810), wk = 0.0028736 k( 214) = ( 0.4423077 0.3886011 0.3950810), wk = 0.0028736 k( 215) = ( 0.4358974 0.3997040 0.3950810), wk = 0.0028736 k( 216) = ( 0.4294872 0.4108069 0.3950810), wk = 0.0028736 k( 217) = ( 0.4230769 0.4219098 0.3950810), wk = 0.0028736 k( 218) = ( 0.4166667 0.4330127 0.3950810), wk = 0.0028736 k( 219) = ( 0.4102564 0.4441156 0.3950810), wk = 0.0028736 k( 220) = ( 0.4038462 0.4552185 0.3950810), wk = 0.0028736 k( 221) = ( 0.3974359 0.4663214 0.3950810), wk = 0.0028736 k( 222) = ( 0.3910256 0.4774243 0.3950810), wk = 0.0028736 k( 223) = ( 0.3846154 0.4885271 0.3950810), wk = 0.0028736 k( 224) = ( 0.3782051 0.4996300 0.3950810), wk = 0.0028736 k( 225) = ( 0.3717949 0.5107329 0.3950810), wk = 0.0028736 k( 226) = ( 0.3653846 0.5218358 0.3950810), wk = 0.0028736 k( 227) = ( 0.3589744 0.5329387 0.3950810), wk = 0.0028736 k( 228) = ( 0.3525641 0.5440416 0.3950810), wk = 0.0028736 k( 229) = ( 0.3461538 0.5551445 0.3950810), wk = 0.0028736 k( 230) = ( 0.3397436 0.5662474 0.3950810), wk = 0.0028736 k( 231) = ( 0.3333333 0.5773503 0.3950810), wk = 0.0028736 k( 232) = ( 0.3333333 0.5773503 0.3950810), wk = 0.0028736 k( 233) = ( 0.3269231 0.5662474 0.3950810), wk = 0.0028736 k( 234) = ( 0.3205128 0.5551445 0.3950810), wk = 0.0028736 k( 235) = ( 0.3141026 0.5440416 0.3950810), wk = 0.0028736 k( 236) = ( 0.3076923 0.5329387 0.3950810), wk = 0.0028736 k( 237) = ( 0.3012821 0.5218358 0.3950810), wk = 0.0028736 k( 238) = ( 0.2948718 0.5107329 0.3950810), wk = 0.0028736 k( 239) = ( 0.2884615 0.4996300 0.3950810), wk = 0.0028736 k( 240) = ( 0.2820513 0.4885271 0.3950810), wk = 0.0028736 k( 241) = ( 0.2756410 0.4774243 0.3950810), wk = 0.0028736 k( 242) = ( 0.2692308 0.4663214 0.3950810), wk = 0.0028736 k( 243) = ( 0.2628205 0.4552185 0.3950810), wk = 0.0028736 k( 244) = ( 0.2564103 0.4441156 0.3950810), wk = 0.0028736 k( 245) = ( 0.2500000 0.4330127 0.3950810), wk = 0.0028736 k( 246) = ( 0.2435897 0.4219098 0.3950810), wk = 0.0028736 k( 247) = ( 0.2371795 0.4108069 0.3950810), wk = 0.0028736 k( 248) = ( 0.2307692 0.3997040 0.3950810), wk = 0.0028736 k( 249) = ( 0.2243590 0.3886011 0.3950810), wk = 0.0028736 k( 250) = ( 0.2179487 0.3774983 0.3950810), wk = 0.0028736 k( 251) = ( 0.2115385 0.3663954 0.3950810), wk = 0.0028736 k( 252) = ( 0.2051282 0.3552925 0.3950810), wk = 0.0028736 k( 253) = ( 0.1987180 0.3441896 0.3950810), wk = 0.0028736 k( 254) = ( 0.1923077 0.3330867 0.3950810), wk = 0.0028736 k( 255) = ( 0.1858974 0.3219838 0.3950810), wk = 0.0028736 k( 256) = ( 0.1794872 0.3108809 0.3950810), wk = 0.0028736 k( 257) = ( 0.1730769 0.2997780 0.3950810), wk = 0.0028736 k( 258) = ( 0.1666667 0.2886751 0.3950810), wk = 0.0028736 k( 259) = ( 0.1602564 0.2775722 0.3950810), wk = 0.0028736 k( 260) = ( 0.1538461 0.2664693 0.3950810), wk = 0.0028736 k( 261) = ( 0.1474359 0.2553665 0.3950810), wk = 0.0028736 k( 262) = ( 0.1410256 0.2442636 0.3950810), wk = 0.0028736 k( 263) = ( 0.1346154 0.2331607 0.3950810), wk = 0.0028736 k( 264) = ( 0.1282051 0.2220578 0.3950810), wk = 0.0028736 k( 265) = ( 0.1217949 0.2109549 0.3950810), wk = 0.0028736 k( 266) = ( 0.1153846 0.1998520 0.3950810), wk = 0.0028736 k( 267) = ( 0.1089744 0.1887491 0.3950810), wk = 0.0028736 k( 268) = ( 0.1025641 0.1776462 0.3950810), wk = 0.0028736 k( 269) = ( 0.0961538 0.1665434 0.3950810), wk = 0.0028736 k( 270) = ( 0.0897436 0.1554405 0.3950810), wk = 0.0028736 k( 271) = ( 0.0833333 0.1443376 0.3950810), wk = 0.0028736 k( 272) = ( 0.0769231 0.1332347 0.3950810), wk = 0.0028736 k( 273) = ( 0.0705128 0.1221318 0.3950810), wk = 0.0028736 k( 274) = ( 0.0641026 0.1110289 0.3950810), wk = 0.0028736 k( 275) = ( 0.0576923 0.0999260 0.3950810), wk = 0.0028736 k( 276) = ( 0.0512821 0.0888231 0.3950810), wk = 0.0028736 k( 277) = ( 0.0448718 0.0777202 0.3950810), wk = 0.0028736 k( 278) = ( 0.0384615 0.0666173 0.3950810), wk = 0.0028736 k( 279) = ( 0.0320513 0.0555144 0.3950810), wk = 0.0028736 k( 280) = ( 0.0256410 0.0444116 0.3950810), wk = 0.0028736 k( 281) = ( 0.0192308 0.0333087 0.3950810), wk = 0.0028736 k( 282) = ( 0.0128205 0.0222058 0.3950810), wk = 0.0028736 k( 283) = ( 0.0064103 0.0111029 0.3950810), wk = 0.0028736 k( 284) = ( 0.0000000 0.0000000 0.3950810), wk = 0.0028736 k( 285) = ( 0.5000000 0.2886751 0.3950810), wk = 0.0028736 k( 286) = ( 0.5000000 0.2886751 0.3823365), wk = 0.0028736 k( 287) = ( 0.5000000 0.2886751 0.3695919), wk = 0.0028736 k( 288) = ( 0.5000000 0.2886751 0.3568474), wk = 0.0028736 k( 289) = ( 0.5000000 0.2886751 0.3441028), wk = 0.0028736 k( 290) = ( 0.5000000 0.2886751 0.3313583), wk = 0.0028736 k( 291) = ( 0.5000000 0.2886751 0.3186137), wk = 0.0028736 k( 292) = ( 0.5000000 0.2886751 0.3058692), wk = 0.0028736 k( 293) = ( 0.5000000 0.2886751 0.2931246), wk = 0.0028736 k( 294) = ( 0.5000000 0.2886751 0.2803801), wk = 0.0028736 k( 295) = ( 0.5000000 0.2886751 0.2676355), wk = 0.0028736 k( 296) = ( 0.5000000 0.2886751 0.2548910), wk = 0.0028736 k( 297) = ( 0.5000000 0.2886751 0.2421464), wk = 0.0028736 k( 298) = ( 0.5000000 0.2886751 0.2294019), wk = 0.0028736 k( 299) = ( 0.5000000 0.2886751 0.2166573), wk = 0.0028736 k( 300) = ( 0.5000000 0.2886751 0.2039128), wk = 0.0028736 k( 301) = ( 0.5000000 0.2886751 0.1911682), wk = 0.0028736 k( 302) = ( 0.5000000 0.2886751 0.1784237), wk = 0.0028736 k( 303) = ( 0.5000000 0.2886751 0.1656791), wk = 0.0028736 k( 304) = ( 0.5000000 0.2886751 0.1529346), wk = 0.0028736 k( 305) = ( 0.5000000 0.2886751 0.1401900), wk = 0.0028736 k( 306) = ( 0.5000000 0.2886751 0.1274455), wk = 0.0028736 k( 307) = ( 0.5000000 0.2886751 0.1147009), wk = 0.0028736 k( 308) = ( 0.5000000 0.2886751 0.1019564), wk = 0.0028736 k( 309) = ( 0.5000000 0.2886751 0.0892118), wk = 0.0028736 k( 310) = ( 0.5000000 0.2886751 0.0764673), wk = 0.0028736 k( 311) = ( 0.5000000 0.2886751 0.0637227), wk = 0.0028736 k( 312) = ( 0.5000000 0.2886751 0.0509782), wk = 0.0028736 k( 313) = ( 0.5000000 0.2886751 0.0382336), wk = 0.0028736 k( 314) = ( 0.5000000 0.2886751 0.0254891), wk = 0.0028736 k( 315) = ( 0.5000000 0.2886751 0.0127445), wk = 0.0028736 k( 316) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0028736 k( 317) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0028736 k( 318) = ( 0.3333333 0.5773503 0.0127445), wk = 0.0028736 k( 319) = ( 0.3333333 0.5773503 0.0254891), wk = 0.0028736 k( 320) = ( 0.3333333 0.5773503 0.0382336), wk = 0.0028736 k( 321) = ( 0.3333333 0.5773503 0.0509782), wk = 0.0028736 k( 322) = ( 0.3333333 0.5773503 0.0637227), wk = 0.0028736 k( 323) = ( 0.3333333 0.5773503 0.0764673), wk = 0.0028736 k( 324) = ( 0.3333333 0.5773503 0.0892118), wk = 0.0028736 k( 325) = ( 0.3333333 0.5773503 0.1019564), wk = 0.0028736 k( 326) = ( 0.3333333 0.5773503 0.1147009), wk = 0.0028736 k( 327) = ( 0.3333333 0.5773503 0.1274455), wk = 0.0028736 k( 328) = ( 0.3333333 0.5773503 0.1401900), wk = 0.0028736 k( 329) = ( 0.3333333 0.5773503 0.1529346), wk = 0.0028736 k( 330) = ( 0.3333333 0.5773503 0.1656791), wk = 0.0028736 k( 331) = ( 0.3333333 0.5773503 0.1784237), wk = 0.0028736 k( 332) = ( 0.3333333 0.5773503 0.1911682), wk = 0.0028736 k( 333) = ( 0.3333333 0.5773503 0.2039128), wk = 0.0028736 k( 334) = ( 0.3333333 0.5773503 0.2166573), wk = 0.0028736 k( 335) = ( 0.3333333 0.5773503 0.2294019), wk = 0.0028736 k( 336) = ( 0.3333333 0.5773503 0.2421464), wk = 0.0028736 k( 337) = ( 0.3333333 0.5773503 0.2548910), wk = 0.0028736 k( 338) = ( 0.3333333 0.5773503 0.2676355), wk = 0.0028736 k( 339) = ( 0.3333333 0.5773503 0.2803801), wk = 0.0028736 k( 340) = ( 0.3333333 0.5773503 0.2931246), wk = 0.0028736 k( 341) = ( 0.3333333 0.5773503 0.3058692), wk = 0.0028736 k( 342) = ( 0.3333333 0.5773503 0.3186137), wk = 0.0028736 k( 343) = ( 0.3333333 0.5773503 0.3313583), wk = 0.0028736 k( 344) = ( 0.3333333 0.5773503 0.3441028), wk = 0.0028736 k( 345) = ( 0.3333333 0.5773503 0.3568474), wk = 0.0028736 k( 346) = ( 0.3333333 0.5773503 0.3695919), wk = 0.0028736 k( 347) = ( 0.3333333 0.5773503 0.3823365), wk = 0.0028736 k( 348) = ( 0.3333333 0.5773503 0.3950810), wk = 0.0028736 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028736 k( 2) = ( 0.0111111 0.0000000 -0.0000000), wk = 0.0028736 k( 3) = ( 0.0222222 0.0000000 -0.0000000), wk = 0.0028736 k( 4) = ( 0.0333333 0.0000000 0.0000000), wk = 0.0028736 k( 5) = ( 0.0444444 0.0000000 -0.0000000), wk = 0.0028736 k( 6) = ( 0.0555556 0.0000000 0.0000000), wk = 0.0028736 k( 7) = ( 0.0666667 0.0000000 0.0000000), wk = 0.0028736 k( 8) = ( 0.0777778 0.0000000 -0.0000000), wk = 0.0028736 k( 9) = ( 0.0888889 0.0000000 0.0000000), wk = 0.0028736 k( 10) = ( 0.1000000 0.0000000 -0.0000000), wk = 0.0028736 k( 11) = ( 0.1111111 0.0000000 0.0000000), wk = 0.0028736 k( 12) = ( 0.1222222 0.0000000 0.0000000), wk = 0.0028736 k( 13) = ( 0.1333333 0.0000000 -0.0000000), wk = 0.0028736 k( 14) = ( 0.1444444 0.0000000 0.0000000), wk = 0.0028736 k( 15) = ( 0.1555556 0.0000000 -0.0000000), wk = 0.0028736 k( 16) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0028736 k( 17) = ( 0.1777778 0.0000000 0.0000000), wk = 0.0028736 k( 18) = ( 0.1888889 0.0000000 0.0000000), wk = 0.0028736 k( 19) = ( 0.2000000 0.0000000 -0.0000000), wk = 0.0028736 k( 20) = ( 0.2111111 0.0000000 -0.0000000), wk = 0.0028736 k( 21) = ( 0.2222222 0.0000000 0.0000000), wk = 0.0028736 k( 22) = ( 0.2333333 0.0000000 -0.0000000), wk = 0.0028736 k( 23) = ( 0.2444444 0.0000000 0.0000000), wk = 0.0028736 k( 24) = ( 0.2555556 0.0000000 0.0000000), wk = 0.0028736 k( 25) = ( 0.2666667 0.0000000 0.0000000), wk = 0.0028736 k( 26) = ( 0.2777778 0.0000000 0.0000000), wk = 0.0028736 k( 27) = ( 0.2888889 0.0000000 0.0000000), wk = 0.0028736 k( 28) = ( 0.3000000 0.0000000 0.0000000), wk = 0.0028736 k( 29) = ( 0.3111111 0.0000000 -0.0000000), wk = 0.0028736 k( 30) = ( 0.3222222 0.0000000 -0.0000000), wk = 0.0028736 k( 31) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0028736 k( 32) = ( 0.3444444 0.0000000 0.0000000), wk = 0.0028736 k( 33) = ( 0.3555556 0.0000000 0.0000000), wk = 0.0028736 k( 34) = ( 0.3666667 0.0000000 0.0000000), wk = 0.0028736 k( 35) = ( 0.3777778 0.0000000 0.0000000), wk = 0.0028736 k( 36) = ( 0.3888889 0.0000000 0.0000000), wk = 0.0028736 k( 37) = ( 0.4000000 0.0000000 -0.0000000), wk = 0.0028736 k( 38) = ( 0.4111111 0.0000000 -0.0000000), wk = 0.0028736 k( 39) = ( 0.4222222 0.0000000 -0.0000000), wk = 0.0028736 k( 40) = ( 0.4333333 0.0000000 0.0000000), wk = 0.0028736 k( 41) = ( 0.4444444 0.0000000 0.0000000), wk = 0.0028736 k( 42) = ( 0.4555556 0.0000000 0.0000000), wk = 0.0028736 k( 43) = ( 0.4666667 0.0000000 -0.0000000), wk = 0.0028736 k( 44) = ( 0.4777778 0.0000000 -0.0000000), wk = 0.0028736 k( 45) = ( 0.4888889 0.0000000 0.0000000), wk = 0.0028736 k( 46) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0028736 k( 47) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0028736 k( 48) = ( 0.4935897 0.0128205 -0.0000000), wk = 0.0028736 k( 49) = ( 0.4871795 0.0256410 -0.0000000), wk = 0.0028736 k( 50) = ( 0.4807692 0.0384615 -0.0000000), wk = 0.0028736 k( 51) = ( 0.4743590 0.0512821 -0.0000000), wk = 0.0028736 k( 52) = ( 0.4679487 0.0641026 -0.0000000), wk = 0.0028736 k( 53) = ( 0.4615385 0.0769231 0.0000000), wk = 0.0028736 k( 54) = ( 0.4551282 0.0897436 -0.0000000), wk = 0.0028736 k( 55) = ( 0.4487179 0.1025641 -0.0000000), wk = 0.0028736 k( 56) = ( 0.4423077 0.1153846 0.0000000), wk = 0.0028736 k( 57) = ( 0.4358974 0.1282051 -0.0000000), wk = 0.0028736 k( 58) = ( 0.4294872 0.1410256 0.0000000), wk = 0.0028736 k( 59) = ( 0.4230769 0.1538462 0.0000000), wk = 0.0028736 k( 60) = ( 0.4166667 0.1666667 -0.0000000), wk = 0.0028736 k( 61) = ( 0.4102564 0.1794872 -0.0000000), wk = 0.0028736 k( 62) = ( 0.4038462 0.1923077 -0.0000000), wk = 0.0028736 k( 63) = ( 0.3974359 0.2051282 -0.0000000), wk = 0.0028736 k( 64) = ( 0.3910256 0.2179487 0.0000000), wk = 0.0028736 k( 65) = ( 0.3846154 0.2307692 0.0000000), wk = 0.0028736 k( 66) = ( 0.3782051 0.2435897 0.0000000), wk = 0.0028736 k( 67) = ( 0.3717949 0.2564103 -0.0000000), wk = 0.0028736 k( 68) = ( 0.3653846 0.2692308 0.0000000), wk = 0.0028736 k( 69) = ( 0.3589744 0.2820513 0.0000000), wk = 0.0028736 k( 70) = ( 0.3525641 0.2948718 0.0000000), wk = 0.0028736 k( 71) = ( 0.3461538 0.3076923 0.0000000), wk = 0.0028736 k( 72) = ( 0.3397436 0.3205128 0.0000000), wk = 0.0028736 k( 73) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0028736 k( 74) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0028736 k( 75) = ( 0.3269231 0.3269231 0.0000000), wk = 0.0028736 k( 76) = ( 0.3205128 0.3205128 0.0000000), wk = 0.0028736 k( 77) = ( 0.3141026 0.3141026 0.0000000), wk = 0.0028736 k( 78) = ( 0.3076923 0.3076923 0.0000000), wk = 0.0028736 k( 79) = ( 0.3012821 0.3012821 0.0000000), wk = 0.0028736 k( 80) = ( 0.2948718 0.2948718 0.0000000), wk = 0.0028736 k( 81) = ( 0.2884615 0.2884615 0.0000000), wk = 0.0028736 k( 82) = ( 0.2820513 0.2820513 0.0000000), wk = 0.0028736 k( 83) = ( 0.2756410 0.2756410 0.0000000), wk = 0.0028736 k( 84) = ( 0.2692308 0.2692308 -0.0000000), wk = 0.0028736 k( 85) = ( 0.2628205 0.2628205 0.0000000), wk = 0.0028736 k( 86) = ( 0.2564103 0.2564103 -0.0000000), wk = 0.0028736 k( 87) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0028736 k( 88) = ( 0.2435897 0.2435897 -0.0000000), wk = 0.0028736 k( 89) = ( 0.2371795 0.2371795 -0.0000000), wk = 0.0028736 k( 90) = ( 0.2307692 0.2307692 -0.0000000), wk = 0.0028736 k( 91) = ( 0.2243590 0.2243590 0.0000000), wk = 0.0028736 k( 92) = ( 0.2179487 0.2179487 -0.0000000), wk = 0.0028736 k( 93) = ( 0.2115385 0.2115385 -0.0000000), wk = 0.0028736 k( 94) = ( 0.2051282 0.2051282 -0.0000000), wk = 0.0028736 k( 95) = ( 0.1987180 0.1987180 0.0000000), wk = 0.0028736 k( 96) = ( 0.1923077 0.1923077 -0.0000000), wk = 0.0028736 k( 97) = ( 0.1858974 0.1858974 0.0000000), wk = 0.0028736 k( 98) = ( 0.1794872 0.1794872 0.0000000), wk = 0.0028736 k( 99) = ( 0.1730769 0.1730769 0.0000000), wk = 0.0028736 k( 100) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0028736 k( 101) = ( 0.1602564 0.1602564 0.0000000), wk = 0.0028736 k( 102) = ( 0.1538461 0.1538462 -0.0000000), wk = 0.0028736 k( 103) = ( 0.1474359 0.1474359 0.0000000), wk = 0.0028736 k( 104) = ( 0.1410256 0.1410256 0.0000000), wk = 0.0028736 k( 105) = ( 0.1346154 0.1346154 0.0000000), wk = 0.0028736 k( 106) = ( 0.1282051 0.1282051 -0.0000000), wk = 0.0028736 k( 107) = ( 0.1217949 0.1217949 -0.0000000), wk = 0.0028736 k( 108) = ( 0.1153846 0.1153846 -0.0000000), wk = 0.0028736 k( 109) = ( 0.1089744 0.1089744 -0.0000000), wk = 0.0028736 k( 110) = ( 0.1025641 0.1025641 -0.0000000), wk = 0.0028736 k( 111) = ( 0.0961538 0.0961539 -0.0000000), wk = 0.0028736 k( 112) = ( 0.0897436 0.0897436 0.0000000), wk = 0.0028736 k( 113) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0028736 k( 114) = ( 0.0769231 0.0769231 -0.0000000), wk = 0.0028736 k( 115) = ( 0.0705128 0.0705128 0.0000000), wk = 0.0028736 k( 116) = ( 0.0641026 0.0641026 -0.0000000), wk = 0.0028736 k( 117) = ( 0.0576923 0.0576923 -0.0000000), wk = 0.0028736 k( 118) = ( 0.0512821 0.0512821 -0.0000000), wk = 0.0028736 k( 119) = ( 0.0448718 0.0448718 0.0000000), wk = 0.0028736 k( 120) = ( 0.0384615 0.0384615 -0.0000000), wk = 0.0028736 k( 121) = ( 0.0320513 0.0320513 -0.0000000), wk = 0.0028736 k( 122) = ( 0.0256410 0.0256410 -0.0000000), wk = 0.0028736 k( 123) = ( 0.0192308 0.0192308 -0.0000000), wk = 0.0028736 k( 124) = ( 0.0128205 0.0128205 -0.0000000), wk = 0.0028736 k( 125) = ( 0.0064103 0.0064103 0.0000000), wk = 0.0028736 k( 126) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028736 k( 127) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028736 k( 128) = ( 0.0000000 0.0000000 0.0161290), wk = 0.0028736 k( 129) = ( 0.0000000 0.0000000 0.0322581), wk = 0.0028736 k( 130) = ( 0.0000000 0.0000000 0.0483871), wk = 0.0028736 k( 131) = ( 0.0000000 0.0000000 0.0645161), wk = 0.0028736 k( 132) = ( 0.0000000 0.0000000 0.0806452), wk = 0.0028736 k( 133) = ( 0.0000000 0.0000000 0.0967742), wk = 0.0028736 k( 134) = ( 0.0000000 0.0000000 0.1129032), wk = 0.0028736 k( 135) = ( 0.0000000 0.0000000 0.1290323), wk = 0.0028736 k( 136) = ( 0.0000000 0.0000000 0.1451613), wk = 0.0028736 k( 137) = ( 0.0000000 0.0000000 0.1612903), wk = 0.0028736 k( 138) = ( 0.0000000 0.0000000 0.1774194), wk = 0.0028736 k( 139) = ( 0.0000000 0.0000000 0.1935484), wk = 0.0028736 k( 140) = ( 0.0000000 0.0000000 0.2096774), wk = 0.0028736 k( 141) = ( 0.0000000 0.0000000 0.2258064), wk = 0.0028736 k( 142) = ( 0.0000000 0.0000000 0.2419355), wk = 0.0028736 k( 143) = ( 0.0000000 0.0000000 0.2580645), wk = 0.0028736 k( 144) = ( 0.0000000 0.0000000 0.2741936), wk = 0.0028736 k( 145) = ( 0.0000000 0.0000000 0.2903226), wk = 0.0028736 k( 146) = ( 0.0000000 0.0000000 0.3064516), wk = 0.0028736 k( 147) = ( 0.0000000 0.0000000 0.3225807), wk = 0.0028736 k( 148) = ( 0.0000000 0.0000000 0.3387097), wk = 0.0028736 k( 149) = ( 0.0000000 0.0000000 0.3548387), wk = 0.0028736 k( 150) = ( 0.0000000 0.0000000 0.3709677), wk = 0.0028736 k( 151) = ( 0.0000000 0.0000000 0.3870968), wk = 0.0028736 k( 152) = ( 0.0000000 0.0000000 0.4032258), wk = 0.0028736 k( 153) = ( 0.0000000 0.0000000 0.4193548), wk = 0.0028736 k( 154) = ( 0.0000000 0.0000000 0.4354839), wk = 0.0028736 k( 155) = ( 0.0000000 0.0000000 0.4516129), wk = 0.0028736 k( 156) = ( 0.0000000 0.0000000 0.4677419), wk = 0.0028736 k( 157) = ( 0.0000000 0.0000000 0.4838710), wk = 0.0028736 k( 158) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028736 k( 159) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028736 k( 160) = ( 0.0111111 0.0000000 0.5000000), wk = 0.0028736 k( 161) = ( 0.0222222 0.0000000 0.5000000), wk = 0.0028736 k( 162) = ( 0.0333333 0.0000000 0.5000000), wk = 0.0028736 k( 163) = ( 0.0444444 0.0000000 0.5000000), wk = 0.0028736 k( 164) = ( 0.0555556 0.0000000 0.5000000), wk = 0.0028736 k( 165) = ( 0.0666667 0.0000000 0.5000000), wk = 0.0028736 k( 166) = ( 0.0777778 0.0000000 0.5000000), wk = 0.0028736 k( 167) = ( 0.0888889 0.0000000 0.5000000), wk = 0.0028736 k( 168) = ( 0.1000000 0.0000000 0.5000000), wk = 0.0028736 k( 169) = ( 0.1111111 0.0000000 0.5000000), wk = 0.0028736 k( 170) = ( 0.1222222 0.0000000 0.5000000), wk = 0.0028736 k( 171) = ( 0.1333333 0.0000000 0.5000000), wk = 0.0028736 k( 172) = ( 0.1444444 0.0000000 0.5000000), wk = 0.0028736 k( 173) = ( 0.1555556 0.0000000 0.5000000), wk = 0.0028736 k( 174) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0028736 k( 175) = ( 0.1777778 0.0000000 0.5000000), wk = 0.0028736 k( 176) = ( 0.1888889 0.0000000 0.5000000), wk = 0.0028736 k( 177) = ( 0.2000000 0.0000000 0.5000000), wk = 0.0028736 k( 178) = ( 0.2111111 0.0000000 0.5000000), wk = 0.0028736 k( 179) = ( 0.2222222 0.0000000 0.5000000), wk = 0.0028736 k( 180) = ( 0.2333333 0.0000000 0.5000000), wk = 0.0028736 k( 181) = ( 0.2444444 0.0000000 0.5000000), wk = 0.0028736 k( 182) = ( 0.2555556 0.0000000 0.5000000), wk = 0.0028736 k( 183) = ( 0.2666667 0.0000000 0.5000000), wk = 0.0028736 k( 184) = ( 0.2777778 0.0000000 0.5000000), wk = 0.0028736 k( 185) = ( 0.2888889 0.0000000 0.5000000), wk = 0.0028736 k( 186) = ( 0.3000000 0.0000000 0.5000000), wk = 0.0028736 k( 187) = ( 0.3111111 0.0000000 0.5000000), wk = 0.0028736 k( 188) = ( 0.3222222 0.0000000 0.5000000), wk = 0.0028736 k( 189) = ( 0.3333333 0.0000000 0.5000000), wk = 0.0028736 k( 190) = ( 0.3444444 0.0000000 0.5000000), wk = 0.0028736 k( 191) = ( 0.3555556 0.0000000 0.5000000), wk = 0.0028736 k( 192) = ( 0.3666667 0.0000000 0.5000000), wk = 0.0028736 k( 193) = ( 0.3777778 0.0000000 0.5000000), wk = 0.0028736 k( 194) = ( 0.3888889 0.0000000 0.5000000), wk = 0.0028736 k( 195) = ( 0.4000000 0.0000000 0.5000000), wk = 0.0028736 k( 196) = ( 0.4111111 0.0000000 0.5000000), wk = 0.0028736 k( 197) = ( 0.4222222 0.0000000 0.5000000), wk = 0.0028736 k( 198) = ( 0.4333333 0.0000000 0.5000000), wk = 0.0028736 k( 199) = ( 0.4444444 0.0000000 0.5000000), wk = 0.0028736 k( 200) = ( 0.4555556 0.0000000 0.5000000), wk = 0.0028736 k( 201) = ( 0.4666667 0.0000000 0.5000000), wk = 0.0028736 k( 202) = ( 0.4777778 0.0000000 0.5000000), wk = 0.0028736 k( 203) = ( 0.4888889 0.0000000 0.5000000), wk = 0.0028736 k( 204) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028736 k( 205) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028736 k( 206) = ( 0.4935897 0.0128205 0.5000000), wk = 0.0028736 k( 207) = ( 0.4871795 0.0256410 0.5000000), wk = 0.0028736 k( 208) = ( 0.4807692 0.0384615 0.5000000), wk = 0.0028736 k( 209) = ( 0.4743590 0.0512821 0.5000000), wk = 0.0028736 k( 210) = ( 0.4679487 0.0641026 0.5000000), wk = 0.0028736 k( 211) = ( 0.4615385 0.0769231 0.5000000), wk = 0.0028736 k( 212) = ( 0.4551282 0.0897436 0.5000000), wk = 0.0028736 k( 213) = ( 0.4487179 0.1025641 0.5000000), wk = 0.0028736 k( 214) = ( 0.4423077 0.1153846 0.5000000), wk = 0.0028736 k( 215) = ( 0.4358974 0.1282051 0.5000000), wk = 0.0028736 k( 216) = ( 0.4294872 0.1410256 0.5000000), wk = 0.0028736 k( 217) = ( 0.4230769 0.1538462 0.5000000), wk = 0.0028736 k( 218) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0028736 k( 219) = ( 0.4102564 0.1794872 0.5000000), wk = 0.0028736 k( 220) = ( 0.4038462 0.1923077 0.5000000), wk = 0.0028736 k( 221) = ( 0.3974359 0.2051282 0.5000000), wk = 0.0028736 k( 222) = ( 0.3910256 0.2179487 0.5000000), wk = 0.0028736 k( 223) = ( 0.3846154 0.2307692 0.5000000), wk = 0.0028736 k( 224) = ( 0.3782051 0.2435897 0.5000000), wk = 0.0028736 k( 225) = ( 0.3717949 0.2564103 0.5000000), wk = 0.0028736 k( 226) = ( 0.3653846 0.2692308 0.5000000), wk = 0.0028736 k( 227) = ( 0.3589744 0.2820513 0.5000000), wk = 0.0028736 k( 228) = ( 0.3525641 0.2948718 0.5000000), wk = 0.0028736 k( 229) = ( 0.3461538 0.3076923 0.5000000), wk = 0.0028736 k( 230) = ( 0.3397436 0.3205128 0.5000000), wk = 0.0028736 k( 231) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0028736 k( 232) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0028736 k( 233) = ( 0.3269231 0.3269231 0.5000000), wk = 0.0028736 k( 234) = ( 0.3205128 0.3205128 0.5000000), wk = 0.0028736 k( 235) = ( 0.3141026 0.3141026 0.5000000), wk = 0.0028736 k( 236) = ( 0.3076923 0.3076923 0.5000000), wk = 0.0028736 k( 237) = ( 0.3012821 0.3012821 0.5000000), wk = 0.0028736 k( 238) = ( 0.2948718 0.2948718 0.5000000), wk = 0.0028736 k( 239) = ( 0.2884615 0.2884615 0.5000000), wk = 0.0028736 k( 240) = ( 0.2820513 0.2820513 0.5000000), wk = 0.0028736 k( 241) = ( 0.2756410 0.2756410 0.5000000), wk = 0.0028736 k( 242) = ( 0.2692308 0.2692308 0.5000000), wk = 0.0028736 k( 243) = ( 0.2628205 0.2628205 0.5000000), wk = 0.0028736 k( 244) = ( 0.2564103 0.2564103 0.5000000), wk = 0.0028736 k( 245) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0028736 k( 246) = ( 0.2435897 0.2435897 0.5000000), wk = 0.0028736 k( 247) = ( 0.2371795 0.2371795 0.5000000), wk = 0.0028736 k( 248) = ( 0.2307692 0.2307692 0.5000000), wk = 0.0028736 k( 249) = ( 0.2243590 0.2243590 0.5000000), wk = 0.0028736 k( 250) = ( 0.2179487 0.2179487 0.5000000), wk = 0.0028736 k( 251) = ( 0.2115385 0.2115385 0.5000000), wk = 0.0028736 k( 252) = ( 0.2051282 0.2051282 0.5000000), wk = 0.0028736 k( 253) = ( 0.1987180 0.1987180 0.5000000), wk = 0.0028736 k( 254) = ( 0.1923077 0.1923077 0.5000000), wk = 0.0028736 k( 255) = ( 0.1858974 0.1858974 0.5000000), wk = 0.0028736 k( 256) = ( 0.1794872 0.1794872 0.5000000), wk = 0.0028736 k( 257) = ( 0.1730769 0.1730769 0.5000000), wk = 0.0028736 k( 258) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0028736 k( 259) = ( 0.1602564 0.1602564 0.5000000), wk = 0.0028736 k( 260) = ( 0.1538461 0.1538462 0.5000000), wk = 0.0028736 k( 261) = ( 0.1474359 0.1474359 0.5000000), wk = 0.0028736 k( 262) = ( 0.1410256 0.1410256 0.5000000), wk = 0.0028736 k( 263) = ( 0.1346154 0.1346154 0.5000000), wk = 0.0028736 k( 264) = ( 0.1282051 0.1282051 0.5000000), wk = 0.0028736 k( 265) = ( 0.1217949 0.1217949 0.5000000), wk = 0.0028736 k( 266) = ( 0.1153846 0.1153846 0.5000000), wk = 0.0028736 k( 267) = ( 0.1089744 0.1089744 0.5000000), wk = 0.0028736 k( 268) = ( 0.1025641 0.1025641 0.5000000), wk = 0.0028736 k( 269) = ( 0.0961538 0.0961539 0.5000000), wk = 0.0028736 k( 270) = ( 0.0897436 0.0897436 0.5000000), wk = 0.0028736 k( 271) = ( 0.0833333 0.0833333 0.5000000), wk = 0.0028736 k( 272) = ( 0.0769231 0.0769231 0.5000000), wk = 0.0028736 k( 273) = ( 0.0705128 0.0705128 0.5000000), wk = 0.0028736 k( 274) = ( 0.0641026 0.0641026 0.5000000), wk = 0.0028736 k( 275) = ( 0.0576923 0.0576923 0.5000000), wk = 0.0028736 k( 276) = ( 0.0512821 0.0512821 0.5000000), wk = 0.0028736 k( 277) = ( 0.0448718 0.0448718 0.5000000), wk = 0.0028736 k( 278) = ( 0.0384615 0.0384615 0.5000000), wk = 0.0028736 k( 279) = ( 0.0320513 0.0320513 0.5000000), wk = 0.0028736 k( 280) = ( 0.0256410 0.0256410 0.5000000), wk = 0.0028736 k( 281) = ( 0.0192308 0.0192308 0.5000000), wk = 0.0028736 k( 282) = ( 0.0128205 0.0128205 0.5000000), wk = 0.0028736 k( 283) = ( 0.0064103 0.0064103 0.5000000), wk = 0.0028736 k( 284) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028736 k( 285) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028736 k( 286) = ( 0.5000000 0.0000000 0.4838710), wk = 0.0028736 k( 287) = ( 0.5000000 0.0000000 0.4677419), wk = 0.0028736 k( 288) = ( 0.5000000 0.0000000 0.4516129), wk = 0.0028736 k( 289) = ( 0.5000000 0.0000000 0.4354839), wk = 0.0028736 k( 290) = ( 0.5000000 0.0000000 0.4193548), wk = 0.0028736 k( 291) = ( 0.5000000 0.0000000 0.4032258), wk = 0.0028736 k( 292) = ( 0.5000000 0.0000000 0.3870968), wk = 0.0028736 k( 293) = ( 0.5000000 0.0000000 0.3709677), wk = 0.0028736 k( 294) = ( 0.5000000 0.0000000 0.3548387), wk = 0.0028736 k( 295) = ( 0.5000000 0.0000000 0.3387097), wk = 0.0028736 k( 296) = ( 0.5000000 0.0000000 0.3225806), wk = 0.0028736 k( 297) = ( 0.5000000 0.0000000 0.3064516), wk = 0.0028736 k( 298) = ( 0.5000000 0.0000000 0.2903226), wk = 0.0028736 k( 299) = ( 0.5000000 0.0000000 0.2741936), wk = 0.0028736 k( 300) = ( 0.5000000 0.0000000 0.2580645), wk = 0.0028736 k( 301) = ( 0.5000000 0.0000000 0.2419355), wk = 0.0028736 k( 302) = ( 0.5000000 0.0000000 0.2258065), wk = 0.0028736 k( 303) = ( 0.5000000 0.0000000 0.2096774), wk = 0.0028736 k( 304) = ( 0.5000000 0.0000000 0.1935484), wk = 0.0028736 k( 305) = ( 0.5000000 0.0000000 0.1774194), wk = 0.0028736 k( 306) = ( 0.5000000 0.0000000 0.1612903), wk = 0.0028736 k( 307) = ( 0.5000000 0.0000000 0.1451613), wk = 0.0028736 k( 308) = ( 0.5000000 0.0000000 0.1290323), wk = 0.0028736 k( 309) = ( 0.5000000 0.0000000 0.1129032), wk = 0.0028736 k( 310) = ( 0.5000000 0.0000000 0.0967742), wk = 0.0028736 k( 311) = ( 0.5000000 0.0000000 0.0806452), wk = 0.0028736 k( 312) = ( 0.5000000 0.0000000 0.0645161), wk = 0.0028736 k( 313) = ( 0.5000000 0.0000000 0.0483871), wk = 0.0028736 k( 314) = ( 0.5000000 0.0000000 0.0322581), wk = 0.0028736 k( 315) = ( 0.5000000 0.0000000 0.0161290), wk = 0.0028736 k( 316) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0028736 k( 317) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0028736 k( 318) = ( 0.3333333 0.3333333 0.0161290), wk = 0.0028736 k( 319) = ( 0.3333333 0.3333333 0.0322581), wk = 0.0028736 k( 320) = ( 0.3333333 0.3333333 0.0483871), wk = 0.0028736 k( 321) = ( 0.3333333 0.3333333 0.0645161), wk = 0.0028736 k( 322) = ( 0.3333333 0.3333333 0.0806452), wk = 0.0028736 k( 323) = ( 0.3333333 0.3333333 0.0967742), wk = 0.0028736 k( 324) = ( 0.3333333 0.3333333 0.1129032), wk = 0.0028736 k( 325) = ( 0.3333333 0.3333333 0.1290323), wk = 0.0028736 k( 326) = ( 0.3333333 0.3333333 0.1451613), wk = 0.0028736 k( 327) = ( 0.3333333 0.3333333 0.1612903), wk = 0.0028736 k( 328) = ( 0.3333333 0.3333333 0.1774194), wk = 0.0028736 k( 329) = ( 0.3333333 0.3333333 0.1935484), wk = 0.0028736 k( 330) = ( 0.3333333 0.3333333 0.2096774), wk = 0.0028736 k( 331) = ( 0.3333333 0.3333333 0.2258064), wk = 0.0028736 k( 332) = ( 0.3333333 0.3333333 0.2419355), wk = 0.0028736 k( 333) = ( 0.3333333 0.3333333 0.2580645), wk = 0.0028736 k( 334) = ( 0.3333333 0.3333333 0.2741936), wk = 0.0028736 k( 335) = ( 0.3333333 0.3333333 0.2903226), wk = 0.0028736 k( 336) = ( 0.3333333 0.3333333 0.3064516), wk = 0.0028736 k( 337) = ( 0.3333333 0.3333333 0.3225807), wk = 0.0028736 k( 338) = ( 0.3333333 0.3333333 0.3387097), wk = 0.0028736 k( 339) = ( 0.3333333 0.3333333 0.3548387), wk = 0.0028736 k( 340) = ( 0.3333333 0.3333333 0.3709677), wk = 0.0028736 k( 341) = ( 0.3333333 0.3333333 0.3870968), wk = 0.0028736 k( 342) = ( 0.3333333 0.3333333 0.4032258), wk = 0.0028736 k( 343) = ( 0.3333333 0.3333333 0.4193548), wk = 0.0028736 k( 344) = ( 0.3333333 0.3333333 0.4354839), wk = 0.0028736 k( 345) = ( 0.3333333 0.3333333 0.4516129), wk = 0.0028736 k( 346) = ( 0.3333333 0.3333333 0.4677419), wk = 0.0028736 k( 347) = ( 0.3333333 0.3333333 0.4838710), wk = 0.0028736 k( 348) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0028736 Dense grid: 32731 G-vectors FFT dimensions: ( 40, 40, 50) Smooth grid: 22063 G-vectors FFT dimensions: ( 36, 36, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.16 Mb ( 178, 58) NL pseudopotentials 0.18 Mb ( 89, 136) Each V/rho on FFT grid 0.05 Mb ( 3200) Each G-vector array 0.01 Mb ( 912) G-vector shells 0.00 Mb ( 470) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.63 Mb ( 178, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.24 Mb ( 136, 2, 58) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./NiSn.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.4 secs Computing kpt #: 2 total cpu time spent up to now is 3.0 secs Computing kpt #: 3 total cpu time spent up to now is 3.4 secs Computing kpt #: 4 total cpu time spent up to now is 3.9 secs Computing kpt #: 5 total cpu time spent up to now is 4.4 secs Computing kpt #: 6 total cpu time spent up to now is 4.8 secs Computing kpt #: 7 total cpu time spent up to now is 5.3 secs Computing kpt #: 8 total cpu time spent up to now is 5.7 secs Computing kpt #: 9 total cpu time spent up to now is 6.2 secs Computing kpt #: 10 total cpu time spent up to now is 6.6 secs Computing kpt #: 11 total cpu time spent up to now is 7.0 secs Computing kpt #: 12 total cpu time spent up to now is 7.4 secs Computing kpt #: 13 total cpu time spent up to now is 7.8 secs Computing kpt #: 14 total cpu time spent up to now is 8.3 secs Computing kpt #: 15 total cpu time spent up to now is 8.7 secs Computing kpt #: 16 total cpu time spent up to now is 9.1 secs Computing kpt #: 17 total cpu time spent up to now is 9.6 secs Computing kpt #: 18 total cpu time spent up to now is 10.0 secs Computing kpt #: 19 total cpu time spent up to now is 10.4 secs Computing kpt #: 20 total cpu time spent up to now is 10.7 secs Computing kpt #: 21 total cpu time spent up to now is 11.1 secs Computing kpt #: 22 total cpu time spent up to now is 11.5 secs Computing kpt #: 23 total cpu time spent up to now is 11.8 secs Computing kpt #: 24 total cpu time spent up to now is 12.2 secs Computing kpt #: 25 total cpu time spent up to now is 12.6 secs Computing kpt #: 26 total cpu time spent up to now is 12.9 secs Computing kpt #: 27 total cpu time spent up to now is 13.3 secs Computing kpt #: 28 total cpu time spent up to now is 13.7 secs Computing kpt #: 29 total cpu time spent up to now is 14.1 secs Computing kpt #: 30 total cpu time spent up to now is 14.4 secs Computing kpt #: 31 total cpu time spent up to now is 14.8 secs Computing kpt #: 32 total cpu time spent up to now is 15.2 secs Computing kpt #: 33 total cpu time spent up to now is 15.5 secs Computing kpt #: 34 total cpu time spent up to now is 15.9 secs Computing kpt #: 35 total cpu time spent up to now is 16.3 secs Computing kpt #: 36 total cpu time spent up to now is 16.6 secs Computing kpt #: 37 total cpu time spent up to now is 17.0 secs Computing kpt #: 38 total cpu time spent up to now is 17.3 secs Computing kpt #: 39 total cpu time spent up to now is 17.7 secs Computing kpt #: 40 total cpu time spent up to now is 18.1 secs Computing kpt #: 41 total cpu time spent up to now is 18.4 secs Computing kpt #: 42 total cpu time spent up to now is 18.8 secs Computing kpt #: 43 total cpu time spent up to now is 19.1 secs Computing kpt #: 44 total cpu time spent up to now is 19.5 secs Computing kpt #: 45 total cpu time spent up to now is 19.8 secs Computing kpt #: 46 total cpu time spent up to now is 20.2 secs Computing kpt #: 47 total cpu time spent up to now is 20.5 secs Computing kpt #: 48 total cpu time spent up to now is 20.9 secs Computing kpt #: 49 total cpu time spent up to now is 21.2 secs Computing kpt #: 50 total cpu time spent up to now is 21.6 secs Computing kpt #: 51 total cpu time spent up to now is 22.0 secs Computing kpt #: 52 total cpu time spent up to now is 22.3 secs Computing kpt #: 53 total cpu time spent up to now is 22.7 secs Computing kpt #: 54 total cpu time spent up to now is 23.1 secs Computing kpt #: 55 total cpu time spent up to now is 23.5 secs Computing kpt #: 56 total cpu time spent up to now is 23.9 secs Computing kpt #: 57 total cpu time spent up to now is 24.3 secs Computing kpt #: 58 total cpu time spent up to now is 24.7 secs Computing kpt #: 59 total cpu time spent up to now is 25.0 secs Computing kpt #: 60 total cpu time spent up to now is 25.3 secs Computing kpt #: 61 total cpu time spent up to now is 25.7 secs Computing kpt #: 62 total cpu time spent up to now is 26.0 secs Computing kpt #: 63 total cpu time spent up to now is 26.4 secs Computing kpt #: 64 total cpu time spent up to now is 26.7 secs Computing kpt #: 65 total cpu time spent up to now is 27.0 secs Computing kpt #: 66 total cpu time spent up to now is 27.3 secs Computing kpt #: 67 total cpu time spent up to now is 27.6 secs Computing kpt #: 68 total cpu time spent up to now is 27.9 secs Computing kpt #: 69 total cpu time spent up to now is 28.2 secs Computing kpt #: 70 total cpu time spent up to now is 28.5 secs Computing kpt #: 71 total cpu time spent up to now is 28.8 secs Computing kpt #: 72 total cpu time spent up to now is 29.1 secs Computing kpt #: 73 total cpu time spent up to now is 29.4 secs Computing kpt #: 74 total cpu time spent up to now is 29.7 secs Computing kpt #: 75 total cpu time spent up to now is 30.0 secs Computing kpt #: 76 total cpu time spent up to now is 30.3 secs Computing kpt #: 77 total cpu time spent up to now is 30.6 secs Computing kpt #: 78 total cpu time spent up to now is 30.9 secs Computing kpt #: 79 total cpu time spent up to now is 31.2 secs Computing kpt #: 80 total cpu time spent up to now is 31.5 secs Computing kpt #: 81 total cpu time spent up to now is 31.8 secs Computing kpt #: 82 total cpu time spent up to now is 32.1 secs Computing kpt #: 83 total cpu time spent up to now is 32.5 secs Computing kpt #: 84 total cpu time spent up to now is 32.8 secs Computing kpt #: 85 total cpu time spent up to now is 33.1 secs Computing kpt #: 86 total cpu time spent up to now is 33.4 secs Computing kpt #: 87 total cpu time spent up to now is 33.8 secs Computing kpt #: 88 total cpu time spent up to now is 34.1 secs Computing kpt #: 89 total cpu time spent up to now is 34.4 secs Computing kpt #: 90 total cpu time spent up to now is 34.8 secs Computing kpt #: 91 total cpu time spent up to now is 35.1 secs Computing kpt #: 92 total cpu time spent up to now is 35.4 secs Computing kpt #: 93 total cpu time spent up to now is 35.8 secs Computing kpt #: 94 total cpu time spent up to now is 36.1 secs Computing kpt #: 95 total cpu time spent up to now is 36.5 secs Computing kpt #: 96 total cpu time spent up to now is 36.8 secs Computing kpt #: 97 total cpu time spent up to now is 37.2 secs Computing kpt #: 98 total cpu time spent up to now is 37.5 secs Computing kpt #: 99 total cpu time spent up to now is 37.9 secs Computing kpt #: 100 total cpu time spent up to now is 38.5 secs Computing kpt #: 101 total cpu time spent up to now is 39.0 secs Computing kpt #: 102 total cpu time spent up to now is 39.5 secs Computing kpt #: 103 total cpu time spent up to now is 39.9 secs Computing kpt #: 104 total cpu time spent up to now is 40.4 secs Computing kpt #: 105 total cpu time spent up to now is 40.8 secs Computing kpt #: 106 total cpu time spent up to now is 41.3 secs Computing kpt #: 107 total cpu time spent up to now is 41.8 secs Computing kpt #: 108 total cpu time spent up to now is 42.2 secs Computing kpt #: 109 total cpu time spent up to now is 42.7 secs Computing kpt #: 110 total cpu time spent up to now is 43.1 secs Computing kpt #: 111 total cpu time spent up to now is 43.5 secs Computing kpt #: 112 total cpu time spent up to now is 44.0 secs Computing kpt #: 113 total cpu time spent up to now is 44.5 secs Computing kpt #: 114 total cpu time spent up to now is 44.9 secs Computing kpt #: 115 total cpu time spent up to now is 45.3 secs Computing kpt #: 116 total cpu time spent up to now is 45.7 secs Computing kpt #: 117 total cpu time spent up to now is 46.1 secs Computing kpt #: 118 total cpu time spent up to now is 46.5 secs Computing kpt #: 119 total cpu time spent up to now is 46.9 secs Computing kpt #: 120 total cpu time spent up to now is 47.4 secs Computing kpt #: 121 total cpu time spent up to now is 47.9 secs Computing kpt #: 122 total cpu time spent up to now is 48.3 secs Computing kpt #: 123 total cpu time spent up to now is 48.8 secs Computing kpt #: 124 total cpu time spent up to now is 49.3 secs Computing kpt #: 125 total cpu time spent up to now is 49.7 secs Computing kpt #: 126 total cpu time spent up to now is 50.2 secs Computing kpt #: 127 total cpu time spent up to now is 50.6 secs Computing kpt #: 128 total cpu time spent up to now is 51.1 secs Computing kpt #: 129 total cpu time spent up to now is 51.6 secs Computing kpt #: 130 total cpu time spent up to now is 52.0 secs Computing kpt #: 131 total cpu time spent up to now is 52.5 secs Computing kpt #: 132 total cpu time spent up to now is 53.0 secs Computing kpt #: 133 total cpu time spent up to now is 53.4 secs Computing kpt #: 134 total cpu time spent up to now is 53.9 secs Computing kpt #: 135 total cpu time spent up to now is 54.3 secs Computing kpt #: 136 total cpu time spent up to now is 54.7 secs Computing kpt #: 137 total cpu time spent up to now is 55.1 secs Computing kpt #: 138 total cpu time spent up to now is 55.5 secs Computing kpt #: 139 total cpu time spent up to now is 55.9 secs Computing kpt #: 140 total cpu time spent up to now is 56.3 secs Computing kpt #: 141 total cpu time spent up to now is 56.6 secs Computing kpt #: 142 total cpu time spent up to now is 57.0 secs Computing kpt #: 143 total cpu time spent up to now is 57.4 secs Computing kpt #: 144 total cpu time spent up to now is 57.8 secs Computing kpt #: 145 total cpu time spent up to now is 58.2 secs Computing kpt #: 146 total cpu time spent up to now is 58.6 secs Computing kpt #: 147 total cpu time spent up to now is 59.0 secs Computing kpt #: 148 total cpu time spent up to now is 59.5 secs Computing kpt #: 149 total cpu time spent up to now is 60.0 secs Computing kpt #: 150 total cpu time spent up to now is 60.5 secs Computing kpt #: 151 total cpu time spent up to now is 61.0 secs Computing kpt #: 152 total cpu time spent up to now is 61.4 secs Computing kpt #: 153 total cpu time spent up to now is 61.9 secs Computing kpt #: 154 total cpu time spent up to now is 62.4 secs Computing kpt #: 155 total cpu time spent up to now is 62.9 secs Computing kpt #: 156 total cpu time spent up to now is 63.4 secs Computing kpt #: 157 total cpu time spent up to now is 64.0 secs Computing kpt #: 158 total cpu time spent up to now is 64.4 secs Computing kpt #: 159 total cpu time spent up to now is 64.9 secs Computing kpt #: 160 total cpu time spent up to now is 65.3 secs Computing kpt #: 161 total cpu time spent up to now is 65.8 secs Computing kpt #: 162 total cpu time spent up to now is 66.2 secs Computing kpt #: 163 total cpu time spent up to now is 66.6 secs Computing kpt #: 164 total cpu time spent up to now is 67.0 secs Computing kpt #: 165 total cpu time spent up to now is 67.5 secs Computing kpt #: 166 total cpu time spent up to now is 67.9 secs Computing kpt #: 167 total cpu time spent up to now is 68.3 secs Computing kpt #: 168 total cpu time spent up to now is 68.7 secs Computing kpt #: 169 total cpu time spent up to now is 69.1 secs Computing kpt #: 170 total cpu time spent up to now is 69.4 secs Computing kpt #: 171 total cpu time spent up to now is 69.8 secs Computing kpt #: 172 total cpu time spent up to now is 70.2 secs Computing kpt #: 173 total cpu time spent up to now is 70.6 secs Computing kpt #: 174 total cpu time spent up to now is 71.0 secs Computing kpt #: 175 total cpu time spent up to now is 71.4 secs Computing kpt #: 176 total cpu time spent up to now is 71.7 secs Computing kpt #: 177 total cpu time spent up to now is 72.1 secs Computing kpt #: 178 total cpu time spent up to now is 72.4 secs Computing kpt #: 179 total cpu time spent up to now is 72.8 secs Computing kpt #: 180 total cpu time spent up to now is 73.2 secs Computing kpt #: 181 total cpu time spent up to now is 73.7 secs Computing kpt #: 182 total cpu time spent up to now is 74.1 secs Computing kpt #: 183 total cpu time spent up to now is 74.4 secs Computing kpt #: 184 total cpu time spent up to now is 74.8 secs Computing kpt #: 185 total cpu time spent up to now is 75.1 secs Computing kpt #: 186 total cpu time spent up to now is 75.5 secs Computing kpt #: 187 total cpu time spent up to now is 75.8 secs Computing kpt #: 188 total cpu time spent up to now is 76.2 secs Computing kpt #: 189 total cpu time spent up to now is 76.5 secs Computing kpt #: 190 total cpu time spent up to now is 76.8 secs Computing kpt #: 191 total cpu time spent up to now is 77.2 secs Computing kpt #: 192 total cpu time spent up to now is 77.5 secs Computing kpt #: 193 total cpu time spent up to now is 77.9 secs Computing kpt #: 194 total cpu time spent up to now is 78.2 secs Computing kpt #: 195 total cpu time spent up to now is 78.5 secs Computing kpt #: 196 total cpu time spent up to now is 78.9 secs Computing kpt #: 197 total cpu time spent up to now is 79.2 secs Computing kpt #: 198 total cpu time spent up to now is 79.6 secs Computing kpt #: 199 total cpu time spent up to now is 79.9 secs Computing kpt #: 200 total cpu time spent up to now is 80.3 secs Computing kpt #: 201 total cpu time spent up to now is 80.6 secs Computing kpt #: 202 total cpu time spent up to now is 81.0 secs Computing kpt #: 203 total cpu time spent up to now is 81.3 secs Computing kpt #: 204 total cpu time spent up to now is 81.7 secs Computing kpt #: 205 total cpu time spent up to now is 82.0 secs Computing kpt #: 206 total cpu time spent up to now is 82.5 secs Computing kpt #: 207 total cpu time spent up to now is 82.9 secs Computing kpt #: 208 total cpu time spent up to now is 83.3 secs Computing kpt #: 209 total cpu time spent up to now is 83.8 secs Computing kpt #: 210 total cpu time spent up to now is 84.2 secs Computing kpt #: 211 total cpu time spent up to now is 84.7 secs Computing kpt #: 212 total cpu time spent up to now is 85.1 secs Computing kpt #: 213 total cpu time spent up to now is 85.6 secs Computing kpt #: 214 total cpu time spent up to now is 86.0 secs Computing kpt #: 215 total cpu time spent up to now is 86.4 secs Computing kpt #: 216 total cpu time spent up to now is 86.9 secs Computing kpt #: 217 total cpu time spent up to now is 87.3 secs Computing kpt #: 218 total cpu time spent up to now is 87.8 secs Computing kpt #: 219 total cpu time spent up to now is 88.2 secs Computing kpt #: 220 total cpu time spent up to now is 88.7 secs Computing kpt #: 221 total cpu time spent up to now is 89.2 secs Computing kpt #: 222 total cpu time spent up to now is 89.6 secs Computing kpt #: 223 total cpu time spent up to now is 90.1 secs Computing kpt #: 224 total cpu time spent up to now is 90.5 secs Computing kpt #: 225 total cpu time spent up to now is 91.1 secs Computing kpt #: 226 total cpu time spent up to now is 91.6 secs Computing kpt #: 227 total cpu time spent up to now is 92.2 secs Computing kpt #: 228 total cpu time spent up to now is 92.8 secs Computing kpt #: 229 total cpu time spent up to now is 93.4 secs Computing kpt #: 230 total cpu time spent up to now is 94.0 secs Computing kpt #: 231 total cpu time spent up to now is 94.7 secs Computing kpt #: 232 total cpu time spent up to now is 95.3 secs Computing kpt #: 233 total cpu time spent up to now is 96.0 secs Computing kpt #: 234 total cpu time spent up to now is 96.7 secs Computing kpt #: 235 total cpu time spent up to now is 97.3 secs Computing kpt #: 236 total cpu time spent up to now is 98.0 secs Computing kpt #: 237 total cpu time spent up to now is 98.6 secs Computing kpt #: 238 total cpu time spent up to now is 99.1 secs Computing kpt #: 239 total cpu time spent up to now is 99.7 secs Computing kpt #: 240 total cpu time spent up to now is 100.2 secs Computing kpt #: 241 total cpu time spent up to now is 100.7 secs Computing kpt #: 242 total cpu time spent up to now is 101.2 secs Computing kpt #: 243 total cpu time spent up to now is 101.8 secs Computing kpt #: 244 total cpu time spent up to now is 102.3 secs Computing kpt #: 245 total cpu time spent up to now is 102.8 secs Computing kpt #: 246 total cpu time spent up to now is 103.3 secs Computing kpt #: 247 total cpu time spent up to now is 103.8 secs Computing kpt #: 248 total cpu time spent up to now is 104.2 secs Computing kpt #: 249 total cpu time spent up to now is 104.7 secs Computing kpt #: 250 total cpu time spent up to now is 105.2 secs Computing kpt #: 251 total cpu time spent up to now is 105.6 secs Computing kpt #: 252 total cpu time spent up to now is 106.1 secs Computing kpt #: 253 total cpu time spent up to now is 106.6 secs Computing kpt #: 254 total cpu time spent up to now is 107.0 secs Computing kpt #: 255 total cpu time spent up to now is 107.5 secs Computing kpt #: 256 total cpu time spent up to now is 108.0 secs Computing kpt #: 257 total cpu time spent up to now is 108.4 secs Computing kpt #: 258 total cpu time spent up to now is 108.9 secs Computing kpt #: 259 total cpu time spent up to now is 109.4 secs Computing kpt #: 260 total cpu time spent up to now is 109.8 secs Computing kpt #: 261 total cpu time spent up to now is 110.3 secs Computing kpt #: 262 total cpu time spent up to now is 110.7 secs Computing kpt #: 263 total cpu time spent up to now is 111.2 secs Computing kpt #: 264 total cpu time spent up to now is 111.7 secs Computing kpt #: 265 total cpu time spent up to now is 112.1 secs Computing kpt #: 266 total cpu time spent up to now is 112.6 secs Computing kpt #: 267 total cpu time spent up to now is 113.1 secs Computing kpt #: 268 total cpu time spent up to now is 113.6 secs Computing kpt #: 269 total cpu time spent up to now is 114.0 secs Computing kpt #: 270 total cpu time spent up to now is 114.4 secs Computing kpt #: 271 total cpu time spent up to now is 114.9 secs Computing kpt #: 272 total cpu time spent up to now is 115.3 secs Computing kpt #: 273 total cpu time spent up to now is 115.7 secs Computing kpt #: 274 total cpu time spent up to now is 116.2 secs Computing kpt #: 275 total cpu time spent up to now is 116.7 secs Computing kpt #: 276 total cpu time spent up to now is 117.1 secs Computing kpt #: 277 total cpu time spent up to now is 117.6 secs Computing kpt #: 278 total cpu time spent up to now is 118.0 secs Computing kpt #: 279 total cpu time spent up to now is 118.5 secs Computing kpt #: 280 total cpu time spent up to now is 119.0 secs Computing kpt #: 281 total cpu time spent up to now is 119.5 secs Computing kpt #: 282 total cpu time spent up to now is 120.4 secs Computing kpt #: 283 total cpu time spent up to now is 120.9 secs Computing kpt #: 284 total cpu time spent up to now is 121.4 secs Computing kpt #: 285 total cpu time spent up to now is 121.7 secs Computing kpt #: 286 total cpu time spent up to now is 122.2 secs Computing kpt #: 287 total cpu time spent up to now is 122.6 secs Computing kpt #: 288 total cpu time spent up to now is 123.0 secs Computing kpt #: 289 total cpu time spent up to now is 123.4 secs Computing kpt #: 290 total cpu time spent up to now is 123.7 secs Computing kpt #: 291 total cpu time spent up to now is 124.1 secs Computing kpt #: 292 total cpu time spent up to now is 124.5 secs Computing kpt #: 293 total cpu time spent up to now is 124.8 secs Computing kpt #: 294 total cpu time spent up to now is 125.2 secs Computing kpt #: 295 total cpu time spent up to now is 125.6 secs Computing kpt #: 296 total cpu time spent up to now is 125.9 secs Computing kpt #: 297 total cpu time spent up to now is 126.3 secs Computing kpt #: 298 total cpu time spent up to now is 126.7 secs Computing kpt #: 299 total cpu time spent up to now is 127.0 secs Computing kpt #: 300 total cpu time spent up to now is 127.4 secs Computing kpt #: 301 total cpu time spent up to now is 127.8 secs Computing kpt #: 302 total cpu time spent up to now is 128.2 secs Computing kpt #: 303 total cpu time spent up to now is 128.6 secs Computing kpt #: 304 total cpu time spent up to now is 129.0 secs Computing kpt #: 305 total cpu time spent up to now is 129.5 secs Computing kpt #: 306 total cpu time spent up to now is 130.0 secs Computing kpt #: 307 total cpu time spent up to now is 130.5 secs Computing kpt #: 308 total cpu time spent up to now is 131.0 secs Computing kpt #: 309 total cpu time spent up to now is 131.4 secs Computing kpt #: 310 total cpu time spent up to now is 131.8 secs Computing kpt #: 311 total cpu time spent up to now is 132.1 secs Computing kpt #: 312 total cpu time spent up to now is 132.5 secs Computing kpt #: 313 total cpu time spent up to now is 132.8 secs Computing kpt #: 314 total cpu time spent up to now is 133.2 secs Computing kpt #: 315 total cpu time spent up to now is 133.6 secs Computing kpt #: 316 total cpu time spent up to now is 133.9 secs Computing kpt #: 317 total cpu time spent up to now is 134.2 secs Computing kpt #: 318 total cpu time spent up to now is 134.5 secs Computing kpt #: 319 total cpu time spent up to now is 134.8 secs Computing kpt #: 320 total cpu time spent up to now is 135.1 secs Computing kpt #: 321 total cpu time spent up to now is 135.4 secs Computing kpt #: 322 total cpu time spent up to now is 135.7 secs Computing kpt #: 323 total cpu time spent up to now is 136.0 secs Computing kpt #: 324 total cpu time spent up to now is 136.3 secs Computing kpt #: 325 total cpu time spent up to now is 136.6 secs Computing kpt #: 326 total cpu time spent up to now is 136.9 secs Computing kpt #: 327 total cpu time spent up to now is 137.2 secs Computing kpt #: 328 total cpu time spent up to now is 137.6 secs Computing kpt #: 329 total cpu time spent up to now is 137.9 secs Computing kpt #: 330 total cpu time spent up to now is 138.2 secs Computing kpt #: 331 total cpu time spent up to now is 138.5 secs Computing kpt #: 332 total cpu time spent up to now is 138.9 secs Computing kpt #: 333 total cpu time spent up to now is 139.2 secs Computing kpt #: 334 total cpu time spent up to now is 139.5 secs Computing kpt #: 335 total cpu time spent up to now is 139.9 secs Computing kpt #: 336 total cpu time spent up to now is 140.2 secs Computing kpt #: 337 total cpu time spent up to now is 140.6 secs Computing kpt #: 338 total cpu time spent up to now is 140.9 secs Computing kpt #: 339 total cpu time spent up to now is 141.3 secs Computing kpt #: 340 total cpu time spent up to now is 141.6 secs Computing kpt #: 341 total cpu time spent up to now is 142.0 secs Computing kpt #: 342 total cpu time spent up to now is 142.5 secs Computing kpt #: 343 total cpu time spent up to now is 142.9 secs Computing kpt #: 344 total cpu time spent up to now is 143.7 secs Computing kpt #: 345 total cpu time spent up to now is 144.3 secs Computing kpt #: 346 total cpu time spent up to now is 144.8 secs Computing kpt #: 347 total cpu time spent up to now is 145.5 secs Computing kpt #: 348 total cpu time spent up to now is 146.1 secs ethr = 2.08E-08, avg # of iterations = 19.0 total cpu time spent up to now is 146.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2763 PWs) bands (ev): -9.6929 -9.6929 -9.6514 -9.6514 -9.6480 -9.6480 -9.6323 -9.6323 -8.6740 -8.6740 -8.6438 -8.6438 -8.6268 -8.6268 -8.6056 -8.6056 -8.6009 -8.6009 -8.5825 -8.5825 1.3358 1.3358 6.5259 6.5259 7.4205 7.4205 9.0924 9.0924 9.1424 9.1424 9.3340 9.3340 9.9678 9.9678 9.9799 9.9799 10.4275 10.4275 10.5817 10.5817 11.0813 11.0813 11.1725 11.1725 12.4913 12.4913 13.9394 13.9394 14.3021 14.3021 15.5920 15.5920 15.8487 15.8487 16.4661 16.4661 17.9794 17.9794 k = 0.0111 0.0064-0.0000 ( 2761 PWs) bands (ev): -9.6929 -9.6929 -9.6514 -9.6514 -9.6480 -9.6480 -9.6323 -9.6323 -8.6739 -8.6739 -8.6438 -8.6438 -8.6268 -8.6268 -8.6055 -8.6055 -8.6009 -8.6009 -8.5825 -8.5825 1.3373 1.3373 6.5255 6.5255 7.4222 7.4222 9.0929 9.0929 9.1429 9.1429 9.3338 9.3338 9.9673 9.9673 9.9794 9.9794 10.4273 10.4273 10.5815 10.5815 11.0813 11.0813 11.1724 11.1724 12.4909 12.4909 13.9267 13.9267 14.2841 14.2841 15.5930 15.5930 15.8400 15.8400 16.4990 16.4990 17.9894 17.9894 k = 0.0222 0.0128-0.0000 ( 2749 PWs) bands (ev): -9.6929 -9.6929 -9.6514 -9.6514 -9.6480 -9.6480 -9.6323 -9.6323 -8.6739 -8.6739 -8.6438 -8.6438 -8.6268 -8.6268 -8.6055 -8.6055 -8.6008 -8.6008 -8.5826 -8.5826 1.3420 1.3420 6.5242 6.5242 7.4273 7.4273 9.0944 9.0944 9.1444 9.1444 9.3330 9.3330 9.9659 9.9659 9.9780 9.9780 10.4269 10.4269 10.5811 10.5811 11.0812 11.0812 11.1723 11.1723 12.4898 12.4898 13.8889 13.8889 14.2331 14.2331 15.5883 15.5883 15.8292 15.8292 16.5873 16.5873 18.0188 18.0188 k = 0.0333 0.0192-0.0000 ( 2749 PWs) bands (ev): -9.6928 -9.6928 -9.6514 -9.6514 -9.6480 -9.6480 -9.6323 -9.6323 -8.6738 -8.6738 -8.6438 -8.6438 -8.6268 -8.6268 -8.6053 -8.6053 -8.6006 -8.6006 -8.5827 -8.5827 1.3497 1.3497 6.5221 6.5221 7.4359 7.4359 9.0967 9.0967 9.1469 9.1469 9.3317 9.3317 9.9635 9.9635 9.9757 9.9757 10.4258 10.4258 10.5802 10.5802 11.0811 11.0811 11.1721 11.1721 12.4879 12.4879 13.8258 13.8258 14.1564 14.1564 15.5628 15.5628 15.8430 15.8430 16.7117 16.7117 18.0654 18.0654 k = 0.0444 0.0257-0.0000 ( 2751 PWs) bands (ev): -9.6927 -9.6927 -9.6513 -9.6513 -9.6480 -9.6480 -9.6323 -9.6323 -8.6737 -8.6737 -8.6439 -8.6439 -8.6269 -8.6269 -8.6051 -8.6051 -8.6003 -8.6003 -8.5829 -8.5829 1.3605 1.3605 6.5192 6.5192 7.4479 7.4479 9.0999 9.0999 9.1504 9.1504 9.3298 9.3298 9.9597 9.9597 9.9729 9.9729 10.4243 10.4243 10.5790 10.5790 11.0809 11.0809 11.1719 11.1719 12.4851 12.4851 13.7374 13.7374 14.0636 14.0636 15.5157 15.5157 15.8879 15.8879 16.8574 16.8574 18.1223 18.1223 k = 0.0556 0.0321-0.0000 ( 2767 PWs) bands (ev): -9.6925 -9.6925 -9.6512 -9.6512 -9.6480 -9.6480 -9.6323 -9.6323 -8.6736 -8.6736 -8.6439 -8.6439 -8.6269 -8.6269 -8.6049 -8.6049 -8.6000 -8.6000 -8.5831 -8.5831 1.3744 1.3744 6.5153 6.5153 7.4633 7.4633 9.1039 9.1039 9.1547 9.1547 9.3274 9.3274 9.9545 9.9545 9.9695 9.9695 10.4222 10.4222 10.5776 10.5776 11.0805 11.0805 11.1714 11.1714 12.4815 12.4815 13.6247 13.6247 13.9632 13.9632 15.4566 15.4566 15.9546 15.9546 17.0146 17.0146 18.1668 18.1668 k = 0.0667 0.0385-0.0000 ( 2763 PWs) bands (ev): -9.6924 -9.6924 -9.6512 -9.6512 -9.6480 -9.6480 -9.6323 -9.6323 -8.6734 -8.6734 -8.6440 -8.6440 -8.6269 -8.6269 -8.6046 -8.6046 -8.5997 -8.5997 -8.5833 -8.5833 1.3914 1.3914 6.5105 6.5105 7.4821 7.4821 9.1086 9.1086 9.1600 9.1600 9.3245 9.3245 9.9480 9.9480 9.9660 9.9660 10.4195 10.4195 10.5762 10.5762 11.0802 11.0802 11.1710 11.1710 12.4772 12.4772 13.4907 13.4907 13.8606 13.8606 15.3920 15.3920 16.0346 16.0346 17.1770 17.1770 18.1626 18.1626 k = 0.0778 0.0449-0.0000 ( 2761 PWs) bands (ev): -9.6922 -9.6922 -9.6511 -9.6511 -9.6480 -9.6480 -9.6323 -9.6323 -8.6733 -8.6733 -8.6440 -8.6440 -8.6269 -8.6269 -8.6043 -8.6043 -8.5992 -8.5992 -8.5836 -8.5836 1.4115 1.4115 6.5047 6.5047 7.5043 7.5043 9.1140 9.1140 9.1662 9.1662 9.3210 9.3210 9.9401 9.9401 9.9622 9.9622 10.4161 10.4161 10.5748 10.5748 11.0798 11.0798 11.1706 11.1706 12.4720 12.4720 13.3400 13.3400 13.7578 13.7578 15.3247 15.3247 16.1227 16.1227 17.3401 17.3401 18.1201 18.1201 k = 0.0889 0.0513-0.0000 ( 2757 PWs) bands (ev): -9.6919 -9.6919 -9.6511 -9.6511 -9.6479 -9.6479 -9.6323 -9.6323 -8.6731 -8.6731 -8.6441 -8.6441 -8.6269 -8.6269 -8.6039 -8.6039 -8.5988 -8.5988 -8.5838 -8.5838 1.4347 1.4347 6.4979 6.4979 7.5298 7.5298 9.1198 9.1198 9.1730 9.1730 9.3170 9.3170 9.9309 9.9309 9.9582 9.9582 10.4119 10.4119 10.5736 10.5736 11.0795 11.0795 11.1701 11.1701 12.4659 12.4659 13.1781 13.1781 13.6552 13.6552 15.2559 15.2559 16.2158 16.2158 17.5006 17.5006 18.0585 18.0585 k = 0.1000 0.0577-0.0000 ( 2755 PWs) bands (ev): -9.6917 -9.6917 -9.6512 -9.6512 -9.6478 -9.6478 -9.6323 -9.6323 -8.6728 -8.6728 -8.6441 -8.6441 -8.6269 -8.6269 -8.6035 -8.6035 -8.5983 -8.5983 -8.5841 -8.5841 1.4609 1.4609 6.4900 6.4900 7.5587 7.5587 9.1261 9.1261 9.1802 9.1802 9.3125 9.3125 9.9207 9.9207 9.9540 9.9540 10.4068 10.4068 10.5726 10.5726 11.0790 11.0790 11.1695 11.1695 12.4589 12.4589 13.0093 13.0093 13.5525 13.5525 15.1859 15.1859 16.3117 16.3117 17.6545 17.6545 17.9854 17.9854 k = 0.1111 0.0642-0.0000 ( 2759 PWs) bands (ev): -9.6914 -9.6914 -9.6513 -9.6513 -9.6476 -9.6476 -9.6323 -9.6323 -8.6726 -8.6726 -8.6442 -8.6442 -8.6269 -8.6269 -8.6032 -8.6032 -8.5977 -8.5977 -8.5844 -8.5844 1.4902 1.4902 6.4810 6.4810 7.5908 7.5908 9.1326 9.1326 9.1871 9.1871 9.3081 9.3081 9.9095 9.9095 9.9497 9.9497 10.4006 10.4006 10.5719 10.5719 11.0784 11.0784 11.1689 11.1689 12.4508 12.4508 12.8373 12.8373 13.4496 13.4496 15.1151 15.1151 16.4084 16.4084 17.7828 17.7828 17.9197 17.9197 k = 0.1222 0.0706-0.0000 ( 2763 PWs) bands (ev): -9.6911 -9.6911 -9.6514 -9.6514 -9.6474 -9.6474 -9.6323 -9.6323 -8.6723 -8.6723 -8.6442 -8.6442 -8.6269 -8.6269 -8.6028 -8.6028 -8.5972 -8.5972 -8.5847 -8.5847 1.5226 1.5226 6.4707 6.4707 7.6263 7.6263 9.1392 9.1392 9.1928 9.1928 9.3041 9.3041 9.8976 9.8976 9.9452 9.9452 10.3935 10.3935 10.5716 10.5716 11.0777 11.0777 11.1682 11.1682 12.4412 12.4412 12.6650 12.6650 13.3466 13.3466 15.0433 15.0433 16.5045 16.5045 17.7638 17.7638 17.9816 17.9816 k = 0.1333 0.0770-0.0000 ( 2767 PWs) bands (ev): -9.6908 -9.6908 -9.6516 -9.6516 -9.6471 -9.6471 -9.6322 -9.6322 -8.6720 -8.6720 -8.6443 -8.6443 -8.6269 -8.6269 -8.6024 -8.6024 -8.5966 -8.5966 -8.5849 -8.5849 1.5580 1.5580 6.4591 6.4591 7.6649 7.6649 9.1454 9.1454 9.1963 9.1963 9.3018 9.3018 9.8854 9.8854 9.9408 9.9408 10.3854 10.3854 10.5719 10.5719 11.0770 11.0770 11.1674 11.1674 12.4269 12.4269 12.4979 12.4979 13.2437 13.2437 14.9708 14.9708 16.5985 16.5985 17.6619 17.6619 18.1003 18.1003 k = 0.1444 0.0834-0.0000 ( 2765 PWs) bands (ev): -9.6904 -9.6904 -9.6518 -9.6518 -9.6467 -9.6467 -9.6322 -9.6322 -8.6717 -8.6717 -8.6443 -8.6443 -8.6269 -8.6269 -8.6020 -8.6020 -8.5960 -8.5960 -8.5850 -8.5850 1.5965 1.5965 6.4461 6.4461 7.7068 7.7068 9.1504 9.1504 9.1965 9.1965 9.3024 9.3024 9.8732 9.8732 9.9364 9.9364 10.3763 10.3763 10.5727 10.5727 11.0762 11.0762 11.1667 11.1667 12.3190 12.3190 12.4266 12.4266 13.1411 13.1411 14.8976 14.8976 16.6887 16.6887 17.5449 17.5449 18.1905 18.1905 k = 0.1556 0.0898-0.0000 ( 2773 PWs) bands (ev): -9.6900 -9.6900 -9.6521 -9.6521 -9.6463 -9.6463 -9.6322 -9.6322 -8.6714 -8.6714 -8.6444 -8.6444 -8.6268 -8.6268 -8.6018 -8.6018 -8.5955 -8.5955 -8.5851 -8.5851 1.6380 1.6380 6.4315 6.4315 7.7518 7.7518 9.1517 9.1517 9.1942 9.1942 9.3065 9.3065 9.8613 9.8613 9.9320 9.9320 10.3662 10.3662 10.5740 10.5740 11.0753 11.0753 11.1659 11.1659 12.1575 12.1575 12.4122 12.4122 13.0391 13.0391 14.8236 14.8236 16.7723 16.7723 17.4212 17.4212 18.2125 18.2125 k = 0.1667 0.0962-0.0000 ( 2775 PWs) bands (ev): -9.6896 -9.6896 -9.6524 -9.6524 -9.6459 -9.6459 -9.6322 -9.6322 -8.6711 -8.6711 -8.6444 -8.6444 -8.6268 -8.6268 -8.6015 -8.6015 -8.5949 -8.5949 -8.5851 -8.5851 1.6825 1.6825 6.4152 6.4152 7.7999 7.7999 9.1448 9.1448 9.1933 9.1933 9.3139 9.3139 9.8505 9.8505 9.9279 9.9279 10.3553 10.3553 10.5759 10.5759 11.0742 11.0742 11.1650 11.1650 12.0001 12.0001 12.3984 12.3984 12.9378 12.9378 14.7488 14.7488 16.8437 16.8437 17.2981 17.2981 18.1621 18.1621 k = 0.1778 0.1026-0.0000 ( 2777 PWs) bands (ev): -9.6892 -9.6892 -9.6527 -9.6527 -9.6454 -9.6454 -9.6322 -9.6322 -8.6707 -8.6707 -8.6445 -8.6445 -8.6266 -8.6266 -8.6014 -8.6014 -8.5943 -8.5943 -8.5849 -8.5849 1.7300 1.7300 6.3970 6.3970 7.8511 7.8511 9.1268 9.1268 9.1966 9.1966 9.3237 9.3237 9.8414 9.8414 9.9242 9.9242 10.3436 10.3436 10.5782 10.5782 11.0729 11.0729 11.1640 11.1640 11.8494 11.8494 12.3835 12.3835 12.8376 12.8376 14.6733 14.6733 16.8850 16.8850 17.1944 17.1944 18.0731 18.0731 k = 0.1889 0.1091-0.0000 ( 2777 PWs) bands (ev): -9.6888 -9.6888 -9.6531 -9.6531 -9.6449 -9.6449 -9.6322 -9.6322 -8.6704 -8.6704 -8.6446 -8.6446 -8.6265 -8.6265 -8.6014 -8.6014 -8.5938 -8.5938 -8.5846 -8.5846 1.7805 1.7805 6.3768 6.3768 7.9052 7.9052 9.0991 9.0991 9.2028 9.2028 9.3349 9.3349 9.8346 9.8346 9.9211 9.9211 10.3312 10.3312 10.5810 10.5810 11.0714 11.0714 11.1629 11.1629 11.7068 11.7068 12.3671 12.3671 12.7386 12.7386 14.5970 14.5970 16.8531 16.8531 17.1540 17.1540 17.9684 17.9684 k = 0.2000 0.1155-0.0000 ( 2777 PWs) bands (ev): -9.6883 -9.6883 -9.6535 -9.6535 -9.6444 -9.6444 -9.6322 -9.6322 -8.6700 -8.6700 -8.6446 -8.6446 -8.6263 -8.6263 -8.6016 -8.6016 -8.5932 -8.5932 -8.5842 -8.5842 1.8340 1.8340 6.3544 6.3544 7.9623 7.9623 9.0630 9.0630 9.2104 9.2104 9.3465 9.3465 9.8309 9.8309 9.9186 9.9186 10.3184 10.3184 10.5843 10.5843 11.0694 11.0694 11.1616 11.1616 11.5732 11.5732 12.3486 12.3486 12.6414 12.6414 14.5198 14.5198 16.7454 16.7454 17.1803 17.1803 17.8579 17.8579 k = 0.2111 0.1219-0.0000 ( 2781 PWs) bands (ev): -9.6879 -9.6879 -9.6539 -9.6539 -9.6439 -9.6439 -9.6322 -9.6322 -8.6696 -8.6696 -8.6447 -8.6447 -8.6261 -8.6261 -8.6018 -8.6018 -8.5926 -8.5926 -8.5837 -8.5837 1.8904 1.8904 6.3296 6.3296 8.0221 8.0221 9.0194 9.0194 9.2185 9.2185 9.3578 9.3578 9.8309 9.8309 9.9169 9.9169 10.3050 10.3050 10.5879 10.5879 11.0666 11.0666 11.1598 11.1598 11.4501 11.4501 12.3274 12.3274 12.5467 12.5467 14.4417 14.4417 16.6071 16.6071 17.2286 17.2286 17.7465 17.7465 k = 0.2222 0.1283-0.0000 ( 2769 PWs) bands (ev): -9.6874 -9.6874 -9.6544 -9.6544 -9.6434 -9.6434 -9.6322 -9.6322 -8.6692 -8.6692 -8.6448 -8.6448 -8.6259 -8.6259 -8.6022 -8.6022 -8.5920 -8.5920 -8.5830 -8.5830 1.9497 1.9497 6.3021 6.3021 8.0846 8.0846 8.9686 8.9686 9.2270 9.2270 9.3684 9.3684 9.8353 9.8353 9.9162 9.9162 10.2916 10.2916 10.5919 10.5919 11.0622 11.0622 11.1570 11.1570 11.3392 11.3392 12.3017 12.3017 12.4562 12.4562 14.3627 14.3627 16.4586 16.4586 17.2787 17.2787 17.6378 17.6378 k = 0.2333 0.1347-0.0000 ( 2771 PWs) bands (ev): -9.6869 -9.6869 -9.6549 -9.6549 -9.6428 -9.6428 -9.6322 -9.6322 -8.6688 -8.6688 -8.6450 -8.6450 -8.6256 -8.6256 -8.6027 -8.6027 -8.5914 -8.5914 -8.5823 -8.5823 2.0120 2.0120 6.2717 6.2717 8.1496 8.1496 8.9110 8.9110 9.2354 9.2354 9.3778 9.3778 9.8442 9.8442 9.9166 9.9166 10.2779 10.2779 10.5961 10.5961 11.0538 11.0538 11.1506 11.1506 11.2457 11.2457 12.2665 12.2665 12.3749 12.3749 14.2827 14.2827 16.3062 16.3062 17.3214 17.3214 17.5369 17.5369 k = 0.2444 0.1411-0.0000 ( 2767 PWs) bands (ev): -9.6864 -9.6864 -9.6554 -9.6554 -9.6422 -9.6422 -9.6322 -9.6322 -8.6684 -8.6684 -8.6451 -8.6451 -8.6253 -8.6253 -8.6032 -8.6032 -8.5907 -8.5907 -8.5816 -8.5816 2.0771 2.0771 6.2381 6.2381 8.2168 8.2168 8.8474 8.8474 9.2436 9.2436 9.3858 9.3858 9.8580 9.8580 9.9182 9.9182 10.2643 10.2643 10.6006 10.6006 11.0334 11.0334 11.1302 11.1302 11.1880 11.1880 12.2114 12.2114 12.3128 12.3128 14.2017 14.2017 16.1529 16.1529 17.3352 17.3352 17.4641 17.4641 k = 0.2556 0.1475-0.0000 ( 2773 PWs) bands (ev): -9.6859 -9.6859 -9.6559 -9.6559 -9.6417 -9.6417 -9.6322 -9.6322 -8.6680 -8.6680 -8.6453 -8.6453 -8.6250 -8.6250 -8.6039 -8.6039 -8.5901 -8.5901 -8.5808 -8.5808 2.1451 2.1451 6.2010 6.2010 8.2859 8.2859 8.7789 8.7789 9.2516 9.2516 9.3925 9.3925 9.8762 9.8762 9.9213 9.9213 10.2508 10.2508 10.6052 10.6052 10.9880 10.9880 11.1029 11.1029 11.1716 11.1716 12.1363 12.1363 12.2703 12.2703 14.1199 14.1199 16.0003 16.0003 17.2797 17.2797 17.4602 17.4602 k = 0.2667 0.1540-0.0000 ( 2769 PWs) bands (ev): -9.6854 -9.6854 -9.6564 -9.6564 -9.6411 -9.6411 -9.6322 -9.6322 -8.6676 -8.6676 -8.6454 -8.6454 -8.6247 -8.6247 -8.6045 -8.6045 -8.5894 -8.5894 -8.5800 -8.5800 2.2159 2.2159 6.1602 6.1602 8.3559 8.3559 8.7075 8.7075 9.2591 9.2591 9.3979 9.3979 9.8988 9.8988 9.9261 9.9261 10.2377 10.2377 10.6099 10.6099 10.9262 10.9262 11.0899 11.0899 11.1670 11.1670 12.0530 12.0530 12.2351 12.2351 14.0372 14.0372 15.8495 15.8495 17.1930 17.1930 17.4872 17.4872 k = 0.2778 0.1604-0.0000 ( 2767 PWs) bands (ev): -9.6849 -9.6849 -9.6569 -9.6569 -9.6405 -9.6405 -9.6322 -9.6322 -8.6672 -8.6672 -8.6456 -8.6456 -8.6243 -8.6243 -8.6053 -8.6053 -8.5887 -8.5887 -8.5792 -8.5792 2.2895 2.2895 6.1152 6.1152 8.4236 8.4236 8.6374 8.6374 9.2662 9.2662 9.4021 9.4021 9.9246 9.9246 9.9334 9.9334 10.2252 10.2252 10.6148 10.6148 10.8636 10.8636 11.0838 11.0838 11.1647 11.1647 11.9678 11.9678 12.2009 12.2009 13.9537 13.9537 15.7016 15.7016 17.1037 17.1037 17.5172 17.5172 k = 0.2889 0.1668-0.0000 ( 2771 PWs) bands (ev): -9.6843 -9.6843 -9.6575 -9.6575 -9.6400 -9.6400 -9.6322 -9.6322 -8.6667 -8.6667 -8.6459 -8.6459 -8.6239 -8.6239 -8.6060 -8.6060 -8.5880 -8.5880 -8.5783 -8.5783 2.3658 2.3658 6.0659 6.0659 8.4697 8.4697 8.5889 8.5889 9.2726 9.2726 9.4053 9.4053 9.9398 9.9398 9.9566 9.9566 10.2133 10.2133 10.6197 10.6197 10.8057 10.8057 11.0802 11.0802 11.1631 11.1631 11.8830 11.8830 12.1652 12.1652 13.8696 13.8696 15.5572 15.5572 17.0171 17.0171 17.5452 17.5452 k = 0.3000 0.1732-0.0000 ( 2771 PWs) bands (ev): -9.6838 -9.6838 -9.6580 -9.6580 -9.6394 -9.6394 -9.6321 -9.6321 -8.6663 -8.6663 -8.6461 -8.6461 -8.6235 -8.6235 -8.6067 -8.6067 -8.5873 -8.5873 -8.5775 -8.5775 2.4448 2.4448 6.0120 6.0120 8.4387 8.4387 8.6187 8.6187 9.2785 9.2785 9.4078 9.4078 9.9503 9.9503 9.9895 9.9895 10.2026 10.2026 10.6245 10.6245 10.7538 10.7538 11.0777 11.0777 11.1620 11.1620 11.7992 11.7992 12.1271 12.1271 13.7850 13.7850 15.4172 15.4172 16.9348 16.9348 17.5702 17.5702 k = 0.3111 0.1796-0.0000 ( 2770 PWs) bands (ev): -9.6833 -9.6833 -9.6586 -9.6586 -9.6389 -9.6389 -9.6321 -9.6321 -8.6658 -8.6658 -8.6464 -8.6464 -8.6230 -8.6230 -8.6075 -8.6075 -8.5866 -8.5866 -8.5767 -8.5767 2.5264 2.5264 5.9532 5.9532 8.3696 8.3696 8.6885 8.6885 9.2836 9.2836 9.4096 9.4096 9.9626 9.9626 10.0250 10.0250 10.1931 10.1931 10.6293 10.6293 10.7080 10.7080 11.0759 11.0759 11.1610 11.1610 11.7170 11.7170 12.0860 12.0860 13.7003 13.7003 15.2821 15.2821 16.8573 16.8573 17.5921 17.5921 k = 0.3222 0.1860-0.0000 ( 2768 PWs) bands (ev): -9.6827 -9.6827 -9.6591 -9.6591 -9.6384 -9.6384 -9.6321 -9.6321 -8.6654 -8.6654 -8.6466 -8.6466 -8.6226 -8.6226 -8.6082 -8.6082 -8.5860 -8.5860 -8.5759 -8.5759 2.6106 2.6106 5.8893 5.8893 8.2956 8.2956 8.7662 8.7662 9.2881 9.2881 9.4109 9.4109 9.9770 9.9770 10.0623 10.0623 10.1854 10.1854 10.6337 10.6337 10.6681 10.6681 11.0745 11.0745 11.1601 11.1601 11.6365 11.6365 12.0415 12.0415 13.6155 13.6155 15.1527 15.1527 16.7847 16.7847 17.6111 17.6111 k = 0.3333 0.1925-0.0000 ( 2762 PWs) bands (ev): -9.6822 -9.6822 -9.6597 -9.6597 -9.6380 -9.6380 -9.6320 -9.6320 -8.6649 -8.6649 -8.6469 -8.6469 -8.6222 -8.6222 -8.6089 -8.6089 -8.5853 -8.5853 -8.5751 -8.5751 2.6973 2.6973 5.8203 5.8203 8.2225 8.2225 8.8466 8.8466 9.2919 9.2919 9.4119 9.4119 9.9934 9.9934 10.1003 10.1003 10.1802 10.1802 10.6304 10.6304 10.6415 10.6415 11.0732 11.0732 11.1592 11.1592 11.5579 11.5579 11.9933 11.9933 13.5312 13.5312 15.0296 15.0296 16.7172 16.7172 17.6275 17.6275 k = 0.3444 0.1989-0.0000 ( 2750 PWs) bands (ev): -9.6817 -9.6817 -9.6603 -9.6603 -9.6375 -9.6375 -9.6319 -9.6319 -8.6644 -8.6644 -8.6472 -8.6472 -8.6218 -8.6218 -8.6096 -8.6096 -8.5847 -8.5847 -8.5744 -8.5744 2.7864 2.7864 5.7462 5.7462 8.1522 8.1522 8.9279 8.9279 9.2950 9.2950 9.4127 9.4127 10.0120 10.0120 10.1361 10.1361 10.1803 10.1803 10.6028 10.6028 10.6443 10.6443 11.0722 11.0722 11.1583 11.1583 11.4815 11.4815 11.9411 11.9411 13.4477 13.4477 14.9131 14.9131 16.6548 16.6548 17.6415 17.6415 k = 0.3556 0.2053-0.0000 ( 2754 PWs) bands (ev): -9.6811 -9.6811 -9.6608 -9.6608 -9.6371 -9.6371 -9.6318 -9.6318 -8.6640 -8.6640 -8.6476 -8.6476 -8.6214 -8.6214 -8.6102 -8.6102 -8.5841 -8.5841 -8.5737 -8.5737 2.8778 2.8778 5.6670 5.6670 8.0858 8.0858 9.0093 9.0093 9.2974 9.2974 9.4133 9.4133 10.0322 10.0322 10.1589 10.1589 10.1963 10.1963 10.5785 10.5785 10.6485 10.6485 11.0712 11.0712 11.1569 11.1569 11.4074 11.4074 11.8846 11.8846 13.3652 13.3652 14.8039 14.8039 16.5974 16.5974 17.6533 17.6533 k = 0.3667 0.2117-0.0000 ( 2750 PWs) bands (ev): -9.6806 -9.6806 -9.6614 -9.6614 -9.6368 -9.6368 -9.6318 -9.6318 -8.6635 -8.6635 -8.6479 -8.6479 -8.6211 -8.6211 -8.6108 -8.6108 -8.5835 -8.5835 -8.5730 -8.5730 2.9714 2.9714 5.5831 5.5831 8.0241 8.0241 9.0897 9.0897 9.2993 9.2993 9.4138 9.4138 10.0541 10.0541 10.1672 10.1672 10.2295 10.2295 10.5593 10.5593 10.6527 10.6527 11.0703 11.0703 11.1551 11.1551 11.3363 11.3363 11.8239 11.8239 13.2845 13.2845 14.7023 14.7023 16.5448 16.5448 17.6633 17.6633 k = 0.3778 0.2181-0.0000 ( 2750 PWs) bands (ev): -9.6801 -9.6801 -9.6620 -9.6620 -9.6365 -9.6365 -9.6316 -9.6316 -8.6631 -8.6631 -8.6482 -8.6482 -8.6208 -8.6208 -8.6114 -8.6114 -8.5830 -8.5830 -8.5724 -8.5724 3.0670 3.0670 5.4946 5.4946 7.9673 7.9673 9.1680 9.1680 9.3007 9.3007 9.4144 9.4144 10.0772 10.0772 10.1753 10.1753 10.2653 10.2653 10.5454 10.5454 10.6568 10.6568 11.0696 11.0696 11.1515 11.1515 11.2693 11.2693 11.7588 11.7588 13.2059 13.2059 14.6086 14.6086 16.4971 16.4971 17.6717 17.6717 k = 0.3889 0.2245-0.0000 ( 2748 PWs) bands (ev): -9.6796 -9.6796 -9.6625 -9.6625 -9.6362 -9.6362 -9.6315 -9.6315 -8.6626 -8.6626 -8.6486 -8.6486 -8.6205 -8.6205 -8.6119 -8.6119 -8.5825 -8.5825 -8.5719 -8.5719 3.1646 3.1646 5.4020 5.4020 7.9157 7.9157 9.2428 9.2428 9.3019 9.3019 9.4154 9.4154 10.1011 10.1011 10.1875 10.1875 10.2992 10.2992 10.5378 10.5378 10.6606 10.6606 11.0688 11.0688 11.1414 11.1414 11.2114 11.2114 11.6894 11.6894 13.1302 13.1302 14.5231 14.5231 16.4541 16.4541 17.6787 17.6787 k = 0.4000 0.2309-0.0000 ( 2744 PWs) bands (ev): -9.6791 -9.6791 -9.6630 -9.6630 -9.6360 -9.6360 -9.6314 -9.6314 -8.6622 -8.6622 -8.6489 -8.6489 -8.6202 -8.6202 -8.6123 -8.6123 -8.5821 -8.5821 -8.5713 -8.5713 3.2638 3.2638 5.3058 5.3058 7.8695 7.8695 9.2991 9.2991 9.3158 9.3158 9.4176 9.4176 10.1256 10.1256 10.2049 10.2049 10.3292 10.3292 10.5370 10.5370 10.6644 10.6644 11.0679 11.0679 11.1093 11.1093 11.1788 11.1788 11.6160 11.6160 13.0579 13.0579 14.4459 14.4459 16.4156 16.4156 17.6845 17.6845 k = 0.4111 0.2374-0.0000 ( 2740 PWs) bands (ev): -9.6786 -9.6786 -9.6635 -9.6635 -9.6358 -9.6358 -9.6313 -9.6313 -8.6617 -8.6617 -8.6493 -8.6493 -8.6201 -8.6201 -8.6126 -8.6126 -8.5816 -8.5816 -8.5709 -8.5709 3.3644 3.3644 5.2066 5.2066 7.8286 7.8286 9.3015 9.3015 9.3723 9.3723 9.4252 9.4252 10.1510 10.1510 10.2272 10.2272 10.3548 10.3548 10.5433 10.5433 10.6679 10.6679 11.0547 11.0547 11.0699 11.0699 11.1691 11.1691 11.5389 11.5389 12.9897 12.9897 14.3772 14.3772 16.3816 16.3816 17.6893 17.6893 k = 0.4222 0.2438-0.0000 ( 2744 PWs) bands (ev): -9.6782 -9.6782 -9.6640 -9.6640 -9.6356 -9.6356 -9.6311 -9.6311 -8.6613 -8.6613 -8.6496 -8.6496 -8.6199 -8.6199 -8.6129 -8.6129 -8.5813 -8.5813 -8.5704 -8.5704 3.4660 3.4660 5.1053 5.1053 7.7930 7.7930 9.3017 9.3017 9.4004 9.4004 9.4562 9.4562 10.1781 10.1781 10.2523 10.2523 10.3774 10.3774 10.5559 10.5559 10.6713 10.6713 11.0019 11.0019 11.0677 11.0677 11.1656 11.1656 11.4584 11.4584 12.9266 12.9266 14.3170 14.3170 16.3519 16.3519 17.6932 17.6932 k = 0.4333 0.2502-0.0000 ( 2744 PWs) bands (ev): -9.6778 -9.6778 -9.6644 -9.6644 -9.6355 -9.6355 -9.6310 -9.6310 -8.6609 -8.6609 -8.6499 -8.6499 -8.6198 -8.6198 -8.6131 -8.6131 -8.5809 -8.5809 -8.5701 -8.5701 3.5680 3.5680 5.0026 5.0026 7.7625 7.7625 9.3016 9.3016 9.4063 9.4063 9.5016 9.5016 10.2075 10.2075 10.2770 10.2770 10.4003 10.4003 10.5726 10.5726 10.6747 10.6747 10.9510 10.9510 11.0671 11.0671 11.1640 11.1640 11.3752 11.3752 12.8692 12.8692 14.2651 14.2651 16.3264 16.3264 17.6963 17.6963 k = 0.4444 0.2566-0.0000 ( 2746 PWs) bands (ev): -9.6774 -9.6774 -9.6648 -9.6648 -9.6354 -9.6354 -9.6309 -9.6309 -8.6606 -8.6606 -8.6502 -8.6502 -8.6198 -8.6198 -8.6133 -8.6133 -8.5806 -8.5806 -8.5698 -8.5698 3.6697 3.6697 4.8997 4.8997 7.7371 7.7371 9.3014 9.3014 9.4080 9.4080 9.5424 9.5424 10.2387 10.2387 10.2984 10.2984 10.4267 10.4267 10.5910 10.5910 10.6786 10.6786 10.9058 10.9058 11.0666 11.0666 11.1631 11.1631 11.2901 11.2901 12.8186 12.8186 14.2215 14.2215 16.3050 16.3050 17.6988 17.6988 k = 0.4556 0.2630-0.0000 ( 2740 PWs) bands (ev): -9.6771 -9.6771 -9.6652 -9.6652 -9.6353 -9.6353 -9.6308 -9.6308 -8.6602 -8.6602 -8.6505 -8.6505 -8.6197 -8.6197 -8.6134 -8.6134 -8.5804 -8.5804 -8.5695 -8.5695 3.7696 3.7696 4.7985 4.7985 7.7165 7.7165 9.3012 9.3012 9.4088 9.4088 9.5755 9.5755 10.2688 10.2688 10.3172 10.3172 10.4546 10.4546 10.6104 10.6104 10.6842 10.6842 10.8687 10.8687 11.0662 11.0662 11.1624 11.1624 11.2041 11.2041 12.7756 12.7756 14.1861 14.1861 16.2877 16.2877 17.7007 17.7007 k = 0.4667 0.2694-0.0000 ( 2736 PWs) bands (ev): -9.6768 -9.6768 -9.6654 -9.6654 -9.6352 -9.6352 -9.6307 -9.6307 -8.6600 -8.6600 -8.6507 -8.6507 -8.6197 -8.6197 -8.6134 -8.6134 -8.5802 -8.5802 -8.5693 -8.5693 3.8651 3.8651 4.7016 4.7016 7.7007 7.7007 9.3009 9.3009 9.4092 9.4092 9.6005 9.6005 10.2911 10.2911 10.3401 10.3401 10.4753 10.4753 10.6317 10.6317 10.6949 10.6949 10.8418 10.8418 11.0654 11.0654 11.1187 11.1187 11.1621 11.1621 12.7411 12.7411 14.1588 14.1588 16.2742 16.2742 17.7021 17.7021 k = 0.4778 0.2758-0.0000 ( 2740 PWs) bands (ev): -9.6766 -9.6766 -9.6657 -9.6657 -9.6352 -9.6352 -9.6306 -9.6306 -8.6598 -8.6598 -8.6509 -8.6509 -8.6197 -8.6197 -8.6135 -8.6135 -8.5801 -8.5801 -8.5692 -8.5692 3.9508 3.9508 4.6148 4.6148 7.6894 7.6894 9.3007 9.3007 9.4093 9.4093 9.6177 9.6177 10.3023 10.3023 10.3710 10.3710 10.4791 10.4791 10.6504 10.6504 10.7199 10.7199 10.8262 10.8262 11.0331 11.0331 11.0673 11.0673 11.1618 11.1618 12.7157 12.7157 14.1393 14.1393 16.2647 16.2647 17.7031 17.7031 k = 0.4889 0.2823-0.0000 ( 2750 PWs) bands (ev): -9.6765 -9.6765 -9.6658 -9.6658 -9.6352 -9.6352 -9.6306 -9.6306 -8.6597 -8.6597 -8.6510 -8.6510 -8.6197 -8.6197 -8.6135 -8.6135 -8.5800 -8.5800 -8.5691 -8.5691 4.0158 4.0158 4.5490 4.5490 7.6827 7.6827 9.3005 9.3005 9.4094 9.4094 9.6277 9.6277 10.3068 10.3068 10.4047 10.4047 10.4655 10.4655 10.6593 10.6593 10.7586 10.7586 10.8246 10.8246 10.9577 10.9577 11.0663 11.0663 11.1616 11.1616 12.7002 12.7002 14.1276 14.1276 16.2589 16.2589 17.7037 17.7037 k = 0.5000 0.2887-0.0000 ( 2750 PWs) bands (ev): -9.6765 -9.6765 -9.6658 -9.6658 -9.6351 -9.6351 -9.6306 -9.6306 -8.6596 -8.6596 -8.6510 -8.6510 -8.6197 -8.6197 -8.6135 -8.6135 -8.5800 -8.5800 -8.5690 -8.5690 4.0415 4.0415 4.5231 4.5231 7.6804 7.6804 9.3005 9.3005 9.4094 9.4094 9.6310 9.6310 10.3080 10.3080 10.4299 10.4299 10.4467 10.4467 10.6617 10.6617 10.7777 10.7777 10.8377 10.8377 10.9142 10.9142 11.0662 11.0662 11.1616 11.1616 12.6950 12.6950 14.1237 14.1237 16.2570 16.2570 17.7039 17.7039 k = 0.5000 0.2887-0.0000 ( 2750 PWs) bands (ev): -9.6765 -9.6765 -9.6658 -9.6658 -9.6351 -9.6351 -9.6306 -9.6306 -8.6596 -8.6596 -8.6510 -8.6510 -8.6197 -8.6197 -8.6135 -8.6135 -8.5800 -8.5800 -8.5690 -8.5690 4.0415 4.0415 4.5231 4.5231 7.6804 7.6804 9.3005 9.3005 9.4094 9.4094 9.6310 9.6310 10.3080 10.3080 10.4299 10.4299 10.4467 10.4467 10.6617 10.6617 10.7777 10.7777 10.8377 10.8377 10.9142 10.9142 11.0662 11.0662 11.1616 11.1616 12.6950 12.6950 14.1237 14.1237 16.2570 16.2570 17.7039 17.7039 k = 0.4936 0.2998-0.0000 ( 2746 PWs) bands (ev): -9.6765 -9.6765 -9.6658 -9.6658 -9.6351 -9.6351 -9.6306 -9.6306 -8.6597 -8.6597 -8.6510 -8.6510 -8.6199 -8.6199 -8.6133 -8.6133 -8.5800 -8.5800 -8.5691 -8.5691 4.0427 4.0427 4.5244 4.5244 7.6791 7.6791 9.2986 9.2986 9.4070 9.4070 9.6318 9.6318 10.2999 10.2999 10.4175 10.4175 10.4588 10.4588 10.6564 10.6564 10.7847 10.7847 10.8417 10.8417 10.9149 10.9149 11.0662 11.0662 11.1617 11.1617 12.7027 12.7027 14.1223 14.1223 16.2644 16.2644 17.6649 17.6649 k = 0.4872 0.3109-0.0000 ( 2744 PWs) bands (ev): -9.6765 -9.6765 -9.6658 -9.6658 -9.6351 -9.6351 -9.6306 -9.6306 -8.6598 -8.6598 -8.6508 -8.6508 -8.6205 -8.6205 -8.6127 -8.6127 -8.5800 -8.5800 -8.5691 -8.5691 4.0461 4.0461 4.5282 4.5282 7.6752 7.6752 9.2930 9.2930 9.3995 9.3995 9.6343 9.6343 10.2759 10.2759 10.4035 10.4035 10.4705 10.4705 10.6469 10.6469 10.7985 10.7985 10.8555 10.8555 10.9176 10.9176 11.0663 11.0663 11.1619 11.1619 12.7250 12.7250 14.1179 14.1179 16.2864 16.2864 17.5613 17.5613 k = 0.4808 0.3220-0.0000 ( 2744 PWs) bands (ev): -9.6765 -9.6765 -9.6659 -9.6659 -9.6351 -9.6351 -9.6306 -9.6306 -8.6600 -8.6600 -8.6505 -8.6505 -8.6212 -8.6212 -8.6119 -8.6119 -8.5800 -8.5800 -8.5692 -8.5692 4.0518 4.0518 4.5346 4.5346 7.6684 7.6684 9.2837 9.2837 9.3868 9.3868 9.6384 9.6384 10.2389 10.2389 10.3937 10.3937 10.4717 10.4717 10.6428 10.6428 10.8103 10.8103 10.8775 10.8775 10.9260 10.9260 11.0664 11.0664 11.1624 11.1624 12.7606 12.7606 14.1105 14.1105 16.3232 16.3232 17.4177 17.4177 k = 0.4744 0.3331-0.0000 ( 2742 PWs) bands (ev): -9.6765 -9.6765 -9.6659 -9.6659 -9.6350 -9.6350 -9.6305 -9.6305 -8.6603 -8.6603 -8.6501 -8.6501 -8.6220 -8.6220 -8.6110 -8.6110 -8.5799 -8.5799 -8.5693 -8.5693 4.0598 4.0598 4.5435 4.5435 7.6586 7.6586 9.2712 9.2712 9.3685 9.3685 9.6442 9.6442 10.1935 10.1935 10.3863 10.3863 10.4611 10.4611 10.6486 10.6486 10.8201 10.8201 10.8944 10.8944 10.9503 10.9503 11.0667 11.0667 11.1629 11.1629 12.8074 12.8074 14.0999 14.0999 16.3747 16.3747 17.2526 17.2526 k = 0.4679 0.3442-0.0000 ( 2736 PWs) bands (ev): -9.6765 -9.6765 -9.6659 -9.6659 -9.6350 -9.6350 -9.6305 -9.6305 -8.6606 -8.6606 -8.6497 -8.6497 -8.6229 -8.6229 -8.6099 -8.6099 -8.5799 -8.5799 -8.5695 -8.5695 4.0701 4.0701 4.5549 4.5549 7.6454 7.6454 9.2557 9.2557 9.3441 9.3441 9.6515 9.6515 10.1439 10.1439 10.3784 10.3784 10.4433 10.4433 10.6620 10.6620 10.8306 10.8306 10.9012 10.9012 10.9914 10.9914 11.0669 11.0669 11.1635 11.1635 12.8631 12.8631 14.0859 14.0859 16.4407 16.4407 17.0765 17.0765 k = 0.4615 0.3553-0.0000 ( 2738 PWs) bands (ev): -9.6765 -9.6765 -9.6660 -9.6660 -9.6349 -9.6349 -9.6305 -9.6305 -8.6610 -8.6610 -8.6492 -8.6492 -8.6238 -8.6238 -8.6089 -8.6089 -8.5799 -8.5799 -8.5696 -8.5696 4.0826 4.0826 4.5686 4.5686 7.6284 7.6284 9.2376 9.2376 9.3133 9.3133 9.6604 9.6604 10.0937 10.0937 10.3664 10.3664 10.4256 10.4256 10.6784 10.6784 10.8443 10.8443 10.9044 10.9044 11.0404 11.0404 11.0679 11.0679 11.1644 11.1644 12.9251 12.9251 14.0683 14.0683 16.5210 16.5210 16.8958 16.8958 k = 0.4551 0.3664-0.0000 ( 2730 PWs) bands (ev): -9.6764 -9.6764 -9.6660 -9.6660 -9.6348 -9.6348 -9.6305 -9.6305 -8.6613 -8.6613 -8.6487 -8.6487 -8.6247 -8.6247 -8.6077 -8.6077 -8.5799 -8.5799 -8.5698 -8.5698 4.0974 4.0974 4.5847 4.5847 7.6072 7.6072 9.2172 9.2172 9.2762 9.2762 9.6708 9.6708 10.0454 10.0454 10.3472 10.3472 10.4138 10.4138 10.6938 10.6938 10.8627 10.8627 10.9071 10.9071 11.0659 11.0659 11.0963 11.0963 11.1662 11.1662 12.9913 12.9913 14.0466 14.0466 16.6109 16.6109 16.7182 16.7182 k = 0.4487 0.3775-0.0000 ( 2734 PWs) bands (ev): -9.6764 -9.6764 -9.6661 -9.6661 -9.6347 -9.6347 -9.6304 -9.6304 -8.6617 -8.6617 -8.6482 -8.6482 -8.6256 -8.6256 -8.6066 -8.6066 -8.5799 -8.5799 -8.5700 -8.5700 4.1144 4.1144 4.6028 4.6028 7.5810 7.5810 9.1946 9.1946 9.2335 9.2335 9.6824 9.6824 10.0012 10.0012 10.3222 10.3222 10.4082 10.4082 10.7059 10.7059 10.8843 10.8843 10.9127 10.9127 11.0668 11.0668 11.1447 11.1447 11.1762 11.1762 13.0596 13.0596 14.0206 14.0206 16.5231 16.5231 16.7326 16.7326 k = 0.4423 0.3886-0.0000 ( 2738 PWs) bands (ev): -9.6764 -9.6764 -9.6661 -9.6661 -9.6346 -9.6346 -9.6304 -9.6304 -8.6620 -8.6620 -8.6477 -8.6477 -8.6265 -8.6265 -8.6054 -8.6054 -8.5798 -8.5798 -8.5703 -8.5703 4.1337 4.1337 4.6230 4.6230 7.5495 7.5495 9.1689 9.1689 9.1880 9.1880 9.6953 9.6953 9.9622 9.9622 10.2947 10.2947 10.4062 10.4062 10.7138 10.7138 10.8981 10.8981 10.9327 10.9327 11.0671 11.0671 11.1586 11.1586 11.2241 11.2241 13.1286 13.1286 13.9898 13.9898 16.3434 16.3434 16.8541 16.8541 k = 0.4359 0.3997-0.0000 ( 2742 PWs) bands (ev): -9.6764 -9.6764 -9.6662 -9.6662 -9.6344 -9.6344 -9.6303 -9.6303 -8.6624 -8.6624 -8.6471 -8.6471 -8.6274 -8.6274 -8.6043 -8.6043 -8.5799 -8.5799 -8.5705 -8.5705 4.1551 4.1551 4.6450 4.6450 7.5120 7.5120 9.1294 9.1294 9.1521 9.1521 9.7095 9.7095 9.9289 9.9289 10.2669 10.2669 10.4060 10.4060 10.7178 10.7178 10.9020 10.9020 10.9683 10.9683 11.0673 11.0673 11.1604 11.1604 11.2867 11.2867 13.1970 13.1970 13.9539 13.9539 16.1644 16.1644 16.8797 16.8797 k = 0.4295 0.4108-0.0000 ( 2738 PWs) bands (ev): -9.6764 -9.6764 -9.6663 -9.6663 -9.6343 -9.6343 -9.6303 -9.6303 -8.6627 -8.6627 -8.6466 -8.6466 -8.6282 -8.6282 -8.6031 -8.6031 -8.5799 -8.5799 -8.5708 -8.5708 4.1787 4.1787 4.6686 4.6686 7.4681 7.4681 9.0790 9.0790 9.1253 9.1253 9.7246 9.7246 9.9011 9.9011 10.2397 10.2397 10.4073 10.4073 10.7190 10.7190 10.9035 10.9035 11.0106 11.0106 11.0677 11.0677 11.1609 11.1609 11.3532 11.3532 13.2639 13.2639 13.9123 13.9123 15.9880 15.9880 16.7313 16.7313 k = 0.4231 0.4219-0.0000 ( 2744 PWs) bands (ev): -9.6763 -9.6763 -9.6663 -9.6663 -9.6342 -9.6342 -9.6302 -9.6302 -8.6630 -8.6630 -8.6460 -8.6460 -8.6290 -8.6290 -8.6019 -8.6019 -8.5799 -8.5799 -8.5710 -8.5710 4.2045 4.2045 4.6935 4.6935 7.4175 7.4175 9.0284 9.0284 9.0996 9.0996 9.7406 9.7406 9.8783 9.8783 10.2137 10.2137 10.4094 10.4094 10.7178 10.7178 10.9045 10.9045 11.0569 11.0569 11.0679 11.0679 11.1609 11.1609 11.4223 11.4223 13.3286 13.3286 13.8649 13.8649 15.8151 15.8151 16.5921 16.5921 k = 0.4167 0.4330-0.0000 ( 2748 PWs) bands (ev): -9.6763 -9.6763 -9.6664 -9.6664 -9.6341 -9.6341 -9.6301 -9.6301 -8.6633 -8.6633 -8.6455 -8.6455 -8.6298 -8.6298 -8.6008 -8.6008 -8.5800 -8.5800 -8.5713 -8.5713 4.2324 4.2324 4.7194 4.7194 7.3602 7.3602 8.9803 8.9803 9.0740 9.0740 9.7571 9.7571 9.8602 9.8602 10.1890 10.1890 10.4122 10.4122 10.7150 10.7150 10.9053 10.9053 11.0681 11.0681 11.1058 11.1058 11.1607 11.1607 11.4938 11.4938 13.3904 13.3904 13.8116 13.8116 15.6461 15.6461 16.4632 16.4632 k = 0.4103 0.4441-0.0000 ( 2748 PWs) bands (ev): -9.6763 -9.6763 -9.6665 -9.6665 -9.6340 -9.6340 -9.6300 -9.6300 -8.6636 -8.6636 -8.6450 -8.6450 -8.6306 -8.6306 -8.5996 -8.5996 -8.5802 -8.5802 -8.5715 -8.5715 4.2623 4.2623 4.7458 4.7458 7.2967 7.2967 8.9366 8.9366 9.0488 9.0488 9.7735 9.7735 9.8462 9.8462 10.1660 10.1660 10.4156 10.4156 10.7109 10.7109 10.9060 10.9060 11.0683 11.0683 11.1555 11.1555 11.1613 11.1613 11.5676 11.5676 13.4484 13.4484 13.7530 13.7530 15.4817 15.4817 16.3451 16.3451 k = 0.4038 0.4552-0.0000 ( 2750 PWs) bands (ev): -9.6762 -9.6762 -9.6666 -9.6666 -9.6339 -9.6339 -9.6300 -9.6300 -8.6638 -8.6638 -8.6445 -8.6445 -8.6313 -8.6313 -8.5984 -8.5984 -8.5804 -8.5804 -8.5717 -8.5717 4.2943 4.2943 4.7721 4.7721 7.2278 7.2278 8.8981 8.8981 9.0240 9.0240 9.7886 9.7886 9.8368 9.8368 10.1448 10.1448 10.4195 10.4195 10.7057 10.7057 10.9068 10.9068 11.0685 11.0685 11.1600 11.1600 11.2077 11.2077 11.6435 11.6435 13.4995 13.4995 13.6921 13.6921 15.3224 15.3224 16.2383 16.2383 k = 0.3974 0.4663-0.0000 ( 2750 PWs) bands (ev): -9.6762 -9.6762 -9.6667 -9.6667 -9.6338 -9.6338 -9.6299 -9.6299 -8.6641 -8.6641 -8.6440 -8.6440 -8.6319 -8.6319 -8.5973 -8.5973 -8.5806 -8.5806 -8.5719 -8.5719 4.3284 4.3284 4.7978 4.7978 7.1545 7.1545 8.8655 8.8655 8.9998 8.9998 9.7989 9.7989 9.8347 9.8347 10.1253 10.1253 10.4239 10.4239 10.6998 10.6998 10.9077 10.9077 11.0687 11.0687 11.1597 11.1597 11.2591 11.2591 11.7215 11.7215 13.5272 13.5272 13.6456 13.6456 15.1685 15.1685 16.1430 16.1430 k = 0.3910 0.4774-0.0000 ( 2742 PWs) bands (ev): -9.6761 -9.6761 -9.6668 -9.6668 -9.6337 -9.6337 -9.6298 -9.6298 -8.6642 -8.6642 -8.6436 -8.6436 -8.6325 -8.6325 -8.5962 -8.5962 -8.5810 -8.5810 -8.5720 -8.5720 4.3644 4.3644 4.8221 4.8221 7.0784 7.0784 8.8388 8.8388 8.9764 8.9764 9.8007 9.8007 9.8430 9.8430 10.1079 10.1079 10.4287 10.4287 10.6934 10.6934 10.9087 10.9087 11.0690 11.0690 11.1593 11.1593 11.3098 11.3098 11.8016 11.8016 13.4901 13.4901 13.6553 13.6553 15.0207 15.0207 16.0591 16.0591 k = 0.3846 0.4885-0.0000 ( 2738 PWs) bands (ev): -9.6761 -9.6761 -9.6669 -9.6669 -9.6336 -9.6336 -9.6297 -9.6297 -8.6644 -8.6644 -8.6432 -8.6432 -8.6331 -8.6331 -8.5951 -8.5951 -8.5814 -8.5814 -8.5721 -8.5721 4.4023 4.4023 4.8439 4.8439 7.0014 7.0014 8.8180 8.8180 8.9539 8.9539 9.7979 9.7979 9.8568 9.8568 10.0925 10.0925 10.4338 10.4338 10.6865 10.6865 10.9098 10.9098 11.0692 11.0692 11.1591 11.1591 11.3592 11.3592 11.8837 11.8837 13.4133 13.4133 13.6970 13.6971 14.8798 14.8798 15.9865 15.9865 k = 0.3782 0.4996-0.0000 ( 2746 PWs) bands (ev): -9.6760 -9.6760 -9.6670 -9.6670 -9.6335 -9.6335 -9.6296 -9.6296 -8.6646 -8.6646 -8.6428 -8.6428 -8.6336 -8.6336 -8.5940 -8.5940 -8.5818 -8.5818 -8.5722 -8.5722 4.4421 4.4421 4.8620 4.8620 6.9256 6.9256 8.8025 8.8025 8.9325 8.9325 9.7942 9.7942 9.8717 9.8717 10.0792 10.0792 10.4389 10.4389 10.6794 10.6794 10.9109 10.9109 11.0694 11.0694 11.1587 11.1587 11.4064 11.4064 11.9677 11.9677 13.3238 13.3238 13.7446 13.7446 14.7462 14.7462 15.9246 15.9246 k = 0.3718 0.5107-0.0000 ( 2752 PWs) bands (ev): -9.6759 -9.6759 -9.6671 -9.6671 -9.6335 -9.6335 -9.6295 -9.6295 -8.6647 -8.6647 -8.6425 -8.6425 -8.6341 -8.6341 -8.5930 -8.5930 -8.5823 -8.5823 -8.5723 -8.5723 4.4837 4.4837 4.8752 4.8752 6.8531 6.8531 8.7920 8.7920 8.9123 8.9123 9.7909 9.7909 9.8858 9.8858 10.0682 10.0682 10.4442 10.4442 10.6723 10.6723 10.9121 10.9121 11.0695 11.0695 11.1584 11.1584 11.4506 11.4506 12.0537 12.0537 13.2279 13.2279 13.7930 13.7930 14.6210 14.6210 15.8730 15.8730 k = 0.3654 0.5218-0.0000 ( 2744 PWs) bands (ev): -9.6759 -9.6759 -9.6672 -9.6672 -9.6334 -9.6334 -9.6294 -9.6294 -8.6648 -8.6648 -8.6422 -8.6422 -8.6345 -8.6345 -8.5920 -8.5920 -8.5829 -8.5829 -8.5723 -8.5723 4.5271 4.5271 4.8819 4.8819 6.7865 6.7865 8.7859 8.7859 8.8936 8.8936 9.7882 9.7882 9.8984 9.8984 10.0600 10.0600 10.4494 10.4494 10.6654 10.6654 10.9136 10.9136 11.0696 11.0696 11.1581 11.1581 11.4907 11.4907 12.1418 12.1418 13.1277 13.1277 13.8412 13.8412 14.5051 14.5051 15.8311 15.8311 k = 0.3590 0.5329-0.0000 ( 2740 PWs) bands (ev): -9.6758 -9.6758 -9.6673 -9.6673 -9.6334 -9.6334 -9.6294 -9.6294 -8.6648 -8.6648 -8.6420 -8.6420 -8.6348 -8.6348 -8.5911 -8.5911 -8.5835 -8.5835 -8.5723 -8.5723 4.5721 4.5721 4.8804 4.8804 6.7282 6.7282 8.7835 8.7835 8.8764 8.8764 9.7861 9.7861 9.9087 9.9087 10.0543 10.0543 10.4543 10.4543 10.6589 10.6589 10.9150 10.9150 11.0698 11.0698 11.1579 11.1579 11.5258 11.5258 12.2317 12.2317 13.0249 13.0249 13.8889 13.8889 14.3995 14.3995 15.7982 15.7982 k = 0.3526 0.5440-0.0000 ( 2748 PWs) bands (ev): -9.6758 -9.6758 -9.6674 -9.6674 -9.6334 -9.6334 -9.6293 -9.6293 -8.6649 -8.6649 -8.6418 -8.6418 -8.6351 -8.6351 -8.5902 -8.5902 -8.5841 -8.5841 -8.5723 -8.5723 4.6188 4.6188 4.8693 4.8693 6.6803 6.6803 8.7841 8.7841 8.8611 8.8611 9.7844 9.7844 9.9163 9.9163 10.0511 10.0511 10.4587 10.4587 10.6532 10.6532 10.9164 10.9164 11.0698 11.0698 11.1576 11.1576 11.5549 11.5549 12.3234 12.3234 12.9209 12.9209 13.9359 13.9359 14.3056 14.3056 15.7736 15.7736 k = 0.3462 0.5551-0.0000 ( 2748 PWs) bands (ev): -9.6757 -9.6757 -9.6675 -9.6675 -9.6333 -9.6333 -9.6293 -9.6293 -8.6649 -8.6649 -8.6417 -8.6417 -8.6352 -8.6352 -8.5894 -8.5894 -8.5846 -8.5846 -8.5723 -8.5723 4.6670 4.6670 4.8473 4.8473 6.6449 6.6449 8.7868 8.7868 8.8483 8.8483 9.7833 9.7833 9.9212 9.9212 10.0500 10.0500 10.4622 10.4622 10.6486 10.6486 10.9176 10.9176 11.0698 11.0698 11.1575 11.1575 11.5767 11.5767 12.4169 12.4169 12.8171 12.8171 13.9812 13.9812 14.2254 14.2254 15.7567 15.7567 k = 0.3397 0.5662-0.0000 ( 2756 PWs) bands (ev): -9.6757 -9.6757 -9.6675 -9.6675 -9.6333 -9.6333 -9.6293 -9.6293 -8.6649 -8.6649 -8.6416 -8.6416 -8.6354 -8.6354 -8.5888 -8.5888 -8.5851 -8.5851 -8.5722 -8.5722 4.7166 4.7166 4.8135 4.8135 6.6232 6.6232 8.7901 8.7901 8.8390 8.8390 9.7827 9.7827 9.9239 9.9239 10.0501 10.0501 10.4644 10.4644 10.6455 10.6455 10.9186 10.9186 11.0698 11.0698 11.1573 11.1573 11.5905 11.5905 12.5113 12.5113 12.7155 12.7155 14.0216 14.0216 14.1634 14.1634 15.7469 15.7469 k = 0.3333 0.5774-0.0000 ( 2760 PWs) bands (ev): -9.6757 -9.6757 -9.6675 -9.6675 -9.6333 -9.6333 -9.6292 -9.6292 -8.6649 -8.6649 -8.6416 -8.6416 -8.6354 -8.6354 -8.5886 -8.5886 -8.5853 -8.5853 -8.5722 -8.5722 4.7654 4.7654 4.7700 4.7700 6.6160 6.6160 8.7918 8.7918 8.8354 8.8354 9.7825 9.7825 9.9246 9.9246 10.0503 10.0503 10.4653 10.4653 10.6444 10.6444 10.9189 10.9189 11.0698 11.0698 11.1573 11.1573 11.5952 11.5952 12.5877 12.5877 12.6365 12.6365 14.0417 14.0417 14.1358 14.1358 15.7438 15.7438 k = 0.3333 0.5774-0.0000 ( 2760 PWs) bands (ev): -9.6757 -9.6757 -9.6675 -9.6675 -9.6333 -9.6333 -9.6292 -9.6292 -8.6649 -8.6649 -8.6416 -8.6416 -8.6354 -8.6354 -8.5886 -8.5886 -8.5853 -8.5853 -8.5722 -8.5722 4.7654 4.7654 4.7700 4.7700 6.6160 6.6160 8.7918 8.7918 8.8354 8.8354 9.7825 9.7825 9.9246 9.9246 10.0503 10.0503 10.4653 10.4653 10.6444 10.6444 10.9189 10.9189 11.0698 11.0698 11.1573 11.1573 11.5952 11.5952 12.5877 12.5877 12.6365 12.6365 14.0417 14.0417 14.1358 14.1358 15.7438 15.7438 k = 0.3269 0.5662-0.0000 ( 2752 PWs) bands (ev): -9.6757 -9.6757 -9.6675 -9.6675 -9.6333 -9.6333 -9.6293 -9.6293 -8.6649 -8.6649 -8.6416 -8.6416 -8.6354 -8.6354 -8.5888 -8.5888 -8.5851 -8.5851 -8.5722 -8.5722 4.7103 4.7103 4.8200 4.8200 6.6231 6.6231 8.7901 8.7901 8.8391 8.8391 9.7827 9.7827 9.9240 9.9240 10.0498 10.0498 10.4644 10.4644 10.6456 10.6456 10.9185 10.9185 11.0698 11.0698 11.1573 11.1573 11.5903 11.5903 12.5125 12.5125 12.7148 12.7148 14.0268 14.0268 14.1584 14.1584 15.7468 15.7468 k = 0.3205 0.5551-0.0000 ( 2752 PWs) bands (ev): -9.6757 -9.6757 -9.6674 -9.6674 -9.6333 -9.6333 -9.6293 -9.6293 -8.6649 -8.6649 -8.6417 -8.6417 -8.6353 -8.6353 -8.5894 -8.5894 -8.5847 -8.5847 -8.5723 -8.5723 4.6426 4.6426 4.8734 4.8734 6.6439 6.6439 8.7861 8.7861 8.8483 8.8483 9.7832 9.7832 9.9222 9.9222 10.0475 10.0475 10.4617 10.4617 10.6493 10.6493 10.9168 10.9168 11.0699 11.0699 11.1575 11.1575 11.5757 11.5757 12.4224 12.4224 12.8149 12.8149 14.0068 14.0068 14.2013 14.2013 15.7556 15.7556 k = 0.3141 0.5440-0.0000 ( 2748 PWs) bands (ev): -9.6758 -9.6758 -9.6674 -9.6674 -9.6334 -9.6334 -9.6293 -9.6293 -8.6649 -8.6649 -8.6417 -8.6417 -8.6351 -8.6351 -8.5901 -8.5901 -8.5841 -8.5841 -8.5723 -8.5723 4.5656 4.5656 4.9278 4.9278 6.6773 6.6773 8.7818 8.7818 8.8611 8.8611 9.7839 9.7839 9.9193 9.9193 10.0432 10.0432 10.4572 10.4572 10.6554 10.6554 10.9138 10.9138 11.0698 11.0698 11.1577 11.1577 11.5514 11.5514 12.3376 12.3376 12.9179 12.9179 13.9966 13.9966 14.2497 14.2497 15.7698 15.7698 k = 0.3077 0.5329-0.0000 ( 2748 PWs) bands (ev): -9.6759 -9.6759 -9.6672 -9.6672 -9.6334 -9.6334 -9.6294 -9.6294 -8.6649 -8.6649 -8.6418 -8.6418 -8.6349 -8.6349 -8.5909 -8.5909 -8.5835 -8.5835 -8.5724 -8.5724 4.4809 4.4809 4.9832 4.9832 6.7221 6.7221 8.7784 8.7784 8.8760 8.8760 9.7847 9.7847 9.9149 9.9149 10.0366 10.0366 10.4510 10.4510 10.6638 10.6638 10.9090 10.9090 11.0698 11.0698 11.1579 11.1579 11.5181 11.5181 12.2600 12.2600 13.0230 13.0230 13.9988 13.9988 14.3005 14.3005 15.7893 15.7893 k = 0.3013 0.5218-0.0000 ( 2744 PWs) bands (ev): -9.6760 -9.6760 -9.6671 -9.6671 -9.6334 -9.6334 -9.6295 -9.6295 -8.6649 -8.6649 -8.6419 -8.6419 -8.6347 -8.6347 -8.5918 -8.5918 -8.5830 -8.5830 -8.5725 -8.5725 4.3900 4.3900 5.0393 5.0393 6.7769 6.7769 8.7763 8.7763 8.8924 8.8924 9.7857 9.7857 9.9078 9.9078 10.0281 10.0281 10.4437 10.4437 10.6742 10.6742 10.9020 10.9020 11.0698 11.0698 11.1583 11.1583 11.4768 11.4768 12.1907 12.1907 13.1299 13.1299 14.0133 14.0133 14.3531 14.3531 15.8137 15.8137 k = 0.2949 0.5107-0.0000 ( 2748 PWs) bands (ev): -9.6762 -9.6762 -9.6668 -9.6668 -9.6335 -9.6335 -9.6296 -9.6296 -8.6649 -8.6649 -8.6420 -8.6420 -8.6344 -8.6344 -8.5927 -8.5927 -8.5824 -8.5824 -8.5726 -8.5726 4.2943 4.2943 5.0962 5.0962 6.8405 6.8405 8.7759 8.7759 8.9098 8.9098 9.7863 9.7863 9.8968 9.8968 10.0191 10.0191 10.4355 10.4355 10.6864 10.6864 10.8928 10.8928 11.0698 11.0698 11.1587 11.1587 11.4286 11.4286 12.1306 12.1306 13.2387 13.2387 14.0394 14.0394 14.4073 14.4073 15.8430 15.8430 k = 0.2885 0.4996-0.0000 ( 2750 PWs) bands (ev): -9.6764 -9.6764 -9.6666 -9.6666 -9.6335 -9.6335 -9.6298 -9.6298 -8.6648 -8.6648 -8.6422 -8.6422 -8.6341 -8.6341 -8.5936 -8.5936 -8.5819 -8.5819 -8.5728 -8.5728 4.1949 4.1949 5.1535 5.1535 6.9117 6.9117 8.7773 8.7773 8.9280 8.9280 9.7861 9.7861 9.8803 9.8803 10.0112 10.0112 10.4268 10.4268 10.6999 10.6999 10.8813 10.8813 11.0697 11.0697 11.1591 11.1591 11.3751 11.3751 12.0802 12.0802 13.3493 13.3493 14.0758 14.0758 14.4630 14.4630 15.8770 15.8770 k = 0.2821 0.4885-0.0000 ( 2750 PWs) bands (ev): -9.6767 -9.6767 -9.6663 -9.6663 -9.6336 -9.6336 -9.6299 -9.6299 -8.6648 -8.6648 -8.6423 -8.6423 -8.6338 -8.6338 -8.5945 -8.5945 -8.5815 -8.5815 -8.5730 -8.5730 4.0929 4.0929 5.2112 5.2112 6.9896 6.9896 8.7806 8.7806 8.9467 8.9467 9.7833 9.7833 9.8581 9.8581 10.0059 10.0059 10.4179 10.4179 10.7142 10.7142 10.8678 10.8678 11.0697 11.0697 11.1596 11.1596 11.3179 11.3179 12.0396 12.0396 13.4616 13.4616 14.1215 14.1215 14.5202 14.5202 15.9156 15.9156 k = 0.2756 0.4774-0.0000 ( 2758 PWs) bands (ev): -9.6769 -9.6769 -9.6660 -9.6660 -9.6337 -9.6337 -9.6301 -9.6301 -8.6649 -8.6649 -8.6424 -8.6424 -8.6334 -8.6334 -8.5954 -8.5954 -8.5811 -8.5811 -8.5733 -8.5733 3.9891 3.9891 5.2691 5.2691 7.0734 7.0734 8.7859 8.7859 8.9658 8.9658 9.7726 9.7726 9.8349 9.8349 10.0038 10.0038 10.4091 10.4091 10.7285 10.7285 10.8525 10.8525 11.0696 11.0696 11.1599 11.1599 11.2589 11.2589 12.0088 12.0088 13.5754 13.5754 14.1751 14.1751 14.5789 14.5789 15.9588 15.9588 k = 0.2692 0.4663-0.0000 ( 2758 PWs) bands (ev): -9.6772 -9.6772 -9.6656 -9.6656 -9.6338 -9.6338 -9.6303 -9.6303 -8.6649 -8.6649 -8.6425 -8.6425 -8.6330 -8.6330 -8.5963 -8.5963 -8.5808 -8.5808 -8.5735 -8.5735 3.8843 3.8843 5.3271 5.3271 7.1622 7.1622 8.7931 8.7931 8.9849 8.9849 9.7443 9.7443 9.8208 9.8208 10.0046 10.0046 10.4007 10.4007 10.7414 10.7414 10.8363 10.8363 11.0696 11.0696 11.1589 11.1589 11.2016 11.2016 11.9872 11.9872 13.6909 13.6909 14.2356 14.2356 14.6392 14.6392 16.0066 16.0066 k = 0.2628 0.4552-0.0000 ( 2748 PWs) bands (ev): -9.6776 -9.6776 -9.6652 -9.6652 -9.6339 -9.6339 -9.6305 -9.6305 -8.6649 -8.6649 -8.6426 -8.6426 -8.6326 -8.6326 -8.5971 -8.5971 -8.5806 -8.5806 -8.5739 -8.5739 3.7792 3.7792 5.3849 5.3849 7.2553 7.2553 8.8023 8.8023 9.0042 9.0042 9.6987 9.6987 9.8163 9.8163 10.0078 10.0078 10.3933 10.3933 10.7508 10.7508 10.8196 10.8196 11.0698 11.0698 11.1374 11.1374 11.1683 11.1683 11.9739 11.9739 13.8077 13.8077 14.3018 14.3018 14.7011 14.7011 16.0588 16.0588 k = 0.2564 0.4441-0.0000 ( 2748 PWs) bands (ev): -9.6779 -9.6779 -9.6648 -9.6648 -9.6340 -9.6340 -9.6307 -9.6307 -8.6650 -8.6650 -8.6426 -8.6426 -8.6322 -8.6322 -8.5980 -8.5980 -8.5804 -8.5804 -8.5742 -8.5742 3.6741 3.6741 5.4425 5.4425 7.3522 7.3522 8.8134 8.8134 9.0233 9.0233 9.6422 9.6422 9.8159 9.8159 10.0130 10.0130 10.3868 10.3868 10.7524 10.7524 10.8038 10.8038 11.0697 11.0697 11.0920 11.0920 11.1665 11.1665 11.9681 11.9681 13.9257 13.9257 14.3729 14.3729 14.7645 14.7645 16.1156 16.1156 k = 0.2500 0.4330-0.0000 ( 2748 PWs) bands (ev): -9.6783 -9.6783 -9.6643 -9.6643 -9.6342 -9.6342 -9.6309 -9.6309 -8.6650 -8.6650 -8.6427 -8.6427 -8.6318 -8.6318 -8.5988 -8.5988 -8.5802 -8.5802 -8.5747 -8.5747 3.5695 3.5695 5.4996 5.4996 7.4523 7.4523 8.8265 8.8265 9.0420 9.0420 9.5783 9.5783 9.8169 9.8169 10.0197 10.0197 10.3818 10.3818 10.7409 10.7409 10.7898 10.7898 11.0565 11.0565 11.0703 11.0703 11.1676 11.1676 11.9687 11.9687 14.0448 14.0448 14.4482 14.4482 14.8295 14.8295 16.1768 16.1768 k = 0.2436 0.4219-0.0000 ( 2756 PWs) bands (ev): -9.6787 -9.6787 -9.6639 -9.6639 -9.6344 -9.6344 -9.6311 -9.6311 -8.6651 -8.6651 -8.6428 -8.6428 -8.6313 -8.6313 -8.5995 -8.5995 -8.5802 -8.5802 -8.5751 -8.5751 3.4658 3.4658 5.5560 5.5560 7.5550 7.5550 8.8412 8.8412 9.0603 9.0603 9.5089 9.5089 9.8187 9.8187 10.0276 10.0276 10.3786 10.3786 10.7143 10.7143 10.7760 10.7760 11.0387 11.0387 11.0703 11.0703 11.1695 11.1695 11.9747 11.9747 14.1645 14.1645 14.5268 14.5268 14.8960 14.8960 16.2426 16.2426 k = 0.2372 0.4108-0.0000 ( 2756 PWs) bands (ev): -9.6791 -9.6791 -9.6634 -9.6634 -9.6346 -9.6346 -9.6313 -9.6313 -8.6652 -8.6652 -8.6429 -8.6429 -8.6309 -8.6309 -8.6003 -8.6003 -8.5802 -8.5802 -8.5756 -8.5756 3.3633 3.3633 5.6117 5.6117 7.6598 7.6598 8.8576 8.8576 9.0782 9.0782 9.4354 9.4354 9.8206 9.8206 10.0368 10.0368 10.3774 10.3774 10.6745 10.6745 10.7611 10.7611 11.0381 11.0381 11.0706 11.0706 11.1723 11.1723 11.9851 11.9851 14.2844 14.2844 14.6085 14.6085 14.9640 14.9640 16.3129 16.3129 k = 0.2308 0.3997-0.0000 ( 2752 PWs) bands (ev): -9.6796 -9.6796 -9.6629 -9.6629 -9.6349 -9.6349 -9.6315 -9.6315 -8.6654 -8.6654 -8.6429 -8.6429 -8.6304 -8.6304 -8.6009 -8.6009 -8.5803 -8.5803 -8.5761 -8.5761 3.2622 3.2622 5.6664 5.6664 7.7660 7.7660 8.8754 8.8754 9.0953 9.0953 9.3591 9.3591 9.8226 9.8226 10.0469 10.0469 10.3785 10.3785 10.6254 10.6254 10.7463 10.7463 11.0504 11.0504 11.0712 11.0712 11.1765 11.1765 11.9991 11.9991 14.4036 14.4036 14.6931 14.6931 15.0333 15.0333 16.3877 16.3877 k = 0.2244 0.3886-0.0000 ( 2752 PWs) bands (ev): -9.6800 -9.6800 -9.6623 -9.6623 -9.6353 -9.6353 -9.6316 -9.6316 -8.6655 -8.6655 -8.6430 -8.6430 -8.6300 -8.6300 -8.6015 -8.6015 -8.5804 -8.5804 -8.5766 -8.5766 3.1627 3.1627 5.7200 5.7200 7.8731 7.8731 8.8939 8.8939 9.1115 9.1115 9.2814 9.2814 9.8246 9.8246 10.0579 10.0579 10.3812 10.3812 10.5718 10.5718 10.7321 10.7321 11.0671 11.0671 11.0753 11.0753 11.1832 11.1832 12.0160 12.0160 14.5212 14.5212 14.7808 14.7808 15.1040 15.1040 16.4670 16.4670 k = 0.2179 0.3775-0.0000 ( 2752 PWs) bands (ev): -9.6805 -9.6805 -9.6618 -9.6618 -9.6357 -9.6357 -9.6318 -9.6318 -8.6657 -8.6657 -8.6431 -8.6431 -8.6296 -8.6296 -8.6020 -8.6020 -8.5806 -8.5806 -8.5772 -8.5772 3.0651 3.0651 5.7724 5.7724 7.9803 7.9803 8.9121 8.9121 9.1259 9.1259 9.2048 9.2048 9.8265 9.8265 10.0698 10.0698 10.3836 10.3836 10.5197 10.5197 10.7187 10.7187 11.0705 11.0705 11.0956 11.0956 11.1945 11.1945 12.0349 12.0349 14.6352 14.6352 14.8727 14.8727 15.1758 15.1758 16.5509 16.5509 k = 0.2115 0.3664-0.0000 ( 2757 PWs) bands (ev): -9.6809 -9.6809 -9.6613 -9.6613 -9.6361 -9.6361 -9.6319 -9.6319 -8.6658 -8.6658 -8.6432 -8.6432 -8.6292 -8.6292 -8.6025 -8.6025 -8.5809 -8.5809 -8.5778 -8.5778 2.9694 2.9694 5.8232 5.8232 8.0870 8.0870 8.9267 8.9267 9.1202 9.1202 9.1515 9.1515 9.8282 9.8282 10.0824 10.0824 10.3772 10.3772 10.4798 10.4798 10.7061 10.7061 11.0713 11.0713 11.1161 11.1161 11.2140 11.2140 12.0556 12.0556 14.7434 14.7434 14.9698 14.9698 15.2486 15.2486 16.6394 16.6394 k = 0.2051 0.3553-0.0000 ( 2757 PWs) bands (ev): -9.6814 -9.6814 -9.6607 -9.6607 -9.6365 -9.6365 -9.6319 -9.6319 -8.6660 -8.6660 -8.6432 -8.6432 -8.6288 -8.6288 -8.6029 -8.6029 -8.5813 -8.5813 -8.5784 -8.5784 2.8758 2.8758 5.8726 5.8726 8.1922 8.1922 8.9273 8.9273 9.0671 9.0671 9.1593 9.1593 9.8298 9.8298 10.0956 10.0956 10.3474 10.3474 10.4692 10.4692 10.6944 10.6944 11.0720 11.0720 11.1309 11.1309 11.2445 11.2445 12.0773 12.0773 14.8435 14.8435 15.0735 15.0735 15.3226 15.3226 16.7323 16.7323 k = 0.1987 0.3442-0.0000 ( 2757 PWs) bands (ev): -9.6819 -9.6819 -9.6602 -9.6602 -9.6370 -9.6370 -9.6320 -9.6320 -8.6662 -8.6662 -8.6433 -8.6433 -8.6284 -8.6284 -8.6032 -8.6032 -8.5817 -8.5817 -8.5789 -8.5789 2.7845 2.7845 5.9202 5.9202 8.2950 8.2950 8.8929 8.8929 9.0451 9.0451 9.1715 9.1715 9.8315 9.8315 10.1096 10.1096 10.2999 10.2999 10.4834 10.4834 10.6834 10.6834 11.0728 11.0728 11.1402 11.1402 11.2852 11.2852 12.0998 12.0998 14.9342 14.9342 15.1839 15.1839 15.3977 15.3977 16.8297 16.8297 k = 0.1923 0.3331-0.0000 ( 2757 PWs) bands (ev): -9.6824 -9.6824 -9.6596 -9.6596 -9.6375 -9.6375 -9.6321 -9.6321 -8.6665 -8.6665 -8.6434 -8.6434 -8.6281 -8.6281 -8.6034 -8.6034 -8.5823 -8.5823 -8.5795 -8.5795 2.6955 2.6955 5.9661 5.9661 8.3940 8.3940 8.8291 8.8291 9.0536 9.0536 9.1831 9.1831 9.8332 9.8332 10.1239 10.1239 10.2475 10.2475 10.5112 10.5112 10.6731 10.6731 11.0736 11.0736 11.1460 11.1460 11.3338 11.3338 12.1227 12.1227 15.0153 15.0153 15.2990 15.2990 15.4749 15.4749 16.9316 16.9316 k = 0.1859 0.3220-0.0000 ( 2761 PWs) bands (ev): -9.6829 -9.6829 -9.6590 -9.6590 -9.6381 -9.6381 -9.6321 -9.6321 -8.6667 -8.6667 -8.6434 -8.6434 -8.6278 -8.6278 -8.6035 -8.6035 -8.5829 -8.5829 -8.5801 -8.5801 2.6089 2.6089 6.0101 6.0101 8.4869 8.4869 8.7574 8.7574 9.0732 9.0732 9.1938 9.1938 9.8351 9.8351 10.1378 10.1378 10.1960 10.1960 10.5487 10.5487 10.6633 10.6633 11.0745 11.0745 11.1499 11.1499 11.3888 11.3888 12.1458 12.1458 15.0875 15.0875 15.4149 15.4149 15.5561 15.5561 17.0378 17.0378 k = 0.1795 0.3109-0.0000 ( 2767 PWs) bands (ev): -9.6834 -9.6834 -9.6585 -9.6585 -9.6386 -9.6386 -9.6321 -9.6321 -8.6670 -8.6670 -8.6435 -8.6435 -8.6276 -8.6276 -8.6035 -8.6035 -8.5836 -8.5836 -8.5807 -8.5807 2.5248 2.5248 6.0521 6.0521 8.5641 8.5641 8.6938 8.6938 9.0963 9.0963 9.2034 9.2034 9.8374 9.8374 10.1365 10.1365 10.1619 10.1619 10.5953 10.5953 10.6541 10.6541 11.0757 11.0757 11.1528 11.1528 11.4491 11.4491 12.1687 12.1687 15.1516 15.1516 15.5245 15.5245 15.6465 15.6465 17.1484 17.1484 k = 0.1731 0.2998-0.0000 ( 2763 PWs) bands (ev): -9.6839 -9.6839 -9.6579 -9.6579 -9.6392 -9.6392 -9.6322 -9.6322 -8.6673 -8.6673 -8.6436 -8.6436 -8.6274 -8.6274 -8.6035 -8.6035 -8.5843 -8.5843 -8.5812 -8.5812 2.4433 2.4433 6.0922 6.0922 8.5667 8.5667 8.6988 8.6988 9.1204 9.1204 9.2120 9.2120 9.8401 9.8401 10.0932 10.0932 10.1732 10.1732 10.6454 10.6454 10.6511 10.6511 11.0772 11.0772 11.1551 11.1551 11.5147 11.5147 12.1914 12.1914 15.2079 15.2079 15.6196 15.6196 15.7528 15.7528 17.2633 17.2633 k = 0.1667 0.2887-0.0000 ( 2763 PWs) bands (ev): -9.6844 -9.6844 -9.6574 -9.6574 -9.6398 -9.6398 -9.6322 -9.6322 -8.6675 -8.6675 -8.6437 -8.6437 -8.6273 -8.6273 -8.6033 -8.6033 -8.5851 -8.5851 -8.5818 -8.5818 2.3644 2.3644 6.1302 6.1302 8.5027 8.5027 8.7648 8.7648 9.1439 9.1439 9.2195 9.2195 9.8434 9.8434 10.0490 10.0490 10.1886 10.1886 10.6372 10.6372 10.7161 10.7161 11.0792 11.0792 11.1572 11.1572 11.5851 11.5851 12.2136 12.2136 15.2567 15.2567 15.6999 15.6999 15.8739 15.8739 17.3824 17.3824 k = 0.1603 0.2776-0.0000 ( 2763 PWs) bands (ev): -9.6849 -9.6849 -9.6569 -9.6569 -9.6404 -9.6404 -9.6322 -9.6322 -8.6678 -8.6678 -8.6438 -8.6438 -8.6272 -8.6272 -8.6031 -8.6031 -8.5859 -8.5859 -8.5823 -8.5823 2.2882 2.2882 6.1661 6.1661 8.4302 8.4302 8.8335 8.8335 9.1660 9.1660 9.2263 9.2263 9.8474 9.8474 10.0082 10.0082 10.2049 10.2049 10.6294 10.6294 10.7902 10.7902 11.0822 11.0822 11.1592 11.1592 11.6603 11.6603 12.2353 12.2353 15.2981 15.2981 15.7704 15.7704 16.0035 16.0035 17.5055 17.5055 k = 0.1538 0.2665-0.0000 ( 2773 PWs) bands (ev): -9.6855 -9.6855 -9.6563 -9.6563 -9.6410 -9.6410 -9.6322 -9.6322 -8.6682 -8.6682 -8.6438 -8.6438 -8.6271 -8.6271 -8.6029 -8.6029 -8.5867 -8.5867 -8.5828 -8.5828 2.2147 2.2147 6.2000 6.2000 8.3574 8.3574 8.8967 8.8967 9.1856 9.1856 9.2326 9.2326 9.8521 9.8521 9.9716 9.9716 10.2212 10.2212 10.6219 10.6219 10.8720 10.8720 11.0871 11.0871 11.1614 11.1614 11.7404 11.7404 12.2564 12.2564 15.3325 15.3325 15.8343 15.8343 16.1374 16.1374 17.6325 17.6325 k = 0.1474 0.2554-0.0000 ( 2769 PWs) bands (ev): -9.6860 -9.6860 -9.6558 -9.6558 -9.6416 -9.6416 -9.6322 -9.6322 -8.6685 -8.6685 -8.6439 -8.6439 -8.6270 -8.6270 -8.6027 -8.6027 -8.5876 -8.5876 -8.5833 -8.5833 2.1440 2.1440 6.2318 6.2318 8.2858 8.2858 8.9530 8.9530 9.2017 9.2017 9.2390 9.2390 9.8575 9.8575 9.9397 9.9397 10.2375 10.2375 10.6150 10.6150 10.9564 10.9564 11.0985 11.0985 11.1652 11.1652 11.8254 11.8254 12.2768 12.2768 15.3600 15.3600 15.8925 15.8925 16.2736 16.2736 17.7633 17.7633 k = 0.1410 0.2443-0.0000 ( 2771 PWs) bands (ev): -9.6865 -9.6865 -9.6553 -9.6553 -9.6422 -9.6422 -9.6322 -9.6322 -8.6688 -8.6688 -8.6440 -8.6440 -8.6270 -8.6270 -8.6024 -8.6024 -8.5885 -8.5885 -8.5838 -8.5838 2.0761 2.0761 6.2616 6.2616 8.2162 8.2162 9.0019 9.0019 9.2135 9.2135 9.2459 9.2459 9.8635 9.8635 9.9128 9.9128 10.2536 10.2536 10.6086 10.6086 11.0236 11.0236 11.1278 11.1278 11.1779 11.1779 11.9150 11.9150 12.2966 12.2966 15.3810 15.3810 15.9452 15.9452 16.4108 16.4108 17.8978 17.8978 k = 0.1346 0.2332-0.0000 ( 2775 PWs) bands (ev): -9.6869 -9.6869 -9.6548 -9.6548 -9.6427 -9.6427 -9.6322 -9.6322 -8.6691 -8.6691 -8.6440 -8.6440 -8.6270 -8.6270 -8.6021 -8.6021 -8.5893 -8.5893 -8.5842 -8.5842 2.0110 2.0110 6.2894 6.2894 8.1487 8.1487 9.0435 9.0435 9.2211 9.2211 9.2529 9.2529 9.8701 9.8701 9.8912 9.8912 10.2694 10.2694 10.6025 10.6025 11.0521 11.0521 11.1519 11.1519 11.2439 11.2439 12.0093 12.0093 12.3157 12.3157 15.3962 15.3962 15.9924 15.9924 16.5482 16.5482 18.0356 18.0356 k = 0.1282 0.2221-0.0000 ( 2779 PWs) bands (ev): -9.6874 -9.6874 -9.6544 -9.6544 -9.6433 -9.6433 -9.6322 -9.6322 -8.6694 -8.6694 -8.6441 -8.6441 -8.6270 -8.6270 -8.6019 -8.6019 -8.5902 -8.5902 -8.5846 -8.5846 1.9488 1.9488 6.3153 6.3153 8.0837 8.0837 9.0779 9.0779 9.2262 9.2262 9.2586 9.2586 9.8744 9.8744 9.8777 9.8777 10.2850 10.2850 10.5969 10.5969 11.0620 11.0620 11.1575 11.1575 11.3558 11.3558 12.1077 12.1077 12.3346 12.3346 15.4061 15.4061 16.0336 16.0336 16.6853 16.6853 18.1766 18.1766 k = 0.1218 0.2110-0.0000 ( 2783 PWs) bands (ev): -9.6879 -9.6879 -9.6539 -9.6539 -9.6439 -9.6439 -9.6322 -9.6322 -8.6698 -8.6698 -8.6441 -8.6441 -8.6270 -8.6270 -8.6017 -8.6017 -8.5911 -8.5911 -8.5849 -8.5849 1.8896 1.8896 6.3393 6.3393 8.0212 8.0212 9.1052 9.1052 9.2303 9.2303 9.2620 9.2620 9.8639 9.8639 9.8846 9.8846 10.3000 10.3000 10.5918 10.5918 11.0666 11.0666 11.1599 11.1599 11.4841 11.4841 12.2091 12.2091 12.3544 12.3544 15.4114 15.4114 16.0688 16.0688 16.8214 16.8214 18.3196 18.3196 k = 0.1154 0.1999-0.0000 ( 2779 PWs) bands (ev): -9.6883 -9.6883 -9.6535 -9.6535 -9.6444 -9.6444 -9.6322 -9.6322 -8.6701 -8.6701 -8.6442 -8.6442 -8.6270 -8.6270 -8.6016 -8.6016 -8.5919 -8.5919 -8.5852 -8.5852 1.8332 1.8332 6.3614 6.3614 7.9615 7.9615 9.1254 9.1254 9.2344 9.2344 9.2631 9.2631 9.8581 9.8581 9.8921 9.8921 10.3146 10.3146 10.5873 10.5873 11.0695 11.0695 11.1615 11.1615 11.6222 11.6222 12.3061 12.3061 12.3821 12.3821 15.4131 15.4131 16.0977 16.0977 16.9558 16.9558 18.4063 18.4063 k = 0.1090 0.1887-0.0000 ( 2775 PWs) bands (ev): -9.6888 -9.6888 -9.6531 -9.6531 -9.6449 -9.6449 -9.6322 -9.6322 -8.6705 -8.6705 -8.6442 -8.6442 -8.6270 -8.6270 -8.6015 -8.6015 -8.5927 -8.5927 -8.5854 -8.5854 1.7798 1.7798 6.3818 6.3818 7.9045 7.9045 9.1389 9.1389 9.2384 9.2384 9.2627 9.2627 9.8568 9.8568 9.8997 9.8997 10.3285 10.3285 10.5833 10.5833 11.0715 11.0715 11.1628 11.1628 11.7676 11.7676 12.3622 12.3622 12.4542 12.4542 15.4118 15.4118 16.1202 16.1202 17.0880 17.0880 18.4573 18.4573 k = 0.1026 0.1776-0.0000 ( 2775 PWs) bands (ev): -9.6892 -9.6892 -9.6527 -9.6527 -9.6454 -9.6454 -9.6322 -9.6322 -8.6708 -8.6708 -8.6442 -8.6442 -8.6270 -8.6270 -8.6016 -8.6016 -8.5935 -8.5935 -8.5854 -8.5854 1.7294 1.7294 6.4004 6.4004 7.8505 7.8505 9.1464 9.1464 9.2398 9.2398 9.2637 9.2637 9.8591 9.8591 9.9073 9.9073 10.3416 10.3416 10.5799 10.5799 11.0730 11.0730 11.1639 11.1639 11.9190 11.9190 12.3843 12.3843 12.5636 12.5636 15.4085 15.4085 16.1365 16.1365 17.2171 17.2171 18.5095 18.5095 k = 0.0962 0.1665-0.0000 ( 2779 PWs) bands (ev): -9.6896 -9.6896 -9.6524 -9.6524 -9.6459 -9.6459 -9.6322 -9.6322 -8.6711 -8.6711 -8.6443 -8.6443 -8.6270 -8.6270 -8.6017 -8.6017 -8.5943 -8.5943 -8.5854 -8.5854 1.6820 1.6820 6.4175 6.4175 7.7994 7.7994 9.1492 9.1492 9.2364 9.2364 9.2686 9.2686 9.8645 9.8645 9.9146 9.9146 10.3539 10.3539 10.5770 10.5770 11.0742 11.0742 11.1648 11.1648 12.0750 12.0750 12.4001 12.4001 12.6822 12.6822 15.4040 15.4040 16.1464 16.1464 17.3422 17.3422 18.5530 18.5530 k = 0.0897 0.1554-0.0000 ( 2781 PWs) bands (ev): -9.6900 -9.6900 -9.6521 -9.6521 -9.6463 -9.6463 -9.6322 -9.6322 -8.6714 -8.6714 -8.6442 -8.6442 -8.6270 -8.6270 -8.6019 -8.6019 -8.5950 -8.5950 -8.5853 -8.5853 1.6375 1.6375 6.4330 6.4330 7.7513 7.7513 9.1487 9.1487 9.2292 9.2292 9.2760 9.2760 9.8721 9.8721 9.9218 9.9218 10.3651 10.3651 10.5747 10.5747 11.0753 11.0753 11.1657 11.1657 12.2342 12.2342 12.4143 12.4143 12.8055 12.8055 15.3992 15.3992 16.1501 16.1501 17.4624 17.4624 18.5443 18.5443 k = 0.0833 0.1443-0.0000 ( 2777 PWs) bands (ev): -9.6904 -9.6904 -9.6518 -9.6518 -9.6467 -9.6467 -9.6322 -9.6322 -8.6717 -8.6717 -8.6442 -8.6442 -8.6270 -8.6270 -8.6021 -8.6021 -8.5957 -8.5957 -8.5852 -8.5852 1.5961 1.5961 6.4471 6.4471 7.7064 7.7064 9.1460 9.1460 9.2203 9.2203 9.2841 9.2841 9.8812 9.8812 9.9287 9.9287 10.3755 10.3755 10.5731 10.5731 11.0762 11.0762 11.1666 11.1666 12.3870 12.3870 12.4364 12.4364 12.9321 12.9321 15.3950 15.3950 16.1477 16.1477 17.5763 17.5763 18.4461 18.4461 k = 0.0769 0.1332-0.0000 ( 2773 PWs) bands (ev): -9.6908 -9.6908 -9.6516 -9.6516 -9.6471 -9.6471 -9.6322 -9.6322 -8.6720 -8.6720 -8.6442 -8.6442 -8.6270 -8.6270 -8.6025 -8.6025 -8.5964 -8.5964 -8.5850 -8.5850 1.5577 1.5577 6.4598 6.4598 7.6646 7.6646 9.1418 9.1418 9.2106 9.2106 9.2920 9.2920 9.8913 9.8913 9.9352 9.9352 10.3849 10.3849 10.5721 10.5721 11.0770 11.0770 11.1674 11.1674 12.4304 12.4304 12.5685 12.5685 13.0610 13.0610 15.3922 15.3922 16.1391 16.1391 17.6819 17.6819 18.3047 18.3047 k = 0.0705 0.1221-0.0000 ( 2771 PWs) bands (ev): -9.6911 -9.6911 -9.6514 -9.6514 -9.6474 -9.6474 -9.6322 -9.6322 -8.6723 -8.6723 -8.6442 -8.6442 -8.6270 -8.6270 -8.6028 -8.6028 -8.5971 -8.5971 -8.5847 -8.5847 1.5223 1.5223 6.4711 6.4711 7.6259 7.6259 9.1367 9.1367 9.2007 9.2007 9.2992 9.2992 9.9018 9.9018 9.9413 9.9413 10.3932 10.3932 10.5717 10.5717 11.0777 11.0777 11.1681 11.1681 12.4418 12.4418 12.7321 12.7321 13.1915 13.1915 15.3919 15.3919 16.1244 16.1244 17.7735 17.7735 18.1485 18.1485 k = 0.0641 0.1110-0.0000 ( 2767 PWs) bands (ev): -9.6914 -9.6914 -9.6513 -9.6513 -9.6476 -9.6476 -9.6323 -9.6323 -8.6726 -8.6726 -8.6442 -8.6442 -8.6270 -8.6270 -8.6032 -8.6032 -8.5977 -8.5977 -8.5844 -8.5844 1.4900 1.4900 6.4813 6.4813 7.5906 7.5906 9.1311 9.1311 9.1912 9.1912 9.3057 9.3057 9.9124 9.9124 9.9470 9.9470 10.4005 10.4005 10.5719 10.5719 11.0783 11.0783 11.1688 11.1688 12.4510 12.4510 12.8963 12.8963 13.3227 13.3227 15.3949 15.3949 16.1033 16.1033 17.8210 17.8210 18.0166 18.0166 k = 0.0577 0.0999-0.0000 ( 2767 PWs) bands (ev): -9.6917 -9.6917 -9.6512 -9.6512 -9.6478 -9.6478 -9.6323 -9.6323 -8.6728 -8.6728 -8.6441 -8.6441 -8.6270 -8.6270 -8.6036 -8.6036 -8.5982 -8.5982 -8.5841 -8.5841 1.4607 1.4607 6.4902 6.4902 7.5584 7.5584 9.1252 9.1252 9.1822 9.1822 9.3114 9.3114 9.9225 9.9225 9.9523 9.9523 10.4067 10.4067 10.5726 10.5726 11.0789 11.0789 11.1694 11.1694 12.4590 12.4590 13.0584 13.0584 13.4536 13.4536 15.4025 15.4025 16.0759 16.0759 17.7247 17.7247 18.0133 18.0133 k = 0.0513 0.0888-0.0000 ( 2761 PWs) bands (ev): -9.6919 -9.6919 -9.6511 -9.6511 -9.6479 -9.6479 -9.6323 -9.6323 -8.6731 -8.6731 -8.6441 -8.6441 -8.6269 -8.6269 -8.6039 -8.6039 -8.5988 -8.5988 -8.5838 -8.5838 1.4345 1.4345 6.4980 6.4980 7.5296 7.5296 9.1193 9.1193 9.1739 9.1739 9.3165 9.3165 9.9320 9.9320 9.9571 9.9571 10.4119 10.4119 10.5736 10.5736 11.0795 11.0795 11.1701 11.1701 12.4660 12.4660 13.2160 13.2160 13.5831 13.5831 15.4156 15.4156 16.0423 16.0423 17.5555 17.5555 18.0702 18.0702 k = 0.0449 0.0777-0.0000 ( 2763 PWs) bands (ev): -9.6922 -9.6922 -9.6511 -9.6511 -9.6480 -9.6480 -9.6323 -9.6323 -8.6733 -8.6733 -8.6440 -8.6440 -8.6269 -8.6269 -8.6043 -8.6043 -8.5992 -8.5992 -8.5836 -8.5836 1.4114 1.4114 6.5048 6.5048 7.5041 7.5041 9.1137 9.1137 9.1666 9.1666 9.3208 9.3208 9.9407 9.9407 9.9616 9.9616 10.4161 10.4161 10.5748 10.5748 11.0799 11.0799 11.1706 11.1706 12.4720 12.4720 13.3666 13.3666 13.7099 13.7099 15.4352 15.4352 16.0028 16.0028 17.3761 17.3761 18.1256 18.1256 k = 0.0385 0.0666-0.0000 ( 2755 PWs) bands (ev): -9.6924 -9.6924 -9.6512 -9.6512 -9.6480 -9.6480 -9.6323 -9.6323 -8.6734 -8.6734 -8.6440 -8.6440 -8.6269 -8.6269 -8.6046 -8.6046 -8.5997 -8.5997 -8.5833 -8.5833 1.3914 1.3914 6.5105 6.5105 7.4820 7.4820 9.1085 9.1085 9.1602 9.1602 9.3244 9.3244 9.9484 9.9484 9.9657 9.9657 10.4195 10.4195 10.5763 10.5763 11.0803 11.0803 11.1711 11.1711 12.4772 12.4772 13.5067 13.5067 13.8328 13.8328 15.4620 15.4620 15.9586 15.9586 17.1975 17.1975 18.1649 18.1649 k = 0.0321 0.0555-0.0000 ( 2755 PWs) bands (ev): -9.6925 -9.6925 -9.6512 -9.6512 -9.6480 -9.6480 -9.6323 -9.6323 -8.6736 -8.6736 -8.6439 -8.6439 -8.6269 -8.6269 -8.6049 -8.6049 -8.6000 -8.6000 -8.5831 -8.5831 1.3744 1.3744 6.5153 6.5153 7.4632 7.4632 9.1039 9.1039 9.1548 9.1548 9.3274 9.3274 9.9548 9.9548 9.9695 9.9695 10.4222 10.4222 10.5777 10.5777 11.0806 11.0806 11.1715 11.1715 12.4816 12.4816 13.6326 13.6326 13.9501 13.9501 15.4956 15.4956 15.9123 15.9123 17.0244 17.0244 18.1672 18.1672 k = 0.0256 0.0444-0.0000 ( 2755 PWs) bands (ev): -9.6927 -9.6927 -9.6513 -9.6513 -9.6480 -9.6480 -9.6323 -9.6323 -8.6737 -8.6737 -8.6439 -8.6439 -8.6269 -8.6269 -8.6051 -8.6051 -8.6003 -8.6003 -8.5829 -8.5829 1.3605 1.3605 6.5192 6.5192 7.4479 7.4479 9.0999 9.0999 9.1503 9.1503 9.3298 9.3298 9.9598 9.9598 9.9728 9.9728 10.4243 10.4243 10.5791 10.5791 11.0808 11.0808 11.1718 11.1718 12.4851 12.4851 13.7403 13.7403 14.0591 14.0591 15.5334 15.5334 15.8688 15.8688 16.8609 16.8609 18.1221 18.1221 k = 0.0192 0.0333-0.0000 ( 2747 PWs) bands (ev): -9.6928 -9.6928 -9.6514 -9.6514 -9.6480 -9.6480 -9.6323 -9.6323 -8.6738 -8.6738 -8.6438 -8.6438 -8.6268 -8.6268 -8.6053 -8.6053 -8.6006 -8.6006 -8.5827 -8.5827 1.3497 1.3497 6.5221 6.5221 7.4359 7.4359 9.0967 9.0967 9.1469 9.1469 9.3317 9.3317 9.9635 9.9635 9.9757 9.9757 10.4259 10.4259 10.5803 10.5803 11.0811 11.0811 11.1721 11.1721 12.4879 12.4879 13.8265 13.8265 14.1555 14.1555 15.5682 15.5682 15.8372 15.8372 16.7125 16.7125 18.0652 18.0652 k = 0.0128 0.0222-0.0000 ( 2751 PWs) bands (ev): -9.6929 -9.6929 -9.6514 -9.6514 -9.6480 -9.6480 -9.6323 -9.6323 -8.6739 -8.6739 -8.6438 -8.6438 -8.6268 -8.6268 -8.6055 -8.6055 -8.6008 -8.6008 -8.5826 -8.5826 1.3419 1.3419 6.5242 6.5242 7.4273 7.4273 9.0944 9.0944 9.1444 9.1444 9.3330 9.3330 9.9659 9.9659 9.9780 9.9780 10.4268 10.4268 10.5811 10.5811 11.0812 11.0812 11.1723 11.1723 12.4898 12.4898 13.8890 13.8890 14.2331 14.2331 15.5889 15.5889 15.8284 15.8284 16.5873 16.5873 18.0187 18.0187 k = 0.0064 0.0111-0.0000 ( 2759 PWs) bands (ev): -9.6929 -9.6929 -9.6514 -9.6514 -9.6480 -9.6480 -9.6323 -9.6323 -8.6739 -8.6739 -8.6438 -8.6438 -8.6268 -8.6268 -8.6055 -8.6055 -8.6009 -8.6009 -8.5825 -8.5825 1.3373 1.3373 6.5255 6.5255 7.4222 7.4222 9.0929 9.0929 9.1429 9.1429 9.3338 9.3338 9.9673 9.9673 9.9794 9.9794 10.4273 10.4273 10.5816 10.5816 11.0813 11.0813 11.1724 11.1724 12.4909 12.4909 13.9268 13.9268 14.2841 14.2841 15.5930 15.5930 15.8400 15.8400 16.4990 16.4990 17.9894 17.9894 k = 0.0000 0.0000 0.0000 ( 2763 PWs) bands (ev): -9.6929 -9.6929 -9.6514 -9.6514 -9.6480 -9.6480 -9.6323 -9.6323 -8.6740 -8.6740 -8.6438 -8.6438 -8.6268 -8.6268 -8.6056 -8.6056 -8.6009 -8.6009 -8.5825 -8.5825 1.3358 1.3358 6.5259 6.5259 7.4205 7.4205 9.0924 9.0924 9.1424 9.1424 9.3340 9.3340 9.9678 9.9678 9.9799 9.9799 10.4275 10.4275 10.5817 10.5817 11.0813 11.0813 11.1725 11.1725 12.4913 12.4913 13.9394 13.9394 14.3021 14.3021 15.5920 15.5920 15.8487 15.8487 16.4661 16.4661 17.9794 17.9794 k = 0.0000 0.0000 0.0000 ( 2763 PWs) bands (ev): -9.6929 -9.6929 -9.6514 -9.6514 -9.6480 -9.6480 -9.6323 -9.6323 -8.6740 -8.6740 -8.6438 -8.6438 -8.6268 -8.6268 -8.6056 -8.6056 -8.6009 -8.6009 -8.5825 -8.5825 1.3358 1.3358 6.5259 6.5259 7.4205 7.4205 9.0924 9.0924 9.1424 9.1424 9.3340 9.3340 9.9678 9.9678 9.9799 9.9799 10.4275 10.4275 10.5817 10.5817 11.0813 11.0813 11.1725 11.1725 12.4913 12.4913 13.9394 13.9394 14.3021 14.3021 15.5920 15.5920 15.8487 15.8487 16.4661 16.4661 17.9794 17.9794 k = 0.0000 0.0000 0.0127 ( 2763 PWs) bands (ev): -9.6929 -9.6929 -9.6514 -9.6514 -9.6480 -9.6480 -9.6323 -9.6323 -8.6739 -8.6739 -8.6438 -8.6438 -8.6269 -8.6269 -8.6055 -8.6055 -8.6008 -8.6008 -8.5825 -8.5825 1.3373 1.3373 6.4974 6.4974 7.4496 7.4496 9.0932 9.0932 9.1432 9.1432 9.3350 9.3350 9.9683 9.9683 9.9804 9.9804 10.4267 10.4267 10.5807 10.5807 11.0799 11.0799 11.1710 11.1710 12.4914 12.4914 13.9418 13.9418 14.3045 14.3045 15.5921 15.5921 15.8490 15.8490 16.4683 16.4683 17.9777 17.9777 k = 0.0000 0.0000 0.0255 ( 2763 PWs) bands (ev): -9.6928 -9.6928 -9.6514 -9.6514 -9.6481 -9.6481 -9.6323 -9.6323 -8.6737 -8.6737 -8.6439 -8.6439 -8.6272 -8.6272 -8.6054 -8.6054 -8.6006 -8.6006 -8.5827 -8.5827 1.3419 1.3419 6.4208 6.4208 7.5279 7.5279 9.0957 9.0957 9.1454 9.1454 9.3379 9.3379 9.9698 9.9698 9.9821 9.9821 10.4245 10.4245 10.5778 10.5778 11.0755 11.0755 11.1665 11.1665 12.4915 12.4915 13.9492 13.9492 14.3118 14.3118 15.5925 15.5925 15.8499 15.8499 16.4748 16.4748 17.9722 17.9722 k = 0.0000 0.0000 0.0382 ( 2763 PWs) bands (ev): -9.6927 -9.6927 -9.6514 -9.6514 -9.6482 -9.6482 -9.6324 -9.6324 -8.6734 -8.6734 -8.6441 -8.6441 -8.6277 -8.6277 -8.6051 -8.6051 -8.6002 -8.6002 -8.5830 -8.5830 1.3496 1.3496 6.3134 6.3134 7.6382 7.6382 9.0997 9.0997 9.1491 9.1491 9.3426 9.3426 9.9723 9.9723 9.9848 9.9848 10.4208 10.4208 10.5729 10.5729 11.0683 11.0683 11.1592 11.1592 12.4919 12.4919 13.9613 13.9613 14.3240 14.3240 15.5931 15.5931 15.8513 15.8513 16.4857 16.4857 17.9617 17.9617 k = 0.0000 0.0000 0.0510 ( 2757 PWs) bands (ev): -9.6925 -9.6925 -9.6513 -9.6513 -9.6484 -9.6484 -9.6325 -9.6325 -8.6730 -8.6730 -8.6444 -8.6444 -8.6283 -8.6283 -8.6047 -8.6047 -8.5996 -8.5996 -8.5834 -8.5834 1.3604 1.3604 6.1884 6.1884 7.7670 7.7670 9.1054 9.1054 9.1543 9.1543 9.3489 9.3489 9.9759 9.9759 9.9887 9.9887 10.4159 10.4159 10.5663 10.5663 11.0583 11.0583 11.1489 11.1489 12.4928 12.4928 13.9782 13.9782 14.3408 14.3408 15.5939 15.5939 15.8532 15.8532 16.5008 16.5008 17.9446 17.9446 k = 0.0000 0.0000 0.0637 ( 2763 PWs) bands (ev): -9.6922 -9.6922 -9.6512 -9.6512 -9.6486 -9.6486 -9.6326 -9.6326 -8.6725 -8.6725 -8.6447 -8.6447 -8.6291 -8.6291 -8.6043 -8.6043 -8.5990 -8.5990 -8.5839 -8.5839 1.3742 1.3742 6.0537 6.0537 7.9061 7.9061 9.1126 9.1126 9.1609 9.1609 9.3574 9.3574 9.9803 9.9803 9.9936 9.9936 10.4093 10.4093 10.5575 10.5575 11.0459 11.0459 11.1361 11.1361 12.4942 12.4942 13.9996 13.9996 14.3622 14.3622 15.5949 15.5949 15.8557 15.8557 16.5203 16.5203 17.9182 17.9182 k = 0.0000 0.0000 0.0765 ( 2781 PWs) bands (ev): -9.6918 -9.6918 -9.6511 -9.6511 -9.6489 -9.6489 -9.6328 -9.6328 -8.6718 -8.6718 -8.6450 -8.6450 -8.6299 -8.6299 -8.6037 -8.6037 -8.5982 -8.5982 -8.5845 -8.5845 1.3911 1.3911 5.9139 5.9139 8.0509 8.0509 9.1214 9.1214 9.1689 9.1689 9.3677 9.3677 9.9855 9.9855 9.9994 9.9994 10.4012 10.4012 10.5465 10.5465 11.0311 11.0311 11.1207 11.1207 12.4965 12.4965 14.0254 14.0254 14.3881 14.3881 15.5961 15.5961 15.8586 15.8586 16.5441 16.5441 17.8797 17.8797 k = 0.0000 0.0000 0.0892 ( 2781 PWs) bands (ev): -9.6915 -9.6915 -9.6510 -9.6510 -9.6493 -9.6493 -9.6330 -9.6330 -8.6710 -8.6710 -8.6454 -8.6454 -8.6309 -8.6309 -8.6031 -8.6031 -8.5974 -8.5974 -8.5853 -8.5853 1.4111 1.4111 5.7713 5.7713 8.1983 8.1983 9.1320 9.1320 9.1784 9.1784 9.3798 9.3798 9.9919 9.9919 10.0065 10.0065 10.3917 10.3917 10.5337 10.5337 11.0142 11.0142 11.1030 11.1030 12.5002 12.5002 14.0552 14.0552 14.4181 14.4181 15.5973 15.5973 15.8619 15.8619 16.5722 16.5722 17.8270 17.8270 k = 0.0000 0.0000 0.1020 ( 2781 PWs) bands (ev): -9.6910 -9.6910 -9.6508 -9.6508 -9.6496 -9.6496 -9.6332 -9.6332 -8.6702 -8.6702 -8.6459 -8.6459 -8.6319 -8.6319 -8.6024 -8.6024 -8.5966 -8.5966 -8.5861 -8.5861 1.4341 1.4341 5.6276 5.6276 8.3465 8.3465 9.1442 9.1442 9.1893 9.1893 9.3937 9.3937 9.9991 9.9991 10.0147 10.0147 10.3808 10.3808 10.5188 10.5188 10.9954 10.9954 11.0832 11.0832 12.5057 12.5057 14.0889 14.0889 14.4521 14.4521 15.5986 15.5986 15.8656 15.8656 16.6045 16.6045 17.7598 17.7598 k = 0.0000 0.0000 0.1147 ( 2781 PWs) bands (ev): -9.6905 -9.6905 -9.6507 -9.6507 -9.6501 -9.6501 -9.6335 -9.6335 -8.6692 -8.6692 -8.6463 -8.6463 -8.6330 -8.6330 -8.6017 -8.6017 -8.5957 -8.5957 -8.5870 -8.5870 1.4602 1.4602 5.4838 5.4838 8.4939 8.4939 9.1580 9.1580 9.2016 9.2016 9.4093 9.4093 10.0072 10.0072 10.0239 10.0239 10.3686 10.3686 10.5018 10.5018 10.9751 10.9751 11.0615 11.0615 12.5135 12.5135 14.1261 14.1261 14.4898 14.4898 15.5998 15.5998 15.8695 15.8695 16.6411 16.6411 17.6791 17.6791 k = 0.0000 0.0000 0.1274 ( 2781 PWs) bands (ev): -9.6900 -9.6900 -9.6506 -9.6506 -9.6505 -9.6505 -9.6337 -9.6337 -8.6681 -8.6681 -8.6468 -8.6468 -8.6341 -8.6341 -8.6009 -8.6009 -8.5948 -8.5948 -8.5881 -8.5881 1.4894 1.4894 5.3404 5.3404 8.6390 8.6390 9.1737 9.1737 9.2153 9.2153 9.4265 9.4265 10.0161 10.0161 10.0342 10.0342 10.3551 10.3551 10.4829 10.4829 10.9534 10.9534 11.0380 11.0380 12.5243 12.5243 14.1667 14.1667 14.5310 14.5310 15.6009 15.6009 15.8735 15.8735 16.6818 16.6818 17.5864 17.5864 k = 0.0000 0.0000 0.1402 ( 2781 PWs) bands (ev): -9.6894 -9.6894 -9.6511 -9.6511 -9.6503 -9.6503 -9.6340 -9.6340 -8.6669 -8.6669 -8.6473 -8.6473 -8.6352 -8.6352 -8.6001 -8.6001 -8.5939 -8.5939 -8.5892 -8.5892 1.5216 1.5216 5.1980 5.1980 8.7806 8.7806 9.1914 9.1914 9.2304 9.2304 9.4454 9.4454 10.0256 10.0256 10.0455 10.0455 10.3404 10.3404 10.4619 10.4619 10.9305 10.9305 11.0131 11.0131 12.5387 12.5387 14.2102 14.2102 14.5754 14.5754 15.6017 15.6017 15.8777 15.8777 16.7267 16.7267 17.4837 17.4837 k = 0.0000 0.0000 0.1529 ( 2781 PWs) bands (ev): -9.6887 -9.6887 -9.6517 -9.6517 -9.6501 -9.6501 -9.6343 -9.6343 -8.6656 -8.6656 -8.6478 -8.6478 -8.6363 -8.6363 -8.5993 -8.5993 -8.5931 -8.5931 -8.5905 -8.5905 1.5569 1.5569 5.0569 5.0569 8.9169 8.9169 9.2117 9.2117 9.2468 9.2468 9.4657 9.4657 10.0357 10.0357 10.0579 10.0579 10.3247 10.3247 10.4389 10.4389 10.9068 10.9068 10.9869 10.9869 12.5576 12.5576 14.2563 14.2563 14.6228 14.6228 15.6023 15.6023 15.8817 15.8817 16.7757 16.7757 17.3725 17.3725 k = 0.0000 0.0000 0.1657 ( 2781 PWs) bands (ev): -9.6880 -9.6880 -9.6523 -9.6523 -9.6499 -9.6499 -9.6347 -9.6347 -8.6642 -8.6642 -8.6483 -8.6483 -8.6375 -8.6375 -8.5984 -8.5984 -8.5922 -8.5922 -8.5918 -8.5918 1.5953 1.5953 4.9174 4.9174 9.0452 9.0452 9.2362 9.2362 9.2645 9.2645 9.4875 9.4875 10.0462 10.0462 10.0713 10.0713 10.3080 10.3080 10.4140 10.4140 10.8824 10.8824 10.9596 10.9596 12.5818 12.5818 14.3048 14.3048 14.6728 14.6728 15.6023 15.6023 15.8856 15.8856 16.8287 16.8287 17.2540 17.2540 k = 0.0000 0.0000 0.1784 ( 2787 PWs) bands (ev): -9.6872 -9.6872 -9.6530 -9.6530 -9.6496 -9.6496 -9.6350 -9.6350 -8.6627 -8.6627 -8.6488 -8.6488 -8.6386 -8.6386 -8.5975 -8.5975 -8.5933 -8.5933 -8.5914 -8.5914 1.6367 1.6367 4.7797 4.7797 9.1574 9.1574 9.2718 9.2718 9.2834 9.2834 9.5106 9.5106 10.0567 10.0567 10.0858 10.0858 10.2908 10.2908 10.3872 10.3872 10.8574 10.8574 10.9313 10.9313 12.6122 12.6122 14.3553 14.3553 14.7251 14.7251 15.6018 15.6018 15.8891 15.8891 16.8859 16.8859 17.1292 17.1292 k = 0.0000 0.0000 0.1912 ( 2787 PWs) bands (ev): -9.6864 -9.6864 -9.6537 -9.6537 -9.6494 -9.6494 -9.6354 -9.6354 -8.6611 -8.6611 -8.6493 -8.6493 -8.6397 -8.6397 -8.5966 -8.5966 -8.5948 -8.5948 -8.5906 -8.5906 1.6812 1.6812 4.6438 4.6438 9.2315 9.2315 9.3037 9.3037 9.3394 9.3394 9.5350 9.5350 10.0668 10.0668 10.1013 10.1013 10.2735 10.2735 10.3586 10.3586 10.8322 10.8322 10.9024 10.9024 12.6498 12.6498 14.4074 14.4074 14.7796 14.7796 15.6006 15.6006 15.8920 15.8920 16.9470 16.9470 16.9990 16.9990 k = 0.0000 0.0000 0.2039 ( 2787 PWs) bands (ev): -9.6856 -9.6856 -9.6545 -9.6545 -9.6491 -9.6491 -9.6358 -9.6358 -8.6594 -8.6594 -8.6498 -8.6498 -8.6408 -8.6408 -8.5964 -8.5964 -8.5957 -8.5957 -8.5899 -8.5899 1.7286 1.7286 4.5101 4.5101 9.2711 9.2711 9.3251 9.3251 9.4345 9.4345 9.5605 9.5605 10.0757 10.0757 10.1178 10.1178 10.2570 10.2570 10.3283 10.3283 10.8068 10.8068 10.8731 10.8731 12.6954 12.6954 14.4609 14.4609 14.8358 14.8358 15.5984 15.5984 15.8941 15.8941 16.8642 16.8642 17.0120 17.0120 k = 0.0000 0.0000 0.2167 ( 2787 PWs) bands (ev): -9.6847 -9.6847 -9.6553 -9.6553 -9.6488 -9.6488 -9.6362 -9.6362 -8.6577 -8.6577 -8.6502 -8.6502 -8.6419 -8.6419 -8.5981 -8.5981 -8.5948 -8.5948 -8.5892 -8.5892 1.7792 1.7792 4.3785 4.3785 9.3014 9.3014 9.3477 9.3477 9.5309 9.5309 9.5871 9.5871 10.0821 10.0821 10.1354 10.1354 10.2424 10.2424 10.2964 10.2964 10.7812 10.7812 10.8433 10.8433 12.7499 12.7499 14.5152 14.5152 14.8934 14.8934 15.5952 15.5952 15.8953 15.8953 16.7253 16.7253 17.0809 17.0809 k = 0.0000 0.0000 0.2294 ( 2775 PWs) bands (ev): -9.6838 -9.6838 -9.6562 -9.6562 -9.6484 -9.6484 -9.6367 -9.6367 -8.6558 -8.6558 -8.6506 -8.6506 -8.6429 -8.6429 -8.5998 -8.5998 -8.5940 -8.5940 -8.5886 -8.5886 1.8327 1.8327 4.2491 4.2491 9.3299 9.3299 9.3714 9.3714 9.6145 9.6145 9.6202 9.6202 10.0842 10.0842 10.1540 10.1540 10.2320 10.2320 10.2631 10.2631 10.7556 10.7556 10.8134 10.8134 12.8140 12.8140 14.5700 14.5700 14.9522 14.9522 15.5907 15.5907 15.8953 15.8953 16.5830 16.5830 17.1535 17.1535 k = 0.0000 0.0000 0.2421 ( 2799 PWs) bands (ev): -9.6829 -9.6829 -9.6570 -9.6570 -9.6481 -9.6481 -9.6371 -9.6371 -8.6539 -8.6539 -8.6509 -8.6509 -8.6439 -8.6439 -8.6017 -8.6017 -8.5931 -8.5931 -8.5880 -8.5880 1.8893 1.8893 4.1222 4.1222 9.3584 9.3584 9.3960 9.3960 9.6425 9.6425 9.6999 9.6999 10.0797 10.0797 10.1734 10.1734 10.2272 10.2272 10.2284 10.2284 10.7301 10.7301 10.7834 10.7834 12.8879 12.8879 14.6248 14.6248 15.0117 15.0117 15.5847 15.5847 15.8938 15.8938 16.4377 16.4377 17.2297 17.2297 k = 0.0000 0.0000 0.2549 ( 2787 PWs) bands (ev): -9.6819 -9.6819 -9.6580 -9.6580 -9.6478 -9.6478 -9.6376 -9.6376 -8.6520 -8.6520 -8.6513 -8.6513 -8.6448 -8.6448 -8.6036 -8.6036 -8.5923 -8.5923 -8.5875 -8.5875 1.9489 1.9489 3.9976 3.9976 9.3877 9.3877 9.4218 9.4218 9.6713 9.6713 9.7691 9.7691 10.0683 10.0683 10.1928 10.1928 10.1938 10.1938 10.2295 10.2295 10.7048 10.7048 10.7536 10.7536 12.9720 12.9720 14.6791 14.6791 15.0718 15.0718 15.5771 15.5771 15.8905 15.8905 16.2902 16.2902 17.3093 17.3093 k = 0.0000 0.0000 0.2676 ( 2788 PWs) bands (ev): -9.6809 -9.6809 -9.6589 -9.6589 -9.6474 -9.6474 -9.6380 -9.6380 -8.6516 -8.6516 -8.6500 -8.6500 -8.6457 -8.6457 -8.6056 -8.6056 -8.5915 -8.5915 -8.5870 -8.5870 2.0116 2.0116 3.8755 3.8755 9.4178 9.4178 9.4486 9.4486 9.7003 9.7003 9.8278 9.8278 10.0506 10.0506 10.1562 10.1562 10.2148 10.2148 10.2379 10.2379 10.6794 10.6794 10.7237 10.7237 13.0664 13.0664 14.7321 14.7321 15.1321 15.1321 15.5677 15.5677 15.8852 15.8852 16.1411 16.1411 17.3922 17.3922 k = 0.0000 0.0000 0.2804 ( 2788 PWs) bands (ev): -9.6798 -9.6798 -9.6599 -9.6599 -9.6470 -9.6470 -9.6385 -9.6385 -8.6518 -8.6518 -8.6479 -8.6479 -8.6465 -8.6465 -8.6076 -8.6076 -8.5908 -8.5908 -8.5866 -8.5866 2.0772 2.0772 3.7560 3.7560 9.4489 9.4489 9.4763 9.4763 9.7294 9.7294 9.8760 9.8760 10.0282 10.0282 10.1188 10.1188 10.2364 10.2364 10.2506 10.2506 10.6541 10.6541 10.6940 10.6940 13.1706 13.1706 14.7829 14.7829 15.1921 15.1921 15.5562 15.5562 15.8776 15.8776 15.9914 15.9914 17.4779 17.4779 k = 0.0000 0.0000 0.2931 ( 2770 PWs) bands (ev): -9.6788 -9.6788 -9.6609 -9.6609 -9.6466 -9.6466 -9.6390 -9.6390 -8.6520 -8.6520 -8.6473 -8.6473 -8.6458 -8.6458 -8.6097 -8.6097 -8.5901 -8.5901 -8.5863 -8.5863 2.1458 2.1458 3.6390 3.6390 9.4809 9.4809 9.5048 9.5048 9.7587 9.7587 9.9145 9.9145 10.0028 10.0028 10.0809 10.0809 10.2584 10.2584 10.2666 10.2666 10.6291 10.6291 10.6646 10.6646 13.2842 13.2842 14.8299 14.8299 15.2516 15.2516 15.5426 15.5426 15.8427 15.8427 15.8673 15.8673 17.5661 17.5661 k = 0.0000 0.0000 0.3059 ( 2764 PWs) bands (ev): -9.6777 -9.6777 -9.6619 -9.6619 -9.6462 -9.6462 -9.6395 -9.6395 -8.6521 -8.6521 -8.6480 -8.6480 -8.6436 -8.6436 -8.6118 -8.6118 -8.5894 -8.5894 -8.5860 -8.5860 2.2174 2.2174 3.5247 3.5247 9.5138 9.5138 9.5342 9.5342 9.7873 9.7873 9.9439 9.9439 9.9751 9.9751 10.0426 10.0426 10.2804 10.2804 10.2847 10.2847 10.6042 10.6042 10.6355 10.6355 13.4063 13.4063 14.8707 14.8707 15.3101 15.3101 15.5266 15.5266 15.6974 15.6974 15.8541 15.8541 17.6562 17.6562 k = 0.0000 0.0000 0.3186 ( 2758 PWs) bands (ev): -9.6766 -9.6766 -9.6630 -9.6630 -9.6458 -9.6458 -9.6400 -9.6400 -8.6522 -8.6522 -8.6487 -8.6487 -8.6414 -8.6414 -8.6140 -8.6140 -8.5888 -8.5888 -8.5859 -8.5859 2.2919 2.2919 3.4131 3.4131 9.5477 9.5477 9.5642 9.5642 9.8152 9.8152 9.9457 9.9457 9.9650 9.9650 10.0042 10.0042 10.3024 10.3024 10.3044 10.3044 10.5794 10.5794 10.6068 10.6068 13.5362 13.5362 14.9004 14.9004 15.3674 15.3674 15.5082 15.5082 15.5605 15.5605 15.8376 15.8376 17.7475 17.7475 k = 0.0000 0.0000 0.3314 ( 2758 PWs) bands (ev): -9.6754 -9.6754 -9.6641 -9.6641 -9.6453 -9.6453 -9.6405 -9.6405 -8.6522 -8.6522 -8.6493 -8.6493 -8.6391 -8.6391 -8.6162 -8.6162 -8.5882 -8.5882 -8.5857 -8.5857 2.3695 2.3695 3.3041 3.3041 9.5823 9.5823 9.5949 9.5949 9.8416 9.8416 9.9153 9.9153 9.9661 9.9661 9.9785 9.9785 10.3243 10.3243 10.3254 10.3254 10.5549 10.5549 10.5784 10.5784 13.6727 13.6727 14.9093 14.9093 15.4229 15.4229 15.4416 15.4416 15.4874 15.4874 15.8178 15.8178 17.8389 17.8389 k = 0.0000 0.0000 0.3441 ( 2776 PWs) bands (ev): -9.6743 -9.6743 -9.6652 -9.6652 -9.6449 -9.6449 -9.6410 -9.6410 -8.6522 -8.6522 -8.6499 -8.6499 -8.6369 -8.6369 -8.6184 -8.6184 -8.5877 -8.5877 -8.5857 -8.5857 2.4499 2.4499 3.1979 3.1979 9.6177 9.6177 9.6261 9.6261 9.8645 9.8645 9.8840 9.8840 9.9302 9.9302 9.9848 9.9848 10.3462 10.3462 10.3474 10.3474 10.5306 10.5306 10.5505 10.5505 13.8145 13.8145 14.8815 14.8815 15.3567 15.3567 15.4642 15.4642 15.4764 15.4764 15.7943 15.7943 17.9290 17.9290 k = 0.0000 0.0000 0.3568 ( 2776 PWs) bands (ev): -9.6732 -9.6732 -9.6663 -9.6663 -9.6444 -9.6444 -9.6415 -9.6415 -8.6521 -8.6521 -8.6504 -8.6504 -8.6346 -8.6346 -8.6207 -8.6207 -8.5872 -8.5872 -8.5857 -8.5857 2.5334 2.5334 3.0945 3.0945 9.6538 9.6538 9.6578 9.6578 9.8521 9.8521 9.8693 9.8693 9.9108 9.9108 9.9855 9.9855 10.3682 10.3682 10.3703 10.3703 10.5065 10.5065 10.5231 10.5231 13.9608 13.9608 14.8058 14.8058 15.3173 15.3173 15.4387 15.4387 15.5275 15.5275 15.7672 15.7672 18.0163 18.0163 k = 0.0000 0.0000 0.3696 ( 2788 PWs) bands (ev): -9.6720 -9.6720 -9.6674 -9.6674 -9.6439 -9.6439 -9.6420 -9.6420 -8.6520 -8.6520 -8.6508 -8.6508 -8.6323 -8.6323 -8.6230 -8.6230 -8.5868 -8.5868 -8.5858 -8.5858 2.6197 2.6197 2.9938 2.9938 9.6898 9.6898 9.6905 9.6905 9.8197 9.8197 9.8399 9.8399 9.9236 9.9236 9.9808 9.9808 10.3905 10.3905 10.3941 10.3941 10.4826 10.4826 10.4961 10.4961 14.1099 14.1099 14.6915 14.6915 15.3143 15.3143 15.4115 15.4115 15.5759 15.5759 15.7362 15.7362 18.0986 18.0986 k = 0.0000 0.0000 0.3823 ( 2788 PWs) bands (ev): -9.6709 -9.6709 -9.6686 -9.6686 -9.6435 -9.6435 -9.6425 -9.6425 -8.6518 -8.6518 -8.6512 -8.6512 -8.6299 -8.6299 -8.6253 -8.6253 -8.5864 -8.5864 -8.5859 -8.5859 2.7089 2.7089 2.8960 2.8960 9.7221 9.7221 9.7278 9.7278 9.7872 9.7872 9.8031 9.8031 9.9418 9.9418 9.9714 9.9714 10.4130 10.4130 10.4186 10.4186 10.4591 10.4591 10.4697 10.4697 14.2604 14.2604 14.5558 14.5558 15.3306 15.3306 15.3833 15.3833 15.6211 15.6211 15.7015 15.7015 18.1738 18.1738 k = 0.0000 0.0000 0.3951 ( 2794 PWs) bands (ev): -9.6697 -9.6697 -9.6697 -9.6697 -9.6430 -9.6430 -9.6430 -9.6430 -8.6515 -8.6515 -8.6515 -8.6515 -8.6276 -8.6276 -8.6276 -8.6276 -8.5862 -8.5862 -8.5862 -8.5862 2.8010 2.8010 2.8010 2.8010 9.7546 9.7546 9.7546 9.7546 9.7654 9.7654 9.7654 9.7654 9.9582 9.9582 9.9582 9.9582 10.4359 10.4359 10.4359 10.4359 10.4438 10.4438 10.4438 10.4438 14.4102 14.4102 14.4102 14.4102 15.3554 15.3554 15.3554 15.3554 15.6631 15.6631 15.6631 15.6631 18.2395 18.2395 k = 0.0000 0.0000 0.3951 ( 2794 PWs) bands (ev): -9.6697 -9.6697 -9.6697 -9.6697 -9.6430 -9.6430 -9.6430 -9.6430 -8.6515 -8.6515 -8.6515 -8.6515 -8.6276 -8.6276 -8.6276 -8.6276 -8.5862 -8.5862 -8.5862 -8.5862 2.8010 2.8010 2.8010 2.8010 9.7546 9.7546 9.7546 9.7546 9.7654 9.7654 9.7654 9.7654 9.9582 9.9582 9.9582 9.9582 10.4359 10.4359 10.4359 10.4359 10.4438 10.4438 10.4438 10.4438 14.4102 14.4102 14.4102 14.4102 15.3554 15.3554 15.3554 15.3554 15.6631 15.6631 15.6631 15.6631 18.2395 18.2395 k = 0.0111 0.0064 0.3951 ( 2790 PWs) bands (ev): -9.6697 -9.6697 -9.6697 -9.6697 -9.6430 -9.6430 -9.6430 -9.6430 -8.6515 -8.6515 -8.6515 -8.6515 -8.6276 -8.6276 -8.6276 -8.6276 -8.5861 -8.5861 -8.5861 -8.5861 2.8025 2.8025 2.8025 2.8025 9.7533 9.7533 9.7533 9.7533 9.7645 9.7645 9.7645 9.7645 9.9587 9.9587 9.9587 9.9587 10.4352 10.4352 10.4352 10.4352 10.4445 10.4445 10.4445 10.4445 14.4070 14.4070 14.4070 14.4070 15.3479 15.3479 15.3479 15.3479 15.6547 15.6547 15.6547 15.6547 18.2451 18.2451 k = 0.0222 0.0128 0.3951 ( 2778 PWs) bands (ev): -9.6697 -9.6697 -9.6697 -9.6697 -9.6429 -9.6429 -9.6429 -9.6429 -8.6515 -8.6515 -8.6515 -8.6515 -8.6276 -8.6276 -8.6276 -8.6276 -8.5861 -8.5861 -8.5861 -8.5861 2.8069 2.8069 2.8069 2.8069 9.7484 9.7484 9.7484 9.7484 9.7628 9.7628 9.7628 9.7628 9.9603 9.9603 9.9603 9.9603 10.4335 10.4335 10.4335 10.4335 10.4462 10.4462 10.4462 10.4462 14.3972 14.3972 14.3972 14.3972 15.3255 15.3255 15.3255 15.3255 15.6305 15.6305 15.6305 15.6305 18.2577 18.2577 k = 0.0333 0.0192 0.3951 ( 2778 PWs) bands (ev): -9.6698 -9.6698 -9.6698 -9.6698 -9.6428 -9.6428 -9.6428 -9.6428 -8.6515 -8.6515 -8.6515 -8.6515 -8.6276 -8.6276 -8.6276 -8.6276 -8.5861 -8.5861 -8.5861 -8.5861 2.8142 2.8142 2.8142 2.8142 9.7384 9.7384 9.7384 9.7384 9.7616 9.7616 9.7616 9.7616 9.9628 9.9628 9.9628 9.9628 10.4313 10.4313 10.4313 10.4313 10.4481 10.4481 10.4481 10.4481 14.3798 14.3798 14.3798 14.3798 15.2894 15.2894 15.2894 15.2894 15.5932 15.5932 15.5932 15.5932 18.2654 18.2654 k = 0.0444 0.0257 0.3951 ( 2778 PWs) bands (ev): -9.6698 -9.6698 -9.6698 -9.6698 -9.6427 -9.6427 -9.6427 -9.6427 -8.6515 -8.6515 -8.6515 -8.6515 -8.6275 -8.6275 -8.6275 -8.6275 -8.5860 -8.5860 -8.5860 -8.5860 2.8244 2.8244 2.8244 2.8244 9.7238 9.7238 9.7238 9.7238 9.7610 9.7610 9.7610 9.7610 9.9658 9.9658 9.9658 9.9658 10.4289 10.4289 10.4289 10.4289 10.4502 10.4502 10.4502 10.4502 14.3533 14.3533 14.3533 14.3533 15.2416 15.2416 15.2416 15.2416 15.5462 15.5462 15.5462 15.5462 18.2552 18.2552 k = 0.0556 0.0321 0.3951 ( 2778 PWs) bands (ev): -9.6699 -9.6699 -9.6699 -9.6699 -9.6425 -9.6425 -9.6425 -9.6425 -8.6514 -8.6514 -8.6514 -8.6514 -8.6275 -8.6275 -8.6275 -8.6275 -8.5859 -8.5859 -8.5859 -8.5859 2.8375 2.8375 2.8375 2.8375 9.7051 9.7051 9.7051 9.7051 9.7605 9.7605 9.7605 9.7605 9.9693 9.9693 9.9693 9.9693 10.4264 10.4264 10.4264 10.4264 10.4524 10.4524 10.4524 10.4524 14.3157 14.3157 14.3157 14.3157 15.1853 15.1853 15.1853 15.1853 15.4930 15.4930 15.4930 15.4930 18.2255 18.2255 k = 0.0667 0.0385 0.3951 ( 2770 PWs) bands (ev): -9.6699 -9.6699 -9.6699 -9.6699 -9.6423 -9.6423 -9.6423 -9.6423 -8.6514 -8.6514 -8.6514 -8.6514 -8.6274 -8.6274 -8.6274 -8.6274 -8.5858 -8.5858 -8.5858 -8.5858 2.8536 2.8536 2.8536 2.8536 9.6826 9.6826 9.6826 9.6826 9.7601 9.7601 9.7601 9.7601 9.9731 9.9731 9.9731 9.9731 10.4239 10.4239 10.4239 10.4239 10.4546 10.4546 10.4546 10.4546 14.2647 14.2647 14.2647 14.2647 15.1251 15.1251 15.1251 15.1251 15.4359 15.4359 15.4359 15.4359 18.1834 18.1834 k = 0.0778 0.0449 0.3951 ( 2758 PWs) bands (ev): -9.6700 -9.6700 -9.6700 -9.6700 -9.6421 -9.6421 -9.6421 -9.6421 -8.6513 -8.6513 -8.6513 -8.6513 -8.6273 -8.6273 -8.6273 -8.6273 -8.5857 -8.5857 -8.5857 -8.5857 2.8725 2.8725 2.8725 2.8725 9.6566 9.6566 9.6566 9.6566 9.7597 9.7597 9.7597 9.7597 9.9771 9.9771 9.9771 9.9771 10.4213 10.4213 10.4213 10.4213 10.4569 10.4569 10.4569 10.4569 14.1982 14.1982 14.1982 14.1982 15.0652 15.0652 15.0652 15.0652 15.3770 15.3770 15.3770 15.3770 18.1360 18.1360 k = 0.0889 0.0513 0.3951 ( 2754 PWs) bands (ev): -9.6701 -9.6701 -9.6701 -9.6701 -9.6418 -9.6418 -9.6418 -9.6418 -8.6513 -8.6513 -8.6513 -8.6513 -8.6272 -8.6272 -8.6272 -8.6272 -8.5856 -8.5856 -8.5856 -8.5856 2.8943 2.8943 2.8943 2.8943 9.6271 9.6271 9.6271 9.6271 9.7593 9.7593 9.7593 9.7593 9.9810 9.9810 9.9810 9.9810 10.4186 10.4186 10.4186 10.4186 10.4591 10.4591 10.4591 10.4591 14.1153 14.1153 14.1153 14.1153 15.0089 15.0089 15.0089 15.0089 15.3177 15.3177 15.3177 15.3177 18.0878 18.0878 k = 0.1000 0.0577 0.3951 ( 2760 PWs) bands (ev): -9.6701 -9.6701 -9.6701 -9.6701 -9.6415 -9.6415 -9.6415 -9.6415 -8.6512 -8.6512 -8.6512 -8.6512 -8.6271 -8.6271 -8.6271 -8.6271 -8.5855 -8.5855 -8.5855 -8.5855 2.9189 2.9189 2.9189 2.9189 9.5942 9.5942 9.5942 9.5942 9.7588 9.7588 9.7588 9.7588 9.9848 9.9848 9.9848 9.9848 10.4159 10.4159 10.4159 10.4159 10.4613 10.4613 10.4613 10.4613 14.0162 14.0162 14.0162 14.0162 14.9574 14.9574 14.9574 14.9574 15.2597 15.2597 15.2597 15.2597 18.0411 18.0411 k = 0.1111 0.0642 0.3951 ( 2754 PWs) bands (ev): -9.6702 -9.6702 -9.6702 -9.6702 -9.6412 -9.6412 -9.6412 -9.6412 -8.6512 -8.6512 -8.6512 -8.6512 -8.6270 -8.6270 -8.6270 -8.6270 -8.5853 -8.5853 -8.5853 -8.5853 2.9464 2.9464 2.9464 2.9464 9.5579 9.5579 9.5579 9.5579 9.7583 9.7583 9.7583 9.7583 9.9886 9.9886 9.9886 9.9886 10.4132 10.4132 10.4132 10.4132 10.4637 10.4637 10.4637 10.4637 13.9030 13.9030 13.9030 13.9030 14.9098 14.9098 14.9098 14.9098 15.2048 15.2048 15.2048 15.2048 17.9977 17.9977 k = 0.1222 0.0706 0.3951 ( 2758 PWs) bands (ev): -9.6703 -9.6703 -9.6703 -9.6703 -9.6409 -9.6409 -9.6409 -9.6409 -8.6511 -8.6511 -8.6511 -8.6511 -8.6268 -8.6268 -8.6268 -8.6268 -8.5852 -8.5852 -8.5852 -8.5852 2.9767 2.9767 2.9767 2.9767 9.5183 9.5183 9.5183 9.5183 9.7576 9.7576 9.7576 9.7576 9.9922 9.9922 9.9922 9.9922 10.4105 10.4105 10.4105 10.4105 10.4660 10.4660 10.4660 10.4660 13.7783 13.7783 13.7783 13.7783 14.8637 14.8637 14.8637 14.8637 15.1552 15.1552 15.1552 15.1552 17.9584 17.9584 k = 0.1333 0.0770 0.3951 ( 2758 PWs) bands (ev): -9.6704 -9.6704 -9.6704 -9.6704 -9.6405 -9.6405 -9.6405 -9.6405 -8.6511 -8.6511 -8.6511 -8.6511 -8.6266 -8.6266 -8.6266 -8.6266 -8.5850 -8.5850 -8.5850 -8.5850 3.0097 3.0097 3.0097 3.0097 9.4754 9.4754 9.4754 9.4754 9.7569 9.7569 9.7569 9.7569 9.9957 9.9957 9.9957 9.9957 10.4077 10.4077 10.4077 10.4077 10.4685 10.4685 10.4685 10.4685 13.6448 13.6448 13.6448 13.6448 14.8159 14.8159 14.8159 14.8159 15.1129 15.1129 15.1129 15.1129 17.9238 17.9238 k = 0.1444 0.0834 0.3951 ( 2754 PWs) bands (ev): -9.6705 -9.6705 -9.6705 -9.6705 -9.6402 -9.6402 -9.6402 -9.6402 -8.6510 -8.6510 -8.6510 -8.6510 -8.6264 -8.6264 -8.6264 -8.6264 -8.5848 -8.5848 -8.5848 -8.5848 3.0456 3.0456 3.0456 3.0456 9.4292 9.4292 9.4292 9.4292 9.7561 9.7561 9.7561 9.7561 9.9991 9.9991 9.9991 9.9991 10.4050 10.4050 10.4050 10.4050 10.4711 10.4711 10.4711 10.4711 13.5053 13.5053 13.5053 13.5053 14.7643 14.7643 14.7643 14.7643 15.0793 15.0793 15.0793 15.0793 17.8941 17.8941 k = 0.1556 0.0898 0.3951 ( 2758 PWs) bands (ev): -9.6705 -9.6705 -9.6705 -9.6705 -9.6398 -9.6398 -9.6398 -9.6398 -8.6510 -8.6510 -8.6510 -8.6510 -8.6262 -8.6262 -8.6262 -8.6262 -8.5847 -8.5847 -8.5847 -8.5847 3.0841 3.0841 3.0841 3.0841 9.3797 9.3797 9.3797 9.3797 9.7551 9.7551 9.7551 9.7551 10.0022 10.0022 10.0022 10.0022 10.4023 10.4023 10.4023 10.4023 10.4738 10.4738 10.4738 10.4738 13.3620 13.3620 13.3620 13.3620 14.7080 14.7080 14.7080 14.7080 15.0543 15.0543 15.0543 15.0543 17.8698 17.8698 k = 0.1667 0.0962 0.3951 ( 2766 PWs) bands (ev): -9.6706 -9.6706 -9.6706 -9.6706 -9.6394 -9.6394 -9.6394 -9.6394 -8.6509 -8.6509 -8.6509 -8.6509 -8.6259 -8.6259 -8.6259 -8.6259 -8.5845 -8.5845 -8.5845 -8.5845 3.1254 3.1254 3.1254 3.1254 9.3268 9.3268 9.3268 9.3268 9.7540 9.7540 9.7540 9.7540 10.0052 10.0052 10.0052 10.0052 10.3996 10.3996 10.3996 10.3996 10.4767 10.4767 10.4767 10.4767 13.2168 13.2168 13.2168 13.2168 14.6476 14.6476 14.6476 14.6476 15.0367 15.0367 15.0367 15.0367 17.8509 17.8509 k = 0.1778 0.1026 0.3951 ( 2762 PWs) bands (ev): -9.6707 -9.6707 -9.6707 -9.6707 -9.6390 -9.6390 -9.6390 -9.6390 -8.6509 -8.6509 -8.6509 -8.6509 -8.6256 -8.6256 -8.6256 -8.6256 -8.5843 -8.5843 -8.5843 -8.5843 3.1693 3.1693 3.1693 3.1693 9.2705 9.2705 9.2705 9.2705 9.7529 9.7529 9.7529 9.7529 10.0080 10.0080 10.0080 10.0080 10.3970 10.3970 10.3970 10.3970 10.4798 10.4798 10.4798 10.4798 13.0713 13.0713 13.0713 13.0713 14.5840 14.5840 14.5840 14.5840 15.0249 15.0249 15.0249 15.0249 17.8375 17.8375 k = 0.1889 0.1091 0.3951 ( 2762 PWs) bands (ev): -9.6708 -9.6708 -9.6708 -9.6708 -9.6385 -9.6385 -9.6385 -9.6385 -8.6509 -8.6509 -8.6509 -8.6509 -8.6254 -8.6254 -8.6254 -8.6254 -8.5841 -8.5841 -8.5841 -8.5841 3.2157 3.2157 3.2157 3.2157 9.2109 9.2109 9.2109 9.2109 9.7516 9.7516 9.7516 9.7516 10.0106 10.0106 10.0106 10.0106 10.3945 10.3945 10.3945 10.3945 10.4831 10.4831 10.4831 10.4831 12.9268 12.9268 12.9268 12.9268 14.5184 14.5184 14.5184 14.5184 15.0175 15.0175 15.0175 15.0175 17.8297 17.8297 k = 0.2000 0.1155 0.3951 ( 2748 PWs) bands (ev): -9.6709 -9.6709 -9.6709 -9.6709 -9.6381 -9.6381 -9.6381 -9.6381 -8.6508 -8.6508 -8.6508 -8.6508 -8.6250 -8.6250 -8.6250 -8.6250 -8.5839 -8.5839 -8.5839 -8.5839 3.2648 3.2648 3.2648 3.2648 9.1479 9.1479 9.1479 9.1479 9.7502 9.7502 9.7502 9.7502 10.0129 10.0129 10.0129 10.0129 10.3923 10.3923 10.3923 10.3923 10.4867 10.4867 10.4867 10.4867 12.7842 12.7842 12.7842 12.7842 14.4519 14.4519 14.4519 14.4519 15.0132 15.0132 15.0132 15.0132 17.8274 17.8274 k = 0.2111 0.1219 0.3951 ( 2754 PWs) bands (ev): -9.6709 -9.6709 -9.6709 -9.6709 -9.6377 -9.6377 -9.6377 -9.6377 -8.6508 -8.6508 -8.6508 -8.6508 -8.6247 -8.6247 -8.6247 -8.6247 -8.5837 -8.5837 -8.5837 -8.5837 3.3163 3.3163 3.3163 3.3163 9.0814 9.0814 9.0814 9.0814 9.7487 9.7487 9.7487 9.7487 10.0150 10.0150 10.0150 10.0150 10.3901 10.3901 10.3901 10.3901 10.4903 10.4903 10.4903 10.4903 12.6443 12.6443 12.6443 12.6443 14.3851 14.3851 14.3851 14.3851 15.0110 15.0110 15.0110 15.0110 17.8305 17.8305 k = 0.2222 0.1283 0.3951 ( 2750 PWs) bands (ev): -9.6710 -9.6710 -9.6710 -9.6710 -9.6372 -9.6372 -9.6372 -9.6372 -8.6508 -8.6508 -8.6508 -8.6508 -8.6243 -8.6243 -8.6243 -8.6243 -8.5835 -8.5835 -8.5835 -8.5835 3.3702 3.3702 3.3702 3.3702 9.0115 9.0115 9.0115 9.0115 9.7471 9.7471 9.7471 9.7471 10.0167 10.0167 10.0167 10.0167 10.3882 10.3882 10.3882 10.3882 10.4943 10.4943 10.4943 10.4943 12.5081 12.5081 12.5081 12.5081 14.3187 14.3187 14.3187 14.3187 15.0104 15.0104 15.0104 15.0104 17.8391 17.8391 k = 0.2333 0.1347 0.3951 ( 2744 PWs) bands (ev): -9.6711 -9.6711 -9.6711 -9.6711 -9.6368 -9.6368 -9.6368 -9.6368 -8.6508 -8.6508 -8.6508 -8.6508 -8.6240 -8.6240 -8.6240 -8.6240 -8.5833 -8.5833 -8.5833 -8.5833 3.4265 3.4265 3.4265 3.4265 8.9383 8.9383 8.9383 8.9383 9.7454 9.7454 9.7454 9.7454 10.0181 10.0181 10.0181 10.0181 10.3867 10.3867 10.3867 10.3867 10.4984 10.4984 10.4984 10.4984 12.3759 12.3759 12.3759 12.3759 14.2531 14.2531 14.2531 14.2531 15.0108 15.0108 15.0108 15.0108 17.8531 17.8531 k = 0.2444 0.1411 0.3951 ( 2744 PWs) bands (ev): -9.6711 -9.6711 -9.6711 -9.6711 -9.6364 -9.6364 -9.6364 -9.6364 -8.6508 -8.6508 -8.6508 -8.6508 -8.6236 -8.6236 -8.6236 -8.6236 -8.5831 -8.5831 -8.5831 -8.5831 3.4850 3.4850 3.4850 3.4850 8.8618 8.8618 8.8618 8.8618 9.7436 9.7436 9.7436 9.7436 10.0191 10.0191 10.0191 10.0191 10.3855 10.3855 10.3855 10.3855 10.5028 10.5028 10.5028 10.5028 12.2483 12.2483 12.2483 12.2483 14.1887 14.1887 14.1887 14.1887 15.0117 15.0117 15.0117 15.0117 17.8722 17.8722 k = 0.2556 0.1475 0.3951 ( 2744 PWs) bands (ev): -9.6712 -9.6712 -9.6712 -9.6712 -9.6360 -9.6360 -9.6360 -9.6360 -8.6509 -8.6509 -8.6509 -8.6509 -8.6232 -8.6232 -8.6232 -8.6232 -8.5829 -8.5829 -8.5829 -8.5829 3.5456 3.5456 3.5456 3.5456 8.7822 8.7822 8.7822 8.7822 9.7417 9.7417 9.7417 9.7417 10.0197 10.0197 10.0197 10.0197 10.3846 10.3846 10.3846 10.3846 10.5074 10.5074 10.5074 10.5074 12.1258 12.1258 12.1258 12.1258 14.1257 14.1257 14.1257 14.1257 15.0130 15.0130 15.0130 15.0130 17.8964 17.8964 k = 0.2667 0.1540 0.3951 ( 2746 PWs) bands (ev): -9.6712 -9.6712 -9.6712 -9.6712 -9.6356 -9.6356 -9.6356 -9.6356 -8.6509 -8.6509 -8.6509 -8.6509 -8.6228 -8.6228 -8.6228 -8.6228 -8.5827 -8.5827 -8.5827 -8.5827 3.6084 3.6084 3.6084 3.6084 8.6994 8.6994 8.6994 8.6994 9.7396 9.7396 9.7396 9.7396 10.0199 10.0199 10.0199 10.0199 10.3842 10.3842 10.3842 10.3842 10.5122 10.5122 10.5122 10.5122 12.0086 12.0086 12.0086 12.0086 14.0644 14.0644 14.0644 14.0644 15.0144 15.0144 15.0144 15.0144 17.9255 17.9255 k = 0.2778 0.1604 0.3951 ( 2746 PWs) bands (ev): -9.6713 -9.6713 -9.6713 -9.6713 -9.6351 -9.6351 -9.6351 -9.6351 -8.6509 -8.6509 -8.6509 -8.6509 -8.6224 -8.6224 -8.6224 -8.6224 -8.5825 -8.5825 -8.5825 -8.5825 3.6730 3.6730 3.6730 3.6730 8.6138 8.6138 8.6138 8.6138 9.7375 9.7375 9.7375 9.7375 10.0195 10.0195 10.0195 10.0195 10.3844 10.3844 10.3844 10.3844 10.5172 10.5172 10.5172 10.5172 11.8969 11.8969 11.8969 11.8969 14.0049 14.0049 14.0049 14.0049 15.0159 15.0159 15.0159 15.0159 17.9593 17.9593 k = 0.2889 0.1668 0.3951 ( 2750 PWs) bands (ev): -9.6713 -9.6713 -9.6713 -9.6713 -9.6348 -9.6348 -9.6348 -9.6348 -8.6510 -8.6510 -8.6510 -8.6510 -8.6219 -8.6219 -8.6219 -8.6219 -8.5823 -8.5823 -8.5823 -8.5823 3.7394 3.7394 3.7394 3.7394 8.5256 8.5256 8.5256 8.5256 9.7354 9.7354 9.7354 9.7354 10.0187 10.0187 10.0187 10.0187 10.3851 10.3851 10.3851 10.3851 10.5224 10.5224 10.5224 10.5224 11.7909 11.7909 11.7909 11.7909 13.9476 13.9476 13.9476 13.9476 15.0172 15.0172 15.0172 15.0172 17.9976 17.9976 k = 0.3000 0.1732 0.3951 ( 2744 PWs) bands (ev): -9.6713 -9.6713 -9.6713 -9.6713 -9.6344 -9.6344 -9.6344 -9.6344 -8.6510 -8.6510 -8.6510 -8.6510 -8.6215 -8.6215 -8.6215 -8.6215 -8.5822 -8.5822 -8.5822 -8.5822 3.8074 3.8074 3.8074 3.8074 8.4350 8.4350 8.4350 8.4350 9.7332 9.7332 9.7332 9.7332 10.0175 10.0175 10.0175 10.0175 10.3864 10.3864 10.3864 10.3864 10.5277 10.5277 10.5277 10.5277 11.6907 11.6907 11.6907 11.6907 13.8924 13.8924 13.8924 13.8924 15.0184 15.0184 15.0184 15.0184 18.0401 18.0401 k = 0.3111 0.1796 0.3951 ( 2744 PWs) bands (ev): -9.6713 -9.6713 -9.6713 -9.6713 -9.6340 -9.6340 -9.6340 -9.6340 -8.6510 -8.6510 -8.6510 -8.6510 -8.6211 -8.6211 -8.6211 -8.6211 -8.5820 -8.5820 -8.5820 -8.5820 3.8768 3.8768 3.8768 3.8768 8.3425 8.3425 8.3425 8.3425 9.7310 9.7310 9.7310 9.7310 10.0157 10.0157 10.0157 10.0157 10.3885 10.3885 10.3885 10.3885 10.5332 10.5332 10.5332 10.5332 11.5964 11.5964 11.5964 11.5964 13.8395 13.8395 13.8395 13.8395 15.0194 15.0194 15.0194 15.0194 18.0866 18.0866 k = 0.3222 0.1860 0.3951 ( 2750 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6336 -9.6336 -9.6336 -9.6336 -8.6511 -8.6511 -8.6511 -8.6511 -8.6207 -8.6207 -8.6207 -8.6207 -8.5818 -8.5818 -8.5818 -8.5818 3.9474 3.9474 3.9474 3.9474 8.2483 8.2483 8.2483 8.2483 9.7288 9.7288 9.7288 9.7288 10.0135 10.0135 10.0135 10.0135 10.3911 10.3911 10.3911 10.3911 10.5387 10.5387 10.5387 10.5387 11.5078 11.5078 11.5078 11.5078 13.7891 13.7891 13.7891 13.7891 15.0201 15.0201 15.0201 15.0201 18.1368 18.1368 k = 0.3333 0.1925 0.3951 ( 2748 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6333 -9.6333 -9.6333 -9.6333 -8.6511 -8.6511 -8.6511 -8.6511 -8.6203 -8.6203 -8.6203 -8.6203 -8.5817 -8.5817 -8.5817 -8.5817 4.0190 4.0190 4.0190 4.0190 8.1530 8.1530 8.1530 8.1530 9.7266 9.7266 9.7266 9.7266 10.0108 10.0108 10.0108 10.0108 10.3946 10.3946 10.3946 10.3946 10.5443 10.5443 10.5443 10.5443 11.4249 11.4249 11.4249 11.4249 13.7412 13.7412 13.7412 13.7412 15.0207 15.0207 15.0207 15.0207 18.1903 18.1903 k = 0.3444 0.1989 0.3951 ( 2748 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6330 -9.6330 -9.6330 -9.6330 -8.6512 -8.6512 -8.6512 -8.6512 -8.6199 -8.6199 -8.6199 -8.6199 -8.5815 -8.5815 -8.5815 -8.5815 4.0911 4.0911 4.0911 4.0911 8.0571 8.0571 8.0571 8.0571 9.7244 9.7244 9.7244 9.7244 10.0078 10.0078 10.0078 10.0078 10.3989 10.3989 10.3989 10.3989 10.5500 10.5500 10.5500 10.5500 11.3477 11.3477 11.3477 11.3477 13.6960 13.6960 13.6960 13.6960 15.0211 15.0211 15.0211 15.0211 18.2468 18.2468 k = 0.3556 0.2053 0.3951 ( 2744 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6327 -9.6327 -9.6327 -9.6327 -8.6512 -8.6512 -8.6512 -8.6512 -8.6195 -8.6195 -8.6195 -8.6195 -8.5814 -8.5814 -8.5814 -8.5814 4.1636 4.1636 4.1636 4.1636 7.9613 7.9613 7.9613 7.9613 9.7222 9.7222 9.7222 9.7222 10.0044 10.0044 10.0044 10.0044 10.4038 10.4038 10.4038 10.4038 10.5558 10.5558 10.5558 10.5558 11.2759 11.2759 11.2759 11.2759 13.6535 13.6535 13.6535 13.6535 15.0212 15.0212 15.0212 15.0212 18.3059 18.3059 k = 0.3667 0.2117 0.3951 ( 2744 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6324 -9.6324 -9.6324 -9.6324 -8.6513 -8.6513 -8.6513 -8.6513 -8.6191 -8.6191 -8.6191 -8.6191 -8.5812 -8.5812 -8.5812 -8.5812 4.2359 4.2359 4.2359 4.2359 7.8661 7.8661 7.8661 7.8661 9.7201 9.7201 9.7201 9.7201 10.0008 10.0008 10.0008 10.0008 10.4095 10.4095 10.4095 10.4095 10.5615 10.5615 10.5615 10.5615 11.2094 11.2094 11.2094 11.2094 13.6138 13.6138 13.6138 13.6138 15.0212 15.0212 15.0212 15.0212 18.3670 18.3670 k = 0.3778 0.2181 0.3951 ( 2742 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6321 -9.6321 -9.6321 -9.6321 -8.6513 -8.6513 -8.6513 -8.6513 -8.6188 -8.6188 -8.6188 -8.6188 -8.5811 -8.5811 -8.5811 -8.5811 4.3075 4.3075 4.3075 4.3075 7.7723 7.7723 7.7723 7.7723 9.7182 9.7182 9.7182 9.7182 9.9970 9.9970 9.9970 9.9970 10.4158 10.4158 10.4158 10.4158 10.5673 10.5673 10.5673 10.5673 11.1479 11.1479 11.1479 11.1479 13.5770 13.5770 13.5770 13.5770 15.0211 15.0211 15.0211 15.0211 18.4296 18.4296 k = 0.3889 0.2245 0.3951 ( 2738 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6319 -9.6319 -9.6319 -9.6319 -8.6514 -8.6514 -8.6514 -8.6514 -8.6185 -8.6185 -8.6185 -8.6185 -8.5810 -8.5810 -8.5810 -8.5810 4.3779 4.3779 4.3779 4.3779 7.6807 7.6807 7.6807 7.6807 9.7163 9.7163 9.7163 9.7163 9.9931 9.9931 9.9931 9.9931 10.4227 10.4227 10.4227 10.4227 10.5731 10.5731 10.5731 10.5731 11.0913 11.0913 11.0913 11.0913 13.5432 13.5432 13.5432 13.5432 15.0208 15.0208 15.0208 15.0208 18.4931 18.4931 k = 0.4000 0.2309 0.3951 ( 2734 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6316 -9.6316 -9.6316 -9.6316 -8.6514 -8.6514 -8.6514 -8.6514 -8.6182 -8.6182 -8.6182 -8.6182 -8.5809 -8.5809 -8.5809 -8.5809 4.4464 4.4464 4.4464 4.4464 7.5923 7.5923 7.5923 7.5923 9.7146 9.7146 9.7146 9.7146 9.9892 9.9892 9.9892 9.9892 10.4301 10.4301 10.4301 10.4301 10.5788 10.5788 10.5788 10.5788 11.0394 11.0394 11.0394 11.0394 13.5123 13.5123 13.5123 13.5123 15.0205 15.0205 15.0205 15.0205 18.5568 18.5568 k = 0.4111 0.2374 0.3951 ( 2738 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6314 -9.6314 -9.6314 -9.6314 -8.6514 -8.6514 -8.6514 -8.6514 -8.6179 -8.6179 -8.6179 -8.6179 -8.5808 -8.5808 -8.5808 -8.5808 4.5123 4.5123 4.5123 4.5123 7.5080 7.5080 7.5080 7.5080 9.7129 9.7129 9.7129 9.7129 9.9854 9.9854 9.9854 9.9854 10.4378 10.4378 10.4378 10.4378 10.5846 10.5846 10.5846 10.5846 10.9921 10.9921 10.9921 10.9921 13.4846 13.4846 13.4846 13.4846 15.0202 15.0202 15.0202 15.0202 18.6196 18.6196 k = 0.4222 0.2438 0.3951 ( 2736 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6313 -9.6313 -9.6313 -9.6313 -8.6515 -8.6515 -8.6515 -8.6515 -8.6177 -8.6177 -8.6177 -8.6177 -8.5807 -8.5807 -8.5807 -8.5807 4.5745 4.5745 4.5745 4.5745 7.4290 7.4290 7.4290 7.4290 9.7114 9.7114 9.7114 9.7114 9.9818 9.9818 9.9818 9.9818 10.4458 10.4458 10.4458 10.4458 10.5904 10.5904 10.5904 10.5904 10.9492 10.9492 10.9492 10.9492 13.4599 13.4599 13.4599 13.4599 15.0198 15.0198 15.0198 15.0198 18.6807 18.6807 k = 0.4333 0.2502 0.3951 ( 2736 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6311 -9.6311 -9.6311 -9.6311 -8.6515 -8.6515 -8.6515 -8.6515 -8.6175 -8.6175 -8.6175 -8.6175 -8.5806 -8.5806 -8.5806 -8.5806 4.6321 4.6321 4.6321 4.6321 7.3565 7.3565 7.3565 7.3565 9.7101 9.7101 9.7101 9.7101 9.9784 9.9784 9.9784 9.9784 10.4536 10.4536 10.4536 10.4536 10.5962 10.5962 10.5962 10.5962 10.9108 10.9108 10.9108 10.9108 13.4385 13.4385 13.4385 13.4385 15.0194 15.0194 15.0194 15.0194 18.7386 18.7386 k = 0.4444 0.2566 0.3951 ( 2744 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6310 -9.6310 -9.6310 -9.6310 -8.6515 -8.6515 -8.6515 -8.6515 -8.6173 -8.6173 -8.6173 -8.6173 -8.5806 -8.5806 -8.5806 -8.5806 4.6838 4.6838 4.6838 4.6838 7.2918 7.2918 7.2918 7.2918 9.7089 9.7089 9.7089 9.7089 9.9754 9.9754 9.9754 9.9754 10.4611 10.4611 10.4611 10.4611 10.6021 10.6021 10.6021 10.6021 10.8768 10.8768 10.8768 10.8768 13.4202 13.4202 13.4202 13.4202 15.0190 15.0190 15.0190 15.0190 18.7920 18.7920 k = 0.4556 0.2630 0.3951 ( 2748 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6309 -9.6309 -9.6309 -9.6309 -8.6516 -8.6516 -8.6516 -8.6516 -8.6171 -8.6171 -8.6171 -8.6171 -8.5805 -8.5805 -8.5805 -8.5805 4.7286 4.7286 4.7286 4.7286 7.2363 7.2363 7.2363 7.2363 9.7080 9.7080 9.7080 9.7080 9.9729 9.9729 9.9729 9.9729 10.4680 10.4680 10.4680 10.4680 10.6079 10.6079 10.6079 10.6079 10.8476 10.8476 10.8476 10.8476 13.4053 13.4053 13.4053 13.4053 15.0187 15.0187 15.0187 15.0187 18.8392 18.8392 k = 0.4667 0.2694 0.3951 ( 2752 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6308 -9.6308 -9.6308 -9.6308 -8.6516 -8.6516 -8.6516 -8.6516 -8.6170 -8.6170 -8.6170 -8.6170 -8.5805 -8.5805 -8.5805 -8.5805 4.7651 4.7651 4.7651 4.7651 7.1913 7.1913 7.1913 7.1913 9.7072 9.7072 9.7072 9.7072 9.9708 9.9708 9.9708 9.9708 10.4738 10.4738 10.4738 10.4738 10.6135 10.6135 10.6135 10.6135 10.8234 10.8234 10.8234 10.8234 13.3936 13.3936 13.3936 13.3936 15.0184 15.0184 15.0184 15.0184 18.8785 18.8785 k = 0.4778 0.2758 0.3951 ( 2756 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6307 -9.6307 -9.6307 -9.6307 -8.6516 -8.6516 -8.6516 -8.6516 -8.6169 -8.6169 -8.6169 -8.6169 -8.5804 -8.5804 -8.5804 -8.5804 4.7921 4.7921 4.7921 4.7921 7.1582 7.1582 7.1582 7.1582 9.7067 9.7067 9.7067 9.7067 9.9693 9.9693 9.9693 9.9693 10.4783 10.4783 10.4783 10.4783 10.6183 10.6183 10.6183 10.6183 10.8051 10.8051 10.8051 10.8051 13.3852 13.3852 13.3852 13.3852 15.0182 15.0182 15.0182 15.0182 18.9081 18.9081 k = 0.4889 0.2823 0.3951 ( 2760 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6307 -9.6307 -9.6307 -9.6307 -8.6516 -8.6516 -8.6516 -8.6516 -8.6169 -8.6169 -8.6169 -8.6169 -8.5804 -8.5804 -8.5804 -8.5804 4.8088 4.8088 4.8088 4.8088 7.1378 7.1378 7.1378 7.1378 9.7063 9.7063 9.7063 9.7063 9.9684 9.9684 9.9684 9.9684 10.4811 10.4811 10.4811 10.4811 10.6217 10.6217 10.6217 10.6217 10.7935 10.7935 10.7935 10.7935 13.3802 13.3802 13.3802 13.3802 15.0181 15.0181 15.0181 15.0181 18.9266 18.9266 k = 0.5000 0.2887 0.3951 ( 2752 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6307 -9.6307 -9.6307 -9.6307 -8.6516 -8.6516 -8.6516 -8.6516 -8.6168 -8.6168 -8.6168 -8.6168 -8.5804 -8.5804 -8.5804 -8.5804 4.8144 4.8144 4.8144 4.8144 7.1310 7.1310 7.1310 7.1310 9.7063 9.7063 9.7063 9.7063 9.9681 9.9681 9.9681 9.9681 10.4821 10.4821 10.4821 10.4821 10.6229 10.6229 10.6229 10.6229 10.7895 10.7895 10.7895 10.7895 13.3786 13.3786 13.3786 13.3786 15.0180 15.0180 15.0180 15.0180 18.9329 18.9329 k = 0.5000 0.2887 0.3951 ( 2752 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6307 -9.6307 -9.6307 -9.6307 -8.6516 -8.6516 -8.6516 -8.6516 -8.6168 -8.6168 -8.6168 -8.6168 -8.5804 -8.5804 -8.5804 -8.5804 4.8144 4.8144 4.8144 4.8144 7.1310 7.1310 7.1310 7.1310 9.7063 9.7063 9.7063 9.7063 9.9681 9.9681 9.9681 9.9681 10.4821 10.4821 10.4821 10.4821 10.6229 10.6229 10.6229 10.6229 10.7895 10.7895 10.7895 10.7895 13.3786 13.3786 13.3786 13.3786 15.0180 15.0180 15.0180 15.0180 18.9329 18.9329 k = 0.4936 0.2998 0.3951 ( 2760 PWs) bands (ev): -9.6715 -9.6715 -9.6712 -9.6712 -9.6307 -9.6307 -9.6306 -9.6306 -8.6522 -8.6522 -8.6509 -8.6509 -8.6174 -8.6174 -8.6163 -8.6163 -8.5806 -8.5806 -8.5803 -8.5803 4.8150 4.8150 4.8154 4.8154 7.1325 7.1325 7.1325 7.1325 9.6985 9.6985 9.7076 9.7076 9.9648 9.9648 9.9729 9.9729 10.4779 10.4779 10.4856 10.4856 10.6154 10.6154 10.6292 10.6292 10.7877 10.7877 10.7934 10.7934 13.3546 13.3546 13.3598 13.3598 15.0380 15.0380 15.0495 15.0495 18.9334 18.9334 k = 0.4872 0.3109 0.3951 ( 2756 PWs) bands (ev): -9.6716 -9.6716 -9.6711 -9.6711 -9.6308 -9.6308 -9.6305 -9.6305 -8.6529 -8.6529 -8.6502 -8.6502 -8.6179 -8.6179 -8.6157 -8.6157 -8.5808 -8.5808 -8.5802 -8.5802 4.8173 4.8173 4.8181 4.8181 7.1370 7.1370 7.1371 7.1371 9.6849 9.6849 9.7023 9.7023 9.9634 9.9634 9.9790 9.9790 10.4731 10.4731 10.4882 10.4882 10.6070 10.6070 10.6341 10.6341 10.7884 10.7884 10.7993 10.7993 13.2924 13.2924 13.3017 13.3017 15.1060 15.1060 15.1280 15.1280 18.9382 18.9382 k = 0.4808 0.3220 0.3951 ( 2756 PWs) bands (ev): -9.6717 -9.6717 -9.6709 -9.6709 -9.6309 -9.6309 -9.6304 -9.6304 -8.6535 -8.6535 -8.6495 -8.6495 -8.6184 -8.6184 -8.6151 -8.6151 -8.5810 -8.5810 -8.5801 -8.5801 4.8213 4.8213 4.8224 4.8224 7.1446 7.1446 7.1448 7.1448 9.6656 9.6656 9.6904 9.6904 9.9637 9.9637 9.9857 9.9857 10.4677 10.4677 10.4901 10.4901 10.5980 10.5980 10.6374 10.6374 10.7915 10.7915 10.8068 10.8068 13.2012 13.2012 13.2131 13.2131 15.2132 15.2132 15.2442 15.2442 18.9474 18.9474 k = 0.4744 0.3331 0.3951 ( 2752 PWs) bands (ev): -9.6719 -9.6719 -9.6708 -9.6708 -9.6310 -9.6310 -9.6302 -9.6302 -8.6540 -8.6540 -8.6488 -8.6488 -8.6189 -8.6189 -8.6145 -8.6145 -8.5813 -8.5813 -8.5801 -8.5801 4.8269 4.8269 4.8283 4.8283 7.1552 7.1552 7.1555 7.1555 9.6412 9.6412 9.6721 9.6721 9.9655 9.9655 9.9929 9.9929 10.4619 10.4619 10.4911 10.4911 10.5885 10.5885 10.6389 10.6389 10.7972 10.7972 10.8159 10.8159 13.0909 13.0909 13.1039 13.1039 15.3495 15.3495 15.3884 15.3884 18.9610 18.9610 k = 0.4679 0.3442 0.3951 ( 2756 PWs) bands (ev): -9.6720 -9.6720 -9.6706 -9.6706 -9.6310 -9.6310 -9.6301 -9.6301 -8.6546 -8.6546 -8.6480 -8.6480 -8.6193 -8.6193 -8.6138 -8.6138 -8.5816 -8.5816 -8.5801 -8.5801 4.8340 4.8340 4.8358 4.8358 7.1688 7.1688 7.1692 7.1692 9.6116 9.6116 9.6474 9.6474 9.9684 9.9684 10.0001 10.0001 10.4556 10.4556 10.4912 10.4912 10.5788 10.5788 10.6387 10.6387 10.8053 10.8053 10.8262 10.8262 12.9692 12.9692 12.9824 12.9824 15.5064 15.5064 15.5525 15.5525 18.9791 18.9791 k = 0.4615 0.3553 0.3951 ( 2752 PWs) bands (ev): -9.6721 -9.6721 -9.6705 -9.6705 -9.6311 -9.6311 -9.6300 -9.6300 -8.6551 -8.6551 -8.6472 -8.6472 -8.6198 -8.6198 -8.6131 -8.6131 -8.5820 -8.5820 -8.5802 -8.5802 4.8427 4.8427 4.8449 4.8449 7.1854 7.1854 7.1860 7.1860 9.5770 9.5770 9.6167 9.6167 9.9721 9.9721 10.0074 10.0074 10.4491 10.4491 10.4903 10.4903 10.5689 10.5689 10.6371 10.6371 10.8156 10.8156 10.8379 10.8379 12.8421 12.8421 12.8547 12.8547 15.6778 15.6778 15.7307 15.7307 19.0019 19.0019 k = 0.4551 0.3664 0.3951 ( 2756 PWs) bands (ev): -9.6721 -9.6721 -9.6703 -9.6703 -9.6311 -9.6311 -9.6299 -9.6299 -8.6556 -8.6556 -8.6464 -8.6464 -8.6202 -8.6202 -8.6124 -8.6124 -8.5823 -8.5823 -8.5803 -8.5803 4.8529 4.8529 4.8554 4.8554 7.2050 7.2050 7.2057 7.2057 9.5373 9.5373 9.5802 9.5802 9.9763 9.9763 10.0143 10.0143 10.4423 10.4423 10.4886 10.4886 10.5591 10.5591 10.6342 10.6342 10.8278 10.8278 10.8506 10.8506 12.7136 12.7136 12.7250 12.7250 15.8589 15.8589 15.9186 15.9186 19.0296 19.0296 k = 0.4487 0.3775 0.3951 ( 2760 PWs) bands (ev): -9.6722 -9.6722 -9.6702 -9.6702 -9.6312 -9.6312 -9.6297 -9.6297 -8.6560 -8.6560 -8.6456 -8.6456 -8.6206 -8.6206 -8.6117 -8.6117 -8.5827 -8.5827 -8.5804 -8.5804 4.8645 4.8645 4.8674 4.8674 7.2275 7.2275 7.2285 7.2285 9.4926 9.4926 9.5380 9.5380 9.9807 9.9807 10.0209 10.0209 10.4354 10.4354 10.4860 10.4860 10.5493 10.5493 10.6304 10.6304 10.8416 10.8416 10.8644 10.8644 12.5863 12.5863 12.5964 12.5964 16.0463 16.0463 16.1133 16.1133 19.0627 19.0627 k = 0.4423 0.3886 0.3951 ( 2754 PWs) bands (ev): -9.6723 -9.6723 -9.6700 -9.6700 -9.6312 -9.6312 -9.6296 -9.6296 -8.6564 -8.6564 -8.6448 -8.6448 -8.6210 -8.6210 -8.6110 -8.6110 -8.5831 -8.5831 -8.5806 -8.5806 4.8775 4.8775 4.8808 4.8808 7.2529 7.2529 7.2541 7.2541 9.4429 9.4429 9.4902 9.4902 9.9850 9.9850 10.0272 10.0272 10.4284 10.4284 10.4825 10.4825 10.5398 10.5398 10.6258 10.6258 10.8570 10.8570 10.8792 10.8792 12.4625 12.4625 12.4710 12.4710 16.2375 16.2375 16.3121 16.3121 19.1014 19.1014 k = 0.4359 0.3997 0.3951 ( 2754 PWs) bands (ev): -9.6724 -9.6724 -9.6698 -9.6698 -9.6313 -9.6313 -9.6295 -9.6295 -8.6568 -8.6568 -8.6440 -8.6440 -8.6214 -8.6214 -8.6103 -8.6103 -8.5835 -8.5835 -8.5808 -8.5808 4.8918 4.8918 4.8954 4.8954 7.2812 7.2812 7.2827 7.2827 9.3880 9.3880 9.4368 9.4368 9.9893 9.9893 10.0332 10.0332 10.4214 10.4214 10.4782 10.4782 10.5306 10.5306 10.6206 10.6206 10.8735 10.8735 10.8949 10.8949 12.3434 12.3434 12.3502 12.3502 16.4299 16.4299 16.5128 16.5128 19.1464 19.1464 k = 0.4295 0.4108 0.3951 ( 2750 PWs) bands (ev): -9.6724 -9.6724 -9.6697 -9.6697 -9.6313 -9.6313 -9.6294 -9.6294 -8.6572 -8.6572 -8.6431 -8.6431 -8.6218 -8.6218 -8.6095 -8.6095 -8.5839 -8.5839 -8.5811 -8.5811 4.9072 4.9072 4.9111 4.9111 7.3122 7.3122 7.3142 7.3142 9.3280 9.3280 9.3782 9.3782 9.9933 9.9933 10.0387 10.0387 10.4145 10.4145 10.4731 10.4731 10.5218 10.5218 10.6151 10.6151 10.8910 10.8910 10.9115 10.9115 12.2302 12.2302 12.2351 12.2351 16.6216 16.6216 16.7135 16.7135 19.1984 19.1984 k = 0.4231 0.4219 0.3951 ( 2754 PWs) bands (ev): -9.6725 -9.6725 -9.6695 -9.6695 -9.6313 -9.6313 -9.6292 -9.6292 -8.6576 -8.6576 -8.6423 -8.6423 -8.6222 -8.6222 -8.6088 -8.6088 -8.5843 -8.5843 -8.5813 -8.5813 4.9236 4.9236 4.9279 4.9279 7.3460 7.3460 7.3484 7.3484 9.2629 9.2629 9.3142 9.3142 9.9971 9.9971 10.0439 10.0439 10.4077 10.4077 10.4672 10.4672 10.5135 10.5135 10.6092 10.6092 10.9096 10.9096 10.9289 10.9289 12.1234 12.1234 12.1264 12.1264 16.8104 16.8104 16.9121 16.9121 19.2583 19.2583 k = 0.4167 0.4330 0.3951 ( 2762 PWs) bands (ev): -9.6725 -9.6725 -9.6694 -9.6694 -9.6313 -9.6313 -9.6291 -9.6291 -8.6579 -8.6579 -8.6414 -8.6414 -8.6225 -8.6225 -8.6080 -8.6080 -8.5847 -8.5847 -8.5816 -8.5816 4.9409 4.9409 4.9456 4.9456 7.3824 7.3824 7.3855 7.3855 9.1931 9.1931 9.2454 9.2454 10.0005 10.0005 10.0487 10.0487 10.4011 10.4011 10.4607 10.4607 10.5058 10.5058 10.6032 10.6032 10.9290 10.9290 10.9470 10.9470 12.0235 12.0235 12.0245 12.0245 16.9942 16.9942 17.1064 17.1064 19.3272 19.3272 k = 0.4103 0.4441 0.3951 ( 2758 PWs) bands (ev): -9.6726 -9.6726 -9.6692 -9.6692 -9.6313 -9.6313 -9.6290 -9.6290 -8.6582 -8.6582 -8.6406 -8.6406 -8.6229 -8.6229 -8.6073 -8.6073 -8.5851 -8.5851 -8.5820 -8.5820 4.9589 4.9589 4.9639 4.9639 7.4213 7.4213 7.4253 7.4253 9.1188 9.1188 9.1722 9.1722 10.0037 10.0037 10.0532 10.0532 10.3948 10.3948 10.4538 10.4538 10.4986 10.4986 10.5971 10.5971 10.9492 10.9492 10.9658 10.9658 11.9298 11.9298 11.9309 11.9309 17.1708 17.1708 17.2942 17.2942 19.4062 19.4062 k = 0.4038 0.4552 0.3951 ( 2758 PWs) bands (ev): -9.6726 -9.6726 -9.6691 -9.6691 -9.6313 -9.6313 -9.6289 -9.6289 -8.6585 -8.6585 -8.6398 -8.6398 -8.6233 -8.6233 -8.6065 -8.6065 -8.5855 -8.5855 -8.5823 -8.5823 4.9775 4.9775 4.9829 4.9829 7.4627 7.4627 7.4677 7.4677 9.0404 9.0404 9.0949 9.0949 10.0066 10.0066 10.0574 10.0574 10.3889 10.3889 10.4467 10.4467 10.4919 10.4919 10.5911 10.5911 10.9701 10.9701 10.9853 10.9853 11.8421 11.8421 11.8453 11.8453 17.3382 17.3382 17.4731 17.4731 19.4968 19.4968 k = 0.3974 0.4663 0.3951 ( 2766 PWs) bands (ev): -9.6727 -9.6727 -9.6690 -9.6690 -9.6313 -9.6313 -9.6287 -9.6287 -8.6587 -8.6587 -8.6390 -8.6390 -8.6237 -8.6237 -8.6058 -8.6058 -8.5859 -8.5859 -8.5827 -8.5827 4.9964 4.9964 5.0021 5.0021 7.5063 7.5063 7.5127 7.5127 8.9586 8.9586 9.0144 9.0144 10.0091 10.0091 10.0611 10.0611 10.3832 10.3832 10.4396 10.4396 10.4856 10.4856 10.5852 10.5852 10.9918 10.9918 11.0053 11.0053 11.7615 11.7615 11.7669 11.7669 17.4943 17.4943 17.6405 17.6405 19.6001 19.6001 k = 0.3910 0.4774 0.3951 ( 2758 PWs) bands (ev): -9.6727 -9.6727 -9.6689 -9.6689 -9.6313 -9.6313 -9.6286 -9.6286 -8.6590 -8.6590 -8.6382 -8.6382 -8.6240 -8.6240 -8.6051 -8.6051 -8.5863 -8.5863 -8.5830 -8.5830 5.0153 5.0153 5.0213 5.0213 7.5520 7.5520 7.5601 7.5601 8.8741 8.8741 8.9316 8.9316 10.0114 10.0114 10.0645 10.0645 10.3781 10.3781 10.4328 10.4328 10.4798 10.4798 10.5796 10.5796 11.0142 11.0142 11.0261 11.0261 11.6876 11.6876 11.6953 11.6953 17.6372 17.6372 17.7942 17.7942 19.7172 19.7172 k = 0.3846 0.4885 0.3951 ( 2764 PWs) bands (ev): -9.6727 -9.6727 -9.6688 -9.6688 -9.6313 -9.6313 -9.6285 -9.6285 -8.6592 -8.6592 -8.6374 -8.6374 -8.6244 -8.6244 -8.6044 -8.6044 -8.5866 -8.5866 -8.5834 -8.5834 5.0340 5.0340 5.0404 5.0404 7.5995 7.5995 7.6098 7.6098 8.7877 8.7877 8.8473 8.8473 10.0133 10.0133 10.0675 10.0675 10.3734 10.3734 10.4264 10.4264 10.4743 10.4743 10.5742 10.5742 11.0371 11.0371 11.0472 11.0472 11.6202 11.6202 11.6303 11.6303 17.7655 17.7655 17.9324 17.9324 19.8483 19.8483 k = 0.3782 0.4996 0.3951 ( 2760 PWs) bands (ev): -9.6727 -9.6727 -9.6687 -9.6687 -9.6313 -9.6313 -9.6284 -9.6284 -8.6593 -8.6593 -8.6367 -8.6367 -8.6248 -8.6248 -8.6038 -8.6038 -8.5869 -8.5869 -8.5837 -8.5837 5.0522 5.0522 5.0589 5.0589 7.6483 7.6483 7.6617 7.6617 8.7003 8.7003 8.7628 8.7628 10.0150 10.0150 10.0703 10.0703 10.3692 10.3692 10.4206 10.4206 10.4691 10.4691 10.5692 10.5692 11.0608 11.0608 11.0687 11.0687 11.5589 11.5589 11.5716 11.5716 17.8782 17.8782 18.0536 18.0536 19.9928 19.9928 k = 0.3718 0.5107 0.3951 ( 2760 PWs) bands (ev): -9.6728 -9.6728 -9.6686 -9.6686 -9.6313 -9.6313 -9.6283 -9.6283 -8.6595 -8.6595 -8.6360 -8.6360 -8.6251 -8.6251 -8.6032 -8.6032 -8.5871 -8.5871 -8.5841 -8.5841 5.0695 5.0695 5.0764 5.0764 7.6980 7.6980 7.7154 7.7154 8.6130 8.6130 8.6794 8.6794 10.0164 10.0164 10.0726 10.0726 10.3657 10.3657 10.4157 10.4157 10.4643 10.4643 10.5646 10.5646 11.0849 11.0849 11.0904 11.0904 11.5033 11.5033 11.5188 11.5188 17.9750 17.9750 18.1573 18.1573 20.1491 20.1491 k = 0.3654 0.5218 0.3951 ( 2756 PWs) bands (ev): -9.6728 -9.6728 -9.6685 -9.6685 -9.6313 -9.6313 -9.6283 -9.6283 -8.6596 -8.6596 -8.6354 -8.6354 -8.6255 -8.6255 -8.6027 -8.6027 -8.5874 -8.5874 -8.5844 -8.5844 5.0855 5.0855 5.0927 5.0927 7.7477 7.7477 7.7706 7.7706 8.5271 8.5271 8.5988 8.5988 10.0175 10.0175 10.0746 10.0746 10.3627 10.3627 10.4116 10.4116 10.4599 10.4599 10.5605 10.5605 11.1095 11.1095 11.1122 11.1122 11.4529 11.4529 11.4718 11.4718 18.0558 18.0558 18.2434 18.2434 20.3141 20.3141 k = 0.3590 0.5329 0.3951 ( 2756 PWs) bands (ev): -9.6728 -9.6728 -9.6685 -9.6685 -9.6313 -9.6313 -9.6282 -9.6282 -8.6597 -8.6597 -8.6348 -8.6348 -8.6258 -8.6258 -8.6022 -8.6022 -8.5876 -8.5876 -8.5847 -8.5847 5.0998 5.0998 5.1071 5.1071 7.7961 7.7961 7.8267 7.8267 8.4440 8.4440 8.5233 8.5233 10.0184 10.0184 10.0762 10.0762 10.3602 10.3602 10.4084 10.4084 10.4559 10.4559 10.5570 10.5570 11.1335 11.1335 11.1344 11.1344 11.4077 11.4077 11.4306 11.4306 18.1208 18.1208 18.3124 18.3124 20.4834 20.4834 k = 0.3526 0.5440 0.3951 ( 2752 PWs) bands (ev): -9.6728 -9.6728 -9.6684 -9.6684 -9.6313 -9.6313 -9.6282 -9.6282 -8.6598 -8.6598 -8.6343 -8.6343 -8.6261 -8.6261 -8.6018 -8.6018 -8.5877 -8.5877 -8.5849 -8.5849 5.1118 5.1118 5.1193 5.1193 7.8411 7.8411 7.8824 7.8824 8.3658 8.3658 8.4558 8.4558 10.0191 10.0191 10.0774 10.0774 10.3584 10.3584 10.4062 10.4062 10.4524 10.4524 10.5542 10.5542 11.1535 11.1535 11.1592 11.1592 11.3675 11.3675 11.3955 11.3955 18.1704 18.1704 18.3649 18.3649 20.6515 20.6515 k = 0.3462 0.5551 0.3951 ( 2752 PWs) bands (ev): -9.6728 -9.6728 -9.6684 -9.6684 -9.6313 -9.6313 -9.6281 -9.6281 -8.6599 -8.6599 -8.6340 -8.6340 -8.6263 -8.6263 -8.6015 -8.6015 -8.5878 -8.5878 -8.5851 -8.5851 5.1210 5.1210 5.1287 5.1287 7.8790 7.8790 7.9350 7.9350 8.2962 8.2962 8.4007 8.4007 10.0195 10.0195 10.0783 10.0783 10.3571 10.3571 10.4049 10.4049 10.4496 10.4496 10.5520 10.5520 11.1710 11.1710 11.1831 11.1831 11.3330 11.3330 11.3675 11.3675 18.2052 18.2052 18.4016 18.4016 20.8112 20.8112 k = 0.3397 0.5662 0.3951 ( 2754 PWs) bands (ev): -9.6728 -9.6728 -9.6683 -9.6683 -9.6313 -9.6313 -9.6281 -9.6281 -8.6599 -8.6599 -8.6338 -8.6338 -8.6265 -8.6265 -8.6014 -8.6014 -8.5879 -8.5879 -8.5852 -8.5852 5.1270 5.1270 5.1348 5.1348 7.9051 7.9051 7.9776 7.9776 8.2428 8.2428 8.3638 8.3638 10.0198 10.0198 10.0788 10.0788 10.3564 10.3564 10.4043 10.4043 10.4477 10.4477 10.5507 10.5507 11.1835 11.1835 11.2032 11.2032 11.3066 11.3066 11.3489 11.3489 18.2257 18.2257 18.4232 18.4232 20.9536 20.9536 k = 0.3333 0.5774 0.3951 ( 2754 PWs) bands (ev): -9.6728 -9.6728 -9.6683 -9.6683 -9.6313 -9.6313 -9.6281 -9.6281 -8.6599 -8.6599 -8.6337 -8.6337 -8.6265 -8.6265 -8.6013 -8.6013 -8.5879 -8.5879 -8.5852 -8.5852 5.1291 5.1291 5.1369 5.1369 7.9143 7.9143 7.9953 7.9953 8.2213 8.2213 8.3509 8.3509 10.0199 10.0199 10.0790 10.0790 10.3562 10.3562 10.4042 10.4042 10.4470 10.4470 10.5502 10.5502 11.1881 11.1881 11.2122 11.2122 11.2956 11.2956 11.3423 11.3423 18.2324 18.2324 18.4302 18.4302 21.0520 21.0520 k = 0.3333 0.5774 0.3951 ( 2754 PWs) bands (ev): -9.6728 -9.6728 -9.6683 -9.6683 -9.6313 -9.6313 -9.6281 -9.6281 -8.6599 -8.6599 -8.6337 -8.6337 -8.6265 -8.6265 -8.6013 -8.6013 -8.5879 -8.5879 -8.5852 -8.5852 5.1291 5.1291 5.1369 5.1369 7.9143 7.9143 7.9953 7.9953 8.2213 8.2213 8.3509 8.3509 10.0199 10.0199 10.0790 10.0790 10.3562 10.3562 10.4042 10.4042 10.4470 10.4470 10.5502 10.5502 11.1881 11.1881 11.2122 11.2122 11.2956 11.2956 11.3423 11.3423 18.2324 18.2324 18.4302 18.4302 21.0520 21.0520 k = 0.3269 0.5662 0.3951 ( 2758 PWs) bands (ev): -9.6728 -9.6728 -9.6683 -9.6683 -9.6313 -9.6313 -9.6281 -9.6281 -8.6599 -8.6599 -8.6338 -8.6338 -8.6265 -8.6265 -8.6014 -8.6014 -8.5879 -8.5879 -8.5852 -8.5852 5.1268 5.1268 5.1346 5.1346 7.9059 7.9059 7.9789 7.9789 8.2417 8.2417 8.3632 8.3632 10.0198 10.0198 10.0788 10.0788 10.3564 10.3564 10.4041 10.4041 10.4478 10.4478 10.5507 10.5507 11.1838 11.1838 11.2038 11.2038 11.3059 11.3059 11.3485 11.3485 18.2259 18.2259 18.4234 18.4234 20.9677 20.9677 k = 0.3205 0.5551 0.3951 ( 2758 PWs) bands (ev): -9.6728 -9.6728 -9.6684 -9.6684 -9.6313 -9.6313 -9.6281 -9.6281 -8.6599 -8.6599 -8.6340 -8.6340 -8.6263 -8.6263 -8.6016 -8.6016 -8.5878 -8.5878 -8.5851 -8.5851 5.1196 5.1196 5.1273 5.1273 7.8850 7.8850 7.9433 7.9433 8.2896 8.2896 8.3965 8.3965 10.0196 10.0196 10.0784 10.0784 10.3570 10.3570 10.4040 10.4040 10.4505 10.4505 10.5522 10.5522 11.1734 11.1734 11.1866 11.1866 11.3292 11.3292 11.3648 11.3648 18.2069 18.2069 18.4034 18.4034 20.8636 20.8636 k = 0.3141 0.5440 0.3951 ( 2758 PWs) bands (ev): -9.6728 -9.6728 -9.6684 -9.6684 -9.6313 -9.6313 -9.6282 -9.6282 -8.6598 -8.6598 -8.6343 -8.6343 -8.6261 -8.6261 -8.6018 -8.6018 -8.5877 -8.5877 -8.5849 -8.5849 5.1070 5.1070 5.1145 5.1145 7.8587 7.8587 7.9044 7.9044 8.3498 8.3498 8.4440 8.4440 10.0193 10.0193 10.0777 10.0777 10.3578 10.3578 10.4034 10.4034 10.4553 10.4553 10.5547 10.5547 11.1602 11.1602 11.1681 11.1681 11.3578 11.3578 11.3878 11.3878 18.1763 18.1763 18.3712 18.3712 20.7576 20.7576 k = 0.3077 0.5329 0.3951 ( 2754 PWs) bands (ev): -9.6728 -9.6728 -9.6684 -9.6684 -9.6313 -9.6313 -9.6282 -9.6282 -8.6597 -8.6597 -8.6348 -8.6348 -8.6259 -8.6259 -8.6022 -8.6022 -8.5876 -8.5876 -8.5847 -8.5847 5.0887 5.0887 5.0959 5.0959 7.8326 7.8326 7.8690 7.8690 8.4156 8.4156 8.5006 8.5006 10.0189 10.0189 10.0768 10.0768 10.3589 10.3589 10.4025 10.4025 10.4621 10.4621 10.5583 10.5583 11.1466 11.1466 11.1509 11.1509 11.3893 11.3893 11.4151 11.4151 18.1349 18.1349 18.3276 18.3276 20.6503 20.6503 k = 0.3013 0.5218 0.3951 ( 2758 PWs) bands (ev): -9.6728 -9.6728 -9.6685 -9.6685 -9.6313 -9.6313 -9.6283 -9.6283 -8.6596 -8.6596 -8.6353 -8.6353 -8.6256 -8.6256 -8.6027 -8.6027 -8.5875 -8.5875 -8.5844 -8.5844 5.0643 5.0643 5.0713 5.0713 7.8101 7.8101 7.8401 7.8401 8.4842 8.4842 8.5629 8.5629 10.0184 10.0184 10.0756 10.0756 10.3601 10.3601 10.4012 10.4012 10.4706 10.4706 10.5629 10.5629 11.1342 11.1342 11.1360 11.1360 11.4226 11.4226 11.4454 11.4454 18.0838 18.0838 18.2737 18.2737 20.5424 20.5424 k = 0.2949 0.5107 0.3951 ( 2758 PWs) bands (ev): -9.6728 -9.6728 -9.6686 -9.6686 -9.6314 -9.6314 -9.6284 -9.6284 -8.6595 -8.6595 -8.6358 -8.6358 -8.6253 -8.6253 -8.6032 -8.6032 -8.5873 -8.5873 -8.5841 -8.5841 5.0339 5.0339 5.0405 5.0405 7.7935 7.7935 7.8190 7.8190 8.5543 8.5543 8.6286 8.6286 10.0179 10.0179 10.0744 10.0744 10.3614 10.3614 10.3998 10.3998 10.4809 10.4809 10.5684 10.5684 11.1237 11.1237 11.1242 11.1242 11.4578 11.4578 11.4781 11.4781 18.0239 18.0239 18.2107 18.2107 20.4343 20.4343 k = 0.2885 0.4996 0.3951 ( 2758 PWs) bands (ev): -9.6728 -9.6728 -9.6686 -9.6686 -9.6314 -9.6314 -9.6285 -9.6285 -8.6593 -8.6593 -8.6365 -8.6365 -8.6250 -8.6250 -8.6039 -8.6039 -8.5871 -8.5871 -8.5838 -8.5838 4.9974 4.9974 5.0037 5.0037 7.7839 7.7839 7.8063 7.8063 8.6251 8.6251 8.6964 8.6964 10.0174 10.0174 10.0730 10.0730 10.3627 10.3627 10.3983 10.3983 10.4922 10.4922 10.5746 10.5746 11.1160 11.1160 11.1161 11.1161 11.4945 11.4945 11.5130 11.5130 17.9565 17.9565 18.1399 18.1399 20.3264 20.3264 k = 0.2821 0.4885 0.3951 ( 2754 PWs) bands (ev): -9.6727 -9.6727 -9.6687 -9.6687 -9.6315 -9.6315 -9.6287 -9.6287 -8.6592 -8.6592 -8.6371 -8.6371 -8.6247 -8.6247 -8.6045 -8.6045 -8.5869 -8.5869 -8.5835 -8.5835 4.9551 4.9551 4.9610 4.9610 7.7818 7.7818 7.8021 7.8021 8.6959 8.6959 8.7653 8.7653 10.0168 10.0168 10.0715 10.0715 10.3640 10.3640 10.3969 10.3969 10.5044 10.5044 10.5813 10.5813 11.1118 11.1118 11.1118 11.1118 11.5329 11.5329 11.5499 11.5499 17.8824 17.8824 18.0622 18.0622 20.2192 20.2192 k = 0.2756 0.4774 0.3951 ( 2750 PWs) bands (ev): -9.6727 -9.6727 -9.6688 -9.6688 -9.6316 -9.6316 -9.6288 -9.6288 -8.6590 -8.6590 -8.6378 -8.6378 -8.6244 -8.6244 -8.6053 -8.6053 -8.5867 -8.5867 -8.5832 -8.5832 4.9073 4.9073 4.9127 4.9127 7.7874 7.7874 7.8063 7.8063 8.7663 8.7663 8.8344 8.8344 10.0163 10.0163 10.0700 10.0700 10.3651 10.3651 10.3956 10.3956 10.5170 10.5170 10.5880 10.5880 11.1117 11.1117 11.1125 11.1125 11.5730 11.5730 11.5888 11.5888 17.8028 17.8028 17.9789 17.9789 20.1131 20.1131 k = 0.2692 0.4663 0.3951 ( 2754 PWs) bands (ev): -9.6727 -9.6727 -9.6689 -9.6689 -9.6316 -9.6316 -9.6290 -9.6290 -8.6588 -8.6588 -8.6385 -8.6385 -8.6241 -8.6241 -8.6060 -8.6060 -8.5865 -8.5865 -8.5828 -8.5828 4.8544 4.8544 4.8593 4.8593 7.8007 7.8007 7.8186 7.8186 8.8357 8.8357 8.9030 8.9030 10.0158 10.0158 10.0683 10.0683 10.3661 10.3661 10.3943 10.3943 10.5293 10.5293 10.5943 10.5943 11.1162 11.1162 11.1185 11.1185 11.6149 11.6149 11.6297 11.6297 17.7186 17.7186 17.8910 17.8910 20.0084 20.0084 k = 0.2628 0.4552 0.3951 ( 2754 PWs) bands (ev): -9.6727 -9.6727 -9.6690 -9.6690 -9.6317 -9.6317 -9.6292 -9.6292 -8.6585 -8.6585 -8.6391 -8.6391 -8.6239 -8.6239 -8.6068 -8.6068 -8.5863 -8.5863 -8.5825 -8.5825 4.7969 4.7969 4.8014 4.8014 7.8212 7.8212 7.8386 7.8386 8.9038 8.9038 8.9706 8.9706 10.0154 10.0154 10.0667 10.0667 10.3670 10.3670 10.3933 10.3933 10.5411 10.5411 10.5999 10.5999 11.1264 11.1264 11.1308 11.1308 11.6588 11.6588 11.6727 11.6727 17.6306 17.6306 17.7993 17.7993 19.9055 19.9055 k = 0.2564 0.4441 0.3951 ( 2754 PWs) bands (ev): -9.6727 -9.6727 -9.6691 -9.6691 -9.6319 -9.6319 -9.6294 -9.6294 -8.6583 -8.6583 -8.6398 -8.6398 -8.6236 -8.6236 -8.6077 -8.6077 -8.5861 -8.5861 -8.5823 -8.5823 4.7354 4.7354 4.7395 4.7395 7.8486 7.8486 7.8656 7.8656 8.9700 8.9700 9.0366 9.0366 10.0150 10.0150 10.0650 10.0650 10.3678 10.3678 10.3924 10.3924 10.5516 10.5516 10.6041 10.6041 11.1429 11.1429 11.1498 11.1498 11.7047 11.7047 11.7179 11.7179 17.5396 17.5396 17.7047 17.7047 19.8044 19.8044 k = 0.2500 0.4330 0.3951 ( 2746 PWs) bands (ev): -9.6726 -9.6726 -9.6693 -9.6693 -9.6320 -9.6320 -9.6296 -9.6296 -8.6580 -8.6580 -8.6405 -8.6405 -8.6234 -8.6234 -8.6085 -8.6085 -8.5859 -8.5859 -8.5820 -8.5820 4.6705 4.6705 4.6742 4.6742 7.8824 7.8824 7.8992 7.8992 9.0341 9.0341 9.1006 9.1006 10.0146 10.0146 10.0634 10.0634 10.3685 10.3685 10.3918 10.3918 10.5604 10.5604 10.6069 10.6069 11.1665 11.1665 11.1763 11.1763 11.7530 11.7530 11.7655 11.7655 17.4463 17.4463 17.6079 17.6079 19.7056 19.7056 k = 0.2436 0.4219 0.3951 ( 2750 PWs) bands (ev): -9.6726 -9.6726 -9.6694 -9.6694 -9.6321 -9.6321 -9.6299 -9.6299 -8.6577 -8.6577 -8.6412 -8.6412 -8.6233 -8.6233 -8.6094 -8.6094 -8.5857 -8.5857 -8.5818 -8.5818 4.6028 4.6028 4.6061 4.6061 7.9218 7.9218 7.9387 7.9387 9.0956 9.0956 9.1622 9.1622 10.0143 10.0143 10.0617 10.0617 10.3691 10.3691 10.3914 10.3914 10.5671 10.5671 10.6078 10.6078 11.1976 11.1976 11.2104 11.2104 11.8036 11.8036 11.8155 11.8155 17.3512 17.3512 17.5095 17.5095 19.6090 19.6090 k = 0.2372 0.4108 0.3951 ( 2748 PWs) bands (ev): -9.6726 -9.6726 -9.6695 -9.6695 -9.6323 -9.6323 -9.6302 -9.6302 -8.6574 -8.6574 -8.6418 -8.6418 -8.6231 -8.6231 -8.6103 -8.6103 -8.5855 -8.5855 -8.5816 -8.5816 4.5328 4.5328 4.5358 4.5358 7.9665 7.9665 7.9835 7.9835 9.1542 9.1542 9.2208 9.2208 10.0141 10.0141 10.0600 10.0600 10.3696 10.3696 10.3912 10.3912 10.5715 10.5715 10.6069 10.6069 11.2367 11.2367 11.2524 11.2524 11.8568 11.8568 11.8682 11.8682 17.2550 17.2550 17.4101 17.4101 19.5148 19.5148 k = 0.2308 0.3997 0.3951 ( 2748 PWs) bands (ev): -9.6725 -9.6725 -9.6696 -9.6696 -9.6325 -9.6325 -9.6305 -9.6305 -8.6571 -8.6571 -8.6425 -8.6425 -8.6230 -8.6230 -8.6112 -8.6112 -8.5853 -8.5853 -8.5814 -8.5814 4.4611 4.4611 4.4638 4.4638 8.0159 8.0159 8.0330 8.0330 9.2098 9.2098 9.2763 9.2763 10.0140 10.0140 10.0583 10.0583 10.3701 10.3701 10.3912 10.3912 10.5737 10.5737 10.6044 10.6044 11.2837 11.2837 11.3023 11.3023 11.9130 11.9130 11.9238 11.9238 17.1580 17.1580 17.3101 17.3101 19.4231 19.4231 k = 0.2244 0.3886 0.3951 ( 2748 PWs) bands (ev): -9.6725 -9.6725 -9.6697 -9.6697 -9.6327 -9.6327 -9.6308 -9.6308 -8.6568 -8.6568 -8.6431 -8.6431 -8.6229 -8.6229 -8.6121 -8.6121 -8.5851 -8.5851 -8.5812 -8.5812 4.3882 4.3882 4.3905 4.3905 8.0693 8.0693 8.0866 8.0866 9.2621 9.2621 9.3285 9.3285 10.0139 10.0139 10.0567 10.0567 10.3704 10.3704 10.3914 10.3914 10.5736 10.5736 10.6003 10.6003 11.3386 11.3386 11.3598 11.3598 11.9721 11.9721 11.9824 11.9824 17.0607 17.0607 17.2100 17.2100 19.3341 19.3341 k = 0.2179 0.3775 0.3951 ( 2740 PWs) bands (ev): -9.6724 -9.6724 -9.6698 -9.6698 -9.6329 -9.6329 -9.6311 -9.6311 -8.6565 -8.6565 -8.6437 -8.6437 -8.6229 -8.6229 -8.6130 -8.6130 -8.5850 -8.5850 -8.5811 -8.5811 4.3145 4.3145 4.3166 4.3166 8.1262 8.1262 8.1437 8.1437 9.3110 9.3110 9.3771 9.3771 10.0139 10.0139 10.0550 10.0550 10.3708 10.3708 10.3919 10.3919 10.5718 10.5718 10.5951 10.5951 11.4011 11.4011 11.4246 11.4246 12.0347 12.0347 12.0444 12.0444 16.9634 16.9634 17.1101 17.1101 19.2477 19.2477 k = 0.2115 0.3664 0.3951 ( 2750 PWs) bands (ev): -9.6724 -9.6724 -9.6699 -9.6699 -9.6331 -9.6331 -9.6315 -9.6315 -8.6561 -8.6561 -8.6443 -8.6443 -8.6229 -8.6229 -8.6139 -8.6139 -8.5849 -8.5849 -8.5811 -8.5811 4.2404 4.2404 4.2422 4.2422 8.1861 8.1861 8.2039 8.2039 9.3564 9.3564 9.4220 9.4220 10.0140 10.0140 10.0532 10.0532 10.3710 10.3710 10.3925 10.3925 10.5683 10.5683 10.5888 10.5888 11.4706 11.4706 11.4961 11.4961 12.1008 12.1008 12.1098 12.1098 16.8665 16.8665 17.0107 17.0107 19.1641 19.1641 k = 0.2051 0.3553 0.3951 ( 2754 PWs) bands (ev): -9.6723 -9.6723 -9.6700 -9.6700 -9.6334 -9.6334 -9.6318 -9.6318 -8.6558 -8.6558 -8.6448 -8.6448 -8.6229 -8.6229 -8.6148 -8.6148 -8.5847 -8.5847 -8.5810 -8.5810 4.1664 4.1664 4.1680 4.1680 8.2485 8.2485 8.2665 8.2665 9.3984 9.3984 9.4633 9.4633 10.0141 10.0141 10.0514 10.0514 10.3712 10.3712 10.3932 10.3932 10.5636 10.5636 10.5819 10.5819 11.5469 11.5469 11.5739 11.5739 12.1708 12.1708 12.1789 12.1789 16.7702 16.7702 16.9122 16.9122 19.0832 19.0832 k = 0.1987 0.3442 0.3951 ( 2754 PWs) bands (ev): -9.6723 -9.6723 -9.6701 -9.6701 -9.6336 -9.6336 -9.6322 -9.6322 -8.6554 -8.6554 -8.6454 -8.6454 -8.6229 -8.6229 -8.6156 -8.6156 -8.5846 -8.5846 -8.5810 -8.5810 4.0927 4.0927 4.0941 4.0941 8.3130 8.3130 8.3312 8.3312 9.4369 9.4369 9.5011 9.5011 10.0142 10.0142 10.0496 10.0496 10.3714 10.3714 10.3941 10.3941 10.5579 10.5579 10.5745 10.5745 11.6292 11.6292 11.6574 11.6574 12.2452 12.2452 12.2520 12.2520 16.6748 16.6748 16.8148 16.8148 19.0052 19.0052 k = 0.1923 0.3331 0.3951 ( 2762 PWs) bands (ev): -9.6722 -9.6722 -9.6702 -9.6702 -9.6339 -9.6339 -9.6326 -9.6326 -8.6551 -8.6551 -8.6459 -8.6459 -8.6230 -8.6230 -8.6165 -8.6165 -8.5846 -8.5846 -8.5810 -8.5810 4.0196 4.0196 4.0208 4.0208 8.3791 8.3791 8.3975 8.3975 9.4723 9.4723 9.5354 9.5354 10.0144 10.0144 10.0478 10.0478 10.3716 10.3716 10.3951 10.3951 10.5514 10.5514 10.5668 10.5668 11.7170 11.7170 11.7461 11.7461 12.3240 12.3240 12.3293 12.3293 16.5806 16.5806 16.7187 16.7187 18.9301 18.9301 k = 0.1859 0.3220 0.3951 ( 2758 PWs) bands (ev): -9.6721 -9.6721 -9.6703 -9.6703 -9.6342 -9.6342 -9.6330 -9.6330 -8.6547 -8.6547 -8.6463 -8.6463 -8.6231 -8.6231 -8.6173 -8.6173 -8.5845 -8.5845 -8.5811 -8.5811 3.9474 3.9474 3.9485 3.9485 8.4464 8.4464 8.4650 8.4650 9.5045 9.5045 9.5664 9.5664 10.0146 10.0146 10.0459 10.0459 10.3719 10.3719 10.3963 10.3963 10.5446 10.5446 10.5591 10.5591 11.8098 11.8098 11.8392 11.8392 12.4076 12.4076 12.4110 12.4110 16.4877 16.4877 16.6242 16.6242 18.8580 18.8580 k = 0.1795 0.3109 0.3951 ( 2754 PWs) bands (ev): -9.6721 -9.6721 -9.6704 -9.6704 -9.6345 -9.6345 -9.6334 -9.6334 -8.6544 -8.6544 -8.6468 -8.6468 -8.6232 -8.6232 -8.6182 -8.6182 -8.5844 -8.5844 -8.5812 -8.5812 3.8764 3.8764 3.8773 3.8773 8.5145 8.5145 8.5332 8.5332 9.5337 9.5337 9.5942 9.5942 10.0148 10.0148 10.0439 10.0439 10.3723 10.3723 10.3976 10.3976 10.5374 10.5374 10.5514 10.5514 11.9070 11.9070 11.9363 11.9363 12.4964 12.4964 12.4972 12.4972 16.3964 16.3964 16.5315 16.5315 18.7888 18.7888 k = 0.1731 0.2998 0.3951 ( 2754 PWs) bands (ev): -9.6720 -9.6720 -9.6705 -9.6705 -9.6349 -9.6349 -9.6338 -9.6338 -8.6540 -8.6540 -8.6472 -8.6472 -8.6233 -8.6233 -8.6190 -8.6190 -8.5844 -8.5844 -8.5813 -8.5813 3.8067 3.8067 3.8075 3.8075 8.5830 8.5830 8.6019 8.6019 9.5602 9.5602 9.6191 9.6191 10.0149 10.0149 10.0419 10.0419 10.3726 10.3726 10.3990 10.3990 10.5301 10.5301 10.5439 10.5439 12.0081 12.0081 12.0366 12.0366 12.5882 12.5882 12.5905 12.5905 16.3069 16.3069 16.4407 16.4407 18.7227 18.7227 k = 0.1667 0.2887 0.3951 ( 2758 PWs) bands (ev): -9.6719 -9.6719 -9.6705 -9.6705 -9.6352 -9.6352 -9.6343 -9.6343 -8.6537 -8.6537 -8.6476 -8.6476 -8.6235 -8.6235 -8.6198 -8.6198 -8.5844 -8.5844 -8.5815 -8.5815 3.7385 3.7385 3.7392 3.7392 8.6516 8.6516 8.6705 8.6705 9.5841 9.5841 9.6412 9.6412 10.0150 10.0150 10.0398 10.0398 10.3730 10.3730 10.4005 10.4005 10.5228 10.5228 10.5366 10.5366 12.1127 12.1127 12.1397 12.1397 12.6839 12.6839 12.6901 12.6901 16.2193 16.2193 16.3522 16.3522 18.6596 18.6596 k = 0.1603 0.2776 0.3951 ( 2750 PWs) bands (ev): -9.6718 -9.6718 -9.6706 -9.6706 -9.6356 -9.6356 -9.6347 -9.6347 -8.6534 -8.6534 -8.6480 -8.6480 -8.6237 -8.6237 -8.6205 -8.6205 -8.5844 -8.5844 -8.5816 -8.5816 3.6720 3.6720 3.6726 3.6726 8.7200 8.7200 8.7389 8.7389 9.6056 9.6056 9.6609 9.6609 10.0150 10.0150 10.0377 10.0377 10.3736 10.3736 10.4020 10.4020 10.5157 10.5157 10.5298 10.5298 12.2202 12.2202 12.2452 12.2452 12.7845 12.7845 12.7953 12.7953 16.1338 16.1338 16.2661 16.2661 18.5997 18.5997 k = 0.1538 0.2665 0.3951 ( 2750 PWs) bands (ev): -9.6717 -9.6717 -9.6706 -9.6706 -9.6359 -9.6359 -9.6352 -9.6352 -8.6531 -8.6531 -8.6483 -8.6483 -8.6239 -8.6239 -8.6212 -8.6212 -8.5844 -8.5844 -8.5818 -8.5818 3.6073 3.6073 3.6078 3.6078 8.7878 8.7878 8.8067 8.8067 9.6248 9.6248 9.6781 9.6781 10.0149 10.0149 10.0354 10.0354 10.3742 10.3742 10.4034 10.4034 10.5090 10.5090 10.5233 10.5233 12.3304 12.3304 12.3527 12.3527 12.8898 12.8898 12.9060 12.9060 16.0507 16.0507 16.1825 16.1825 18.5430 18.5430 k = 0.1474 0.2554 0.3951 ( 2754 PWs) bands (ev): -9.6716 -9.6716 -9.6706 -9.6706 -9.6363 -9.6363 -9.6356 -9.6356 -8.6528 -8.6528 -8.6486 -8.6486 -8.6241 -8.6241 -8.6219 -8.6219 -8.5844 -8.5844 -8.5820 -8.5820 3.5446 3.5446 3.5451 3.5451 8.8548 8.8548 8.8736 8.8736 9.6421 9.6421 9.6931 9.6931 10.0145 10.0145 10.0329 10.0329 10.3751 10.3751 10.4049 10.4049 10.5025 10.5025 10.5172 10.5172 12.4429 12.4429 12.4620 12.4620 12.9997 12.9997 13.0221 13.0221 15.9700 15.9700 16.1018 16.1018 18.4895 18.4895 k = 0.1410 0.2443 0.3951 ( 2754 PWs) bands (ev): -9.6715 -9.6715 -9.6706 -9.6706 -9.6367 -9.6367 -9.6361 -9.6361 -8.6525 -8.6525 -8.6489 -8.6489 -8.6243 -8.6243 -8.6225 -8.6225 -8.5844 -8.5844 -8.5822 -8.5822 3.4840 3.4840 3.4844 3.4844 8.9206 8.9206 8.9394 8.9394 9.6574 9.6574 9.7062 9.7062 10.0139 10.0139 10.0304 10.0304 10.3761 10.3761 10.4064 10.4064 10.4965 10.4965 10.5116 10.5116 12.5576 12.5576 12.5728 12.5728 13.1138 13.1138 13.1432 13.1432 15.8921 15.8921 16.0241 16.0241 18.4394 18.4394 k = 0.1346 0.2332 0.3951 ( 2758 PWs) bands (ev): -9.6714 -9.6714 -9.6706 -9.6706 -9.6371 -9.6371 -9.6366 -9.6366 -8.6523 -8.6523 -8.6492 -8.6492 -8.6246 -8.6246 -8.6231 -8.6231 -8.5845 -8.5845 -8.5825 -8.5825 3.4255 3.4255 3.4258 3.4258 8.9851 8.9851 9.0037 9.0037 9.6710 9.6710 9.7175 9.7175 10.0131 10.0131 10.0277 10.0277 10.3774 10.3774 10.4078 10.4078 10.4908 10.4908 10.5063 10.5063 12.6742 12.6742 12.6852 12.6852 13.2320 13.2320 13.2691 13.2691 15.8170 15.8170 15.9497 15.9497 18.3927 18.3927 k = 0.1282 0.2221 0.3951 ( 2762 PWs) bands (ev): -9.6713 -9.6713 -9.6706 -9.6706 -9.6375 -9.6375 -9.6370 -9.6370 -8.6521 -8.6521 -8.6494 -8.6494 -8.6248 -8.6248 -8.6237 -8.6237 -8.5846 -8.5846 -8.5827 -8.5827 3.3693 3.3693 3.3696 3.3696 9.0480 9.0480 9.0665 9.0665 9.6831 9.6831 9.7272 9.7272 10.0120 10.0120 10.0249 10.0249 10.3789 10.3789 10.4092 10.4092 10.4857 10.4857 10.5015 10.5015 12.7924 12.7924 12.7990 12.7990 13.3536 13.3536 13.3992 13.3992 15.7451 15.7451 15.8788 15.8788 18.3496 18.3496 k = 0.1218 0.2110 0.3951 ( 2758 PWs) bands (ev): -9.6712 -9.6712 -9.6706 -9.6706 -9.6379 -9.6379 -9.6375 -9.6375 -8.6519 -8.6519 -8.6497 -8.6497 -8.6250 -8.6250 -8.6242 -8.6242 -8.5846 -8.5846 -8.5830 -8.5830 3.3155 3.3155 3.3157 3.3157 9.1091 9.1091 9.1274 9.1274 9.6938 9.6938 9.7355 9.7355 10.0106 10.0106 10.0219 10.0219 10.3807 10.3807 10.4105 10.4105 10.4812 10.4812 10.4970 10.4970 12.9122 12.9122 12.9140 12.9140 13.4781 13.4781 13.5331 13.5331 15.6765 15.6765 15.8118 15.8118 18.3101 18.3101 k = 0.1154 0.1999 0.3951 ( 2758 PWs) bands (ev): -9.6711 -9.6711 -9.6706 -9.6706 -9.6383 -9.6383 -9.6379 -9.6379 -8.6517 -8.6517 -8.6499 -8.6499 -8.6253 -8.6253 -8.6247 -8.6247 -8.5847 -8.5847 -8.5832 -8.5832 3.2640 3.2640 3.2642 3.2642 9.1683 9.1683 9.1863 9.1863 9.7031 9.7031 9.7424 9.7424 10.0090 10.0090 10.0188 10.0188 10.3828 10.3828 10.4118 10.4118 10.4771 10.4771 10.4929 10.4929 13.0302 13.0302 13.0332 13.0332 13.6050 13.6050 13.6700 13.6700 15.6115 15.6115 15.7490 15.7490 18.2745 18.2745 k = 0.1090 0.1887 0.3951 ( 2758 PWs) bands (ev): -9.6710 -9.6710 -9.6706 -9.6706 -9.6387 -9.6387 -9.6384 -9.6384 -8.6516 -8.6516 -8.6501 -8.6501 -8.6255 -8.6255 -8.6251 -8.6251 -8.5848 -8.5848 -8.5835 -8.5835 3.2151 3.2151 3.2152 3.2152 9.2253 9.2253 9.2430 9.2430 9.7113 9.7113 9.7482 9.7482 10.0071 10.0071 10.0156 10.0156 10.3852 10.3852 10.4130 10.4130 10.4735 10.4735 10.4891 10.4891 13.1473 13.1473 13.1552 13.1552 13.7337 13.7337 13.8094 13.8094 15.5505 15.5505 15.6908 15.6908 18.2428 18.2428 k = 0.1026 0.1776 0.3951 ( 2762 PWs) bands (ev): -9.6709 -9.6709 -9.6705 -9.6705 -9.6391 -9.6391 -9.6388 -9.6388 -8.6515 -8.6515 -8.6503 -8.6503 -8.6258 -8.6258 -8.6255 -8.6255 -8.5849 -8.5849 -8.5838 -8.5838 3.1687 3.1687 3.1688 3.1688 9.2800 9.2800 9.2973 9.2973 9.7185 9.7185 9.7529 9.7529 10.0049 10.0049 10.0123 10.0123 10.3878 10.3878 10.4142 10.4142 10.4703 10.4703 10.4856 10.4856 13.2650 13.2650 13.2775 13.2775 13.8633 13.8633 13.9505 13.9505 15.4938 15.4938 15.6376 15.6376 18.2154 18.2154 k = 0.0962 0.1665 0.3951 ( 2760 PWs) bands (ev): -9.6708 -9.6708 -9.6705 -9.6705 -9.6395 -9.6395 -9.6393 -9.6393 -8.6514 -8.6514 -8.6504 -8.6504 -8.6260 -8.6260 -8.6258 -8.6258 -8.5850 -8.5850 -8.5840 -8.5840 3.1249 3.1249 3.1250 3.1250 9.3323 9.3323 9.3493 9.3493 9.7247 9.7247 9.7567 9.7567 10.0025 10.0025 10.0089 10.0089 10.3907 10.3907 10.4154 10.4154 10.4676 10.4676 10.4822 10.4822 13.3828 13.3828 13.3997 13.3997 13.9931 13.9931 14.0927 14.0927 15.4418 15.4418 15.5900 15.5900 18.1923 18.1923 k = 0.0897 0.1554 0.3951 ( 2760 PWs) bands (ev): -9.6707 -9.6707 -9.6704 -9.6704 -9.6399 -9.6399 -9.6397 -9.6397 -8.6513 -8.6513 -8.6506 -8.6506 -8.6262 -8.6262 -8.6261 -8.6261 -8.5851 -8.5851 -8.5843 -8.5843 3.0837 3.0837 3.0838 3.0838 9.3821 9.3821 9.3986 9.3986 9.7301 9.7301 9.7597 9.7597 9.9998 9.9998 10.0053 10.0053 10.3937 10.3937 10.4165 10.4165 10.4652 10.4652 10.4791 10.4791 13.4999 13.4999 13.5209 13.5209 14.1225 14.1225 14.2351 14.2351 15.3951 15.3951 15.5486 15.5486 18.1739 18.1739 k = 0.0833 0.1443 0.3951 ( 2756 PWs) bands (ev): -9.6706 -9.6706 -9.6704 -9.6704 -9.6402 -9.6402 -9.6401 -9.6401 -8.6513 -8.6513 -8.6507 -8.6507 -8.6264 -8.6264 -8.6264 -8.6264 -8.5852 -8.5852 -8.5845 -8.5845 3.0452 3.0452 3.0453 3.0453 9.4293 9.4293 9.4453 9.4453 9.7347 9.7347 9.7620 9.7620 9.9969 9.9969 10.0016 10.0016 10.3970 10.3970 10.4176 10.4176 10.4631 10.4631 10.4761 10.4761 13.6157 13.6157 13.6399 13.6399 14.2505 14.2505 14.3768 14.3768 15.3542 15.3542 15.5141 15.5141 18.1605 18.1605 k = 0.0769 0.1332 0.3951 ( 2756 PWs) bands (ev): -9.6705 -9.6705 -9.6703 -9.6703 -9.6406 -9.6406 -9.6405 -9.6405 -8.6513 -8.6513 -8.6508 -8.6508 -8.6266 -8.6266 -8.6266 -8.6266 -8.5853 -8.5853 -8.5848 -8.5848 3.0094 3.0094 3.0095 3.0095 9.4737 9.4737 9.4891 9.4891 9.7387 9.7387 9.7637 9.7637 9.9939 9.9939 9.9979 9.9979 10.4004 10.4004 10.4187 10.4187 10.4613 10.4613 10.4731 10.4731 13.7288 13.7288 13.7555 13.7555 14.3764 14.3764 14.5167 14.5167 15.3202 15.3202 15.4872 15.4872 18.1522 18.1522 k = 0.0705 0.1221 0.3951 ( 2754 PWs) bands (ev): -9.6704 -9.6704 -9.6702 -9.6702 -9.6409 -9.6409 -9.6408 -9.6408 -8.6513 -8.6513 -8.6509 -8.6509 -8.6268 -8.6268 -8.6268 -8.6268 -8.5854 -8.5854 -8.5850 -8.5850 2.9764 2.9764 2.9764 2.9764 9.5153 9.5153 9.5301 9.5301 9.7421 9.7421 9.7649 9.7649 9.9906 9.9906 9.9940 9.9940 10.4039 10.4039 10.4199 10.4199 10.4596 10.4596 10.4703 10.4703 13.8381 13.8381 13.8658 13.8658 14.4994 14.4994 14.6534 14.6534 15.2942 15.2942 15.4687 15.4687 18.1494 18.1494 k = 0.0641 0.1110 0.3951 ( 2754 PWs) bands (ev): -9.6703 -9.6703 -9.6702 -9.6702 -9.6413 -9.6413 -9.6412 -9.6412 -8.6513 -8.6513 -8.6510 -8.6510 -8.6270 -8.6270 -8.6269 -8.6269 -8.5855 -8.5855 -8.5852 -8.5852 2.9462 2.9462 2.9462 2.9462 9.5540 9.5540 9.5680 9.5680 9.7451 9.7451 9.7656 9.7656 9.9872 9.9872 9.9900 9.9900 10.4075 10.4075 10.4211 10.4211 10.4581 10.4581 10.4675 10.4675 13.9417 13.9417 13.9691 13.9691 14.6190 14.6190 14.7852 14.7852 15.2776 15.2776 15.4592 15.4592 18.1522 18.1522 k = 0.0577 0.0999 0.3951 ( 2754 PWs) bands (ev): -9.6702 -9.6702 -9.6701 -9.6701 -9.6416 -9.6416 -9.6415 -9.6415 -8.6513 -8.6513 -8.6511 -8.6511 -8.6271 -8.6271 -8.6271 -8.6271 -8.5856 -8.5856 -8.5854 -8.5854 2.9187 2.9187 2.9187 2.9187 9.5898 9.5898 9.6030 9.6030 9.7476 9.7476 9.7660 9.7660 9.9837 9.9837 9.9860 9.9860 10.4111 10.4111 10.4223 10.4223 10.4567 10.4567 10.4647 10.4647 14.0379 14.0379 14.0633 14.0633 14.7346 14.7346 14.9092 14.9092 15.2729 15.2729 15.4592 15.4592 18.1607 18.1607 k = 0.0513 0.0888 0.3951 ( 2758 PWs) bands (ev): -9.6701 -9.6701 -9.6700 -9.6700 -9.6418 -9.6418 -9.6418 -9.6418 -8.6513 -8.6513 -8.6512 -8.6512 -8.6272 -8.6272 -8.6272 -8.6272 -8.5857 -8.5857 -8.5855 -8.5855 2.8941 2.8941 2.8941 2.8941 9.6226 9.6226 9.6348 9.6348 9.7498 9.7498 9.7660 9.7660 9.9800 9.9800 9.9819 9.9819 10.4146 10.4146 10.4237 10.4237 10.4553 10.4553 10.4619 10.4619 14.1246 14.1246 14.1465 14.1465 14.8455 14.8455 15.0207 15.0207 15.2842 15.2842 15.4685 15.4685 18.1745 18.1745 k = 0.0449 0.0777 0.3951 ( 2766 PWs) bands (ev): -9.6700 -9.6700 -9.6700 -9.6700 -9.6421 -9.6421 -9.6421 -9.6421 -8.6514 -8.6514 -8.6513 -8.6513 -8.6273 -8.6273 -8.6273 -8.6273 -8.5858 -8.5858 -8.5857 -8.5857 2.8724 2.8724 2.8724 2.8724 9.6521 9.6521 9.6633 9.6633 9.7517 9.7517 9.7658 9.7658 9.9763 9.9763 9.9777 9.9777 10.4181 10.4181 10.4251 10.4251 10.4539 10.4539 10.4592 10.4592 14.2002 14.2002 14.2174 14.2174 14.9509 14.9509 15.1123 15.1123 15.3176 15.3176 15.4863 15.4863 18.1930 18.1930 k = 0.0385 0.0666 0.3951 ( 2770 PWs) bands (ev): -9.6699 -9.6699 -9.6699 -9.6699 -9.6423 -9.6423 -9.6423 -9.6423 -8.6514 -8.6514 -8.6514 -8.6514 -8.6274 -8.6274 -8.6274 -8.6274 -8.5859 -8.5859 -8.5858 -8.5858 2.8535 2.8535 2.8535 2.8535 9.6785 9.6785 9.6884 9.6884 9.7534 9.7534 9.7654 9.7654 9.9726 9.9726 9.9736 9.9736 10.4215 10.4215 10.4267 10.4267 10.4524 10.4524 10.4564 10.4564 14.2633 14.2633 14.2755 14.2755 15.0494 15.0494 15.1787 15.1787 15.3758 15.3758 15.5111 15.5111 18.2144 18.2144 k = 0.0321 0.0555 0.3951 ( 2778 PWs) bands (ev): -9.6699 -9.6699 -9.6699 -9.6699 -9.6425 -9.6425 -9.6425 -9.6425 -8.6514 -8.6514 -8.6514 -8.6514 -8.6275 -8.6275 -8.6275 -8.6275 -8.5860 -8.5860 -8.5859 -8.5859 2.8375 2.8375 2.8375 2.8375 9.7015 9.7015 9.7100 9.7100 9.7550 9.7550 9.7648 9.7648 9.9690 9.9690 9.9697 9.9697 10.4247 10.4247 10.4283 10.4283 10.4508 10.4508 10.4537 10.4537 14.3136 14.3136 14.3213 14.3213 15.1388 15.1388 15.2268 15.2268 15.4481 15.4481 15.5408 15.5408 18.2358 18.2358 k = 0.0256 0.0444 0.3951 ( 2774 PWs) bands (ev): -9.6698 -9.6698 -9.6698 -9.6698 -9.6427 -9.6427 -9.6427 -9.6427 -8.6515 -8.6515 -8.6515 -8.6515 -8.6275 -8.6275 -8.6275 -8.6275 -8.5860 -8.5860 -8.5860 -8.5860 2.8244 2.8244 2.8244 2.8244 9.7209 9.7209 9.7278 9.7278 9.7567 9.7567 9.7643 9.7643 9.9656 9.9656 9.9660 9.9660 10.4279 10.4279 10.4301 10.4301 10.4493 10.4493 10.4511 10.4511 14.3518 14.3518 14.3559 14.3559 15.2161 15.2161 15.2665 15.2665 15.5197 15.5197 15.5732 15.5732 18.2525 18.2525 k = 0.0192 0.0333 0.3951 ( 2774 PWs) bands (ev): -9.6698 -9.6698 -9.6698 -9.6698 -9.6428 -9.6428 -9.6428 -9.6428 -8.6515 -8.6515 -8.6515 -8.6515 -8.6276 -8.6276 -8.6276 -8.6276 -8.5861 -8.5861 -8.5861 -8.5861 2.8142 2.8142 2.8142 2.8142 9.7363 9.7363 9.7412 9.7412 9.7587 9.7587 9.7639 9.7639 9.9627 9.9627 9.9628 9.9628 10.4307 10.4307 10.4319 10.4319 10.4476 10.4476 10.4486 10.4486 14.3790 14.3790 14.3808 14.3808 15.2780 15.2780 15.3009 15.3009 15.5809 15.5809 15.6055 15.6055 18.2593 18.2593 k = 0.0128 0.0222 0.3951 ( 2780 PWs) bands (ev): -9.6697 -9.6697 -9.6697 -9.6697 -9.6429 -9.6429 -9.6429 -9.6429 -8.6515 -8.6515 -8.6515 -8.6515 -8.6276 -8.6276 -8.6276 -8.6276 -8.5861 -8.5861 -8.5861 -8.5861 2.8069 2.8069 2.8069 2.8069 9.7472 9.7472 9.7496 9.7496 9.7615 9.7615 9.7639 9.7639 9.9603 9.9603 9.9603 9.9603 10.4333 10.4333 10.4337 10.4337 10.4460 10.4460 10.4464 10.4464 14.3969 14.3969 14.3974 14.3974 15.3220 15.3220 15.3292 15.3292 15.6266 15.6266 15.6344 15.6344 18.2546 18.2546 k = 0.0064 0.0111 0.3951 ( 2788 PWs) bands (ev): -9.6697 -9.6697 -9.6697 -9.6697 -9.6430 -9.6430 -9.6430 -9.6430 -8.6515 -8.6515 -8.6515 -8.6515 -8.6276 -8.6276 -8.6276 -8.6276 -8.5861 -8.5861 -8.5861 -8.5861 2.8025 2.8025 2.8025 2.8025 9.7531 9.7531 9.7535 9.7535 9.7643 9.7643 9.7647 9.7647 9.9587 9.9587 9.9587 9.9587 10.4351 10.4351 10.4352 10.4352 10.4445 10.4445 10.4446 10.4446 14.4070 14.4070 14.4070 14.4070 15.3474 15.3474 15.3484 15.3484 15.6542 15.6542 15.6552 15.6552 18.2447 18.2453 k = 0.0000 0.0000 0.3951 ( 2794 PWs) bands (ev): -9.6697 -9.6697 -9.6697 -9.6697 -9.6430 -9.6430 -9.6430 -9.6430 -8.6515 -8.6515 -8.6515 -8.6515 -8.6276 -8.6276 -8.6276 -8.6276 -8.5862 -8.5862 -8.5862 -8.5862 2.8010 2.8010 2.8010 2.8010 9.7546 9.7546 9.7546 9.7546 9.7654 9.7654 9.7654 9.7654 9.9582 9.9582 9.9582 9.9582 10.4359 10.4359 10.4359 10.4359 10.4438 10.4438 10.4438 10.4438 14.4102 14.4102 14.4102 14.4102 15.3554 15.3554 15.3554 15.3554 15.6631 15.6631 15.6631 15.6631 18.2395 18.2395 k = 0.5000 0.2887 0.3951 ( 2752 PWs) bands (ev): -9.6714 -9.6714 -9.6714 -9.6714 -9.6307 -9.6307 -9.6307 -9.6307 -8.6516 -8.6516 -8.6516 -8.6516 -8.6168 -8.6168 -8.6168 -8.6168 -8.5804 -8.5804 -8.5804 -8.5804 4.8144 4.8144 4.8144 4.8144 7.1310 7.1310 7.1310 7.1310 9.7063 9.7063 9.7063 9.7063 9.9681 9.9681 9.9681 9.9681 10.4821 10.4821 10.4821 10.4821 10.6229 10.6229 10.6229 10.6229 10.7895 10.7895 10.7895 10.7895 13.3786 13.3786 13.3786 13.3786 15.0180 15.0180 15.0180 15.0180 18.9329 18.9329 k = 0.5000 0.2887 0.3823 ( 2760 PWs) bands (ev): -9.6717 -9.6717 -9.6710 -9.6710 -9.6309 -9.6309 -9.6305 -9.6305 -8.6529 -8.6529 -8.6502 -8.6502 -8.6173 -8.6173 -8.6164 -8.6164 -8.5812 -8.5812 -8.5796 -8.5796 4.7879 4.7879 4.8376 4.8376 7.0861 7.0861 7.1831 7.1831 9.6828 9.6828 9.7298 9.7298 9.9325 9.9325 10.0039 10.0039 10.4716 10.4716 10.4927 10.4927 10.6137 10.6137 10.6321 10.6321 10.7779 10.7779 10.8021 10.8021 13.2658 13.2658 13.4938 13.4938 14.9419 14.9419 15.0939 15.0939 18.9045 18.9045 k = 0.5000 0.2887 0.3696 ( 2760 PWs) bands (ev): -9.6721 -9.6721 -9.6707 -9.6707 -9.6311 -9.6311 -9.6303 -9.6303 -8.6542 -8.6542 -8.6488 -8.6488 -8.6179 -8.6179 -8.6160 -8.6160 -8.5820 -8.5820 -8.5787 -8.5787 4.7586 4.7586 4.8572 4.8572 7.0488 7.0488 7.2419 7.2419 9.6598 9.6598 9.7529 9.7529 9.8979 9.8979 10.0395 10.0395 10.4612 10.4612 10.5032 10.5032 10.6046 10.6046 10.6412 10.6412 10.7675 10.7675 10.8154 10.8154 13.1555 13.1555 13.6114 13.6114 14.8654 14.8654 15.1695 15.1695 18.8260 18.8260 k = 0.5000 0.2887 0.3568 ( 2760 PWs) bands (ev): -9.6724 -9.6724 -9.6703 -9.6703 -9.6313 -9.6313 -9.6301 -9.6301 -8.6554 -8.6554 -8.6474 -8.6474 -8.6185 -8.6185 -8.6157 -8.6157 -8.5827 -8.5827 -8.5779 -8.5779 4.7270 4.7270 4.8726 4.8726 7.0194 7.0194 7.3072 7.3072 9.6371 9.6371 9.7739 9.7739 9.8662 9.8662 10.0747 10.0747 10.4511 10.4511 10.5135 10.5135 10.5956 10.5956 10.6499 10.6499 10.7587 10.7587 10.8293 10.8293 13.0477 13.0477 13.7315 13.7315 14.7885 14.7885 15.2449 15.2449 18.7065 18.7065 k = 0.5000 0.2887 0.3441 ( 2754 PWs) bands (ev): -9.6727 -9.6727 -9.6700 -9.6700 -9.6316 -9.6316 -9.6299 -9.6299 -8.6565 -8.6565 -8.6460 -8.6460 -8.6192 -8.6192 -8.6154 -8.6154 -8.5834 -8.5834 -8.5770 -8.5770 4.6935 4.6935 4.8838 4.8838 6.9981 6.9981 7.3782 7.3782 9.6151 9.6151 9.7847 9.7847 9.8457 9.8457 10.1091 10.1091 10.4413 10.4413 10.5236 10.5236 10.5868 10.5868 10.6580 10.6580 10.7521 10.7521 10.8436 10.8436 12.9424 12.9424 13.8541 13.8541 14.7111 14.7111 15.3197 15.3197 18.5575 18.5575 k = 0.5000 0.2887 0.3314 ( 2750 PWs) bands (ev): -9.6730 -9.6730 -9.6696 -9.6696 -9.6318 -9.6318 -9.6298 -9.6298 -8.6576 -8.6576 -8.6445 -8.6445 -8.6200 -8.6200 -8.6152 -8.6152 -8.5840 -8.5840 -8.5762 -8.5762 4.6585 4.6585 4.8905 4.8905 6.9850 6.9850 7.4547 7.4547 9.5937 9.5937 9.7702 9.7702 9.8515 9.8515 10.1427 10.1427 10.4319 10.4319 10.5330 10.5330 10.5783 10.5783 10.6649 10.6649 10.7482 10.7482 10.8583 10.8583 12.8396 12.8396 13.9789 13.9789 14.6330 14.6330 15.3936 15.3936 18.3899 18.3899 k = 0.5000 0.2887 0.3186 ( 2752 PWs) bands (ev): -9.6733 -9.6733 -9.6693 -9.6693 -9.6321 -9.6321 -9.6297 -9.6297 -8.6586 -8.6586 -8.6430 -8.6430 -8.6208 -8.6208 -8.6150 -8.6150 -8.5845 -8.5845 -8.5753 -8.5753 4.6226 4.6226 4.8927 4.8927 6.9798 6.9798 7.5361 7.5361 9.5728 9.5728 9.7418 9.7418 9.8725 9.8725 10.1750 10.1750 10.4230 10.4230 10.5418 10.5418 10.5700 10.5700 10.6703 10.6703 10.7477 10.7477 10.8731 10.8731 12.7393 12.7393 14.1059 14.1059 14.5543 14.5543 15.4662 15.4662 18.2119 18.2119 k = 0.5000 0.2887 0.3059 ( 2748 PWs) bands (ev): -9.6736 -9.6736 -9.6690 -9.6690 -9.6324 -9.6324 -9.6296 -9.6296 -8.6595 -8.6595 -8.6415 -8.6415 -8.6218 -8.6218 -8.6148 -8.6148 -8.5850 -8.5850 -8.5745 -8.5745 4.5860 4.5860 4.8904 4.8904 6.9825 6.9825 7.6220 7.6220 9.5525 9.5525 9.7107 9.7107 9.8976 9.8976 10.2060 10.2060 10.4146 10.4146 10.5494 10.5494 10.5622 10.5622 10.6741 10.6741 10.7509 10.7509 10.8882 10.8882 12.6414 12.6414 14.2343 14.2343 14.4753 14.4753 15.5364 15.5364 18.0299 18.0299 k = 0.5000 0.2887 0.2931 ( 2748 PWs) bands (ev): -9.6739 -9.6739 -9.6687 -9.6687 -9.6326 -9.6326 -9.6295 -9.6295 -8.6604 -8.6604 -8.6400 -8.6400 -8.6228 -8.6228 -8.6147 -8.6147 -8.5854 -8.5854 -8.5738 -8.5738 4.5492 4.5492 4.8841 4.8841 6.9925 6.9925 7.7119 7.7119 9.5329 9.5329 9.6796 9.6796 9.9242 9.9242 10.2352 10.2352 10.4069 10.4069 10.5527 10.5527 10.5578 10.5578 10.6768 10.6768 10.7574 10.7574 10.9034 10.9034 12.5461 12.5461 14.3513 14.3513 14.4087 14.4087 15.6029 15.6029 17.8492 17.8492 k = 0.5000 0.2887 0.2804 ( 2754 PWs) bands (ev): -9.6742 -9.6742 -9.6684 -9.6684 -9.6329 -9.6329 -9.6294 -9.6294 -8.6612 -8.6612 -8.6385 -8.6385 -8.6239 -8.6239 -8.6146 -8.6146 -8.5857 -8.5857 -8.5730 -8.5730 4.5124 4.5124 4.8739 4.8739 7.0093 7.0093 7.8055 7.8055 9.5139 9.5139 9.6494 9.6494 9.9517 9.9517 10.2625 10.2625 10.4002 10.4002 10.5460 10.5460 10.5625 10.5625 10.6790 10.6790 10.7667 10.7667 10.9186 10.9186 12.4532 12.4532 14.3039 14.3039 14.5075 14.5075 15.6636 15.6636 17.6744 17.6744 k = 0.5000 0.2887 0.2676 ( 2748 PWs) bands (ev): -9.6744 -9.6744 -9.6681 -9.6681 -9.6331 -9.6331 -9.6294 -9.6294 -8.6619 -8.6619 -8.6370 -8.6370 -8.6250 -8.6250 -8.6145 -8.6145 -8.5859 -8.5859 -8.5724 -8.5724 4.4759 4.4759 4.8603 4.8603 7.0323 7.0323 7.9023 7.9023 9.4957 9.4957 9.6203 9.6203 9.9797 9.9797 10.2875 10.2875 10.3949 10.3949 10.5388 10.5388 10.5671 10.5671 10.6816 10.6816 10.7780 10.7780 10.9338 10.9338 12.3628 12.3628 14.2211 14.2211 14.6422 14.6422 15.7155 15.7155 17.5107 17.5107 k = 0.5000 0.2887 0.2549 ( 2748 PWs) bands (ev): -9.6747 -9.6747 -9.6678 -9.6678 -9.6334 -9.6334 -9.6293 -9.6293 -8.6625 -8.6625 -8.6356 -8.6356 -8.6262 -8.6262 -8.6144 -8.6144 -8.5860 -8.5860 -8.5717 -8.5717 4.4399 4.4399 4.8439 4.8439 7.0607 7.0607 8.0019 8.0019 9.4782 9.4782 9.5927 9.5927 10.0081 10.0081 10.3091 10.3091 10.3918 10.3918 10.5317 10.5317 10.5710 10.5710 10.6847 10.6847 10.7907 10.7907 10.9488 10.9488 12.2750 12.2750 14.1354 14.1354 14.7802 14.7802 15.7542 15.7542 17.3642 17.3642 k = 0.5000 0.2887 0.2421 ( 2744 PWs) bands (ev): -9.6749 -9.6749 -9.6675 -9.6675 -9.6336 -9.6336 -9.6293 -9.6293 -8.6630 -8.6630 -8.6342 -8.6342 -8.6275 -8.6275 -8.6143 -8.6143 -8.5861 -8.5861 -8.5711 -8.5711 4.4048 4.4048 4.8251 4.8251 7.0937 7.0937 8.1039 8.1039 9.4614 9.4614 9.5669 9.5669 10.0367 10.0367 10.3257 10.3257 10.3928 10.3928 10.5248 10.5248 10.5745 10.5745 10.6885 10.6885 10.8042 10.8042 10.9637 10.9637 12.1895 12.1895 14.0478 14.0478 14.9202 14.9202 15.7740 15.7740 17.2417 17.2417 k = 0.5000 0.2887 0.2294 ( 2748 PWs) bands (ev): -9.6751 -9.6751 -9.6673 -9.6673 -9.6338 -9.6338 -9.6293 -9.6293 -8.6634 -8.6634 -8.6328 -8.6328 -8.6288 -8.6288 -8.6142 -8.6142 -8.5861 -8.5861 -8.5706 -8.5706 4.3705 4.3705 4.8045 4.8045 7.1306 7.1306 8.2079 8.2079 9.4454 9.4454 9.5429 9.5429 10.0655 10.0655 10.3354 10.3354 10.3997 10.3997 10.5181 10.5181 10.5780 10.5780 10.6927 10.6927 10.8183 10.8183 10.9782 10.9782 12.1066 12.1066 13.9584 13.9584 15.0613 15.0613 15.7690 15.7690 17.1508 17.1508 k = 0.5000 0.2887 0.2167 ( 2744 PWs) bands (ev): -9.6753 -9.6753 -9.6671 -9.6671 -9.6340 -9.6340 -9.6294 -9.6294 -8.6638 -8.6638 -8.6318 -8.6318 -8.6298 -8.6298 -8.6142 -8.6142 -8.5860 -8.5860 -8.5701 -8.5701 4.3375 4.3375 4.7826 4.7826 7.1705 7.1705 8.3133 8.3133 9.4302 9.4302 9.5207 9.5207 10.0943 10.0943 10.3387 10.3387 10.4124 10.4124 10.5117 10.5117 10.5822 10.5822 10.6973 10.6973 10.8325 10.8325 10.9923 10.9923 12.0262 12.0262 13.8676 13.8676 15.2019 15.2019 15.7360 15.7360 17.0963 17.0963 k = 0.5000 0.2887 0.2039 ( 2744 PWs) bands (ev): -9.6755 -9.6755 -9.6669 -9.6669 -9.6342 -9.6342 -9.6294 -9.6294 -8.6641 -8.6641 -8.6321 -8.6321 -8.6297 -8.6297 -8.6141 -8.6141 -8.5858 -8.5858 -8.5697 -8.5697 4.3057 4.3057 4.7598 4.7598 7.2126 7.2126 8.4198 8.4198 9.4157 9.4157 9.5007 9.5007 10.1230 10.1230 10.3381 10.3381 10.4284 10.4284 10.5055 10.5055 10.5871 10.5871 10.7019 10.7019 10.8466 10.8466 11.0059 11.0059 11.9483 11.9483 13.7755 13.7755 15.3357 15.3357 15.6807 15.6807 17.0677 17.0677 k = 0.5000 0.2887 0.1912 ( 2744 PWs) bands (ev): -9.6756 -9.6756 -9.6667 -9.6667 -9.6344 -9.6344 -9.6295 -9.6295 -8.6642 -8.6642 -8.6334 -8.6334 -8.6286 -8.6286 -8.6141 -8.6141 -8.5856 -8.5856 -8.5693 -8.5693 4.2753 4.2753 4.7366 4.7366 7.2561 7.2561 8.5269 8.5269 9.4020 9.4020 9.4827 9.4827 10.1514 10.1514 10.3358 10.3358 10.4459 10.4459 10.4997 10.4997 10.5932 10.5932 10.7065 10.7065 10.8603 10.8603 11.0189 11.0189 11.8729 11.8729 13.6825 13.6825 15.4277 15.4277 15.6428 15.6428 16.9807 16.9807 k = 0.5000 0.2887 0.1784 ( 2736 PWs) bands (ev): -9.6758 -9.6758 -9.6665 -9.6665 -9.6345 -9.6345 -9.6295 -9.6295 -8.6643 -8.6643 -8.6348 -8.6348 -8.6275 -8.6275 -8.6141 -8.6141 -8.5853 -8.5853 -8.5690 -8.5690 4.2464 4.2464 4.7134 4.7134 7.3003 7.3003 8.6339 8.6339 9.3892 9.3892 9.4668 9.4668 10.1794 10.1794 10.3329 10.3329 10.4640 10.4640 10.4944 10.4944 10.6008 10.6008 10.7108 10.7108 10.8733 10.8733 11.0312 11.0312 11.8001 11.8001 13.5890 13.5890 15.3907 15.3907 15.7166 15.7166 16.8843 16.8843 k = 0.5000 0.2887 0.1657 ( 2732 PWs) bands (ev): -9.6759 -9.6759 -9.6664 -9.6664 -9.6347 -9.6347 -9.6296 -9.6296 -8.6643 -8.6643 -8.6363 -8.6363 -8.6264 -8.6264 -8.6140 -8.6140 -8.5849 -8.5849 -8.5688 -8.5688 4.2192 4.2192 4.6906 4.6906 7.3444 7.3444 8.7402 8.7402 9.3772 9.3772 9.4532 9.4532 10.2067 10.2067 10.3297 10.3297 10.4799 10.4799 10.4923 10.4923 10.6097 10.6097 10.7147 10.7147 10.8856 10.8856 11.0426 11.0426 11.7299 11.7299 13.4955 13.4955 15.2817 15.2817 15.8523 15.8523 16.7946 16.7946 k = 0.5000 0.2887 0.1529 ( 2728 PWs) bands (ev): -9.6760 -9.6760 -9.6663 -9.6663 -9.6348 -9.6348 -9.6297 -9.6297 -8.6643 -8.6643 -8.6377 -8.6377 -8.6254 -8.6254 -8.6140 -8.6140 -8.5845 -8.5845 -8.5686 -8.5686 4.1936 4.1936 4.6684 4.6684 7.3878 7.3878 8.8452 8.8452 9.3660 9.3660 9.4416 9.4416 10.2331 10.2331 10.3266 10.3266 10.4810 10.4810 10.5061 10.5061 10.6201 10.6201 10.7182 10.7182 10.8967 10.8967 11.0530 11.0530 11.6622 11.6622 13.4028 13.4028 15.1545 15.1545 16.0019 16.0019 16.7126 16.7126 k = 0.5000 0.2887 0.1402 ( 2736 PWs) bands (ev): -9.6761 -9.6761 -9.6662 -9.6662 -9.6349 -9.6349 -9.6298 -9.6298 -8.6641 -8.6641 -8.6392 -8.6392 -8.6245 -8.6245 -8.6139 -8.6139 -8.5841 -8.5841 -8.5685 -8.5685 4.1699 4.1699 4.6471 4.6471 7.4299 7.4299 8.9480 8.9480 9.3556 9.3556 9.4320 9.4320 10.2583 10.2583 10.3237 10.3237 10.4769 10.4769 10.5266 10.5266 10.6316 10.6316 10.7213 10.7213 10.9066 10.9066 11.0622 11.0622 11.5973 11.5973 13.3114 13.3114 15.0222 15.0222 16.1562 16.1562 16.6387 16.6387 k = 0.5000 0.2887 0.1274 ( 2744 PWs) bands (ev): -9.6762 -9.6762 -9.6661 -9.6661 -9.6350 -9.6350 -9.6299 -9.6299 -8.6638 -8.6638 -8.6407 -8.6407 -8.6236 -8.6236 -8.6139 -8.6139 -8.5836 -8.5836 -8.5684 -8.5684 4.1481 4.1481 4.6270 4.6270 7.4699 7.4699 9.0479 9.0479 9.3461 9.3461 9.4245 9.4245 10.2822 10.2822 10.3211 10.3211 10.4725 10.4725 10.5490 10.5490 10.6441 10.6441 10.7242 10.7242 10.9151 10.9151 11.0700 11.0700 11.5352 11.5352 13.2223 13.2223 14.8905 14.8905 16.3115 16.3115 16.5742 16.5742 k = 0.5000 0.2887 0.1147 ( 2740 PWs) bands (ev): -9.6762 -9.6762 -9.6660 -9.6660 -9.6350 -9.6350 -9.6300 -9.6300 -8.6635 -8.6635 -8.6421 -8.6421 -8.6229 -8.6229 -8.6138 -8.6138 -8.5831 -8.5831 -8.5684 -8.5684 4.1281 4.1281 4.6083 4.6083 7.5076 7.5076 9.1437 9.1437 9.3375 9.3375 9.4187 9.4187 10.3037 10.3037 10.3198 10.3198 10.4685 10.4685 10.5729 10.5729 10.6569 10.6569 10.7275 10.7275 10.9222 10.9222 11.0765 11.0765 11.4760 11.4760 13.1365 13.1365 14.7629 14.7629 16.4483 16.4483 16.5377 16.5377 k = 0.5000 0.2887 0.1020 ( 2748 PWs) bands (ev): -9.6763 -9.6763 -9.6660 -9.6660 -9.6351 -9.6351 -9.6301 -9.6301 -8.6631 -8.6631 -8.6436 -8.6436 -8.6222 -8.6222 -8.6138 -8.6138 -8.5826 -8.5826 -8.5684 -8.5684 4.1102 4.1102 4.5911 4.5911 7.5422 7.5422 9.2345 9.2345 9.3298 9.3298 9.4145 9.4145 10.3136 10.3136 10.3289 10.3289 10.4647 10.4647 10.5981 10.5981 10.6691 10.6691 10.7318 10.7318 10.9275 10.9275 11.0815 11.0815 11.4199 11.4199 13.0549 13.0549 14.6419 14.6419 16.4439 16.4439 16.6508 16.6508 k = 0.5000 0.2887 0.0892 ( 2738 PWs) bands (ev): -9.6763 -9.6763 -9.6659 -9.6659 -9.6351 -9.6351 -9.6302 -9.6302 -8.6627 -8.6627 -8.6449 -8.6449 -8.6216 -8.6216 -8.6137 -8.6137 -8.5821 -8.5821 -8.5685 -8.5685 4.0942 4.0942 4.5756 4.5756 7.5736 7.5736 9.3177 9.3177 9.3243 9.3243 9.4118 9.4118 10.3130 10.3130 10.3474 10.3474 10.4614 10.4614 10.6239 10.6239 10.6796 10.6796 10.7387 10.7387 10.9312 10.9312 11.0849 11.0849 11.3672 11.3672 12.9787 12.9787 14.5297 14.5297 16.4020 16.4020 16.8092 16.8092 k = 0.5000 0.2887 0.0765 ( 2738 PWs) bands (ev): -9.6764 -9.6764 -9.6659 -9.6659 -9.6351 -9.6351 -9.6303 -9.6303 -8.6622 -8.6622 -8.6462 -8.6462 -8.6211 -8.6211 -8.6137 -8.6137 -8.5816 -8.5816 -8.5686 -8.5686 4.0803 4.0803 4.5620 4.5620 7.6014 7.6014 9.3169 9.3169 9.3959 9.3959 9.4103 9.4103 10.3116 10.3116 10.3654 10.3654 10.4584 10.4584 10.6479 10.6479 10.6889 10.6889 10.7493 10.7493 10.9331 10.9331 11.0866 11.0866 11.3183 11.3183 12.9091 12.9091 14.4281 14.4281 16.3636 16.3636 16.9705 16.9705 k = 0.5000 0.2887 0.0637 ( 2746 PWs) bands (ev): -9.6764 -9.6764 -9.6659 -9.6659 -9.6351 -9.6351 -9.6304 -9.6304 -8.6616 -8.6616 -8.6475 -8.6475 -8.6207 -8.6207 -8.6136 -8.6136 -8.5812 -8.5812 -8.5687 -8.5687 4.0685 4.0685 4.5503 4.5503 7.6252 7.6252 9.3119 9.3119 9.4091 9.4091 9.4645 9.4645 10.3104 10.3104 10.3819 10.3819 10.4557 10.4557 10.6640 10.6640 10.7022 10.7022 10.7633 10.7633 10.9332 10.9332 11.0864 11.0864 11.2736 11.2736 12.8472 12.8472 14.3389 14.3389 16.3309 16.3309 17.1311 17.1311 k = 0.5000 0.2887 0.0510 ( 2746 PWs) bands (ev): -9.6764 -9.6764 -9.6659 -9.6659 -9.6351 -9.6351 -9.6304 -9.6304 -8.6611 -8.6611 -8.6486 -8.6486 -8.6203 -8.6203 -8.6136 -8.6136 -8.5808 -8.5808 -8.5688 -8.5688 4.0588 4.0588 4.5406 4.5406 7.6449 7.6449 9.3078 9.3078 9.4089 9.4089 9.5224 9.5224 10.3095 10.3095 10.3968 10.3968 10.4533 10.4533 10.6687 10.6687 10.7230 10.7230 10.7798 10.7798 10.9314 10.9314 11.0843 11.0843 11.2346 11.2346 12.7944 12.7944 14.2635 14.2635 16.3042 16.3042 17.2881 17.2881 k = 0.5000 0.2887 0.0382 ( 2746 PWs) bands (ev): -9.6765 -9.6765 -9.6658 -9.6658 -9.6351 -9.6351 -9.6305 -9.6305 -8.6605 -8.6605 -8.6495 -8.6495 -8.6201 -8.6201 -8.6136 -8.6136 -8.5804 -8.5804 -8.5689 -8.5689 4.0513 4.0513 4.5330 4.5330 7.6604 7.6604 9.3046 9.3046 9.4089 9.4089 9.5690 9.5690 10.3088 10.3088 10.4097 10.4097 10.4512 10.4512 10.6677 10.6677 10.7449 10.7449 10.7977 10.7977 10.9278 10.9278 11.0801 11.0801 11.2027 11.2027 12.7519 12.7519 14.2033 14.2033 16.2835 16.2835 17.4368 17.4368 k = 0.5000 0.2887 0.0255 ( 2736 PWs) bands (ev): -9.6765 -9.6765 -9.6658 -9.6658 -9.6351 -9.6351 -9.6305 -9.6305 -8.6601 -8.6601 -8.6503 -8.6503 -8.6199 -8.6199 -8.6135 -8.6135 -8.5802 -8.5802 -8.5690 -8.5690 4.0459 4.0459 4.5275 4.5275 7.6716 7.6716 9.3024 9.3024 9.4092 9.4092 9.6032 9.6032 10.3084 10.3084 10.4201 10.4201 10.4492 10.4492 10.6650 10.6650 10.7628 10.7628 10.8160 10.8160 10.9226 10.9226 11.0744 11.0744 11.1796 11.1796 12.7207 12.7207 14.1594 14.1594 16.2688 16.2688 17.5685 17.5685 k = 0.5000 0.2887 0.0127 ( 2750 PWs) bands (ev): -9.6765 -9.6765 -9.6658 -9.6658 -9.6351 -9.6351 -9.6306 -9.6306 -8.6597 -8.6597 -8.6508 -8.6508 -8.6198 -8.6198 -8.6135 -8.6135 -8.5800 -8.5800 -8.5690 -8.5690 4.0426 4.0426 4.5242 4.5242 7.6782 7.6782 9.3010 9.3010 9.4093 9.4093 9.6240 9.6240 10.3081 10.3081 10.4272 10.4272 10.4475 10.4475 10.6626 10.6626 10.7739 10.7739 10.8313 10.8313 10.9169 10.9169 11.0686 11.0686 11.1659 11.1659 12.7015 12.7015 14.1327 14.1327 16.2599 16.2599 17.6662 17.6662 k = 0.5000 0.2887-0.0000 ( 2750 PWs) bands (ev): -9.6765 -9.6765 -9.6658 -9.6658 -9.6351 -9.6351 -9.6306 -9.6306 -8.6596 -8.6596 -8.6510 -8.6510 -8.6197 -8.6197 -8.6135 -8.6135 -8.5800 -8.5800 -8.5690 -8.5690 4.0415 4.0415 4.5231 4.5231 7.6804 7.6804 9.3005 9.3005 9.4094 9.4094 9.6310 9.6310 10.3080 10.3080 10.4299 10.4299 10.4467 10.4467 10.6617 10.6617 10.7777 10.7777 10.8377 10.8377 10.9142 10.9142 11.0662 11.0662 11.1616 11.1616 12.6950 12.6950 14.1237 14.1237 16.2570 16.2570 17.7039 17.7039 k = 0.3333 0.5774-0.0000 ( 2760 PWs) bands (ev): -9.6757 -9.6757 -9.6675 -9.6675 -9.6333 -9.6333 -9.6292 -9.6292 -8.6649 -8.6649 -8.6416 -8.6416 -8.6354 -8.6354 -8.5886 -8.5886 -8.5853 -8.5853 -8.5722 -8.5722 4.7654 4.7654 4.7700 4.7700 6.6160 6.6160 8.7918 8.7918 8.8354 8.8354 9.7825 9.7825 9.9246 9.9246 10.0503 10.0503 10.4653 10.4653 10.6444 10.6444 10.9189 10.9189 11.0698 11.0698 11.1573 11.1573 11.5952 11.5952 12.5877 12.5877 12.6365 12.6365 14.0417 14.0417 14.1358 14.1358 15.7438 15.7438 k = 0.3333 0.5774 0.0127 ( 2748 PWs) bands (ev): -9.6757 -9.6757 -9.6675 -9.6675 -9.6333 -9.6333 -9.6292 -9.6292 -8.6649 -8.6649 -8.6416 -8.6416 -8.6354 -8.6354 -8.5887 -8.5887 -8.5853 -8.5853 -8.5723 -8.5723 4.7662 4.7662 4.7707 4.7707 6.6178 6.6178 8.7899 8.7899 8.8338 8.8338 9.7833 9.7833 9.9248 9.9248 10.0502 10.0502 10.4653 10.4653 10.6443 10.6443 10.9174 10.9174 11.0698 11.0698 11.1571 11.1571 11.5874 11.5874 12.5777 12.5777 12.6267 12.6267 14.0568 14.0568 14.1509 14.1509 15.7550 15.7550 k = 0.3333 0.5774 0.0255 ( 2736 PWs) bands (ev): -9.6756 -9.6756 -9.6675 -9.6675 -9.6333 -9.6333 -9.6292 -9.6292 -8.6649 -8.6649 -8.6415 -8.6415 -8.6353 -8.6353 -8.5888 -8.5888 -8.5853 -8.5853 -8.5723 -8.5723 4.7685 4.7685 4.7730 4.7730 6.6232 6.6232 8.7838 8.7838 8.8284 8.8284 9.7856 9.7856 9.9252 9.9252 10.0498 10.0498 10.4655 10.4655 10.6440 10.6440 10.9126 10.9126 11.0699 11.0699 11.1568 11.1568 11.5645 11.5645 12.5490 12.5490 12.5983 12.5983 14.1007 14.1007 14.1945 14.1945 15.7885 15.7885 k = 0.3333 0.5774 0.0382 ( 2736 PWs) bands (ev): -9.6756 -9.6756 -9.6675 -9.6675 -9.6333 -9.6333 -9.6292 -9.6292 -8.6649 -8.6649 -8.6413 -8.6413 -8.6352 -8.6352 -8.5890 -8.5890 -8.5853 -8.5853 -8.5725 -8.5725 4.7724 4.7724 4.7768 4.7768 6.6321 6.6321 8.7736 8.7736 8.8195 8.8195 9.7892 9.7892 9.9259 9.9259 10.0492 10.0492 10.4657 10.4657 10.6434 10.6434 10.9043 10.9043 11.0698 11.0698 11.1560 11.1560 11.5273 11.5273 12.5047 12.5047 12.5545 12.5545 14.1701 14.1701 14.2637 14.2637 15.8433 15.8433 k = 0.3333 0.5774 0.0510 ( 2736 PWs) bands (ev): -9.6755 -9.6755 -9.6675 -9.6675 -9.6334 -9.6334 -9.6291 -9.6291 -8.6649 -8.6649 -8.6411 -8.6411 -8.6351 -8.6351 -8.5892 -8.5892 -8.5854 -8.5854 -8.5727 -8.5727 4.7778 4.7778 4.7821 4.7821 6.6446 6.6446 8.7595 8.7595 8.8070 8.8070 9.7941 9.7941 9.9268 9.9268 10.0485 10.0485 10.4660 10.4660 10.6425 10.6425 10.8922 10.8922 11.0697 11.0697 11.1548 11.1548 11.4776 11.4776 12.4489 12.4489 12.4993 12.4993 14.2609 14.2609 14.3544 14.3544 15.9183 15.9183 k = 0.3333 0.5774 0.0637 ( 2736 PWs) bands (ev): -9.6755 -9.6755 -9.6676 -9.6676 -9.6334 -9.6334 -9.6290 -9.6290 -8.6649 -8.6649 -8.6408 -8.6408 -8.6350 -8.6350 -8.5895 -8.5895 -8.5854 -8.5854 -8.5729 -8.5729 4.7847 4.7847 4.7889 4.7889 6.6607 6.6607 8.7416 8.7416 8.7912 8.7912 9.8005 9.8005 9.9280 9.9280 10.0475 10.0475 10.4664 10.4664 10.6412 10.6412 10.8755 10.8755 11.0697 11.0697 11.1535 11.1535 11.4176 11.4176 12.3854 12.3854 12.4363 12.4363 14.3693 14.3693 14.4629 14.4629 16.0120 16.0120 k = 0.3333 0.5774 0.0765 ( 2736 PWs) bands (ev): -9.6754 -9.6754 -9.6676 -9.6676 -9.6334 -9.6334 -9.6289 -9.6289 -8.6648 -8.6648 -8.6405 -8.6405 -8.6348 -8.6348 -8.5899 -8.5899 -8.5855 -8.5855 -8.5732 -8.5732 4.7931 4.7931 4.7971 4.7971 6.6803 6.6803 8.7199 8.7199 8.7718 8.7718 9.8082 9.8082 9.9296 9.9296 10.0466 10.0466 10.4667 10.4667 10.6396 10.6396 10.8532 10.8532 11.0698 11.0698 11.1518 11.1518 11.3500 11.3500 12.3174 12.3174 12.3688 12.3688 14.4918 14.4918 14.5857 14.5857 16.1227 16.1227 k = 0.3333 0.5774 0.0892 ( 2745 PWs) bands (ev): -9.6753 -9.6753 -9.6676 -9.6676 -9.6334 -9.6334 -9.6288 -9.6288 -8.6648 -8.6648 -8.6401 -8.6401 -8.6346 -8.6346 -8.5904 -8.5904 -8.5855 -8.5855 -8.5735 -8.5735 4.8029 4.8029 4.8066 4.8066 6.7034 6.7034 8.6945 8.6945 8.7491 8.7491 9.8173 9.8173 9.9314 9.9314 10.0458 10.0458 10.4671 10.4671 10.6376 10.6376 10.8235 10.8235 11.0700 11.0700 11.1500 11.1500 11.2781 11.2781 12.2472 12.2472 12.2992 12.2992 14.6258 14.6258 14.7203 14.7203 16.2487 16.2487 k = 0.3333 0.5774 0.1020 ( 2754 PWs) bands (ev): -9.6752 -9.6752 -9.6676 -9.6676 -9.6334 -9.6334 -9.6287 -9.6287 -8.6647 -8.6647 -8.6396 -8.6396 -8.6344 -8.6344 -8.5909 -8.5909 -8.5856 -8.5856 -8.5739 -8.5739 4.8140 4.8140 4.8175 4.8175 6.7302 6.7302 8.6659 8.6659 8.7234 8.7234 9.8277 9.8277 9.9337 9.9337 10.0451 10.0451 10.4673 10.4673 10.6348 10.6348 10.7842 10.7842 11.0702 11.0702 11.1479 11.1479 11.2062 11.2062 12.1767 12.1767 12.2293 12.2293 14.7693 14.7693 14.8646 14.8646 16.3884 16.3884 k = 0.3333 0.5774 0.1147 ( 2742 PWs) bands (ev): -9.6751 -9.6751 -9.6677 -9.6677 -9.6334 -9.6334 -9.6286 -9.6286 -8.6646 -8.6646 -8.6391 -8.6391 -8.6342 -8.6342 -8.5914 -8.5914 -8.5857 -8.5857 -8.5743 -8.5743 4.8265 4.8265 4.8296 4.8296 6.7604 6.7604 8.6341 8.6341 8.6947 8.6947 9.8394 9.8394 9.9363 9.9363 10.0446 10.0446 10.4677 10.4677 10.6314 10.6314 10.7328 10.7328 11.0707 11.0707 11.1386 11.1386 11.1460 11.1460 12.1072 12.1072 12.1604 12.1604 14.9207 14.9207 15.0172 15.0172 16.5405 16.5405 k = 0.3333 0.5774 0.1274 ( 2754 PWs) bands (ev): -9.6749 -9.6749 -9.6677 -9.6677 -9.6334 -9.6334 -9.6285 -9.6285 -8.6645 -8.6645 -8.6386 -8.6386 -8.6340 -8.6340 -8.5920 -8.5920 -8.5858 -8.5858 -8.5747 -8.5747 4.8401 4.8401 4.8428 4.8428 6.7941 6.7941 8.5994 8.5994 8.6631 8.6631 9.8521 9.8521 9.9392 9.9392 10.0444 10.0444 10.4678 10.4678 10.6249 10.6249 10.6693 10.6693 11.0676 11.0676 11.0823 11.0823 11.1438 11.1438 12.0395 12.0395 12.0934 12.0934 15.0789 15.0789 15.1766 15.1766 16.7035 16.7035 k = 0.3333 0.5774 0.1402 ( 2754 PWs) bands (ev): -9.6748 -9.6748 -9.6677 -9.6677 -9.6333 -9.6333 -9.6284 -9.6284 -8.6644 -8.6644 -8.6380 -8.6380 -8.6337 -8.6337 -8.5926 -8.5926 -8.5859 -8.5859 -8.5752 -8.5752 4.8548 4.8548 4.8572 4.8572 6.8313 6.8313 8.5622 8.5622 8.6290 8.6290 9.8660 9.8660 9.9425 9.9425 10.0446 10.0446 10.4680 10.4680 10.5785 10.5785 10.6306 10.6306 11.0249 11.0249 11.0750 11.0750 11.1418 11.1418 11.9743 11.9743 12.0288 12.0288 15.2427 15.2427 15.3420 15.3420 16.8762 16.8762 k = 0.3333 0.5774 0.1529 ( 2754 PWs) bands (ev): -9.6747 -9.6747 -9.6678 -9.6678 -9.6333 -9.6333 -9.6283 -9.6283 -8.6643 -8.6643 -8.6374 -8.6374 -8.6335 -8.6335 -8.5933 -8.5933 -8.5860 -8.5860 -8.5758 -8.5758 4.8706 4.8706 4.8725 4.8725 6.8720 6.8720 8.5227 8.5227 8.5927 8.5927 9.8808 9.8808 9.9462 9.9462 10.0452 10.0452 10.4679 10.4679 10.4876 10.4876 10.6235 10.6235 10.9818 10.9818 11.0765 11.0765 11.1398 11.1398 11.9119 11.9119 11.9672 11.9672 15.4113 15.4113 15.5125 15.5125 17.0576 17.0576 k = 0.3333 0.5774 0.1657 ( 2757 PWs) bands (ev): -9.6745 -9.6745 -9.6678 -9.6678 -9.6332 -9.6332 -9.6282 -9.6282 -8.6641 -8.6641 -8.6367 -8.6367 -8.6333 -8.6333 -8.5939 -8.5939 -8.5861 -8.5861 -8.5763 -8.5763 4.8872 4.8872 4.8886 4.8886 6.9161 6.9161 8.4814 8.4814 8.5545 8.5545 9.8961 9.8961 9.9502 9.9502 10.0461 10.0461 10.3853 10.3853 10.4678 10.4678 10.6180 10.6180 10.9443 10.9443 11.0790 11.0790 11.1381 11.1381 11.8526 11.8526 11.9086 11.9086 15.5842 15.5842 15.6874 15.6874 17.2469 17.2469 k = 0.3333 0.5774 0.1784 ( 2757 PWs) bands (ev): -9.6744 -9.6744 -9.6679 -9.6679 -9.6332 -9.6332 -9.6281 -9.6281 -8.6639 -8.6639 -8.6360 -8.6360 -8.6331 -8.6331 -8.5946 -8.5946 -8.5862 -8.5862 -8.5769 -8.5769 4.9046 4.9046 4.9055 4.9055 6.9637 6.9637 8.4386 8.4386 8.5148 8.5148 9.9118 9.9118 9.9545 9.9545 10.0469 10.0469 10.2772 10.2772 10.4674 10.4674 10.6123 10.6123 10.9108 10.9108 11.0821 11.0821 11.1366 11.1366 11.7966 11.7966 11.8532 11.8532 15.7605 15.7605 15.8661 15.8661 17.4433 17.4433 k = 0.3333 0.5774 0.1912 ( 2757 PWs) bands (ev): -9.6742 -9.6742 -9.6679 -9.6679 -9.6331 -9.6331 -9.6280 -9.6280 -8.6637 -8.6637 -8.6353 -8.6353 -8.6330 -8.6330 -8.5953 -8.5953 -8.5863 -8.5863 -8.5775 -8.5775 4.9226 4.9226 4.9230 4.9230 7.0147 7.0147 8.3947 8.3947 8.4738 8.4738 9.9263 9.9263 9.9590 9.9590 10.0454 10.0454 10.1693 10.1693 10.4669 10.4669 10.6062 10.6062 10.8797 10.8797 11.0859 11.0859 11.1355 11.1355 11.7437 11.7437 11.8010 11.8010 15.9396 15.9396 16.0479 16.0479 17.6461 17.6461 k = 0.3333 0.5774 0.2039 ( 2757 PWs) bands (ev): -9.6741 -9.6741 -9.6680 -9.6680 -9.6330 -9.6330 -9.6280 -9.6280 -8.6635 -8.6635 -8.6346 -8.6346 -8.6329 -8.6329 -8.5959 -8.5959 -8.5865 -8.5865 -8.5782 -8.5782 4.9409 4.9409 4.9411 4.9411 7.0690 7.0690 8.3503 8.3503 8.4322 8.4322 9.9314 9.9314 9.9639 9.9639 10.0239 10.0239 10.0889 10.0889 10.4661 10.4661 10.5997 10.5997 10.8501 10.8501 11.0904 11.0904 11.1348 11.1348 11.6942 11.6942 11.7519 11.7519 16.1210 16.1210 16.2322 16.2322 17.8548 17.8548 k = 0.3333 0.5774 0.2167 ( 2760 PWs) bands (ev): -9.6739 -9.6739 -9.6680 -9.6680 -9.6329 -9.6329 -9.6279 -9.6279 -8.6632 -8.6632 -8.6338 -8.6338 -8.6328 -8.6328 -8.5966 -8.5966 -8.5866 -8.5866 -8.5788 -8.5788 4.9590 4.9590 4.9599 4.9599 7.1267 7.1267 8.3057 8.3057 8.3903 8.3903 9.8800 9.8800 9.9689 9.9689 9.9921 9.9921 10.0750 10.0750 10.4652 10.4652 10.5927 10.5927 10.8214 10.8214 11.0956 11.0956 11.1346 11.1346 11.6478 11.6478 11.7059 11.7059 16.3039 16.3039 16.4185 16.4185 18.0688 18.0688 k = 0.3333 0.5774 0.2294 ( 2757 PWs) bands (ev): -9.6738 -9.6738 -9.6680 -9.6680 -9.6328 -9.6328 -9.6279 -9.6279 -8.6629 -8.6629 -8.6330 -8.6330 -8.6327 -8.6327 -8.5972 -8.5972 -8.5867 -8.5867 -8.5795 -8.5795 4.9773 4.9773 4.9788 4.9788 7.1876 7.1876 8.2615 8.2615 8.3486 8.3486 9.7723 9.7723 9.9740 9.9740 9.9987 9.9987 10.0790 10.0790 10.4640 10.4640 10.5853 10.5853 10.7932 10.7932 11.1016 11.1016 11.1350 11.1350 11.6045 11.6045 11.6628 11.6628 16.4877 16.4877 16.6060 16.6060 18.2878 18.2878 k = 0.3333 0.5774 0.2421 ( 2769 PWs) bands (ev): -9.6737 -9.6737 -9.6681 -9.6681 -9.6326 -9.6326 -9.6278 -9.6278 -8.6626 -8.6626 -8.6327 -8.6327 -8.6323 -8.6323 -8.5978 -8.5978 -8.5869 -8.5869 -8.5802 -8.5802 4.9954 4.9954 4.9976 4.9976 7.2518 7.2518 8.2181 8.2181 8.3076 8.3076 9.6540 9.6540 9.9791 9.9791 10.0118 10.0118 10.0880 10.0880 10.4627 10.4627 10.5775 10.5775 10.7652 10.7652 11.1083 11.1083 11.1359 11.1359 11.5641 11.5641 11.6225 11.6225 16.6715 16.6715 16.7940 16.7940 18.5113 18.5113 k = 0.3333 0.5774 0.2549 ( 2769 PWs) bands (ev): -9.6735 -9.6735 -9.6681 -9.6681 -9.6325 -9.6325 -9.6278 -9.6278 -8.6623 -8.6623 -8.6327 -8.6327 -8.6315 -8.6315 -8.5984 -8.5984 -8.5870 -8.5870 -8.5808 -8.5808 5.0133 5.0133 5.0161 5.0161 7.3192 7.3192 8.1759 8.1759 8.2677 8.2677 9.5334 9.5334 9.9843 9.9843 10.0247 10.0247 10.1010 10.1010 10.4612 10.4612 10.5694 10.5694 10.7375 10.7375 11.1158 11.1158 11.1376 11.1376 11.5266 11.5266 11.5849 11.5849 16.8544 16.8544 16.9815 16.9815 18.7390 18.7390 k = 0.3333 0.5774 0.2676 ( 2769 PWs) bands (ev): -9.6734 -9.6734 -9.6681 -9.6681 -9.6323 -9.6323 -9.6278 -9.6278 -8.6620 -8.6620 -8.6327 -8.6327 -8.6308 -8.6308 -8.5989 -8.5989 -8.5871 -8.5871 -8.5814 -8.5814 5.0306 5.0306 5.0341 5.0341 7.3897 7.3897 8.1354 8.1354 8.2294 8.2294 9.4125 9.4125 9.9894 9.9894 10.0358 10.0358 10.1177 10.1177 10.4595 10.4595 10.5609 10.5609 10.7099 10.7099 11.1240 11.1240 11.1401 11.1401 11.4918 11.4918 11.5497 11.5497 17.0353 17.0353 17.1677 17.1677 18.9706 18.9706 k = 0.3333 0.5774 0.2804 ( 2769 PWs) bands (ev): -9.6733 -9.6733 -9.6682 -9.6682 -9.6322 -9.6322 -9.6278 -9.6278 -8.6617 -8.6617 -8.6328 -8.6328 -8.6301 -8.6301 -8.5994 -8.5994 -8.5873 -8.5873 -8.5821 -8.5821 5.0472 5.0472 5.0513 5.0513 7.4633 7.4633 8.0971 8.0971 8.1932 8.1932 9.2922 9.2922 9.9944 9.9944 10.0449 10.0449 10.1377 10.1377 10.4578 10.4578 10.5520 10.5520 10.6827 10.6827 11.1329 11.1329 11.1433 11.1433 11.4597 11.4597 11.5170 11.5170 17.2129 17.2129 17.3511 17.3511 19.2057 19.2057 k = 0.3333 0.5774 0.2931 ( 2766 PWs) bands (ev): -9.6732 -9.6732 -9.6682 -9.6682 -9.6320 -9.6320 -9.6279 -9.6279 -8.6614 -8.6614 -8.6329 -8.6329 -8.6294 -8.6294 -8.5998 -8.5998 -8.5874 -8.5874 -8.5827 -8.5827 5.0628 5.0628 5.0676 5.0676 7.5398 7.5398 8.0615 8.0615 8.1597 8.1597 9.1729 9.1729 9.9991 9.9991 10.0524 10.0524 10.1602 10.1602 10.4560 10.4560 10.5424 10.5424 10.6562 10.6562 11.1425 11.1425 11.1474 11.1474 11.4301 11.4301 11.4866 11.4866 17.3856 17.3856 17.5303 17.5303 19.4440 19.4440 k = 0.3333 0.5774 0.3059 ( 2760 PWs) bands (ev): -9.6731 -9.6731 -9.6682 -9.6682 -9.6319 -9.6319 -9.6279 -9.6279 -8.6611 -8.6611 -8.6330 -8.6330 -8.6288 -8.6288 -8.6001 -8.6001 -8.5875 -8.5875 -8.5832 -8.5832 5.0772 5.0772 5.0826 5.0826 7.6190 7.6190 8.0288 8.0288 8.1293 8.1293 9.0552 9.0552 10.0036 10.0036 10.0587 10.0587 10.1845 10.1845 10.4543 10.4543 10.5318 10.5318 10.6310 10.6310 11.1523 11.1523 11.1528 11.1528 11.4029 11.4029 11.4584 11.4584 17.5513 17.5513 17.7031 17.7031 19.6850 19.6850 k = 0.3333 0.5774 0.3186 ( 2748 PWs) bands (ev): -9.6730 -9.6730 -9.6683 -9.6683 -9.6317 -9.6317 -9.6279 -9.6279 -8.6608 -8.6608 -8.6331 -8.6331 -8.6282 -8.6282 -8.6005 -8.6005 -8.5876 -8.5876 -8.5837 -8.5837 5.0903 5.0903 5.0963 5.0963 7.7007 7.7007 7.9997 7.9997 8.1026 8.1026 8.9392 8.9392 10.0076 10.0076 10.0641 10.0641 10.2102 10.2102 10.4526 10.4526 10.5194 10.5194 10.6080 10.6080 11.1579 11.1579 11.1635 11.1635 11.3782 11.3782 11.4324 11.4324 17.7074 17.7074 17.8670 17.8670 19.9281 19.9281 k = 0.3333 0.5774 0.3314 ( 2754 PWs) bands (ev): -9.6730 -9.6730 -9.6683 -9.6683 -9.6316 -9.6316 -9.6280 -9.6280 -8.6606 -8.6606 -8.6333 -8.6333 -8.6277 -8.6277 -8.6007 -8.6007 -8.5877 -8.5877 -8.5842 -8.5842 5.1017 5.1017 5.1082 5.1082 7.7840 7.7840 7.9743 7.9743 8.0807 8.0807 8.8253 8.8253 10.0112 10.0112 10.0685 10.0685 10.2367 10.2367 10.4510 10.4510 10.5042 10.5042 10.5884 10.5884 11.1640 11.1640 11.1743 11.1743 11.3560 11.3560 11.4088 11.4088 17.8509 17.8509 18.0187 18.0187 20.1720 20.1720 k = 0.3333 0.5774 0.3441 ( 2754 PWs) bands (ev): -9.6729 -9.6729 -9.6683 -9.6683 -9.6315 -9.6315 -9.6280 -9.6280 -8.6603 -8.6603 -8.6334 -8.6334 -8.6273 -8.6273 -8.6009 -8.6009 -8.5877 -8.5877 -8.5845 -8.5845 5.1113 5.1113 5.1183 5.1183 7.8670 7.8670 7.9531 7.9531 8.0654 8.0654 8.7139 8.7139 10.0142 10.0142 10.0722 10.0722 10.2638 10.2638 10.4496 10.4496 10.4856 10.4856 10.5732 10.5732 11.1704 11.1704 11.1850 11.1850 11.3364 11.3364 11.3877 11.3877 17.9779 17.9779 18.1542 18.1542 20.4146 20.4146 k = 0.3333 0.5774 0.3568 ( 2748 PWs) bands (ev): -9.6729 -9.6729 -9.6683 -9.6683 -9.6314 -9.6314 -9.6280 -9.6280 -8.6602 -8.6602 -8.6335 -8.6335 -8.6270 -8.6270 -8.6011 -8.6011 -8.5878 -8.5878 -8.5848 -8.5848 5.1190 5.1190 5.1263 5.1263 7.9363 7.9363 7.9422 7.9422 8.0643 8.0643 8.6056 8.6056 10.0167 10.0167 10.0752 10.0752 10.2914 10.2914 10.4485 10.4485 10.4637 10.4637 10.5624 10.5624 11.1768 11.1768 11.1951 11.1951 11.3199 11.3199 11.3696 11.3696 18.0841 18.0841 18.2685 18.2685 20.6499 20.6499 k = 0.3333 0.5774 0.3696 ( 2760 PWs) bands (ev): -9.6728 -9.6728 -9.6683 -9.6683 -9.6313 -9.6313 -9.6281 -9.6281 -8.6600 -8.6600 -8.6336 -8.6336 -8.6267 -8.6267 -8.6012 -8.6012 -8.5878 -8.5878 -8.5851 -8.5851 5.1246 5.1246 5.1322 5.1322 7.9241 7.9241 7.9852 7.9852 8.1006 8.1006 8.5015 8.5015 10.0184 10.0184 10.0772 10.0772 10.3183 10.3183 10.4399 10.4399 10.4476 10.4476 10.5554 10.5554 11.1824 11.1824 11.2038 11.2038 11.3069 11.3069 11.3551 11.3551 18.1646 18.1646 18.3560 18.3560 20.8597 20.8597 k = 0.3333 0.5774 0.3823 ( 2754 PWs) bands (ev): -9.6728 -9.6728 -9.6683 -9.6683 -9.6313 -9.6313 -9.6281 -9.6281 -8.6599 -8.6599 -8.6337 -8.6337 -8.6266 -8.6266 -8.6013 -8.6013 -8.5879 -8.5879 -8.5852 -8.5852 5.1280 5.1280 5.1357 5.1357 7.9167 7.9167 7.9944 7.9944 8.1719 8.1719 8.4061 8.4061 10.0195 10.0195 10.0785 10.0785 10.3429 10.3429 10.4169 10.4169 10.4471 10.4471 10.5515 10.5515 11.1865 11.1865 11.2099 11.2099 11.2985 11.2985 11.3457 11.3457 18.2151 18.2151 18.4113 18.4113 20.9991 20.9991 k = 0.3333 0.5774 0.3951 ( 2754 PWs) bands (ev): -9.6728 -9.6728 -9.6683 -9.6683 -9.6313 -9.6313 -9.6281 -9.6281 -8.6599 -8.6599 -8.6337 -8.6337 -8.6265 -8.6265 -8.6013 -8.6013 -8.5879 -8.5879 -8.5852 -8.5852 5.1291 5.1291 5.1369 5.1369 7.9143 7.9143 7.9953 7.9953 8.2213 8.2213 8.3509 8.3509 10.0199 10.0199 10.0790 10.0790 10.3562 10.3562 10.4042 10.4042 10.4470 10.4470 10.5502 10.5502 11.1881 11.1881 11.2122 11.2122 11.2956 11.2956 11.3423 11.3423 18.2324 18.2324 18.4302 18.4302 21.0520 21.0520 Writing output data file NiSn.save init_run : 0.19s CPU 0.34s WALL ( 1 calls) electrons : 141.78s CPU 144.19s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 141.77s CPU 144.18s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.05s CPU 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.04s WALL ( 348 calls) cegterg : 129.18s CPU 131.07s WALL ( 480 calls) Called by sum_band: Called by *egterg: h_psi : 67.85s CPU 69.73s WALL ( 7433 calls) s_psi : 5.04s CPU 5.10s WALL ( 7433 calls) g_psi : 0.17s CPU 0.17s WALL ( 6605 calls) cdiaghg : 53.07s CPU 53.13s WALL ( 6953 calls) cegterg:over : 4.81s CPU 4.87s WALL ( 6605 calls) cegterg:upda : 3.17s CPU 3.41s WALL ( 6605 calls) cegterg:last : 2.32s CPU 2.34s WALL ( 1176 calls) cdiaghg:chol : 2.89s CPU 2.88s WALL ( 6953 calls) cdiaghg:inve : 1.97s CPU 2.04s WALL ( 6953 calls) cdiaghg:para : 2.96s CPU 3.23s WALL ( 13906 calls) Called by h_psi: h_psi:vloc : 57.18s CPU 58.89s WALL ( 7433 calls) h_psi:vnl : 10.51s CPU 10.66s WALL ( 7433 calls) add_vuspsi : 5.80s CPU 5.83s WALL ( 7433 calls) General routines calbec : 4.66s CPU 4.81s WALL ( 7433 calls) fft : 0.00s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 54.04s CPU 55.57s WALL ( 848060 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.13s CPU 0.23s WALL ( 696 calls) Parallel routines fft_scatter : 21.09s CPU 21.68s WALL ( 848083 calls) PWSCF : 2m37.06s CPU 2m55.24s WALL This run was terminated on: 20:58:54 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=