Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:10:38 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: ./TeRh.save/ file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized file Rh.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 5S 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 39 23 7 1711 792 125 Max 40 24 8 1718 822 130 Sum 1417 859 253 61697 29037 4611 bravais-lattice index = 14 lattice parameter (alat) = 7.5400 a.u. unit-cell volume = 526.6103 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 46.00 number of Kohn-Sham states= 56 kinetic-energy cutoff = 55.0000 Ry charge density cutoff = 364.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.540007 celldm(2)= 1.000000 celldm(3)= 1.418546 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 1.418546 ) 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 0.704947 ) PseudoPot. # 1 for Te read from file: /users/gautes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 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 Rh read from file: /users/gautes/Pseudo/Rh.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 05b2c48bcc7a2cf2a48258d60087199c Pseudo is Ultrasoft + core correction, Zval = 17.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1233 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 Te 6.00 127.60000 Te( 1.00) Rh 17.00 102.90550 Rh( 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 ) ( 0.7092732 ) 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 ) ( 0.7092732 ) 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 ) ( 0.7092732 ) 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 ) ( 0.7092732 ) 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 ) ( 0.7092732 ) 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 ) ( 0.7092732 ) 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 ) ( 0.7092732 ) 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 ) ( 0.7092732 ) 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 ) ( 0.7092732 ) 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 ) ( 0.7092732 ) 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 ) ( 0.7092732 ) 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 ) ( 0.7092732 ) 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= 345 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 2) = ( 0.0108696 0.0062755 -0.0000000), wk = 0.0028986 k( 3) = ( 0.0217391 0.0125511 -0.0000000), wk = 0.0028986 k( 4) = ( 0.0326087 0.0188266 -0.0000000), wk = 0.0028986 k( 5) = ( 0.0434783 0.0251022 -0.0000000), wk = 0.0028986 k( 6) = ( 0.0543478 0.0313777 -0.0000000), wk = 0.0028986 k( 7) = ( 0.0652174 0.0376533 -0.0000000), wk = 0.0028986 k( 8) = ( 0.0760870 0.0439288 -0.0000000), wk = 0.0028986 k( 9) = ( 0.0869565 0.0502044 -0.0000000), wk = 0.0028986 k( 10) = ( 0.0978261 0.0564799 -0.0000000), wk = 0.0028986 k( 11) = ( 0.1086957 0.0627555 -0.0000000), wk = 0.0028986 k( 12) = ( 0.1195652 0.0690310 -0.0000000), wk = 0.0028986 k( 13) = ( 0.1304348 0.0753066 -0.0000000), wk = 0.0028986 k( 14) = ( 0.1413043 0.0815821 -0.0000000), wk = 0.0028986 k( 15) = ( 0.1521739 0.0878576 -0.0000000), wk = 0.0028986 k( 16) = ( 0.1630435 0.0941332 -0.0000000), wk = 0.0028986 k( 17) = ( 0.1739130 0.1004087 -0.0000000), wk = 0.0028986 k( 18) = ( 0.1847826 0.1066843 -0.0000000), wk = 0.0028986 k( 19) = ( 0.1956522 0.1129598 -0.0000000), wk = 0.0028986 k( 20) = ( 0.2065217 0.1192354 -0.0000000), wk = 0.0028986 k( 21) = ( 0.2173913 0.1255109 -0.0000000), wk = 0.0028986 k( 22) = ( 0.2282609 0.1317865 -0.0000000), wk = 0.0028986 k( 23) = ( 0.2391304 0.1380620 -0.0000000), wk = 0.0028986 k( 24) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0028986 k( 25) = ( 0.2608696 0.1506131 -0.0000000), wk = 0.0028986 k( 26) = ( 0.2717391 0.1568887 -0.0000000), wk = 0.0028986 k( 27) = ( 0.2826087 0.1631642 -0.0000000), wk = 0.0028986 k( 28) = ( 0.2934783 0.1694398 -0.0000000), wk = 0.0028986 k( 29) = ( 0.3043478 0.1757153 -0.0000000), wk = 0.0028986 k( 30) = ( 0.3152174 0.1819908 -0.0000000), wk = 0.0028986 k( 31) = ( 0.3260870 0.1882664 -0.0000000), wk = 0.0028986 k( 32) = ( 0.3369565 0.1945419 -0.0000000), wk = 0.0028986 k( 33) = ( 0.3478261 0.2008175 -0.0000000), wk = 0.0028986 k( 34) = ( 0.3586956 0.2070930 -0.0000000), wk = 0.0028986 k( 35) = ( 0.3695652 0.2133686 -0.0000000), wk = 0.0028986 k( 36) = ( 0.3804348 0.2196441 -0.0000000), wk = 0.0028986 k( 37) = ( 0.3913044 0.2259197 -0.0000000), wk = 0.0028986 k( 38) = ( 0.4021739 0.2321952 -0.0000000), wk = 0.0028986 k( 39) = ( 0.4130435 0.2384708 -0.0000000), wk = 0.0028986 k( 40) = ( 0.4239130 0.2447463 -0.0000000), wk = 0.0028986 k( 41) = ( 0.4347826 0.2510219 -0.0000000), wk = 0.0028986 k( 42) = ( 0.4456522 0.2572974 -0.0000000), wk = 0.0028986 k( 43) = ( 0.4565217 0.2635729 -0.0000000), wk = 0.0028986 k( 44) = ( 0.4673913 0.2698485 -0.0000000), wk = 0.0028986 k( 45) = ( 0.4782609 0.2761240 -0.0000000), wk = 0.0028986 k( 46) = ( 0.4891304 0.2823996 -0.0000000), wk = 0.0028986 k( 47) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0028986 k( 48) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0028986 k( 49) = ( 0.4938272 0.2993668 -0.0000000), wk = 0.0028986 k( 50) = ( 0.4876543 0.3100585 -0.0000000), wk = 0.0028986 k( 51) = ( 0.4814815 0.3207502 -0.0000000), wk = 0.0028986 k( 52) = ( 0.4753086 0.3314418 -0.0000000), wk = 0.0028986 k( 53) = ( 0.4691358 0.3421335 -0.0000000), wk = 0.0028986 k( 54) = ( 0.4629630 0.3528252 -0.0000000), wk = 0.0028986 k( 55) = ( 0.4567901 0.3635168 -0.0000000), wk = 0.0028986 k( 56) = ( 0.4506173 0.3742085 -0.0000000), wk = 0.0028986 k( 57) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0028986 k( 58) = ( 0.4382716 0.3955918 -0.0000000), wk = 0.0028986 k( 59) = ( 0.4320988 0.4062835 -0.0000000), wk = 0.0028986 k( 60) = ( 0.4259259 0.4169752 -0.0000000), wk = 0.0028986 k( 61) = ( 0.4197531 0.4276669 -0.0000000), wk = 0.0028986 k( 62) = ( 0.4135802 0.4383585 -0.0000000), wk = 0.0028986 k( 63) = ( 0.4074074 0.4490502 -0.0000000), wk = 0.0028986 k( 64) = ( 0.4012346 0.4597419 -0.0000000), wk = 0.0028986 k( 65) = ( 0.3950617 0.4704335 -0.0000000), wk = 0.0028986 k( 66) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0028986 k( 67) = ( 0.3827160 0.4918169 -0.0000000), wk = 0.0028986 k( 68) = ( 0.3765432 0.5025086 -0.0000000), wk = 0.0028986 k( 69) = ( 0.3703704 0.5132002 -0.0000000), wk = 0.0028986 k( 70) = ( 0.3641975 0.5238919 -0.0000000), wk = 0.0028986 k( 71) = ( 0.3580247 0.5345836 -0.0000000), wk = 0.0028986 k( 72) = ( 0.3518519 0.5452753 -0.0000000), wk = 0.0028986 k( 73) = ( 0.3456790 0.5559669 -0.0000000), wk = 0.0028986 k( 74) = ( 0.3395062 0.5666586 -0.0000000), wk = 0.0028986 k( 75) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0028986 k( 76) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0028986 k( 77) = ( 0.3270440 0.5664569 -0.0000000), wk = 0.0028986 k( 78) = ( 0.3207547 0.5555635 -0.0000000), wk = 0.0028986 k( 79) = ( 0.3144654 0.5446701 -0.0000000), wk = 0.0028986 k( 80) = ( 0.3081761 0.5337767 -0.0000000), wk = 0.0028986 k( 81) = ( 0.3018868 0.5228833 -0.0000000), wk = 0.0028986 k( 82) = ( 0.2955975 0.5119899 -0.0000000), wk = 0.0028986 k( 83) = ( 0.2893082 0.5010965 -0.0000000), wk = 0.0028986 k( 84) = ( 0.2830189 0.4902031 -0.0000000), wk = 0.0028986 k( 85) = ( 0.2767296 0.4793097 -0.0000000), wk = 0.0028986 k( 86) = ( 0.2704402 0.4684163 -0.0000000), wk = 0.0028986 k( 87) = ( 0.2641509 0.4575228 -0.0000000), wk = 0.0028986 k( 88) = ( 0.2578616 0.4466295 -0.0000000), wk = 0.0028986 k( 89) = ( 0.2515723 0.4357361 -0.0000000), wk = 0.0028986 k( 90) = ( 0.2452830 0.4248427 -0.0000000), wk = 0.0028986 k( 91) = ( 0.2389937 0.4139492 -0.0000000), wk = 0.0028986 k( 92) = ( 0.2327044 0.4030558 -0.0000000), wk = 0.0028986 k( 93) = ( 0.2264151 0.3921624 -0.0000000), wk = 0.0028986 k( 94) = ( 0.2201258 0.3812691 -0.0000000), wk = 0.0028986 k( 95) = ( 0.2138365 0.3703756 -0.0000000), wk = 0.0028986 k( 96) = ( 0.2075472 0.3594822 -0.0000000), wk = 0.0028986 k( 97) = ( 0.2012579 0.3485888 -0.0000000), wk = 0.0028986 k( 98) = ( 0.1949685 0.3376954 -0.0000000), wk = 0.0028986 k( 99) = ( 0.1886792 0.3268020 -0.0000000), wk = 0.0028986 k( 100) = ( 0.1823899 0.3159086 -0.0000000), wk = 0.0028986 k( 101) = ( 0.1761006 0.3050152 -0.0000000), wk = 0.0028986 k( 102) = ( 0.1698113 0.2941218 -0.0000000), wk = 0.0028986 k( 103) = ( 0.1635220 0.2832284 -0.0000000), wk = 0.0028986 k( 104) = ( 0.1572327 0.2723350 -0.0000000), wk = 0.0028986 k( 105) = ( 0.1509434 0.2614416 -0.0000000), wk = 0.0028986 k( 106) = ( 0.1446541 0.2505482 -0.0000000), wk = 0.0028986 k( 107) = ( 0.1383648 0.2396548 -0.0000000), wk = 0.0028986 k( 108) = ( 0.1320755 0.2287614 -0.0000000), wk = 0.0028986 k( 109) = ( 0.1257862 0.2178680 -0.0000000), wk = 0.0028986 k( 110) = ( 0.1194969 0.2069746 -0.0000000), wk = 0.0028986 k( 111) = ( 0.1132076 0.1960812 -0.0000000), wk = 0.0028986 k( 112) = ( 0.1069182 0.1851878 -0.0000000), wk = 0.0028986 k( 113) = ( 0.1006289 0.1742944 -0.0000000), wk = 0.0028986 k( 114) = ( 0.0943396 0.1634010 -0.0000000), wk = 0.0028986 k( 115) = ( 0.0880503 0.1525076 -0.0000000), wk = 0.0028986 k( 116) = ( 0.0817610 0.1416142 -0.0000000), wk = 0.0028986 k( 117) = ( 0.0754717 0.1307208 -0.0000000), wk = 0.0028986 k( 118) = ( 0.0691824 0.1198274 -0.0000000), wk = 0.0028986 k( 119) = ( 0.0628931 0.1089340 -0.0000000), wk = 0.0028986 k( 120) = ( 0.0566038 0.0980406 -0.0000000), wk = 0.0028986 k( 121) = ( 0.0503145 0.0871472 -0.0000000), wk = 0.0028986 k( 122) = ( 0.0440252 0.0762538 -0.0000000), wk = 0.0028986 k( 123) = ( 0.0377359 0.0653604 -0.0000000), wk = 0.0028986 k( 124) = ( 0.0314465 0.0544670 -0.0000000), wk = 0.0028986 k( 125) = ( 0.0251572 0.0435736 -0.0000000), wk = 0.0028986 k( 126) = ( 0.0188679 0.0326802 -0.0000000), wk = 0.0028986 k( 127) = ( 0.0125786 0.0217868 -0.0000000), wk = 0.0028986 k( 128) = ( 0.0062893 0.0108934 -0.0000000), wk = 0.0028986 k( 129) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 130) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 131) = ( 0.0000000 0.0000000 0.0125883), wk = 0.0028986 k( 132) = ( 0.0000000 0.0000000 0.0251767), wk = 0.0028986 k( 133) = ( 0.0000000 0.0000000 0.0377650), wk = 0.0028986 k( 134) = ( 0.0000000 0.0000000 0.0503534), wk = 0.0028986 k( 135) = ( 0.0000000 0.0000000 0.0629417), wk = 0.0028986 k( 136) = ( 0.0000000 0.0000000 0.0755300), wk = 0.0028986 k( 137) = ( 0.0000000 0.0000000 0.0881184), wk = 0.0028986 k( 138) = ( 0.0000000 0.0000000 0.1007067), wk = 0.0028986 k( 139) = ( 0.0000000 0.0000000 0.1132951), wk = 0.0028986 k( 140) = ( 0.0000000 0.0000000 0.1258834), wk = 0.0028986 k( 141) = ( 0.0000000 0.0000000 0.1384717), wk = 0.0028986 k( 142) = ( 0.0000000 0.0000000 0.1510601), wk = 0.0028986 k( 143) = ( 0.0000000 0.0000000 0.1636484), wk = 0.0028986 k( 144) = ( 0.0000000 0.0000000 0.1762367), wk = 0.0028986 k( 145) = ( 0.0000000 0.0000000 0.1888251), wk = 0.0028986 k( 146) = ( 0.0000000 0.0000000 0.2014134), wk = 0.0028986 k( 147) = ( 0.0000000 0.0000000 0.2140018), wk = 0.0028986 k( 148) = ( 0.0000000 0.0000000 0.2265901), wk = 0.0028986 k( 149) = ( 0.0000000 0.0000000 0.2391784), wk = 0.0028986 k( 150) = ( 0.0000000 0.0000000 0.2517668), wk = 0.0028986 k( 151) = ( 0.0000000 0.0000000 0.2643551), wk = 0.0028986 k( 152) = ( 0.0000000 0.0000000 0.2769435), wk = 0.0028986 k( 153) = ( 0.0000000 0.0000000 0.2895318), wk = 0.0028986 k( 154) = ( 0.0000000 0.0000000 0.3021201), wk = 0.0028986 k( 155) = ( 0.0000000 0.0000000 0.3147085), wk = 0.0028986 k( 156) = ( 0.0000000 0.0000000 0.3272968), wk = 0.0028986 k( 157) = ( 0.0000000 0.0000000 0.3398852), wk = 0.0028986 k( 158) = ( 0.0000000 0.0000000 0.3524735), wk = 0.0028986 k( 159) = ( 0.0000000 0.0000000 0.3524735), wk = 0.0028986 k( 160) = ( 0.0108696 0.0062755 0.3524735), wk = 0.0028986 k( 161) = ( 0.0217391 0.0125511 0.3524735), wk = 0.0028986 k( 162) = ( 0.0326087 0.0188266 0.3524735), wk = 0.0028986 k( 163) = ( 0.0434783 0.0251022 0.3524735), wk = 0.0028986 k( 164) = ( 0.0543478 0.0313777 0.3524735), wk = 0.0028986 k( 165) = ( 0.0652174 0.0376533 0.3524735), wk = 0.0028986 k( 166) = ( 0.0760870 0.0439288 0.3524735), wk = 0.0028986 k( 167) = ( 0.0869565 0.0502044 0.3524735), wk = 0.0028986 k( 168) = ( 0.0978261 0.0564799 0.3524735), wk = 0.0028986 k( 169) = ( 0.1086957 0.0627555 0.3524735), wk = 0.0028986 k( 170) = ( 0.1195652 0.0690310 0.3524735), wk = 0.0028986 k( 171) = ( 0.1304348 0.0753066 0.3524735), wk = 0.0028986 k( 172) = ( 0.1413043 0.0815821 0.3524735), wk = 0.0028986 k( 173) = ( 0.1521739 0.0878576 0.3524735), wk = 0.0028986 k( 174) = ( 0.1630435 0.0941332 0.3524735), wk = 0.0028986 k( 175) = ( 0.1739130 0.1004087 0.3524735), wk = 0.0028986 k( 176) = ( 0.1847826 0.1066843 0.3524735), wk = 0.0028986 k( 177) = ( 0.1956522 0.1129598 0.3524735), wk = 0.0028986 k( 178) = ( 0.2065217 0.1192354 0.3524735), wk = 0.0028986 k( 179) = ( 0.2173913 0.1255109 0.3524735), wk = 0.0028986 k( 180) = ( 0.2282609 0.1317865 0.3524735), wk = 0.0028986 k( 181) = ( 0.2391304 0.1380620 0.3524735), wk = 0.0028986 k( 182) = ( 0.2500000 0.1443376 0.3524735), wk = 0.0028986 k( 183) = ( 0.2608696 0.1506131 0.3524735), wk = 0.0028986 k( 184) = ( 0.2717391 0.1568887 0.3524735), wk = 0.0028986 k( 185) = ( 0.2826087 0.1631642 0.3524735), wk = 0.0028986 k( 186) = ( 0.2934783 0.1694398 0.3524735), wk = 0.0028986 k( 187) = ( 0.3043478 0.1757153 0.3524735), wk = 0.0028986 k( 188) = ( 0.3152174 0.1819908 0.3524735), wk = 0.0028986 k( 189) = ( 0.3260870 0.1882664 0.3524735), wk = 0.0028986 k( 190) = ( 0.3369565 0.1945419 0.3524735), wk = 0.0028986 k( 191) = ( 0.3478261 0.2008175 0.3524735), wk = 0.0028986 k( 192) = ( 0.3586956 0.2070930 0.3524735), wk = 0.0028986 k( 193) = ( 0.3695652 0.2133686 0.3524735), wk = 0.0028986 k( 194) = ( 0.3804348 0.2196441 0.3524735), wk = 0.0028986 k( 195) = ( 0.3913044 0.2259197 0.3524735), wk = 0.0028986 k( 196) = ( 0.4021739 0.2321952 0.3524735), wk = 0.0028986 k( 197) = ( 0.4130435 0.2384708 0.3524735), wk = 0.0028986 k( 198) = ( 0.4239130 0.2447463 0.3524735), wk = 0.0028986 k( 199) = ( 0.4347826 0.2510219 0.3524735), wk = 0.0028986 k( 200) = ( 0.4456522 0.2572974 0.3524735), wk = 0.0028986 k( 201) = ( 0.4565217 0.2635729 0.3524735), wk = 0.0028986 k( 202) = ( 0.4673913 0.2698485 0.3524735), wk = 0.0028986 k( 203) = ( 0.4782609 0.2761240 0.3524735), wk = 0.0028986 k( 204) = ( 0.4891304 0.2823996 0.3524735), wk = 0.0028986 k( 205) = ( 0.5000000 0.2886751 0.3524735), wk = 0.0028986 k( 206) = ( 0.5000000 0.2886751 0.3524735), wk = 0.0028986 k( 207) = ( 0.4938272 0.2993668 0.3524735), wk = 0.0028986 k( 208) = ( 0.4876543 0.3100585 0.3524735), wk = 0.0028986 k( 209) = ( 0.4814815 0.3207502 0.3524735), wk = 0.0028986 k( 210) = ( 0.4753086 0.3314418 0.3524735), wk = 0.0028986 k( 211) = ( 0.4691358 0.3421335 0.3524735), wk = 0.0028986 k( 212) = ( 0.4629630 0.3528252 0.3524735), wk = 0.0028986 k( 213) = ( 0.4567901 0.3635168 0.3524735), wk = 0.0028986 k( 214) = ( 0.4506173 0.3742085 0.3524735), wk = 0.0028986 k( 215) = ( 0.4444444 0.3849002 0.3524735), wk = 0.0028986 k( 216) = ( 0.4382716 0.3955918 0.3524735), wk = 0.0028986 k( 217) = ( 0.4320988 0.4062835 0.3524735), wk = 0.0028986 k( 218) = ( 0.4259259 0.4169752 0.3524735), wk = 0.0028986 k( 219) = ( 0.4197531 0.4276669 0.3524735), wk = 0.0028986 k( 220) = ( 0.4135802 0.4383585 0.3524735), wk = 0.0028986 k( 221) = ( 0.4074074 0.4490502 0.3524735), wk = 0.0028986 k( 222) = ( 0.4012346 0.4597419 0.3524735), wk = 0.0028986 k( 223) = ( 0.3950617 0.4704335 0.3524735), wk = 0.0028986 k( 224) = ( 0.3888889 0.4811252 0.3524735), wk = 0.0028986 k( 225) = ( 0.3827160 0.4918169 0.3524735), wk = 0.0028986 k( 226) = ( 0.3765432 0.5025086 0.3524735), wk = 0.0028986 k( 227) = ( 0.3703704 0.5132002 0.3524735), wk = 0.0028986 k( 228) = ( 0.3641975 0.5238919 0.3524735), wk = 0.0028986 k( 229) = ( 0.3580247 0.5345836 0.3524735), wk = 0.0028986 k( 230) = ( 0.3518519 0.5452753 0.3524735), wk = 0.0028986 k( 231) = ( 0.3456790 0.5559669 0.3524735), wk = 0.0028986 k( 232) = ( 0.3395062 0.5666586 0.3524735), wk = 0.0028986 k( 233) = ( 0.3333333 0.5773503 0.3524735), wk = 0.0028986 k( 234) = ( 0.3333333 0.5773503 0.3524735), wk = 0.0028986 k( 235) = ( 0.3270440 0.5664569 0.3524735), wk = 0.0028986 k( 236) = ( 0.3207547 0.5555635 0.3524735), wk = 0.0028986 k( 237) = ( 0.3144654 0.5446701 0.3524735), wk = 0.0028986 k( 238) = ( 0.3081761 0.5337767 0.3524735), wk = 0.0028986 k( 239) = ( 0.3018868 0.5228833 0.3524735), wk = 0.0028986 k( 240) = ( 0.2955975 0.5119899 0.3524735), wk = 0.0028986 k( 241) = ( 0.2893082 0.5010965 0.3524735), wk = 0.0028986 k( 242) = ( 0.2830189 0.4902031 0.3524735), wk = 0.0028986 k( 243) = ( 0.2767296 0.4793097 0.3524735), wk = 0.0028986 k( 244) = ( 0.2704402 0.4684163 0.3524735), wk = 0.0028986 k( 245) = ( 0.2641509 0.4575228 0.3524735), wk = 0.0028986 k( 246) = ( 0.2578616 0.4466295 0.3524735), wk = 0.0028986 k( 247) = ( 0.2515723 0.4357361 0.3524735), wk = 0.0028986 k( 248) = ( 0.2452830 0.4248427 0.3524735), wk = 0.0028986 k( 249) = ( 0.2389937 0.4139492 0.3524735), wk = 0.0028986 k( 250) = ( 0.2327044 0.4030558 0.3524735), wk = 0.0028986 k( 251) = ( 0.2264151 0.3921624 0.3524735), wk = 0.0028986 k( 252) = ( 0.2201258 0.3812691 0.3524735), wk = 0.0028986 k( 253) = ( 0.2138365 0.3703756 0.3524735), wk = 0.0028986 k( 254) = ( 0.2075472 0.3594822 0.3524735), wk = 0.0028986 k( 255) = ( 0.2012579 0.3485888 0.3524735), wk = 0.0028986 k( 256) = ( 0.1949685 0.3376954 0.3524735), wk = 0.0028986 k( 257) = ( 0.1886792 0.3268020 0.3524735), wk = 0.0028986 k( 258) = ( 0.1823899 0.3159086 0.3524735), wk = 0.0028986 k( 259) = ( 0.1761006 0.3050152 0.3524735), wk = 0.0028986 k( 260) = ( 0.1698113 0.2941218 0.3524735), wk = 0.0028986 k( 261) = ( 0.1635220 0.2832284 0.3524735), wk = 0.0028986 k( 262) = ( 0.1572327 0.2723350 0.3524735), wk = 0.0028986 k( 263) = ( 0.1509434 0.2614416 0.3524735), wk = 0.0028986 k( 264) = ( 0.1446541 0.2505482 0.3524735), wk = 0.0028986 k( 265) = ( 0.1383648 0.2396548 0.3524735), wk = 0.0028986 k( 266) = ( 0.1320755 0.2287614 0.3524735), wk = 0.0028986 k( 267) = ( 0.1257862 0.2178680 0.3524735), wk = 0.0028986 k( 268) = ( 0.1194969 0.2069746 0.3524735), wk = 0.0028986 k( 269) = ( 0.1132076 0.1960812 0.3524735), wk = 0.0028986 k( 270) = ( 0.1069182 0.1851878 0.3524735), wk = 0.0028986 k( 271) = ( 0.1006289 0.1742944 0.3524735), wk = 0.0028986 k( 272) = ( 0.0943396 0.1634010 0.3524735), wk = 0.0028986 k( 273) = ( 0.0880503 0.1525076 0.3524735), wk = 0.0028986 k( 274) = ( 0.0817610 0.1416142 0.3524735), wk = 0.0028986 k( 275) = ( 0.0754717 0.1307208 0.3524735), wk = 0.0028986 k( 276) = ( 0.0691824 0.1198274 0.3524735), wk = 0.0028986 k( 277) = ( 0.0628931 0.1089340 0.3524735), wk = 0.0028986 k( 278) = ( 0.0566038 0.0980406 0.3524735), wk = 0.0028986 k( 279) = ( 0.0503145 0.0871472 0.3524735), wk = 0.0028986 k( 280) = ( 0.0440252 0.0762538 0.3524735), wk = 0.0028986 k( 281) = ( 0.0377359 0.0653604 0.3524735), wk = 0.0028986 k( 282) = ( 0.0314465 0.0544670 0.3524735), wk = 0.0028986 k( 283) = ( 0.0251572 0.0435736 0.3524735), wk = 0.0028986 k( 284) = ( 0.0188679 0.0326802 0.3524735), wk = 0.0028986 k( 285) = ( 0.0125786 0.0217868 0.3524735), wk = 0.0028986 k( 286) = ( 0.0062893 0.0108934 0.3524735), wk = 0.0028986 k( 287) = ( 0.0000000 0.0000000 0.3524735), wk = 0.0028986 k( 288) = ( 0.5000000 0.2886751 0.3524735), wk = 0.0028986 k( 289) = ( 0.5000000 0.2886751 0.3398852), wk = 0.0028986 k( 290) = ( 0.5000000 0.2886751 0.3272968), wk = 0.0028986 k( 291) = ( 0.5000000 0.2886751 0.3147085), wk = 0.0028986 k( 292) = ( 0.5000000 0.2886751 0.3021201), wk = 0.0028986 k( 293) = ( 0.5000000 0.2886751 0.2895318), wk = 0.0028986 k( 294) = ( 0.5000000 0.2886751 0.2769435), wk = 0.0028986 k( 295) = ( 0.5000000 0.2886751 0.2643551), wk = 0.0028986 k( 296) = ( 0.5000000 0.2886751 0.2517668), wk = 0.0028986 k( 297) = ( 0.5000000 0.2886751 0.2391784), wk = 0.0028986 k( 298) = ( 0.5000000 0.2886751 0.2265901), wk = 0.0028986 k( 299) = ( 0.5000000 0.2886751 0.2140018), wk = 0.0028986 k( 300) = ( 0.5000000 0.2886751 0.2014134), wk = 0.0028986 k( 301) = ( 0.5000000 0.2886751 0.1888251), wk = 0.0028986 k( 302) = ( 0.5000000 0.2886751 0.1762367), wk = 0.0028986 k( 303) = ( 0.5000000 0.2886751 0.1636484), wk = 0.0028986 k( 304) = ( 0.5000000 0.2886751 0.1510601), wk = 0.0028986 k( 305) = ( 0.5000000 0.2886751 0.1384717), wk = 0.0028986 k( 306) = ( 0.5000000 0.2886751 0.1258834), wk = 0.0028986 k( 307) = ( 0.5000000 0.2886751 0.1132951), wk = 0.0028986 k( 308) = ( 0.5000000 0.2886751 0.1007067), wk = 0.0028986 k( 309) = ( 0.5000000 0.2886751 0.0881184), wk = 0.0028986 k( 310) = ( 0.5000000 0.2886751 0.0755300), wk = 0.0028986 k( 311) = ( 0.5000000 0.2886751 0.0629417), wk = 0.0028986 k( 312) = ( 0.5000000 0.2886751 0.0503534), wk = 0.0028986 k( 313) = ( 0.5000000 0.2886751 0.0377650), wk = 0.0028986 k( 314) = ( 0.5000000 0.2886751 0.0251767), wk = 0.0028986 k( 315) = ( 0.5000000 0.2886751 0.0125883), wk = 0.0028986 k( 316) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0028986 k( 317) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0028986 k( 318) = ( 0.3333333 0.5773503 0.0125883), wk = 0.0028986 k( 319) = ( 0.3333333 0.5773503 0.0251767), wk = 0.0028986 k( 320) = ( 0.3333333 0.5773503 0.0377650), wk = 0.0028986 k( 321) = ( 0.3333333 0.5773503 0.0503534), wk = 0.0028986 k( 322) = ( 0.3333333 0.5773503 0.0629417), wk = 0.0028986 k( 323) = ( 0.3333333 0.5773503 0.0755300), wk = 0.0028986 k( 324) = ( 0.3333333 0.5773503 0.0881184), wk = 0.0028986 k( 325) = ( 0.3333333 0.5773503 0.1007067), wk = 0.0028986 k( 326) = ( 0.3333333 0.5773503 0.1132951), wk = 0.0028986 k( 327) = ( 0.3333333 0.5773503 0.1258834), wk = 0.0028986 k( 328) = ( 0.3333333 0.5773503 0.1384717), wk = 0.0028986 k( 329) = ( 0.3333333 0.5773503 0.1510601), wk = 0.0028986 k( 330) = ( 0.3333333 0.5773503 0.1636484), wk = 0.0028986 k( 331) = ( 0.3333333 0.5773503 0.1762367), wk = 0.0028986 k( 332) = ( 0.3333333 0.5773503 0.1888251), wk = 0.0028986 k( 333) = ( 0.3333333 0.5773503 0.2014134), wk = 0.0028986 k( 334) = ( 0.3333333 0.5773503 0.2140018), wk = 0.0028986 k( 335) = ( 0.3333333 0.5773503 0.2265901), wk = 0.0028986 k( 336) = ( 0.3333333 0.5773503 0.2391784), wk = 0.0028986 k( 337) = ( 0.3333333 0.5773503 0.2517668), wk = 0.0028986 k( 338) = ( 0.3333333 0.5773503 0.2643551), wk = 0.0028986 k( 339) = ( 0.3333333 0.5773503 0.2769435), wk = 0.0028986 k( 340) = ( 0.3333333 0.5773503 0.2895318), wk = 0.0028986 k( 341) = ( 0.3333333 0.5773503 0.3021201), wk = 0.0028986 k( 342) = ( 0.3333333 0.5773503 0.3147085), wk = 0.0028986 k( 343) = ( 0.3333333 0.5773503 0.3272968), wk = 0.0028986 k( 344) = ( 0.3333333 0.5773503 0.3398852), wk = 0.0028986 k( 345) = ( 0.3333333 0.5773503 0.3524735), wk = 0.0028986 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 2) = ( 0.0108696 0.0000000 -0.0000000), wk = 0.0028986 k( 3) = ( 0.0217391 0.0000000 -0.0000000), wk = 0.0028986 k( 4) = ( 0.0326087 -0.0000000 -0.0000000), wk = 0.0028986 k( 5) = ( 0.0434783 0.0000000 -0.0000000), wk = 0.0028986 k( 6) = ( 0.0543478 0.0000000 -0.0000000), wk = 0.0028986 k( 7) = ( 0.0652174 -0.0000000 -0.0000000), wk = 0.0028986 k( 8) = ( 0.0760870 0.0000000 -0.0000000), wk = 0.0028986 k( 9) = ( 0.0869565 0.0000000 -0.0000000), wk = 0.0028986 k( 10) = ( 0.0978261 0.0000000 -0.0000000), wk = 0.0028986 k( 11) = ( 0.1086957 0.0000000 -0.0000000), wk = 0.0028986 k( 12) = ( 0.1195652 0.0000000 -0.0000000), wk = 0.0028986 k( 13) = ( 0.1304348 -0.0000000 -0.0000000), wk = 0.0028986 k( 14) = ( 0.1413043 0.0000000 -0.0000000), wk = 0.0028986 k( 15) = ( 0.1521739 0.0000000 -0.0000000), wk = 0.0028986 k( 16) = ( 0.1630435 0.0000000 -0.0000000), wk = 0.0028986 k( 17) = ( 0.1739130 0.0000000 -0.0000000), wk = 0.0028986 k( 18) = ( 0.1847826 0.0000000 -0.0000000), wk = 0.0028986 k( 19) = ( 0.1956522 0.0000000 0.0000000), wk = 0.0028986 k( 20) = ( 0.2065217 0.0000000 -0.0000000), wk = 0.0028986 k( 21) = ( 0.2173913 0.0000000 -0.0000000), wk = 0.0028986 k( 22) = ( 0.2282609 0.0000000 -0.0000000), wk = 0.0028986 k( 23) = ( 0.2391304 0.0000000 0.0000000), wk = 0.0028986 k( 24) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0028986 k( 25) = ( 0.2608696 0.0000000 -0.0000000), wk = 0.0028986 k( 26) = ( 0.2717391 -0.0000000 -0.0000000), wk = 0.0028986 k( 27) = ( 0.2826087 0.0000000 -0.0000000), wk = 0.0028986 k( 28) = ( 0.2934783 0.0000000 0.0000000), wk = 0.0028986 k( 29) = ( 0.3043478 0.0000000 0.0000000), wk = 0.0028986 k( 30) = ( 0.3152174 0.0000000 -0.0000000), wk = 0.0028986 k( 31) = ( 0.3260870 0.0000000 -0.0000000), wk = 0.0028986 k( 32) = ( 0.3369565 0.0000000 -0.0000000), wk = 0.0028986 k( 33) = ( 0.3478261 0.0000000 0.0000000), wk = 0.0028986 k( 34) = ( 0.3586956 0.0000000 -0.0000000), wk = 0.0028986 k( 35) = ( 0.3695652 0.0000000 -0.0000000), wk = 0.0028986 k( 36) = ( 0.3804348 0.0000000 -0.0000000), wk = 0.0028986 k( 37) = ( 0.3913044 0.0000000 -0.0000000), wk = 0.0028986 k( 38) = ( 0.4021739 0.0000000 0.0000000), wk = 0.0028986 k( 39) = ( 0.4130435 0.0000000 -0.0000000), wk = 0.0028986 k( 40) = ( 0.4239130 0.0000000 -0.0000000), wk = 0.0028986 k( 41) = ( 0.4347826 0.0000000 0.0000000), wk = 0.0028986 k( 42) = ( 0.4456522 0.0000000 -0.0000000), wk = 0.0028986 k( 43) = ( 0.4565217 0.0000000 -0.0000000), wk = 0.0028986 k( 44) = ( 0.4673913 0.0000000 -0.0000000), wk = 0.0028986 k( 45) = ( 0.4782609 0.0000000 -0.0000000), wk = 0.0028986 k( 46) = ( 0.4891304 0.0000000 -0.0000000), wk = 0.0028986 k( 47) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0028986 k( 48) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0028986 k( 49) = ( 0.4938272 0.0123457 -0.0000000), wk = 0.0028986 k( 50) = ( 0.4876543 0.0246914 -0.0000000), wk = 0.0028986 k( 51) = ( 0.4814815 0.0370370 -0.0000000), wk = 0.0028986 k( 52) = ( 0.4753086 0.0493827 0.0000000), wk = 0.0028986 k( 53) = ( 0.4691358 0.0617284 -0.0000000), wk = 0.0028986 k( 54) = ( 0.4629630 0.0740741 -0.0000000), wk = 0.0028986 k( 55) = ( 0.4567901 0.0864198 -0.0000000), wk = 0.0028986 k( 56) = ( 0.4506173 0.0987654 0.0000000), wk = 0.0028986 k( 57) = ( 0.4444444 0.1111111 -0.0000000), wk = 0.0028986 k( 58) = ( 0.4382716 0.1234568 -0.0000000), wk = 0.0028986 k( 59) = ( 0.4320988 0.1358025 -0.0000000), wk = 0.0028986 k( 60) = ( 0.4259259 0.1481482 -0.0000000), wk = 0.0028986 k( 61) = ( 0.4197531 0.1604938 -0.0000000), wk = 0.0028986 k( 62) = ( 0.4135802 0.1728395 -0.0000000), wk = 0.0028986 k( 63) = ( 0.4074074 0.1851852 -0.0000000), wk = 0.0028986 k( 64) = ( 0.4012346 0.1975309 0.0000000), wk = 0.0028986 k( 65) = ( 0.3950617 0.2098765 -0.0000000), wk = 0.0028986 k( 66) = ( 0.3888889 0.2222222 -0.0000000), wk = 0.0028986 k( 67) = ( 0.3827160 0.2345679 -0.0000000), wk = 0.0028986 k( 68) = ( 0.3765432 0.2469136 -0.0000000), wk = 0.0028986 k( 69) = ( 0.3703704 0.2592593 0.0000000), wk = 0.0028986 k( 70) = ( 0.3641975 0.2716049 -0.0000000), wk = 0.0028986 k( 71) = ( 0.3580247 0.2839506 0.0000000), wk = 0.0028986 k( 72) = ( 0.3518519 0.2962963 -0.0000000), wk = 0.0028986 k( 73) = ( 0.3456790 0.3086420 0.0000000), wk = 0.0028986 k( 74) = ( 0.3395062 0.3209877 0.0000000), wk = 0.0028986 k( 75) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0028986 k( 76) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0028986 k( 77) = ( 0.3270440 0.3270440 0.0000000), wk = 0.0028986 k( 78) = ( 0.3207547 0.3207547 0.0000000), wk = 0.0028986 k( 79) = ( 0.3144654 0.3144654 0.0000000), wk = 0.0028986 k( 80) = ( 0.3081761 0.3081761 0.0000000), wk = 0.0028986 k( 81) = ( 0.3018868 0.3018868 0.0000000), wk = 0.0028986 k( 82) = ( 0.2955975 0.2955975 0.0000000), wk = 0.0028986 k( 83) = ( 0.2893082 0.2893082 0.0000000), wk = 0.0028986 k( 84) = ( 0.2830189 0.2830189 0.0000000), wk = 0.0028986 k( 85) = ( 0.2767296 0.2767296 0.0000000), wk = 0.0028986 k( 86) = ( 0.2704402 0.2704403 0.0000000), wk = 0.0028986 k( 87) = ( 0.2641509 0.2641509 0.0000000), wk = 0.0028986 k( 88) = ( 0.2578616 0.2578616 -0.0000000), wk = 0.0028986 k( 89) = ( 0.2515723 0.2515723 -0.0000000), wk = 0.0028986 k( 90) = ( 0.2452830 0.2452830 -0.0000000), wk = 0.0028986 k( 91) = ( 0.2389937 0.2389937 -0.0000000), wk = 0.0028986 k( 92) = ( 0.2327044 0.2327044 -0.0000000), wk = 0.0028986 k( 93) = ( 0.2264151 0.2264151 0.0000000), wk = 0.0028986 k( 94) = ( 0.2201258 0.2201258 0.0000000), wk = 0.0028986 k( 95) = ( 0.2138365 0.2138365 0.0000000), wk = 0.0028986 k( 96) = ( 0.2075472 0.2075472 0.0000000), wk = 0.0028986 k( 97) = ( 0.2012579 0.2012579 -0.0000000), wk = 0.0028986 k( 98) = ( 0.1949685 0.1949686 0.0000000), wk = 0.0028986 k( 99) = ( 0.1886792 0.1886793 -0.0000000), wk = 0.0028986 k( 100) = ( 0.1823899 0.1823899 -0.0000000), wk = 0.0028986 k( 101) = ( 0.1761006 0.1761006 0.0000000), wk = 0.0028986 k( 102) = ( 0.1698113 0.1698113 -0.0000000), wk = 0.0028986 k( 103) = ( 0.1635220 0.1635220 0.0000000), wk = 0.0028986 k( 104) = ( 0.1572327 0.1572327 -0.0000000), wk = 0.0028986 k( 105) = ( 0.1509434 0.1509434 0.0000000), wk = 0.0028986 k( 106) = ( 0.1446541 0.1446541 0.0000000), wk = 0.0028986 k( 107) = ( 0.1383648 0.1383648 0.0000000), wk = 0.0028986 k( 108) = ( 0.1320755 0.1320755 0.0000000), wk = 0.0028986 k( 109) = ( 0.1257862 0.1257862 0.0000000), wk = 0.0028986 k( 110) = ( 0.1194969 0.1194969 -0.0000000), wk = 0.0028986 k( 111) = ( 0.1132076 0.1132076 0.0000000), wk = 0.0028986 k( 112) = ( 0.1069182 0.1069182 0.0000000), wk = 0.0028986 k( 113) = ( 0.1006289 0.1006289 -0.0000000), wk = 0.0028986 k( 114) = ( 0.0943396 0.0943396 0.0000000), wk = 0.0028986 k( 115) = ( 0.0880503 0.0880503 0.0000000), wk = 0.0028986 k( 116) = ( 0.0817610 0.0817610 -0.0000000), wk = 0.0028986 k( 117) = ( 0.0754717 0.0754717 0.0000000), wk = 0.0028986 k( 118) = ( 0.0691824 0.0691824 0.0000000), wk = 0.0028986 k( 119) = ( 0.0628931 0.0628931 0.0000000), wk = 0.0028986 k( 120) = ( 0.0566038 0.0566038 -0.0000000), wk = 0.0028986 k( 121) = ( 0.0503145 0.0503145 -0.0000000), wk = 0.0028986 k( 122) = ( 0.0440252 0.0440252 0.0000000), wk = 0.0028986 k( 123) = ( 0.0377359 0.0377359 0.0000000), wk = 0.0028986 k( 124) = ( 0.0314465 0.0314465 0.0000000), wk = 0.0028986 k( 125) = ( 0.0251572 0.0251572 -0.0000000), wk = 0.0028986 k( 126) = ( 0.0188679 0.0188679 -0.0000000), wk = 0.0028986 k( 127) = ( 0.0125786 0.0125786 0.0000000), wk = 0.0028986 k( 128) = ( 0.0062893 0.0062893 0.0000000), wk = 0.0028986 k( 129) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 130) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 131) = ( 0.0000000 0.0000000 0.0178571), wk = 0.0028986 k( 132) = ( 0.0000000 0.0000000 0.0357143), wk = 0.0028986 k( 133) = ( 0.0000000 0.0000000 0.0535714), wk = 0.0028986 k( 134) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0028986 k( 135) = ( 0.0000000 0.0000000 0.0892857), wk = 0.0028986 k( 136) = ( 0.0000000 0.0000000 0.1071429), wk = 0.0028986 k( 137) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0028986 k( 138) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0028986 k( 139) = ( 0.0000000 0.0000000 0.1607143), wk = 0.0028986 k( 140) = ( 0.0000000 0.0000000 0.1785714), wk = 0.0028986 k( 141) = ( 0.0000000 0.0000000 0.1964286), wk = 0.0028986 k( 142) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0028986 k( 143) = ( 0.0000000 0.0000000 0.2321429), wk = 0.0028986 k( 144) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0028986 k( 145) = ( 0.0000000 0.0000000 0.2678571), wk = 0.0028986 k( 146) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0028986 k( 147) = ( 0.0000000 0.0000000 0.3035714), wk = 0.0028986 k( 148) = ( 0.0000000 0.0000000 0.3214286), wk = 0.0028986 k( 149) = ( 0.0000000 0.0000000 0.3392857), wk = 0.0028986 k( 150) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0028986 k( 151) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0028986 k( 152) = ( 0.0000000 0.0000000 0.3928571), wk = 0.0028986 k( 153) = ( 0.0000000 0.0000000 0.4107143), wk = 0.0028986 k( 154) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0028986 k( 155) = ( 0.0000000 0.0000000 0.4464286), wk = 0.0028986 k( 156) = ( 0.0000000 0.0000000 0.4642857), wk = 0.0028986 k( 157) = ( 0.0000000 0.0000000 0.4821429), wk = 0.0028986 k( 158) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028986 k( 159) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028986 k( 160) = ( 0.0108696 0.0000000 0.5000000), wk = 0.0028986 k( 161) = ( 0.0217391 0.0000000 0.5000000), wk = 0.0028986 k( 162) = ( 0.0326087 -0.0000000 0.5000000), wk = 0.0028986 k( 163) = ( 0.0434783 0.0000000 0.5000000), wk = 0.0028986 k( 164) = ( 0.0543478 0.0000000 0.5000000), wk = 0.0028986 k( 165) = ( 0.0652174 -0.0000000 0.5000000), wk = 0.0028986 k( 166) = ( 0.0760870 0.0000000 0.5000000), wk = 0.0028986 k( 167) = ( 0.0869565 0.0000000 0.5000000), wk = 0.0028986 k( 168) = ( 0.0978261 0.0000000 0.5000000), wk = 0.0028986 k( 169) = ( 0.1086957 0.0000000 0.5000000), wk = 0.0028986 k( 170) = ( 0.1195652 0.0000000 0.5000000), wk = 0.0028986 k( 171) = ( 0.1304348 -0.0000000 0.5000000), wk = 0.0028986 k( 172) = ( 0.1413043 0.0000000 0.5000000), wk = 0.0028986 k( 173) = ( 0.1521739 0.0000000 0.5000000), wk = 0.0028986 k( 174) = ( 0.1630435 0.0000000 0.5000000), wk = 0.0028986 k( 175) = ( 0.1739130 0.0000000 0.5000000), wk = 0.0028986 k( 176) = ( 0.1847826 0.0000000 0.5000000), wk = 0.0028986 k( 177) = ( 0.1956522 0.0000000 0.5000000), wk = 0.0028986 k( 178) = ( 0.2065217 0.0000000 0.5000000), wk = 0.0028986 k( 179) = ( 0.2173913 0.0000000 0.5000000), wk = 0.0028986 k( 180) = ( 0.2282609 0.0000000 0.5000000), wk = 0.0028986 k( 181) = ( 0.2391304 0.0000000 0.5000000), wk = 0.0028986 k( 182) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0028986 k( 183) = ( 0.2608696 0.0000000 0.5000000), wk = 0.0028986 k( 184) = ( 0.2717391 -0.0000000 0.5000000), wk = 0.0028986 k( 185) = ( 0.2826087 0.0000000 0.5000000), wk = 0.0028986 k( 186) = ( 0.2934783 0.0000000 0.5000000), wk = 0.0028986 k( 187) = ( 0.3043478 0.0000000 0.5000000), wk = 0.0028986 k( 188) = ( 0.3152174 0.0000000 0.5000000), wk = 0.0028986 k( 189) = ( 0.3260870 0.0000000 0.5000000), wk = 0.0028986 k( 190) = ( 0.3369565 0.0000000 0.5000000), wk = 0.0028986 k( 191) = ( 0.3478261 0.0000000 0.5000000), wk = 0.0028986 k( 192) = ( 0.3586956 0.0000000 0.5000000), wk = 0.0028986 k( 193) = ( 0.3695652 0.0000000 0.5000000), wk = 0.0028986 k( 194) = ( 0.3804348 0.0000000 0.5000000), wk = 0.0028986 k( 195) = ( 0.3913044 0.0000000 0.5000000), wk = 0.0028986 k( 196) = ( 0.4021739 0.0000000 0.5000000), wk = 0.0028986 k( 197) = ( 0.4130435 0.0000000 0.5000000), wk = 0.0028986 k( 198) = ( 0.4239130 0.0000000 0.5000000), wk = 0.0028986 k( 199) = ( 0.4347826 0.0000000 0.5000000), wk = 0.0028986 k( 200) = ( 0.4456522 0.0000000 0.5000000), wk = 0.0028986 k( 201) = ( 0.4565217 0.0000000 0.5000000), wk = 0.0028986 k( 202) = ( 0.4673913 0.0000000 0.5000000), wk = 0.0028986 k( 203) = ( 0.4782609 0.0000000 0.5000000), wk = 0.0028986 k( 204) = ( 0.4891304 0.0000000 0.5000000), wk = 0.0028986 k( 205) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028986 k( 206) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028986 k( 207) = ( 0.4938272 0.0123457 0.5000000), wk = 0.0028986 k( 208) = ( 0.4876543 0.0246914 0.5000000), wk = 0.0028986 k( 209) = ( 0.4814815 0.0370370 0.5000000), wk = 0.0028986 k( 210) = ( 0.4753086 0.0493827 0.5000000), wk = 0.0028986 k( 211) = ( 0.4691358 0.0617284 0.5000000), wk = 0.0028986 k( 212) = ( 0.4629630 0.0740741 0.5000000), wk = 0.0028986 k( 213) = ( 0.4567901 0.0864198 0.5000000), wk = 0.0028986 k( 214) = ( 0.4506173 0.0987654 0.5000000), wk = 0.0028986 k( 215) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0028986 k( 216) = ( 0.4382716 0.1234568 0.5000000), wk = 0.0028986 k( 217) = ( 0.4320988 0.1358025 0.5000000), wk = 0.0028986 k( 218) = ( 0.4259259 0.1481482 0.5000000), wk = 0.0028986 k( 219) = ( 0.4197531 0.1604938 0.5000000), wk = 0.0028986 k( 220) = ( 0.4135802 0.1728395 0.5000000), wk = 0.0028986 k( 221) = ( 0.4074074 0.1851852 0.5000000), wk = 0.0028986 k( 222) = ( 0.4012346 0.1975309 0.5000000), wk = 0.0028986 k( 223) = ( 0.3950617 0.2098765 0.5000000), wk = 0.0028986 k( 224) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0028986 k( 225) = ( 0.3827160 0.2345679 0.5000000), wk = 0.0028986 k( 226) = ( 0.3765432 0.2469136 0.5000000), wk = 0.0028986 k( 227) = ( 0.3703704 0.2592593 0.5000000), wk = 0.0028986 k( 228) = ( 0.3641975 0.2716049 0.5000000), wk = 0.0028986 k( 229) = ( 0.3580247 0.2839506 0.5000000), wk = 0.0028986 k( 230) = ( 0.3518519 0.2962963 0.5000000), wk = 0.0028986 k( 231) = ( 0.3456790 0.3086420 0.5000000), wk = 0.0028986 k( 232) = ( 0.3395062 0.3209877 0.5000000), wk = 0.0028986 k( 233) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0028986 k( 234) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0028986 k( 235) = ( 0.3270440 0.3270440 0.5000000), wk = 0.0028986 k( 236) = ( 0.3207547 0.3207547 0.5000000), wk = 0.0028986 k( 237) = ( 0.3144654 0.3144654 0.5000000), wk = 0.0028986 k( 238) = ( 0.3081761 0.3081761 0.5000000), wk = 0.0028986 k( 239) = ( 0.3018868 0.3018868 0.5000000), wk = 0.0028986 k( 240) = ( 0.2955975 0.2955975 0.5000000), wk = 0.0028986 k( 241) = ( 0.2893082 0.2893082 0.5000000), wk = 0.0028986 k( 242) = ( 0.2830189 0.2830189 0.5000000), wk = 0.0028986 k( 243) = ( 0.2767296 0.2767296 0.5000000), wk = 0.0028986 k( 244) = ( 0.2704402 0.2704403 0.5000000), wk = 0.0028986 k( 245) = ( 0.2641509 0.2641509 0.5000000), wk = 0.0028986 k( 246) = ( 0.2578616 0.2578616 0.5000000), wk = 0.0028986 k( 247) = ( 0.2515723 0.2515723 0.5000000), wk = 0.0028986 k( 248) = ( 0.2452830 0.2452830 0.5000000), wk = 0.0028986 k( 249) = ( 0.2389937 0.2389937 0.5000000), wk = 0.0028986 k( 250) = ( 0.2327044 0.2327044 0.5000000), wk = 0.0028986 k( 251) = ( 0.2264151 0.2264151 0.5000000), wk = 0.0028986 k( 252) = ( 0.2201258 0.2201258 0.5000000), wk = 0.0028986 k( 253) = ( 0.2138365 0.2138365 0.5000000), wk = 0.0028986 k( 254) = ( 0.2075472 0.2075472 0.5000000), wk = 0.0028986 k( 255) = ( 0.2012579 0.2012579 0.5000000), wk = 0.0028986 k( 256) = ( 0.1949685 0.1949686 0.5000000), wk = 0.0028986 k( 257) = ( 0.1886792 0.1886793 0.5000000), wk = 0.0028986 k( 258) = ( 0.1823899 0.1823899 0.5000000), wk = 0.0028986 k( 259) = ( 0.1761006 0.1761006 0.5000000), wk = 0.0028986 k( 260) = ( 0.1698113 0.1698113 0.5000000), wk = 0.0028986 k( 261) = ( 0.1635220 0.1635220 0.5000000), wk = 0.0028986 k( 262) = ( 0.1572327 0.1572327 0.5000000), wk = 0.0028986 k( 263) = ( 0.1509434 0.1509434 0.5000000), wk = 0.0028986 k( 264) = ( 0.1446541 0.1446541 0.5000000), wk = 0.0028986 k( 265) = ( 0.1383648 0.1383648 0.5000000), wk = 0.0028986 k( 266) = ( 0.1320755 0.1320755 0.5000000), wk = 0.0028986 k( 267) = ( 0.1257862 0.1257862 0.5000000), wk = 0.0028986 k( 268) = ( 0.1194969 0.1194969 0.5000000), wk = 0.0028986 k( 269) = ( 0.1132076 0.1132076 0.5000000), wk = 0.0028986 k( 270) = ( 0.1069182 0.1069182 0.5000000), wk = 0.0028986 k( 271) = ( 0.1006289 0.1006289 0.5000000), wk = 0.0028986 k( 272) = ( 0.0943396 0.0943396 0.5000000), wk = 0.0028986 k( 273) = ( 0.0880503 0.0880503 0.5000000), wk = 0.0028986 k( 274) = ( 0.0817610 0.0817610 0.5000000), wk = 0.0028986 k( 275) = ( 0.0754717 0.0754717 0.5000000), wk = 0.0028986 k( 276) = ( 0.0691824 0.0691824 0.5000000), wk = 0.0028986 k( 277) = ( 0.0628931 0.0628931 0.5000000), wk = 0.0028986 k( 278) = ( 0.0566038 0.0566038 0.5000000), wk = 0.0028986 k( 279) = ( 0.0503145 0.0503145 0.5000000), wk = 0.0028986 k( 280) = ( 0.0440252 0.0440252 0.5000000), wk = 0.0028986 k( 281) = ( 0.0377359 0.0377359 0.5000000), wk = 0.0028986 k( 282) = ( 0.0314465 0.0314465 0.5000000), wk = 0.0028986 k( 283) = ( 0.0251572 0.0251572 0.5000000), wk = 0.0028986 k( 284) = ( 0.0188679 0.0188679 0.5000000), wk = 0.0028986 k( 285) = ( 0.0125786 0.0125786 0.5000000), wk = 0.0028986 k( 286) = ( 0.0062893 0.0062893 0.5000000), wk = 0.0028986 k( 287) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028986 k( 288) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028986 k( 289) = ( 0.5000000 0.0000000 0.4821429), wk = 0.0028986 k( 290) = ( 0.5000000 0.0000000 0.4642857), wk = 0.0028986 k( 291) = ( 0.5000000 0.0000000 0.4464286), wk = 0.0028986 k( 292) = ( 0.5000000 0.0000000 0.4285714), wk = 0.0028986 k( 293) = ( 0.5000000 0.0000000 0.4107143), wk = 0.0028986 k( 294) = ( 0.5000000 0.0000000 0.3928571), wk = 0.0028986 k( 295) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0028986 k( 296) = ( 0.5000000 0.0000000 0.3571429), wk = 0.0028986 k( 297) = ( 0.5000000 0.0000000 0.3392857), wk = 0.0028986 k( 298) = ( 0.5000000 0.0000000 0.3214286), wk = 0.0028986 k( 299) = ( 0.5000000 0.0000000 0.3035714), wk = 0.0028986 k( 300) = ( 0.5000000 0.0000000 0.2857143), wk = 0.0028986 k( 301) = ( 0.5000000 0.0000000 0.2678571), wk = 0.0028986 k( 302) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0028986 k( 303) = ( 0.5000000 0.0000000 0.2321429), wk = 0.0028986 k( 304) = ( 0.5000000 0.0000000 0.2142857), wk = 0.0028986 k( 305) = ( 0.5000000 0.0000000 0.1964286), wk = 0.0028986 k( 306) = ( 0.5000000 0.0000000 0.1785714), wk = 0.0028986 k( 307) = ( 0.5000000 0.0000000 0.1607143), wk = 0.0028986 k( 308) = ( 0.5000000 0.0000000 0.1428571), wk = 0.0028986 k( 309) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0028986 k( 310) = ( 0.5000000 0.0000000 0.1071429), wk = 0.0028986 k( 311) = ( 0.5000000 0.0000000 0.0892857), wk = 0.0028986 k( 312) = ( 0.5000000 0.0000000 0.0714286), wk = 0.0028986 k( 313) = ( 0.5000000 0.0000000 0.0535714), wk = 0.0028986 k( 314) = ( 0.5000000 0.0000000 0.0357143), wk = 0.0028986 k( 315) = ( 0.5000000 0.0000000 0.0178571), wk = 0.0028986 k( 316) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0028986 k( 317) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0028986 k( 318) = ( 0.3333333 0.3333333 0.0178571), wk = 0.0028986 k( 319) = ( 0.3333333 0.3333333 0.0357143), wk = 0.0028986 k( 320) = ( 0.3333333 0.3333333 0.0535714), wk = 0.0028986 k( 321) = ( 0.3333333 0.3333333 0.0714286), wk = 0.0028986 k( 322) = ( 0.3333333 0.3333333 0.0892857), wk = 0.0028986 k( 323) = ( 0.3333333 0.3333333 0.1071429), wk = 0.0028986 k( 324) = ( 0.3333333 0.3333333 0.1250000), wk = 0.0028986 k( 325) = ( 0.3333333 0.3333333 0.1428571), wk = 0.0028986 k( 326) = ( 0.3333333 0.3333333 0.1607143), wk = 0.0028986 k( 327) = ( 0.3333333 0.3333333 0.1785714), wk = 0.0028986 k( 328) = ( 0.3333333 0.3333333 0.1964286), wk = 0.0028986 k( 329) = ( 0.3333333 0.3333333 0.2142857), wk = 0.0028986 k( 330) = ( 0.3333333 0.3333333 0.2321429), wk = 0.0028986 k( 331) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0028986 k( 332) = ( 0.3333333 0.3333333 0.2678571), wk = 0.0028986 k( 333) = ( 0.3333333 0.3333333 0.2857143), wk = 0.0028986 k( 334) = ( 0.3333333 0.3333333 0.3035714), wk = 0.0028986 k( 335) = ( 0.3333333 0.3333333 0.3214286), wk = 0.0028986 k( 336) = ( 0.3333333 0.3333333 0.3392857), wk = 0.0028986 k( 337) = ( 0.3333333 0.3333333 0.3571429), wk = 0.0028986 k( 338) = ( 0.3333333 0.3333333 0.3750000), wk = 0.0028986 k( 339) = ( 0.3333333 0.3333333 0.3928571), wk = 0.0028986 k( 340) = ( 0.3333333 0.3333333 0.4107143), wk = 0.0028986 k( 341) = ( 0.3333333 0.3333333 0.4285714), wk = 0.0028986 k( 342) = ( 0.3333333 0.3333333 0.4464286), wk = 0.0028986 k( 343) = ( 0.3333333 0.3333333 0.4642857), wk = 0.0028986 k( 344) = ( 0.3333333 0.3333333 0.4821429), wk = 0.0028986 k( 345) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0028986 Dense grid: 61697 G-vectors FFT dimensions: ( 45, 45, 72) Smooth grid: 29037 G-vectors FFT dimensions: ( 36, 36, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.18 Mb ( 208, 56) NL pseudopotentials 0.22 Mb ( 104, 136) Each V/rho on FFT grid 0.06 Mb ( 4050) Each G-vector array 0.01 Mb ( 1718) G-vector shells 0.01 Mb ( 820) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.71 Mb ( 208, 224) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.23 Mb ( 136, 2, 56) The potential is recalculated from file : ./TeRh.save/charge-density.dat Starting wfc are 56 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.8 secs Computing kpt #: 2 total cpu time spent up to now is 3.1 secs Computing kpt #: 3 total cpu time spent up to now is 3.5 secs Computing kpt #: 4 total cpu time spent up to now is 3.8 secs Computing kpt #: 5 total cpu time spent up to now is 4.2 secs Computing kpt #: 6 total cpu time spent up to now is 5.0 secs Computing kpt #: 7 total cpu time spent up to now is 5.4 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 6.1 secs Computing kpt #: 10 total cpu time spent up to now is 6.4 secs Computing kpt #: 11 total cpu time spent up to now is 6.8 secs Computing kpt #: 12 total cpu time spent up to now is 7.2 secs Computing kpt #: 13 total cpu time spent up to now is 7.5 secs Computing kpt #: 14 total cpu time spent up to now is 7.9 secs Computing kpt #: 15 total cpu time spent up to now is 8.3 secs Computing kpt #: 16 total cpu time spent up to now is 8.7 secs Computing kpt #: 17 total cpu time spent up to now is 9.1 secs Computing kpt #: 18 total cpu time spent up to now is 9.5 secs Computing kpt #: 19 total cpu time spent up to now is 9.8 secs Computing kpt #: 20 total cpu time spent up to now is 10.3 secs Computing kpt #: 21 total cpu time spent up to now is 10.7 secs Computing kpt #: 22 total cpu time spent up to now is 11.0 secs Computing kpt #: 23 total cpu time spent up to now is 11.4 secs Computing kpt #: 24 total cpu time spent up to now is 11.8 secs Computing kpt #: 25 total cpu time spent up to now is 12.2 secs Computing kpt #: 26 total cpu time spent up to now is 12.6 secs Computing kpt #: 27 total cpu time spent up to now is 13.0 secs Computing kpt #: 28 total cpu time spent up to now is 13.4 secs Computing kpt #: 29 total cpu time spent up to now is 13.8 secs Computing kpt #: 30 total cpu time spent up to now is 14.2 secs Computing kpt #: 31 total cpu time spent up to now is 14.6 secs Computing kpt #: 32 total cpu time spent up to now is 15.0 secs Computing kpt #: 33 total cpu time spent up to now is 15.4 secs Computing kpt #: 34 total cpu time spent up to now is 15.8 secs Computing kpt #: 35 total cpu time spent up to now is 16.2 secs Computing kpt #: 36 total cpu time spent up to now is 16.5 secs Computing kpt #: 37 total cpu time spent up to now is 16.9 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 19.2 secs Computing kpt #: 44 total cpu time spent up to now is 19.6 secs Computing kpt #: 45 total cpu time spent up to now is 20.0 secs Computing kpt #: 46 total cpu time spent up to now is 20.4 secs Computing kpt #: 47 total cpu time spent up to now is 20.8 secs Computing kpt #: 48 total cpu time spent up to now is 21.2 secs Computing kpt #: 49 total cpu time spent up to now is 21.5 secs Computing kpt #: 50 total cpu time spent up to now is 21.9 secs Computing kpt #: 51 total cpu time spent up to now is 22.3 secs Computing kpt #: 52 total cpu time spent up to now is 22.7 secs Computing kpt #: 53 total cpu time spent up to now is 23.0 secs Computing kpt #: 54 total cpu time spent up to now is 23.4 secs Computing kpt #: 55 total cpu time spent up to now is 23.8 secs Computing kpt #: 56 total cpu time spent up to now is 24.2 secs Computing kpt #: 57 total cpu time spent up to now is 24.5 secs Computing kpt #: 58 total cpu time spent up to now is 24.9 secs Computing kpt #: 59 total cpu time spent up to now is 25.2 secs Computing kpt #: 60 total cpu time spent up to now is 25.6 secs Computing kpt #: 61 total cpu time spent up to now is 25.9 secs Computing kpt #: 62 total cpu time spent up to now is 26.3 secs Computing kpt #: 63 total cpu time spent up to now is 26.7 secs Computing kpt #: 64 total cpu time spent up to now is 27.0 secs Computing kpt #: 65 total cpu time spent up to now is 27.4 secs Computing kpt #: 66 total cpu time spent up to now is 27.7 secs Computing kpt #: 67 total cpu time spent up to now is 28.1 secs Computing kpt #: 68 total cpu time spent up to now is 28.5 secs Computing kpt #: 69 total cpu time spent up to now is 28.8 secs Computing kpt #: 70 total cpu time spent up to now is 29.2 secs Computing kpt #: 71 total cpu time spent up to now is 29.5 secs Computing kpt #: 72 total cpu time spent up to now is 29.9 secs Computing kpt #: 73 total cpu time spent up to now is 30.2 secs Computing kpt #: 74 total cpu time spent up to now is 30.6 secs Computing kpt #: 75 total cpu time spent up to now is 30.9 secs Computing kpt #: 76 total cpu time spent up to now is 31.3 secs Computing kpt #: 77 total cpu time spent up to now is 31.6 secs Computing kpt #: 78 total cpu time spent up to now is 32.0 secs Computing kpt #: 79 total cpu time spent up to now is 32.3 secs Computing kpt #: 80 total cpu time spent up to now is 32.7 secs Computing kpt #: 81 total cpu time spent up to now is 33.0 secs Computing kpt #: 82 total cpu time spent up to now is 33.4 secs Computing kpt #: 83 total cpu time spent up to now is 33.8 secs Computing kpt #: 84 total cpu time spent up to now is 34.1 secs Computing kpt #: 85 total cpu time spent up to now is 34.5 secs Computing kpt #: 86 total cpu time spent up to now is 35.0 secs Computing kpt #: 87 total cpu time spent up to now is 35.3 secs Computing kpt #: 88 total cpu time spent up to now is 35.7 secs Computing kpt #: 89 total cpu time spent up to now is 36.1 secs Computing kpt #: 90 total cpu time spent up to now is 36.5 secs Computing kpt #: 91 total cpu time spent up to now is 36.8 secs Computing kpt #: 92 total cpu time spent up to now is 37.2 secs Computing kpt #: 93 total cpu time spent up to now is 37.6 secs Computing kpt #: 94 total cpu time spent up to now is 37.9 secs Computing kpt #: 95 total cpu time spent up to now is 38.3 secs Computing kpt #: 96 total cpu time spent up to now is 38.7 secs Computing kpt #: 97 total cpu time spent up to now is 39.1 secs Computing kpt #: 98 total cpu time spent up to now is 39.5 secs Computing kpt #: 99 total cpu time spent up to now is 40.2 secs Computing kpt #: 100 total cpu time spent up to now is 40.6 secs Computing kpt #: 101 total cpu time spent up to now is 41.0 secs Computing kpt #: 102 total cpu time spent up to now is 41.4 secs Computing kpt #: 103 total cpu time spent up to now is 41.8 secs Computing kpt #: 104 total cpu time spent up to now is 42.2 secs Computing kpt #: 105 total cpu time spent up to now is 42.6 secs Computing kpt #: 106 total cpu time spent up to now is 43.0 secs Computing kpt #: 107 total cpu time spent up to now is 43.4 secs Computing kpt #: 108 total cpu time spent up to now is 43.8 secs Computing kpt #: 109 total cpu time spent up to now is 44.2 secs Computing kpt #: 110 total cpu time spent up to now is 44.6 secs Computing kpt #: 111 total cpu time spent up to now is 45.0 secs Computing kpt #: 112 total cpu time spent up to now is 45.3 secs Computing kpt #: 113 total cpu time spent up to now is 45.7 secs Computing kpt #: 114 total cpu time spent up to now is 46.1 secs Computing kpt #: 115 total cpu time spent up to now is 46.4 secs Computing kpt #: 116 total cpu time spent up to now is 46.8 secs Computing kpt #: 117 total cpu time spent up to now is 47.2 secs Computing kpt #: 118 total cpu time spent up to now is 47.6 secs Computing kpt #: 119 total cpu time spent up to now is 48.0 secs Computing kpt #: 120 total cpu time spent up to now is 48.3 secs Computing kpt #: 121 total cpu time spent up to now is 48.6 secs Computing kpt #: 122 total cpu time spent up to now is 49.0 secs Computing kpt #: 123 total cpu time spent up to now is 49.3 secs Computing kpt #: 124 total cpu time spent up to now is 49.7 secs Computing kpt #: 125 total cpu time spent up to now is 50.0 secs Computing kpt #: 126 total cpu time spent up to now is 50.3 secs Computing kpt #: 127 total cpu time spent up to now is 50.7 secs Computing kpt #: 128 total cpu time spent up to now is 51.0 secs Computing kpt #: 129 total cpu time spent up to now is 51.4 secs Computing kpt #: 130 total cpu time spent up to now is 51.7 secs Computing kpt #: 131 total cpu time spent up to now is 52.0 secs Computing kpt #: 132 total cpu time spent up to now is 52.3 secs Computing kpt #: 133 total cpu time spent up to now is 52.7 secs Computing kpt #: 134 total cpu time spent up to now is 53.0 secs Computing kpt #: 135 total cpu time spent up to now is 53.4 secs Computing kpt #: 136 total cpu time spent up to now is 53.7 secs Computing kpt #: 137 total cpu time spent up to now is 54.1 secs Computing kpt #: 138 total cpu time spent up to now is 54.4 secs Computing kpt #: 139 total cpu time spent up to now is 54.8 secs Computing kpt #: 140 total cpu time spent up to now is 55.1 secs Computing kpt #: 141 total cpu time spent up to now is 55.5 secs Computing kpt #: 142 total cpu time spent up to now is 55.9 secs Computing kpt #: 143 total cpu time spent up to now is 56.3 secs Computing kpt #: 144 total cpu time spent up to now is 56.7 secs Computing kpt #: 145 total cpu time spent up to now is 57.2 secs Computing kpt #: 146 total cpu time spent up to now is 57.6 secs Computing kpt #: 147 total cpu time spent up to now is 58.1 secs Computing kpt #: 148 total cpu time spent up to now is 58.5 secs Computing kpt #: 149 total cpu time spent up to now is 58.9 secs Computing kpt #: 150 total cpu time spent up to now is 59.3 secs Computing kpt #: 151 total cpu time spent up to now is 59.7 secs Computing kpt #: 152 total cpu time spent up to now is 60.1 secs Computing kpt #: 153 total cpu time spent up to now is 60.4 secs Computing kpt #: 154 total cpu time spent up to now is 60.8 secs Computing kpt #: 155 total cpu time spent up to now is 61.2 secs Computing kpt #: 156 total cpu time spent up to now is 61.5 secs Computing kpt #: 157 total cpu time spent up to now is 61.9 secs Computing kpt #: 158 total cpu time spent up to now is 62.2 secs Computing kpt #: 159 total cpu time spent up to now is 62.6 secs Computing kpt #: 160 total cpu time spent up to now is 63.0 secs Computing kpt #: 161 total cpu time spent up to now is 63.3 secs Computing kpt #: 162 total cpu time spent up to now is 63.7 secs Computing kpt #: 163 total cpu time spent up to now is 64.1 secs Computing kpt #: 164 total cpu time spent up to now is 64.5 secs Computing kpt #: 165 total cpu time spent up to now is 64.9 secs Computing kpt #: 166 total cpu time spent up to now is 65.2 secs Computing kpt #: 167 total cpu time spent up to now is 65.6 secs Computing kpt #: 168 total cpu time spent up to now is 66.0 secs Computing kpt #: 169 total cpu time spent up to now is 66.5 secs Computing kpt #: 170 total cpu time spent up to now is 66.9 secs Computing kpt #: 171 total cpu time spent up to now is 67.3 secs Computing kpt #: 172 total cpu time spent up to now is 67.6 secs Computing kpt #: 173 total cpu time spent up to now is 68.0 secs Computing kpt #: 174 total cpu time spent up to now is 68.4 secs Computing kpt #: 175 total cpu time spent up to now is 68.8 secs Computing kpt #: 176 total cpu time spent up to now is 69.2 secs Computing kpt #: 177 total cpu time spent up to now is 69.5 secs Computing kpt #: 178 total cpu time spent up to now is 70.0 secs Computing kpt #: 179 total cpu time spent up to now is 70.3 secs Computing kpt #: 180 total cpu time spent up to now is 70.7 secs Computing kpt #: 181 total cpu time spent up to now is 71.0 secs Computing kpt #: 182 total cpu time spent up to now is 71.4 secs Computing kpt #: 183 total cpu time spent up to now is 71.7 secs Computing kpt #: 184 total cpu time spent up to now is 72.0 secs Computing kpt #: 185 total cpu time spent up to now is 72.4 secs Computing kpt #: 186 total cpu time spent up to now is 72.7 secs Computing kpt #: 187 total cpu time spent up to now is 73.0 secs Computing kpt #: 188 total cpu time spent up to now is 73.4 secs Computing kpt #: 189 total cpu time spent up to now is 73.7 secs Computing kpt #: 190 total cpu time spent up to now is 74.0 secs Computing kpt #: 191 total cpu time spent up to now is 74.3 secs Computing kpt #: 192 total cpu time spent up to now is 75.1 secs Computing kpt #: 193 total cpu time spent up to now is 75.5 secs Computing kpt #: 194 total cpu time spent up to now is 75.8 secs Computing kpt #: 195 total cpu time spent up to now is 76.1 secs Computing kpt #: 196 total cpu time spent up to now is 76.4 secs Computing kpt #: 197 total cpu time spent up to now is 76.8 secs Computing kpt #: 198 total cpu time spent up to now is 77.1 secs Computing kpt #: 199 total cpu time spent up to now is 77.4 secs Computing kpt #: 200 total cpu time spent up to now is 77.7 secs Computing kpt #: 201 total cpu time spent up to now is 78.0 secs Computing kpt #: 202 total cpu time spent up to now is 78.4 secs Computing kpt #: 203 total cpu time spent up to now is 78.7 secs Computing kpt #: 204 total cpu time spent up to now is 79.0 secs Computing kpt #: 205 total cpu time spent up to now is 79.3 secs Computing kpt #: 206 total cpu time spent up to now is 79.6 secs Computing kpt #: 207 total cpu time spent up to now is 80.0 secs Computing kpt #: 208 total cpu time spent up to now is 80.3 secs Computing kpt #: 209 total cpu time spent up to now is 80.6 secs Computing kpt #: 210 total cpu time spent up to now is 80.9 secs Computing kpt #: 211 total cpu time spent up to now is 81.3 secs Computing kpt #: 212 total cpu time spent up to now is 81.6 secs Computing kpt #: 213 total cpu time spent up to now is 81.9 secs Computing kpt #: 214 total cpu time spent up to now is 82.2 secs Computing kpt #: 215 total cpu time spent up to now is 82.6 secs Computing kpt #: 216 total cpu time spent up to now is 82.9 secs Computing kpt #: 217 total cpu time spent up to now is 83.2 secs Computing kpt #: 218 total cpu time spent up to now is 83.5 secs Computing kpt #: 219 total cpu time spent up to now is 83.9 secs Computing kpt #: 220 total cpu time spent up to now is 84.2 secs Computing kpt #: 221 total cpu time spent up to now is 84.5 secs Computing kpt #: 222 total cpu time spent up to now is 84.9 secs Computing kpt #: 223 total cpu time spent up to now is 85.2 secs Computing kpt #: 224 total cpu time spent up to now is 85.5 secs Computing kpt #: 225 total cpu time spent up to now is 85.9 secs Computing kpt #: 226 total cpu time spent up to now is 86.2 secs Computing kpt #: 227 total cpu time spent up to now is 86.6 secs Computing kpt #: 228 total cpu time spent up to now is 86.9 secs Computing kpt #: 229 total cpu time spent up to now is 87.3 secs Computing kpt #: 230 total cpu time spent up to now is 87.6 secs Computing kpt #: 231 total cpu time spent up to now is 88.0 secs Computing kpt #: 232 total cpu time spent up to now is 88.4 secs Computing kpt #: 233 total cpu time spent up to now is 88.9 secs Computing kpt #: 234 total cpu time spent up to now is 89.3 secs Computing kpt #: 235 total cpu time spent up to now is 89.8 secs Computing kpt #: 236 total cpu time spent up to now is 90.2 secs Computing kpt #: 237 total cpu time spent up to now is 90.5 secs Computing kpt #: 238 total cpu time spent up to now is 90.9 secs Computing kpt #: 239 total cpu time spent up to now is 91.3 secs Computing kpt #: 240 total cpu time spent up to now is 91.6 secs Computing kpt #: 241 total cpu time spent up to now is 92.0 secs Computing kpt #: 242 total cpu time spent up to now is 92.4 secs Computing kpt #: 243 total cpu time spent up to now is 92.7 secs Computing kpt #: 244 total cpu time spent up to now is 93.1 secs Computing kpt #: 245 total cpu time spent up to now is 93.4 secs Computing kpt #: 246 total cpu time spent up to now is 93.8 secs Computing kpt #: 247 total cpu time spent up to now is 94.2 secs Computing kpt #: 248 total cpu time spent up to now is 94.5 secs Computing kpt #: 249 total cpu time spent up to now is 94.9 secs Computing kpt #: 250 total cpu time spent up to now is 95.3 secs Computing kpt #: 251 total cpu time spent up to now is 95.6 secs Computing kpt #: 252 total cpu time spent up to now is 96.0 secs Computing kpt #: 253 total cpu time spent up to now is 96.3 secs Computing kpt #: 254 total cpu time spent up to now is 96.7 secs Computing kpt #: 255 total cpu time spent up to now is 97.0 secs Computing kpt #: 256 total cpu time spent up to now is 97.4 secs Computing kpt #: 257 total cpu time spent up to now is 97.8 secs Computing kpt #: 258 total cpu time spent up to now is 98.1 secs Computing kpt #: 259 total cpu time spent up to now is 98.5 secs Computing kpt #: 260 total cpu time spent up to now is 98.9 secs Computing kpt #: 261 total cpu time spent up to now is 99.3 secs Computing kpt #: 262 total cpu time spent up to now is 99.6 secs Computing kpt #: 263 total cpu time spent up to now is 100.0 secs Computing kpt #: 264 total cpu time spent up to now is 100.4 secs Computing kpt #: 265 total cpu time spent up to now is 100.8 secs Computing kpt #: 266 total cpu time spent up to now is 101.2 secs Computing kpt #: 267 total cpu time spent up to now is 101.5 secs Computing kpt #: 268 total cpu time spent up to now is 101.9 secs Computing kpt #: 269 total cpu time spent up to now is 102.3 secs Computing kpt #: 270 total cpu time spent up to now is 102.7 secs Computing kpt #: 271 total cpu time spent up to now is 103.1 secs Computing kpt #: 272 total cpu time spent up to now is 103.5 secs Computing kpt #: 273 total cpu time spent up to now is 103.9 secs Computing kpt #: 274 total cpu time spent up to now is 104.4 secs Computing kpt #: 275 total cpu time spent up to now is 104.8 secs Computing kpt #: 276 total cpu time spent up to now is 105.2 secs Computing kpt #: 277 total cpu time spent up to now is 105.6 secs Computing kpt #: 278 total cpu time spent up to now is 106.0 secs Computing kpt #: 279 total cpu time spent up to now is 106.4 secs Computing kpt #: 280 total cpu time spent up to now is 106.8 secs Computing kpt #: 281 total cpu time spent up to now is 107.2 secs Computing kpt #: 282 total cpu time spent up to now is 107.6 secs Computing kpt #: 283 total cpu time spent up to now is 108.0 secs Computing kpt #: 284 total cpu time spent up to now is 108.3 secs Computing kpt #: 285 total cpu time spent up to now is 108.7 secs Computing kpt #: 286 total cpu time spent up to now is 109.0 secs Computing kpt #: 287 total cpu time spent up to now is 109.4 secs Computing kpt #: 288 total cpu time spent up to now is 110.2 secs Computing kpt #: 289 total cpu time spent up to now is 110.5 secs Computing kpt #: 290 total cpu time spent up to now is 110.9 secs Computing kpt #: 291 total cpu time spent up to now is 111.2 secs Computing kpt #: 292 total cpu time spent up to now is 111.5 secs Computing kpt #: 293 total cpu time spent up to now is 111.8 secs Computing kpt #: 294 total cpu time spent up to now is 112.2 secs Computing kpt #: 295 total cpu time spent up to now is 112.5 secs Computing kpt #: 296 total cpu time spent up to now is 112.8 secs Computing kpt #: 297 total cpu time spent up to now is 113.2 secs Computing kpt #: 298 total cpu time spent up to now is 113.5 secs Computing kpt #: 299 total cpu time spent up to now is 113.8 secs Computing kpt #: 300 total cpu time spent up to now is 114.2 secs Computing kpt #: 301 total cpu time spent up to now is 114.5 secs Computing kpt #: 302 total cpu time spent up to now is 114.8 secs Computing kpt #: 303 total cpu time spent up to now is 115.1 secs Computing kpt #: 304 total cpu time spent up to now is 115.4 secs Computing kpt #: 305 total cpu time spent up to now is 115.8 secs Computing kpt #: 306 total cpu time spent up to now is 116.1 secs Computing kpt #: 307 total cpu time spent up to now is 116.4 secs Computing kpt #: 308 total cpu time spent up to now is 116.8 secs Computing kpt #: 309 total cpu time spent up to now is 117.1 secs Computing kpt #: 310 total cpu time spent up to now is 117.4 secs Computing kpt #: 311 total cpu time spent up to now is 117.8 secs Computing kpt #: 312 total cpu time spent up to now is 118.1 secs Computing kpt #: 313 total cpu time spent up to now is 118.5 secs Computing kpt #: 314 total cpu time spent up to now is 118.8 secs Computing kpt #: 315 total cpu time spent up to now is 119.2 secs Computing kpt #: 316 total cpu time spent up to now is 119.6 secs Computing kpt #: 317 total cpu time spent up to now is 119.9 secs Computing kpt #: 318 total cpu time spent up to now is 120.3 secs Computing kpt #: 319 total cpu time spent up to now is 120.6 secs Computing kpt #: 320 total cpu time spent up to now is 120.9 secs Computing kpt #: 321 total cpu time spent up to now is 121.3 secs Computing kpt #: 322 total cpu time spent up to now is 121.6 secs Computing kpt #: 323 total cpu time spent up to now is 122.0 secs Computing kpt #: 324 total cpu time spent up to now is 122.3 secs Computing kpt #: 325 total cpu time spent up to now is 122.6 secs Computing kpt #: 326 total cpu time spent up to now is 123.0 secs Computing kpt #: 327 total cpu time spent up to now is 123.3 secs Computing kpt #: 328 total cpu time spent up to now is 123.7 secs Computing kpt #: 329 total cpu time spent up to now is 124.1 secs Computing kpt #: 330 total cpu time spent up to now is 124.4 secs Computing kpt #: 331 total cpu time spent up to now is 124.9 secs Computing kpt #: 332 total cpu time spent up to now is 125.3 secs Computing kpt #: 333 total cpu time spent up to now is 125.8 secs Computing kpt #: 334 total cpu time spent up to now is 126.3 secs Computing kpt #: 335 total cpu time spent up to now is 126.8 secs Computing kpt #: 336 total cpu time spent up to now is 127.2 secs Computing kpt #: 337 total cpu time spent up to now is 127.7 secs Computing kpt #: 338 total cpu time spent up to now is 128.1 secs Computing kpt #: 339 total cpu time spent up to now is 128.6 secs Computing kpt #: 340 total cpu time spent up to now is 129.0 secs Computing kpt #: 341 total cpu time spent up to now is 129.4 secs Computing kpt #: 342 total cpu time spent up to now is 129.8 secs Computing kpt #: 343 total cpu time spent up to now is 130.2 secs Computing kpt #: 344 total cpu time spent up to now is 130.6 secs Computing kpt #: 345 total cpu time spent up to now is 131.0 secs ethr = 2.17E-08, avg # of iterations = 15.5 total cpu time spent up to now is 131.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3631 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5870 -30.5870 -30.5589 -30.5589 -30.5365 -30.5365 0.3569 0.3569 2.9670 2.9670 7.3162 7.3162 8.8320 8.8320 9.0333 9.0333 10.2488 10.2488 11.2000 11.2000 11.2253 11.2253 11.6808 11.6808 11.8990 11.8990 12.9119 12.9119 13.0779 13.0779 13.2211 13.2211 13.8177 13.8177 14.9988 14.9988 15.3713 15.3713 16.9985 16.9985 17.4047 17.4047 17.6390 17.6390 19.1103 19.1103 k = 0.0109 0.0063-0.0000 ( 3631 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5870 -30.5870 -30.5589 -30.5589 -30.5365 -30.5365 0.3582 0.3582 2.9666 2.9666 7.3178 7.3178 8.8327 8.8327 9.0339 9.0339 10.2483 10.2483 11.1974 11.1974 11.2232 11.2232 11.6789 11.6789 11.8973 11.8973 12.9117 12.9117 13.0781 13.0781 13.2211 13.2211 13.8145 13.8145 15.0024 15.0024 15.3706 15.3706 16.9838 16.9838 17.4114 17.4114 17.6427 17.6427 19.1184 19.1184 k = 0.0217 0.0126-0.0000 ( 3631 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5870 -30.5870 -30.5589 -30.5589 -30.5365 -30.5365 0.3620 0.3620 2.9653 2.9653 7.3228 7.3228 8.8346 8.8346 9.0358 9.0358 10.2469 10.2469 11.1895 11.1895 11.2171 11.2171 11.6728 11.6728 11.8925 11.8925 12.9108 12.9108 13.0785 13.0785 13.2212 13.2212 13.8053 13.8053 15.0130 15.0130 15.3682 15.3682 16.9444 16.9444 17.4245 17.4245 17.6563 17.6563 19.1428 19.1428 k = 0.0326 0.0188-0.0000 ( 3631 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5871 -30.5871 -30.5589 -30.5589 -30.5365 -30.5365 0.3684 0.3684 2.9632 2.9632 7.3311 7.3311 8.8378 8.8378 9.0390 9.0390 10.2444 10.2444 11.1760 11.1760 11.2075 11.2075 11.6620 11.6620 11.8858 11.8858 12.9090 12.9090 13.0792 13.0792 13.2211 13.2211 13.7904 13.7904 15.0305 15.0305 15.3643 15.3643 16.8886 16.8886 17.4310 17.4310 17.6845 17.6845 19.1836 19.1836 k = 0.0435 0.0251-0.0000 ( 3633 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5871 -30.5871 -30.5590 -30.5590 -30.5365 -30.5365 0.3773 0.3773 2.9602 2.9602 7.3427 7.3427 8.8423 8.8423 9.0434 9.0434 10.2408 10.2408 11.1564 11.1564 11.1948 11.1948 11.6456 11.6456 11.8785 11.8785 12.9058 12.9058 13.0799 13.0799 13.2208 13.2208 13.7709 13.7709 15.0548 15.0548 15.3587 15.3587 16.8230 16.8230 17.4240 17.4240 17.7279 17.7279 19.2406 19.2406 k = 0.0543 0.0314-0.0000 ( 3633 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5872 -30.5872 -30.5590 -30.5590 -30.5366 -30.5366 0.3887 0.3887 2.9564 2.9564 7.3576 7.3576 8.8479 8.8479 9.0491 9.0491 10.2359 10.2359 11.1306 11.1306 11.1793 11.1793 11.6230 11.6230 11.8723 11.8723 12.9008 12.9008 13.0807 13.0807 13.2202 13.2202 13.7479 13.7479 15.0857 15.0857 15.3516 15.3516 16.7513 16.7513 17.4048 17.4048 17.7818 17.7818 19.3136 19.3136 k = 0.0652 0.0377-0.0000 ( 3633 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5129 -34.5129 -34.4573 -34.4573 -30.7037 -30.7037 -30.5873 -30.5873 -30.5591 -30.5591 -30.5366 -30.5366 0.4026 0.4026 2.9518 2.9518 7.3757 7.3757 8.8548 8.8548 9.0560 9.0560 10.2294 10.2294 11.0987 11.0987 11.1614 11.1614 11.5938 11.5938 11.8682 11.8682 12.8935 12.8935 13.0811 13.0811 13.2190 13.2190 13.7225 13.7225 15.1226 15.1226 15.3428 15.3428 16.6755 16.6755 17.3771 17.3771 17.8409 17.8409 19.4020 19.4020 k = 0.0761 0.0439-0.0000 ( 3637 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5129 -34.5129 -34.4573 -34.4573 -30.7037 -30.7037 -30.5874 -30.5874 -30.5592 -30.5592 -30.5366 -30.5366 0.4190 0.4190 2.9464 2.9464 7.3971 7.3971 8.8628 8.8628 9.0640 9.0640 10.2211 10.2211 11.0609 11.0609 11.1412 11.1412 11.5585 11.5585 11.8670 11.8670 12.8835 12.8835 13.0811 13.0811 13.2170 13.2170 13.6963 13.6963 15.1648 15.1648 15.3326 15.3326 16.5964 16.5964 17.3445 17.3445 17.9013 17.9013 19.5046 19.5046 k = 0.0870 0.0502-0.0000 ( 3631 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5129 -34.5129 -34.4573 -34.4573 -30.7037 -30.7037 -30.5875 -30.5875 -30.5592 -30.5592 -30.5366 -30.5366 0.4379 0.4379 2.9403 2.9403 7.4217 7.4217 8.8718 8.8718 9.0732 9.0732 10.2105 10.2105 11.0177 11.0177 11.1191 11.1191 11.5179 11.5179 11.8687 11.8687 12.8706 12.8706 13.0804 13.0804 13.2140 13.2140 13.6703 13.6703 15.2108 15.2108 15.3218 15.3218 16.5146 16.5146 17.3095 17.3095 17.9609 17.9609 19.6195 19.6195 k = 0.0978 0.0565-0.0000 ( 3627 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5129 -34.5129 -34.4574 -34.4574 -30.7037 -30.7037 -30.5876 -30.5876 -30.5593 -30.5593 -30.5366 -30.5366 0.4592 0.4592 2.9333 2.9333 7.4495 7.4495 8.8818 8.8818 9.0836 9.0836 10.1971 10.1971 10.9695 10.9695 11.0952 11.0952 11.4728 11.4728 11.8731 11.8731 12.8547 12.8547 13.0789 13.0789 13.2100 13.2100 13.6455 13.6455 15.2550 15.2550 15.3153 15.3153 16.4303 16.4303 17.2739 17.2739 18.0187 18.0187 19.7434 19.7434 k = 0.1087 0.0628-0.0000 ( 3623 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5129 -34.5129 -34.4574 -34.4574 -30.7037 -30.7037 -30.5878 -30.5878 -30.5594 -30.5594 -30.5367 -30.5367 0.4829 0.4829 2.9256 2.9256 7.4804 7.4804 8.8927 8.8927 9.0949 9.0949 10.1800 10.1800 10.9174 10.9174 11.0700 11.0700 11.4243 11.4243 11.8798 11.8798 12.8360 12.8360 13.0765 13.0765 13.2052 13.2052 13.6222 13.6222 15.2701 15.2701 15.3392 15.3392 16.3438 16.3438 17.2393 17.2393 18.0740 18.0740 19.8704 19.8704 k = 0.1196 0.0690-0.0000 ( 3625 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5130 -34.5130 -34.4575 -34.4575 -30.7037 -30.7037 -30.5879 -30.5879 -30.5595 -30.5595 -30.5367 -30.5367 0.5090 0.5090 2.9172 2.9172 7.5144 7.5144 8.9043 8.9043 9.1072 9.1072 10.1583 10.1583 10.8627 10.8627 11.0436 11.0436 11.3731 11.3731 11.8887 11.8887 12.8148 12.8148 13.0731 13.0731 13.1997 13.1997 13.6006 13.6006 15.2568 15.2568 15.3921 15.3921 16.2554 16.2554 17.2068 17.2068 18.1264 18.1264 19.9898 19.9898 k = 0.1304 0.0753-0.0000 ( 3619 PWs) bands (ev): -63.8564 -63.8564 -63.8360 -63.8360 -34.5130 -34.5130 -34.4575 -34.4575 -30.7036 -30.7036 -30.5881 -30.5881 -30.5596 -30.5596 -30.5367 -30.5367 0.5374 0.5374 2.9081 2.9081 7.5515 7.5515 8.9166 8.9166 9.1204 9.1204 10.1307 10.1307 10.8069 10.8069 11.0165 11.0165 11.3201 11.3201 11.8995 11.8995 12.7913 12.7913 13.0689 13.0689 13.1939 13.1939 13.5800 13.5800 15.2362 15.2362 15.4518 15.4518 16.1655 16.1655 17.1774 17.1774 18.1759 18.1759 20.0900 20.0900 k = 0.1413 0.0816-0.0000 ( 3623 PWs) bands (ev): -63.8564 -63.8564 -63.8360 -63.8360 -34.5130 -34.5130 -34.4576 -34.4576 -30.7036 -30.7036 -30.5883 -30.5883 -30.5598 -30.5598 -30.5368 -30.5368 0.5681 0.5681 2.8984 2.8984 7.5915 7.5915 8.9294 8.9294 9.1343 9.1343 10.0960 10.0960 10.7520 10.7520 10.9889 10.9889 11.2659 11.2659 11.9120 11.9120 12.7663 12.7663 13.0638 13.0638 13.1880 13.1880 13.5600 13.5600 15.2117 15.2117 15.5133 15.5133 16.0748 16.0748 17.1519 17.1519 18.2224 18.2224 20.1723 20.1723 k = 0.1522 0.0879-0.0000 ( 3619 PWs) bands (ev): -63.8564 -63.8564 -63.8360 -63.8360 -34.5131 -34.5131 -34.4577 -34.4577 -30.7036 -30.7036 -30.5885 -30.5885 -30.5599 -30.5599 -30.5368 -30.5368 0.6011 0.6011 2.8880 2.8880 7.6345 7.6345 8.9426 8.9426 9.1488 9.1488 10.0529 10.0529 10.7000 10.7000 10.9612 10.9612 11.2109 11.2109 11.9261 11.9261 12.7403 12.7403 13.0580 13.0580 13.1823 13.1823 13.5398 13.5398 15.1837 15.1837 15.5743 15.5743 15.9849 15.9849 17.1308 17.1308 18.2657 18.2657 20.2480 20.2480 k = 0.1630 0.0941-0.0000 ( 3625 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5131 -34.5131 -34.4578 -34.4578 -30.7036 -30.7036 -30.5887 -30.5887 -30.5601 -30.5601 -30.5368 -30.5368 0.6362 0.6362 2.8770 2.8770 7.6803 7.6803 8.9560 8.9560 9.1636 9.1636 10.0005 10.0005 10.6527 10.6527 10.9334 10.9334 11.1556 11.1556 11.9413 11.9413 12.7139 12.7139 13.0517 13.0517 13.1769 13.1769 13.5186 13.5186 15.1523 15.1523 15.6301 15.6301 15.8996 15.8996 17.1146 17.1146 18.3060 18.3060 20.3239 20.3239 k = 0.1739 0.1004-0.0000 ( 3629 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5131 -34.5131 -34.4578 -34.4578 -30.7036 -30.7036 -30.5889 -30.5889 -30.5602 -30.5602 -30.5369 -30.5369 0.6734 0.6734 2.8654 2.8654 7.7289 7.7289 8.9693 8.9693 9.1783 9.1783 9.9388 9.9388 10.6112 10.6112 10.9060 10.9060 11.1006 11.1006 11.9579 11.9579 12.6877 12.6877 13.0449 13.0449 13.1719 13.1719 13.4956 13.4956 15.1174 15.1174 15.6644 15.6644 15.8351 15.8351 17.1033 17.1033 18.3432 18.3432 20.4025 20.4025 k = 0.1848 0.1067-0.0000 ( 3617 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5132 -34.5132 -34.4579 -34.4579 -30.7036 -30.7036 -30.5891 -30.5891 -30.5603 -30.5603 -30.5369 -30.5369 0.7127 0.7127 2.8533 2.8533 7.7801 7.7801 8.9823 8.9823 9.1923 9.1923 9.8688 9.8688 10.5760 10.5760 10.8788 10.8788 11.0465 11.0465 11.9755 11.9755 12.6621 12.6621 13.0380 13.0380 13.1674 13.1674 13.4706 13.4706 15.0789 15.0789 15.6360 15.6360 15.8322 15.8322 17.0972 17.0972 18.3774 18.3774 20.4835 20.4835 k = 0.1957 0.1130-0.0000 ( 3621 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5132 -34.5132 -34.4580 -34.4580 -30.7036 -30.7036 -30.5893 -30.5893 -30.5605 -30.5605 -30.5370 -30.5370 0.7539 0.7539 2.8406 2.8406 7.8338 7.8338 8.9945 8.9945 9.2046 9.2046 9.7927 9.7927 10.5466 10.5466 10.8518 10.8518 10.9939 10.9939 11.9940 11.9940 12.6373 12.6373 13.0307 13.0307 13.1629 13.1629 13.4430 13.4430 15.0364 15.0364 15.5601 15.5601 15.8756 15.8756 17.0962 17.0962 18.4087 18.4087 20.5621 20.5621 k = 0.2065 0.1192-0.0000 ( 3621 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5133 -34.5133 -34.4581 -34.4581 -30.7036 -30.7036 -30.5896 -30.5896 -30.5607 -30.5607 -30.5370 -30.5370 0.7971 0.7971 2.8273 2.8273 7.8900 7.8900 9.0053 9.0053 9.2134 9.2134 9.7142 9.7142 10.5224 10.5224 10.8245 10.8245 10.9440 10.9440 12.0134 12.0134 12.6137 12.6137 13.0233 13.0233 13.1584 13.1584 13.4129 13.4129 14.9899 14.9899 15.4720 15.4720 15.9300 15.9300 17.1001 17.1001 18.4371 18.4371 20.6208 20.6208 k = 0.2174 0.1255-0.0000 ( 3621 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5133 -34.5133 -34.4582 -34.4582 -30.7036 -30.7036 -30.5898 -30.5898 -30.5608 -30.5608 -30.5371 -30.5371 0.8421 0.8421 2.8136 2.8136 7.9483 7.9483 9.0136 9.0136 9.2159 9.2159 9.6388 9.6388 10.5023 10.5023 10.7955 10.7955 10.8984 10.8984 12.0335 12.0335 12.5911 12.5911 13.0159 13.0159 13.1537 13.1537 13.3805 13.3805 14.9391 14.9391 15.3811 15.3811 15.9858 15.9858 17.1086 17.1086 18.4629 18.4629 20.6077 20.6077 k = 0.2283 0.1318-0.0000 ( 3621 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5134 -34.5134 -34.4582 -34.4582 -30.7036 -30.7036 -30.5900 -30.5900 -30.5610 -30.5610 -30.5371 -30.5371 0.8888 0.8888 2.7994 2.7994 8.0087 8.0087 9.0170 9.0170 9.2081 9.2081 9.5742 9.5742 10.4855 10.4855 10.7631 10.7631 10.8596 10.8596 12.0544 12.0544 12.5698 12.5698 13.0084 13.0084 13.1481 13.1481 13.3460 13.3460 14.8840 14.8840 15.2903 15.2903 16.0401 16.0401 17.1214 17.1214 18.4861 18.4861 20.5335 20.5335 k = 0.2391 0.1381-0.0000 ( 3621 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5134 -34.5134 -34.4583 -34.4583 -30.7036 -30.7036 -30.5903 -30.5903 -30.5611 -30.5611 -30.5371 -30.5371 0.9371 0.9371 2.7847 2.7847 8.0708 8.0708 9.0105 9.0105 9.1880 9.1880 9.5288 9.5288 10.4713 10.4713 10.7261 10.7261 10.8293 10.8293 12.0756 12.0756 12.5494 12.5494 13.0008 13.0008 13.1410 13.1410 13.3105 13.3105 14.8243 14.8243 15.2007 15.2007 16.0919 16.0919 17.1381 17.1381 18.5069 18.5069 20.4518 20.4518 k = 0.2500 0.1443-0.0000 ( 3627 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5134 -34.5134 -34.4584 -34.4584 -30.7036 -30.7036 -30.5905 -30.5905 -30.5613 -30.5613 -30.5372 -30.5372 0.9870 0.9870 2.7696 2.7696 8.1343 8.1343 8.9839 8.9839 9.1632 9.1632 9.5062 9.5062 10.4587 10.4587 10.6855 10.6855 10.8069 10.8069 12.0971 12.0971 12.5300 12.5300 12.9931 12.9931 13.1307 13.1307 13.2757 13.2757 14.7602 14.7602 15.1133 15.1133 16.1405 16.1405 17.1581 17.1581 18.5255 18.5255 20.3765 20.3765 k = 0.2609 0.1506-0.0000 ( 3625 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5135 -34.5135 -34.4585 -34.4585 -30.7036 -30.7036 -30.5908 -30.5908 -30.5615 -30.5615 -30.5372 -30.5372 1.0383 1.0383 2.7539 2.7539 8.1986 8.1986 8.9295 8.9295 9.1472 9.1472 9.5024 9.5024 10.4473 10.4473 10.6434 10.6434 10.7909 10.7909 12.1189 12.1189 12.5113 12.5113 12.9854 12.9854 13.1149 13.1149 13.2444 13.2444 14.6915 14.6915 15.0285 15.0285 16.1854 16.1854 17.1811 17.1811 18.5422 18.5422 20.3110 20.3110 k = 0.2717 0.1569-0.0000 ( 3637 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5135 -34.5135 -34.4586 -34.4586 -30.7036 -30.7036 -30.5910 -30.5910 -30.5617 -30.5617 -30.5373 -30.5373 1.0908 1.0908 2.7379 2.7379 8.2626 8.2626 8.8527 8.8527 9.1422 9.1422 9.5108 9.5108 10.4362 10.4362 10.6018 10.6018 10.7798 10.7798 12.1406 12.1406 12.4932 12.4932 12.9773 12.9773 13.0905 13.0905 13.2200 13.2200 14.6183 14.6183 14.9470 14.9470 16.2264 16.2264 17.2066 17.2066 18.5569 18.5569 20.2560 20.2560 k = 0.2826 0.1632-0.0000 ( 3641 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5136 -34.5136 -34.4587 -34.4587 -30.7036 -30.7036 -30.5913 -30.5913 -30.5618 -30.5618 -30.5373 -30.5373 1.1445 1.1445 2.7213 2.7213 8.3240 8.3240 8.7659 8.7659 9.1433 9.1433 9.5267 9.5267 10.4249 10.4249 10.5622 10.5622 10.7729 10.7729 12.1625 12.1625 12.4754 12.4754 12.9683 12.9683 13.0573 13.0573 13.2035 13.2035 14.5410 14.5410 14.8689 14.8689 16.2633 16.2633 17.2343 17.2343 18.5701 18.5701 20.2114 20.2114 k = 0.2935 0.1694-0.0000 ( 3638 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5136 -34.5136 -34.4588 -34.4588 -30.7036 -30.7036 -30.5915 -30.5915 -30.5620 -30.5620 -30.5374 -30.5374 1.1992 1.1992 2.7042 2.7042 8.3766 8.3766 8.6822 8.6822 9.1472 9.1472 9.5472 9.5472 10.4124 10.4124 10.5260 10.5260 10.7699 10.7699 12.1842 12.1842 12.4577 12.4577 12.9569 12.9569 13.0190 13.0190 13.1934 13.1934 14.4600 14.4600 14.7948 14.7948 16.2960 16.2960 17.2637 17.2637 18.5816 18.5816 20.1761 20.1761 k = 0.3043 0.1757-0.0000 ( 3644 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5137 -34.5137 -34.4589 -34.4589 -30.7036 -30.7036 -30.5918 -30.5918 -30.5621 -30.5621 -30.5374 -30.5374 1.2548 1.2548 2.6866 2.6866 8.3997 8.3997 8.6258 8.6258 9.1522 9.1522 9.5706 9.5706 10.3975 10.3975 10.4946 10.4946 10.7704 10.7704 12.2055 12.2055 12.4398 12.4398 12.9363 12.9363 12.9849 12.9849 13.1872 13.1872 14.3754 14.3754 14.7248 14.7248 16.3247 16.3247 17.2945 17.2945 18.5918 18.5918 20.1477 20.1477 k = 0.3152 0.1820-0.0000 ( 3644 PWs) bands (ev): -63.8563 -63.8563 -63.8358 -63.8358 -34.5137 -34.5137 -34.4590 -34.4590 -30.7036 -30.7036 -30.5920 -30.5920 -30.5623 -30.5623 -30.5375 -30.5375 1.3111 1.3111 2.6685 2.6685 8.3623 8.3623 8.6294 8.6294 9.1574 9.1574 9.5959 9.5959 10.3789 10.3789 10.4694 10.4694 10.7742 10.7742 12.2265 12.2265 12.4218 12.4218 12.8983 12.8983 12.9654 12.9654 13.1835 13.1835 14.2879 14.2879 14.6592 14.6592 16.3495 16.3495 17.3263 17.3263 18.6007 18.6007 20.1194 20.1194 k = 0.3261 0.1883-0.0000 ( 3642 PWs) bands (ev): -63.8563 -63.8563 -63.8358 -63.8358 -34.5137 -34.5137 -34.4591 -34.4591 -30.7036 -30.7036 -30.5922 -30.5922 -30.5624 -30.5624 -30.5375 -30.5375 1.3679 1.3679 2.6498 2.6498 8.2835 8.2835 8.6753 8.6753 9.1627 9.1627 9.6223 9.6223 10.3571 10.3571 10.4504 10.4504 10.7813 10.7813 12.2469 12.2469 12.4032 12.4032 12.8501 12.8501 12.9544 12.9544 13.1812 13.1812 14.1980 14.1980 14.5982 14.5982 16.3706 16.3706 17.3588 17.3588 18.6083 18.6083 20.0755 20.0755 k = 0.3370 0.1945-0.0000 ( 3634 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5138 -34.5138 -34.4591 -34.4591 -30.7036 -30.7036 -30.5924 -30.5924 -30.5626 -30.5626 -30.5376 -30.5376 1.4251 1.4251 2.6304 2.6304 8.1920 8.1920 8.7351 8.7351 9.1679 9.1679 9.6493 9.6493 10.3335 10.3335 10.4361 10.4361 10.7914 10.7914 12.2665 12.2665 12.3841 12.3841 12.7987 12.7987 12.9460 12.9460 13.1799 13.1799 14.1065 14.1065 14.5420 14.5420 16.3882 16.3882 17.3916 17.3916 18.6149 18.6149 20.0104 20.0104 k = 0.3478 0.2008-0.0000 ( 3642 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5138 -34.5138 -34.4592 -34.4592 -30.7036 -30.7036 -30.5926 -30.5926 -30.5627 -30.5627 -30.5376 -30.5376 1.4824 1.4824 2.6103 2.6103 8.0984 8.0984 8.7984 8.7984 9.1733 9.1733 9.6764 9.6764 10.3101 10.3101 10.4248 10.4248 10.8043 10.8043 12.2850 12.2850 12.3644 12.3644 12.7462 12.7462 12.9385 12.9385 13.1793 13.1793 14.0140 14.0140 14.4904 14.4904 16.4027 16.4027 17.4243 17.4243 18.6204 18.6204 19.9375 19.9375 k = 0.3587 0.2071-0.0000 ( 3638 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5139 -34.5139 -34.4593 -34.4593 -30.7036 -30.7036 -30.5928 -30.5928 -30.5628 -30.5628 -30.5376 -30.5376 1.5398 1.5398 2.5895 2.5895 8.0061 8.0061 8.8615 8.8615 9.1794 9.1794 9.7030 9.7030 10.2886 10.2886 10.4151 10.4151 10.8198 10.8198 12.3018 12.3018 12.3447 12.3447 12.6942 12.6942 12.9314 12.9314 13.1792 13.1792 13.9215 13.9215 14.4437 14.4437 16.4145 16.4145 17.4566 17.4566 18.6250 18.6250 19.8645 19.8645 k = 0.3696 0.2134-0.0000 ( 3634 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5139 -34.5139 -34.4593 -34.4593 -30.7036 -30.7036 -30.5930 -30.5930 -30.5630 -30.5630 -30.5377 -30.5377 1.5969 1.5969 2.5679 2.5679 7.9171 7.9171 8.9219 8.9219 9.1869 9.1869 9.7287 9.7287 10.2700 10.2700 10.4064 10.4064 10.8377 10.8377 12.3108 12.3108 12.3308 12.3308 12.6432 12.6432 12.9244 12.9244 13.1793 13.1793 13.8298 13.8298 14.4019 14.4019 16.4240 16.4240 17.4881 17.4881 18.6288 18.6288 19.7944 19.7944 k = 0.3804 0.2196-0.0000 ( 3628 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5139 -34.5139 -34.4594 -34.4594 -30.7036 -30.7036 -30.5932 -30.5932 -30.5631 -30.5631 -30.5377 -30.5377 1.6537 1.6537 2.5453 2.5453 7.8323 7.8323 8.9773 8.9773 9.1972 9.1972 9.7530 9.7530 10.2550 10.2550 10.3983 10.3983 10.8575 10.8575 12.2955 12.2955 12.3391 12.3391 12.5942 12.5942 12.9174 12.9174 13.1797 13.1797 13.7400 13.7400 14.3646 14.3646 16.4314 16.4314 17.5186 17.5186 18.6317 18.6317 19.7282 19.7282 k = 0.3913 0.2259-0.0000 ( 3622 PWs) bands (ev): -63.8561 -63.8561 -63.8358 -63.8358 -34.5140 -34.5140 -34.4594 -34.4594 -30.7036 -30.7036 -30.5933 -30.5933 -30.5632 -30.5632 -30.5377 -30.5377 1.7098 1.7098 2.5217 2.5217 7.7526 7.7526 9.0247 9.0247 9.2123 9.2123 9.7753 9.7753 10.2441 10.2441 10.3903 10.3903 10.8789 10.8789 12.2733 12.2733 12.3519 12.3519 12.5481 12.5481 12.9102 12.9102 13.1803 13.1803 13.6531 13.6531 14.3318 14.3318 16.4372 16.4372 17.5477 17.5477 18.6338 18.6338 19.6666 19.6666 k = 0.4022 0.2322-0.0000 ( 3620 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5140 -34.5140 -34.4595 -34.4595 -30.7036 -30.7036 -30.5935 -30.5935 -30.5633 -30.5633 -30.5377 -30.5377 1.7652 1.7652 2.4969 2.4969 7.6785 7.6785 9.0613 9.0613 9.2346 9.2346 9.7952 9.7952 10.2377 10.2377 10.3824 10.3824 10.9015 10.9015 12.2496 12.2496 12.3631 12.3631 12.5059 12.5059 12.9026 12.9026 13.1808 13.1808 13.5703 13.5703 14.3034 14.3034 16.4415 16.4415 17.5750 17.5750 18.6353 18.6353 19.6101 19.6101 k = 0.4130 0.2385-0.0000 ( 3618 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5140 -34.5140 -34.4595 -34.4595 -30.7036 -30.7036 -30.5936 -30.5936 -30.5634 -30.5634 -30.5377 -30.5377 1.8195 1.8195 2.4710 2.4710 7.6108 7.6108 9.0861 9.0861 9.2640 9.2640 9.8124 9.8124 10.2357 10.2357 10.3745 10.3745 10.9247 10.9247 12.2254 12.2254 12.3711 12.3711 12.4697 12.4697 12.8945 12.8945 13.1813 13.1813 13.4930 13.4930 14.2790 14.2790 16.4448 16.4448 17.6002 17.6002 18.6361 18.6361 19.5590 19.5590 k = 0.4239 0.2447-0.0000 ( 3616 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5140 -34.5140 -34.4596 -34.4596 -30.7036 -30.7036 -30.5937 -30.5937 -30.5635 -30.5635 -30.5378 -30.5378 1.8726 1.8726 2.4438 2.4438 7.5498 7.5498 9.1015 9.1015 9.2980 9.2980 9.8266 9.8266 10.2380 10.2380 10.3667 10.3667 10.9480 10.9480 12.2008 12.2008 12.3726 12.3726 12.4428 12.4428 12.8858 12.8858 13.1817 13.1817 13.4226 13.4226 14.2584 14.2584 16.4471 16.4471 17.6231 17.6231 18.6365 18.6365 19.5136 19.5136 k = 0.4348 0.2510-0.0000 ( 3616 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5140 -34.5140 -34.4596 -34.4596 -30.7036 -30.7036 -30.5938 -30.5938 -30.5635 -30.5635 -30.5378 -30.5378 1.9244 1.9244 2.4152 2.4152 7.4960 7.4960 9.1107 9.1107 9.3325 9.3325 9.8381 9.8381 10.2438 10.2438 10.3590 10.3590 10.9706 10.9706 12.1767 12.1767 12.3634 12.3634 12.4300 12.4300 12.8764 12.8764 13.1817 13.1817 13.3603 13.3603 14.2412 14.2412 16.4488 16.4488 17.6435 17.6435 18.6364 18.6364 19.4740 19.4740 k = 0.4457 0.2573-0.0000 ( 3616 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5939 -30.5939 -30.5636 -30.5636 -30.5378 -30.5378 1.9745 1.9745 2.3851 2.3851 7.4497 7.4497 9.1161 9.1161 9.3648 9.3648 9.8471 9.8471 10.2522 10.2522 10.3514 10.3514 10.9919 10.9919 12.1536 12.1536 12.3465 12.3465 12.4283 12.4283 12.8664 12.8664 13.1810 13.1810 13.3076 13.3076 14.2272 14.2272 16.4500 16.4500 17.6612 17.6612 18.6361 18.6361 19.4403 19.4403 k = 0.4565 0.2636-0.0000 ( 3616 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5940 -30.5940 -30.5636 -30.5636 -30.5378 -30.5378 2.0229 2.0229 2.3535 2.3535 7.4114 7.4114 9.1194 9.1194 9.3928 9.3928 9.8539 9.8539 10.2621 10.2621 10.3441 10.3441 11.0109 11.0109 12.1327 12.1327 12.3290 12.3290 12.4307 12.4307 12.8564 12.8564 13.1791 13.1791 13.2658 13.2658 14.2162 14.2162 16.4508 16.4508 17.6759 17.6759 18.6356 18.6356 19.4128 19.4128 k = 0.4674 0.2698-0.0000 ( 3620 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5941 -30.5941 -30.5637 -30.5637 -30.5378 -30.5378 2.0691 2.0691 2.3206 2.3206 7.3813 7.3813 9.1213 9.1213 9.4153 9.4153 9.8588 9.8588 10.2725 10.2725 10.3371 10.3371 11.0269 11.0269 12.1149 12.1149 12.3144 12.3144 12.4338 12.4338 12.8469 12.8469 13.1749 13.1749 13.2363 13.2363 14.2079 14.2079 16.4513 16.4513 17.6874 17.6874 18.6350 18.6350 19.3913 19.3913 k = 0.4783 0.2761-0.0000 ( 3624 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5941 -30.5941 -30.5637 -30.5637 -30.5378 -30.5378 2.1126 2.1126 2.2867 2.2867 7.3596 7.3596 9.1224 9.1224 9.4318 9.4318 9.8622 9.8622 10.2820 10.2820 10.3307 10.3307 11.0390 11.0390 12.1014 12.1014 12.3036 12.3036 12.4364 12.4364 12.8390 12.8390 13.1683 13.1683 13.2192 13.2192 14.2020 14.2020 16.4516 16.4516 17.6958 17.6958 18.6345 18.6345 19.3759 19.3759 k = 0.4891 0.2824-0.0000 ( 3622 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5942 -30.5942 -30.5637 -30.5637 -30.5379 -30.5379 2.1511 2.1511 2.2540 2.2540 7.3466 7.3466 9.1230 9.1230 9.4418 9.4418 9.8642 9.8642 10.2893 10.2893 10.3255 10.3255 11.0466 11.0466 12.0928 12.0928 12.2971 12.2971 12.4380 12.4380 12.8337 12.8337 13.1621 13.1621 13.2115 13.2115 14.1986 14.1986 16.4518 16.4518 17.7009 17.7009 18.6342 18.6342 19.3667 19.3667 k = 0.5000 0.2887-0.0000 ( 3624 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5942 -30.5942 -30.5637 -30.5637 -30.5379 -30.5379 2.1719 2.1719 2.2351 2.2351 7.3422 7.3422 9.1231 9.1231 9.4452 9.4452 9.8648 9.8648 10.2923 10.2923 10.3234 10.3234 11.0492 11.0492 12.0899 12.0899 12.2949 12.2949 12.4386 12.4386 12.8319 12.8319 13.1595 13.1595 13.2095 13.2095 14.1975 14.1975 16.4518 16.4518 17.7026 17.7026 18.6340 18.6340 19.3637 19.3637 k = 0.5000 0.2887-0.0000 ( 3624 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5942 -30.5942 -30.5637 -30.5637 -30.5379 -30.5379 2.1719 2.1719 2.2351 2.2351 7.3422 7.3422 9.1231 9.1231 9.4452 9.4452 9.8648 9.8648 10.2923 10.2923 10.3234 10.3234 11.0492 11.0492 12.0899 12.0899 12.2949 12.2949 12.4386 12.4386 12.8319 12.8319 13.1595 13.1595 13.2095 13.2095 14.1975 14.1975 16.4518 16.4518 17.7026 17.7026 18.6340 18.6340 19.3637 19.3637 k = 0.4938 0.2994-0.0000 ( 3624 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5942 -30.5942 -30.5637 -30.5637 -30.5379 -30.5379 2.1722 2.1722 2.2357 2.2357 7.3431 7.3431 9.1189 9.1189 9.4458 9.4458 9.8679 9.8679 10.2844 10.2844 10.3256 10.3256 11.0496 11.0496 12.0911 12.0911 12.2967 12.2967 12.4416 12.4416 12.8322 12.8322 13.1594 13.1594 13.2092 13.2092 14.2001 14.2001 16.4473 16.4473 17.6694 17.6694 18.6691 18.6691 19.3676 19.3676 k = 0.4877 0.3101-0.0000 ( 3624 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5942 -30.5942 -30.5637 -30.5637 -30.5379 -30.5379 2.1729 2.1729 2.2373 2.2373 7.3456 7.3456 9.1064 9.1064 9.4476 9.4476 9.8759 9.8759 10.2647 10.2647 10.3292 10.3292 11.0508 11.0508 12.0946 12.0946 12.3022 12.3022 12.4506 12.4506 12.8330 12.8330 13.1589 13.1589 13.2084 13.2084 14.2081 14.2081 16.4338 16.4338 17.5818 17.5818 18.7618 18.7618 19.3793 19.3793 k = 0.4815 0.3208-0.0000 ( 3624 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5942 -30.5942 -30.5637 -30.5637 -30.5379 -30.5379 2.1742 2.1742 2.2399 2.2399 7.3499 7.3499 9.0867 9.0867 9.4512 9.4512 9.8854 9.8854 10.2378 10.2378 10.3327 10.3327 11.0527 11.0527 12.0997 12.0997 12.3110 12.3110 12.4656 12.4656 12.8343 12.8343 13.1581 13.1581 13.2069 13.2069 14.2213 14.2213 16.4113 16.4113 17.4615 17.4615 18.8890 18.8890 19.3989 19.3989 k = 0.4753 0.3314-0.0000 ( 3620 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4598 -34.4598 -30.7036 -30.7036 -30.5942 -30.5942 -30.5638 -30.5638 -30.5379 -30.5379 2.1759 2.1759 2.2435 2.2435 7.3559 7.3559 9.0609 9.0609 9.4568 9.4568 9.8905 9.8905 10.2082 10.2082 10.3374 10.3374 11.0551 11.0551 12.1059 12.1059 12.3229 12.3229 12.4863 12.4863 12.8361 12.8361 13.1569 13.1569 13.2050 13.2050 14.2394 14.2394 16.3796 16.3796 17.3242 17.3242 19.0278 19.0278 19.3945 19.3945 k = 0.4691 0.3421-0.0000 ( 3618 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4598 -34.4598 -30.7036 -30.7036 -30.5942 -30.5942 -30.5638 -30.5638 -30.5379 -30.5379 2.1781 2.1781 2.2481 2.2481 7.3635 7.3635 9.0304 9.0304 9.4647 9.4647 9.8836 9.8836 10.1813 10.1813 10.3455 10.3455 11.0582 11.0582 12.1125 12.1125 12.3374 12.3374 12.5126 12.5126 12.8385 12.8385 13.1554 13.1554 13.2025 13.2025 14.2623 14.2623 16.3388 16.3388 17.1785 17.1785 19.1243 19.1243 19.3475 19.3475 k = 0.4630 0.3528-0.0000 ( 3612 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4598 -34.4598 -30.7036 -30.7036 -30.5942 -30.5942 -30.5638 -30.5638 -30.5379 -30.5379 2.1809 2.1809 2.2536 2.2536 7.3727 7.3727 8.9965 8.9965 9.4750 9.4750 9.8574 9.8574 10.1617 10.1617 10.3599 10.3599 11.0617 11.0617 12.1190 12.1190 12.3536 12.3536 12.5440 12.5440 12.8414 12.8414 13.1537 13.1537 13.1996 13.1996 14.2894 14.2894 16.2888 16.2888 17.0295 17.0295 19.0840 19.0840 19.4480 19.4480 k = 0.4568 0.3635-0.0000 ( 3620 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4598 -34.4598 -30.7036 -30.7036 -30.5943 -30.5943 -30.5638 -30.5638 -30.5379 -30.5379 2.1841 2.1841 2.2599 2.2599 7.3835 7.3835 8.9603 8.9603 9.4876 9.4876 9.8108 9.8108 10.1492 10.1492 10.3829 10.3829 11.0656 11.0656 12.1250 12.1250 12.3706 12.3706 12.5803 12.5803 12.8449 12.8449 13.1514 13.1514 13.1961 13.1961 14.3205 14.3205 16.2297 16.2297 16.8797 16.8797 18.9914 18.9914 19.5536 19.5536 k = 0.4506 0.3742-0.0000 ( 3620 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4598 -34.4598 -30.7036 -30.7036 -30.5943 -30.5943 -30.5638 -30.5638 -30.5379 -30.5379 2.1878 2.1878 2.2670 2.2670 7.3957 7.3957 8.9229 8.9229 9.5024 9.5024 9.7475 9.7475 10.1396 10.1396 10.4154 10.4154 11.0700 11.0700 12.1303 12.1303 12.3879 12.3879 12.6209 12.6209 12.8491 12.8491 13.1490 13.1490 13.1925 13.1925 14.3548 14.3548 16.1616 16.1616 16.7310 16.7310 18.8952 18.8952 19.6141 19.6141 k = 0.4444 0.3849-0.0000 ( 3621 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4598 -34.4598 -30.7036 -30.7036 -30.5943 -30.5943 -30.5639 -30.5639 -30.5379 -30.5379 2.1920 2.1920 2.2747 2.2747 7.4094 7.4094 8.8850 8.8850 9.5192 9.5192 9.6728 9.6728 10.1295 10.1295 10.4567 10.4567 11.0747 11.0747 12.1351 12.1351 12.4045 12.4045 12.6652 12.6652 12.8542 12.8542 13.1463 13.1463 13.1886 13.1886 14.3919 14.3919 16.0849 16.0849 16.5844 16.5844 18.8036 18.8036 19.6814 19.6814 k = 0.4383 0.3956-0.0000 ( 3623 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4598 -34.4598 -30.7036 -30.7036 -30.5944 -30.5944 -30.5639 -30.5639 -30.5379 -30.5379 2.1967 2.1967 2.2830 2.2830 7.4243 7.4243 8.8471 8.8471 9.5378 9.5378 9.5908 9.5908 10.1174 10.1174 10.5050 10.5050 11.0797 11.0797 12.1391 12.1391 12.4199 12.4199 12.7121 12.7121 12.8608 12.8608 13.1432 13.1432 13.1848 13.1848 14.4311 14.4311 16.0001 16.0001 16.4409 16.4409 18.7188 18.7188 19.7564 19.7564 k = 0.4321 0.4063-0.0000 ( 3629 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4598 -34.4598 -30.7036 -30.7036 -30.5944 -30.5944 -30.5640 -30.5640 -30.5379 -30.5379 2.2018 2.2018 2.2917 2.2917 7.4405 7.4405 8.8098 8.8098 9.5041 9.5041 9.5584 9.5584 10.1034 10.1034 10.5582 10.5582 11.0851 11.0851 12.1426 12.1426 12.4337 12.4337 12.7594 12.7594 12.8704 12.8704 13.1400 13.1400 13.1813 13.1813 14.4717 14.4717 15.9078 15.9078 16.3010 16.3010 18.6416 18.6416 19.8391 19.8391 k = 0.4259 0.4170-0.0000 ( 3641 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4599 -34.4599 -30.7036 -30.7036 -30.5945 -30.5945 -30.5640 -30.5640 -30.5380 -30.5380 2.2074 2.2074 2.3007 2.3007 7.4577 7.4577 8.7734 8.7734 9.4154 9.4154 9.5803 9.5803 10.0878 10.0878 10.6146 10.6146 11.0909 11.0909 12.1453 12.1453 12.4454 12.4454 12.8025 12.8025 12.8867 12.8867 13.1365 13.1365 13.1788 13.1788 14.5131 14.5131 15.8087 15.8087 16.1654 16.1654 18.5720 18.5720 19.9293 19.9293 k = 0.4198 0.4277-0.0000 ( 3629 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4599 -34.4599 -30.7036 -30.7036 -30.5945 -30.5945 -30.5640 -30.5640 -30.5380 -30.5380 2.2135 2.2135 2.3098 2.3098 7.4758 7.4758 8.7382 8.7382 9.3259 9.3259 9.6035 9.6035 10.0711 10.0711 10.6728 10.6728 11.0973 11.0973 12.1475 12.1475 12.4552 12.4552 12.8330 12.8330 12.9169 12.9169 13.1331 13.1331 13.1785 13.1785 14.5546 14.5546 15.7040 15.7040 16.0345 16.0345 18.5099 18.5099 20.0268 20.0268 k = 0.4136 0.4384-0.0000 ( 3625 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4599 -34.4599 -30.7036 -30.7036 -30.5945 -30.5945 -30.5640 -30.5640 -30.5380 -30.5380 2.2200 2.2200 2.3189 2.3189 7.4945 7.4945 8.7042 8.7042 9.2373 9.2373 9.6278 9.6278 10.0539 10.0539 10.7316 10.7316 11.1042 11.1042 12.1491 12.1491 12.4627 12.4627 12.8503 12.8503 12.9587 12.9587 13.1297 13.1297 13.1829 13.1829 14.5957 14.5957 15.5941 15.5941 15.9090 15.9090 18.4549 18.4549 20.1312 20.1312 k = 0.4074 0.4491-0.0000 ( 3631 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4599 -34.4599 -30.7036 -30.7036 -30.5946 -30.5946 -30.5641 -30.5641 -30.5380 -30.5380 2.2269 2.2269 2.3277 2.3277 7.5138 7.5138 8.6716 8.6716 9.1506 9.1506 9.6529 9.6529 10.0364 10.0364 10.7898 10.7898 11.1117 11.1117 12.1500 12.1500 12.4680 12.4680 12.8612 12.8612 13.0000 13.0000 13.1263 13.1263 13.1968 13.1968 14.6357 14.6357 15.4802 15.4802 15.7892 15.7892 18.4064 18.4064 20.2421 20.2421 k = 0.4012 0.4597-0.0000 ( 3635 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4599 -34.4599 -30.7036 -30.7036 -30.5947 -30.5947 -30.5641 -30.5641 -30.5380 -30.5380 2.2342 2.2342 2.3362 2.3362 7.5332 7.5332 8.6404 8.6404 9.0673 9.0673 9.6784 9.6784 10.0190 10.0190 10.8463 10.8463 11.1203 11.1203 12.1502 12.1502 12.4712 12.4712 12.8700 12.8700 13.0306 13.0306 13.1226 13.1226 13.2267 13.2268 14.6743 14.6743 15.3633 15.3633 15.6757 15.6757 18.3639 18.3639 20.3589 20.3589 k = 0.3951 0.4704-0.0000 ( 3631 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5947 -30.5947 -30.5641 -30.5641 -30.5381 -30.5381 2.2419 2.2419 2.3442 2.3442 7.5525 7.5525 8.6105 8.6105 8.9885 8.9885 9.7042 9.7042 10.0020 10.0020 10.8999 10.8999 11.1304 11.1304 12.1499 12.1499 12.4726 12.4726 12.8780 12.8780 13.0468 13.0468 13.1187 13.1187 13.2749 13.2749 14.7111 14.7111 15.2443 15.2443 15.5691 15.5691 18.3269 18.3269 20.4808 20.4808 k = 0.3889 0.4811-0.0000 ( 3633 PWs) bands (ev): -63.8562 -63.8562 -63.8356 -63.8356 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5948 -30.5948 -30.5642 -30.5642 -30.5381 -30.5381 2.2500 2.2500 2.3513 2.3513 7.5713 7.5713 8.5817 8.5817 8.9153 8.9153 9.7299 9.7299 9.9856 9.9856 10.9491 10.9491 11.1427 11.1427 12.1490 12.1490 12.4722 12.4722 12.8859 12.8859 13.0520 13.0520 13.1144 13.1144 13.3369 13.3369 14.7453 14.7453 15.1246 15.1246 15.4697 15.4697 18.2950 18.2950 20.6069 20.6069 k = 0.3827 0.4918-0.0000 ( 3631 PWs) bands (ev): -63.8562 -63.8562 -63.8356 -63.8356 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5948 -30.5948 -30.5642 -30.5642 -30.5381 -30.5381 2.2585 2.2585 2.3574 2.3574 7.5892 7.5892 8.5539 8.5539 8.8492 8.8492 9.7551 9.7551 9.9700 9.9700 10.9920 10.9920 11.1583 11.1583 12.1474 12.1474 12.4703 12.4703 12.8941 12.8941 13.0509 13.0509 13.1099 13.1099 13.4077 13.4077 14.7760 14.7760 15.0059 15.0059 15.3781 15.3781 18.2676 18.2676 20.7359 20.7359 k = 0.3765 0.5025-0.0000 ( 3631 PWs) bands (ev): -63.8562 -63.8562 -63.8356 -63.8356 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5948 -30.5948 -30.5642 -30.5642 -30.5381 -30.5381 2.2674 2.2674 2.3624 2.3624 7.6057 7.6057 8.5268 8.5268 8.7912 8.7912 9.7794 9.7794 9.9554 9.9554 11.0269 11.0269 11.1781 11.1781 12.1453 12.1453 12.4672 12.4672 12.9025 12.9025 13.0464 13.0464 13.1054 13.1054 13.4842 13.4842 14.7971 14.7971 14.8951 14.8951 15.2946 15.2946 18.2444 18.2444 20.8662 20.8662 k = 0.3704 0.5132-0.0000 ( 3631 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5949 -30.5949 -30.5643 -30.5643 -30.5381 -30.5381 2.2765 2.2765 2.3659 2.3659 7.6204 7.6204 8.5005 8.5005 8.7422 8.7422 9.8025 9.8025 9.9419 9.9419 11.0531 11.0531 11.2021 11.2021 12.1428 12.1428 12.4631 12.4631 12.9114 12.9114 13.0399 13.0399 13.1011 13.1011 13.5644 13.5644 14.7471 14.7471 14.8542 14.8542 15.2197 15.2197 18.2249 18.2249 20.9955 20.9955 k = 0.3642 0.5239-0.0000 ( 3631 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5949 -30.5949 -30.5643 -30.5643 -30.5381 -30.5381 2.2860 2.2860 2.3678 2.3678 7.6329 7.6329 8.4756 8.4756 8.7026 8.7026 9.8238 9.8238 9.9297 9.9297 11.0715 11.0715 11.2284 11.2284 12.1401 12.1401 12.4584 12.4584 12.9205 12.9205 13.0323 13.0323 13.0969 13.0969 13.6472 13.6472 14.6383 14.6383 14.8721 14.8721 15.1538 15.1538 18.2090 18.2090 21.1209 21.1209 k = 0.3580 0.5346-0.0000 ( 3631 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5949 -30.5949 -30.5643 -30.5643 -30.5381 -30.5381 2.2957 2.2957 2.3678 2.3678 7.6427 7.6427 8.4530 8.4530 8.6722 8.6722 9.8428 9.8428 9.9190 9.9190 11.0842 11.0842 11.2540 11.2540 12.1373 12.1373 12.4535 12.4535 12.9300 12.9300 13.0240 13.0240 13.0931 13.0931 13.7322 13.7322 14.5269 14.5269 14.8936 14.8936 15.0971 15.0971 18.1963 18.1963 21.2378 21.2378 k = 0.3519 0.5453-0.0000 ( 3627 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4601 -34.4601 -30.7036 -30.7036 -30.5949 -30.5949 -30.5643 -30.5643 -30.5381 -30.5381 2.3055 2.3055 2.3659 2.3659 7.6498 7.6498 8.4339 8.4339 8.6502 8.6502 9.8591 9.8591 9.9100 9.9100 11.0928 11.0928 11.2764 11.2764 12.1348 12.1348 12.4487 12.4487 12.9397 12.9397 13.0155 13.0155 13.0898 13.0898 13.8181 13.8181 14.4188 14.4188 14.9140 14.9140 15.0498 15.0498 18.1866 18.1866 21.3400 21.3400 k = 0.3457 0.5560-0.0000 ( 3611 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5949 -30.5949 -30.5643 -30.5643 -30.5381 -30.5381 2.3152 2.3152 2.3622 2.3622 7.6542 7.6542 8.4196 8.4196 8.6356 8.6356 9.8717 9.8717 9.9030 9.9030 11.0985 11.0985 11.2937 11.2937 12.1328 12.1328 12.4447 12.4447 12.9488 12.9488 13.0075 13.0075 13.0872 13.0872 13.9034 13.9034 14.3170 14.3170 14.9326 14.9326 15.0121 15.0121 18.1799 18.1799 21.4194 21.4194 k = 0.3395 0.5667-0.0000 ( 3607 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4601 -34.4601 -30.7035 -30.7035 -30.5950 -30.5950 -30.5643 -30.5643 -30.5381 -30.5381 2.3239 2.3239 2.3571 2.3571 7.6563 7.6563 8.4109 8.4109 8.6275 8.6275 9.8795 9.8795 9.8989 9.8989 11.1017 11.1017 11.3046 11.3046 12.1316 12.1316 12.4418 12.4418 12.9563 12.9563 13.0009 13.0009 13.0854 13.0854 13.9822 13.9822 14.2277 14.2277 14.9495 14.9495 14.9839 14.9839 18.1759 18.1759 21.4684 21.4684 k = 0.3333 0.5774-0.0000 ( 3603 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4601 -34.4601 -30.7035 -30.7035 -30.5950 -30.5950 -30.5643 -30.5643 -30.5381 -30.5381 2.3284 2.3284 2.3539 2.3539 7.6567 7.6567 8.4080 8.4080 8.6249 8.6249 9.8817 9.8817 9.8980 9.8980 11.1027 11.1027 11.3084 11.3084 12.1312 12.1312 12.4407 12.4407 12.9594 12.9594 12.9983 12.9983 13.0847 13.0847 14.0249 14.0249 14.1814 14.1814 14.9631 14.9631 14.9666 14.9666 18.1746 18.1746 21.4840 21.4840 k = 0.3333 0.5774-0.0000 ( 3603 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4601 -34.4601 -30.7035 -30.7035 -30.5950 -30.5950 -30.5643 -30.5643 -30.5381 -30.5381 2.3284 2.3284 2.3539 2.3539 7.6567 7.6567 8.4080 8.4080 8.6249 8.6249 9.8817 9.8817 9.8980 9.8980 11.1027 11.1027 11.3084 11.3084 12.1312 12.1312 12.4407 12.4407 12.9594 12.9594 12.9983 12.9983 13.0847 13.0847 14.0249 14.0249 14.1814 14.1814 14.9631 14.9631 14.9666 14.9666 18.1746 18.1746 21.4840 21.4840 k = 0.3270 0.5665-0.0000 ( 3611 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4601 -34.4601 -30.7036 -30.7036 -30.5950 -30.5950 -30.5643 -30.5643 -30.5381 -30.5381 2.3226 2.3226 2.3583 2.3583 7.6566 7.6566 8.4108 8.4108 8.6274 8.6274 9.8807 9.8807 9.8975 9.8975 11.1016 11.1016 11.3045 11.3045 12.1316 12.1316 12.4421 12.4421 12.9561 12.9561 13.0007 13.0007 13.0856 13.0856 13.9833 13.9833 14.2271 14.2271 14.9545 14.9545 14.9789 14.9789 18.1759 18.1759 21.4704 21.4704 k = 0.3208 0.5556-0.0000 ( 3621 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5949 -30.5949 -30.5643 -30.5643 -30.5381 -30.5381 2.3089 2.3089 2.3679 2.3679 7.6569 7.6569 8.4190 8.4190 8.6345 8.6345 9.8788 9.8788 9.8947 9.8947 11.0981 11.0981 11.2931 11.2931 12.1327 12.1327 12.4463 12.4463 12.9480 12.9480 13.0062 13.0062 13.0884 13.0884 13.9121 13.9121 14.3108 14.3108 14.9533 14.9533 14.9916 14.9916 18.1800 18.1800 21.4355 21.4355 k = 0.3145 0.5447-0.0000 ( 3633 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4601 -34.4601 -30.7036 -30.7036 -30.5949 -30.5949 -30.5643 -30.5643 -30.5381 -30.5381 2.2904 2.2904 2.3792 2.3792 7.6587 7.6587 8.4318 8.4318 8.6458 8.6458 9.8741 9.8741 9.8912 9.8912 11.0918 11.0918 11.2748 11.2748 12.1342 12.1342 12.4539 12.4539 12.9373 12.9373 13.0113 13.0113 13.0934 13.0934 13.8425 13.8425 14.4026 14.4026 14.9603 14.9603 15.0032 15.0032 18.1868 18.1868 21.3876 21.3876 k = 0.3082 0.5338-0.0000 ( 3641 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5949 -30.5949 -30.5643 -30.5643 -30.5381 -30.5381 2.2683 2.2683 2.3913 2.3913 7.6632 7.6632 8.4484 8.4484 8.6609 8.6609 9.8623 9.8623 9.8913 9.8913 11.0821 11.0821 11.2509 11.2509 12.1359 12.1359 12.4650 12.4650 12.9249 12.9249 13.0147 13.0147 13.1005 13.1005 13.7810 13.7810 14.4970 14.4970 14.9751 14.9751 15.0141 15.0141 18.1963 18.1963 21.3324 21.3324 k = 0.3019 0.5229-0.0000 ( 3637 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5949 -30.5949 -30.5643 -30.5643 -30.5381 -30.5381 2.2426 2.2426 2.4038 2.4038 7.6711 7.6711 8.4682 8.4682 8.6796 8.6796 9.8430 9.8430 9.8950 9.8950 11.0681 11.0681 11.2230 11.2230 12.1379 12.1379 12.4797 12.4797 12.9108 12.9108 13.0158 13.0158 13.1086 13.1086 13.7306 13.7306 14.5924 14.5924 14.9969 14.9969 15.0246 15.0246 18.2088 18.2088 21.2734 21.2734 k = 0.2956 0.5120-0.0000 ( 3629 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5948 -30.5948 -30.5642 -30.5642 -30.5381 -30.5381 2.2135 2.2135 2.4167 2.4167 7.6833 7.6833 8.4906 8.4906 8.7012 8.7012 9.8173 9.8173 9.9014 9.9014 11.0484 11.0484 11.1934 11.1934 12.1400 12.1400 12.4980 12.4980 12.8947 12.8947 13.0147 13.0147 13.1165 13.1165 13.6934 13.6934 14.6878 14.6878 15.0245 15.0245 15.0356 15.0356 18.2242 18.2242 21.2128 21.2128 k = 0.2893 0.5011-0.0000 ( 3627 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5947 -30.5947 -30.5642 -30.5642 -30.5381 -30.5381 2.1812 2.1812 2.4300 2.4300 7.7002 7.7002 8.5152 8.5152 8.7255 8.7255 9.7856 9.7856 9.9101 9.9101 11.0216 11.0216 11.1644 11.1644 12.1426 12.1426 12.5194 12.5194 12.8763 12.8763 13.0118 13.0118 13.1229 13.1229 13.6706 13.6706 14.7825 14.7825 15.0440 15.0440 15.0606 15.0606 18.2426 18.2426 21.1520 21.1520 k = 0.2830 0.4902-0.0000 ( 3633 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4600 -34.4600 -30.7036 -30.7036 -30.5947 -30.5947 -30.5641 -30.5641 -30.5381 -30.5381 2.1458 2.1458 2.4435 2.4435 7.7223 7.7223 8.5416 8.5416 8.7520 8.7520 9.7483 9.7483 9.9208 9.9208 10.9869 10.9869 11.1377 11.1377 12.1455 12.1455 12.5435 12.5435 12.8551 12.8551 13.0074 13.0074 13.1273 13.1273 13.6628 13.6628 14.8757 14.8757 15.0556 15.0556 15.0995 15.0995 18.2641 18.2641 21.0919 21.0919 k = 0.2767 0.4793-0.0000 ( 3641 PWs) bands (ev): -63.8562 -63.8562 -63.8357 -63.8357 -34.5142 -34.5142 -34.4599 -34.4599 -30.7036 -30.7036 -30.5946 -30.5946 -30.5641 -30.5641 -30.5381 -30.5381 2.1073 2.1073 2.4572 2.4572 7.7498 7.7498 8.5694 8.5694 8.7804 8.7804 9.7056 9.7056 9.9337 9.9337 10.9448 10.9448 11.1136 11.1136 12.1491 12.1491 12.5699 12.5699 12.8309 12.8309 13.0021 13.0021 13.1299 13.1299 13.6696 13.6696 14.9655 14.9655 15.0684 15.0684 15.1439 15.1439 18.2890 18.2890 21.0330 21.0330 k = 0.2704 0.4684-0.0000 ( 3641 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4599 -34.4599 -30.7036 -30.7036 -30.5945 -30.5945 -30.5640 -30.5640 -30.5380 -30.5380 2.0660 2.0660 2.4712 2.4712 7.7829 7.7829 8.5984 8.5984 8.8100 8.8100 9.6581 9.6581 9.9487 9.9487 10.8970 10.8970 11.0915 11.0915 12.1536 12.1536 12.5983 12.5983 12.8037 12.8037 12.9963 12.9963 13.1314 13.1314 13.6896 13.6896 15.0452 15.0452 15.0884 15.0884 15.1940 15.1940 18.3174 18.3174 20.9756 20.9756 k = 0.2642 0.4575-0.0000 ( 3641 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5142 -34.5142 -34.4598 -34.4598 -30.7036 -30.7036 -30.5944 -30.5944 -30.5639 -30.5639 -30.5380 -30.5380 2.0220 2.0220 2.4854 2.4854 7.8215 7.8215 8.6282 8.6282 8.8408 8.8408 9.6063 9.6063 9.9658 9.9658 10.8451 10.8451 11.0704 11.0704 12.1592 12.1592 12.6279 12.6279 12.7741 12.7741 12.9906 12.9906 13.1324 13.1324 13.7207 13.7207 15.0833 15.0833 15.1444 15.1444 15.2514 15.2514 18.3495 18.3495 20.9200 20.9200 k = 0.2579 0.4466-0.0000 ( 3633 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4598 -34.4598 -30.7036 -30.7036 -30.5942 -30.5942 -30.5639 -30.5639 -30.5380 -30.5380 1.9756 1.9756 2.4998 2.4998 7.8657 7.8657 8.6584 8.6584 8.8723 8.8723 9.5508 9.5508 9.9849 9.9849 10.7907 10.7907 11.0496 11.0496 12.1662 12.1662 12.6574 12.6574 12.7437 12.7437 12.9854 12.9854 13.1335 13.1335 13.7609 13.7609 15.1016 15.1016 15.2124 15.2124 15.3179 15.3179 18.3855 18.3855 20.8662 20.8662 k = 0.2516 0.4357-0.0000 ( 3637 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5941 -30.5941 -30.5638 -30.5638 -30.5380 -30.5380 1.9269 1.9269 2.5144 2.5144 7.9153 7.9153 8.6885 8.6885 8.9042 8.9042 9.4924 9.4924 10.0060 10.0060 10.7350 10.7350 11.0286 11.0286 12.1743 12.1743 12.6776 12.6776 12.7219 12.7219 12.9808 12.9808 13.1350 13.1350 13.8085 13.8085 15.1193 15.1193 15.2731 15.2731 15.3924 15.3924 18.4255 18.4255 20.8143 20.8143 k = 0.2453 0.4248-0.0000 ( 3637 PWs) bands (ev): -63.8562 -63.8562 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5940 -30.5940 -30.5637 -30.5637 -30.5379 -30.5379 1.8763 1.8763 2.5292 2.5292 7.9701 7.9701 8.7177 8.7177 8.9365 8.9365 9.4320 9.4320 10.0291 10.0291 10.6790 10.6790 11.0076 11.0076 12.1837 12.1837 12.6600 12.6600 12.7377 12.7377 12.9772 12.9772 13.1371 13.1371 13.8620 13.8620 15.1386 15.1386 15.3277 15.3277 15.4709 15.4709 18.4700 18.4700 20.7644 20.7644 k = 0.2390 0.4139-0.0000 ( 3641 PWs) bands (ev): -63.8562 -63.8562 -63.8357 -63.8357 -34.5141 -34.5141 -34.4596 -34.4596 -30.7036 -30.7036 -30.5938 -30.5938 -30.5636 -30.5636 -30.5379 -30.5379 1.8240 1.8240 2.5441 2.5441 8.0299 8.0299 8.7448 8.7448 8.9689 8.9689 9.3710 9.3710 10.0541 10.0541 10.6236 10.6236 10.9864 10.9864 12.1943 12.1943 12.6265 12.6265 12.7691 12.7691 12.9746 12.9746 13.1399 13.1399 13.9200 13.9200 15.1601 15.1601 15.3780 15.3780 15.5501 15.5501 18.5189 18.5189 20.7162 20.7162 k = 0.2327 0.4031-0.0000 ( 3641 PWs) bands (ev): -63.8562 -63.8562 -63.8357 -63.8357 -34.5140 -34.5140 -34.4596 -34.4596 -30.7036 -30.7036 -30.5937 -30.5937 -30.5635 -30.5635 -30.5378 -30.5378 1.7702 1.7702 2.5592 2.5592 8.0943 8.0943 8.7683 8.7683 9.0016 9.0016 9.3110 9.3110 10.0807 10.0807 10.5696 10.5696 10.9651 10.9651 12.2063 12.2063 12.5906 12.5906 12.8029 12.8029 12.9732 12.9732 13.1433 13.1433 13.9816 13.9816 15.1842 15.1842 15.4253 15.4253 15.6277 15.6277 18.5727 18.5727 20.6699 20.6699 k = 0.2264 0.3922-0.0000 ( 3641 PWs) bands (ev): -63.8562 -63.8562 -63.8357 -63.8357 -34.5140 -34.5140 -34.4595 -34.4595 -30.7036 -30.7036 -30.5935 -30.5935 -30.5633 -30.5633 -30.5378 -30.5378 1.7152 1.7152 2.5744 2.5744 8.1631 8.1631 8.7857 8.7857 9.0343 9.0343 9.2543 9.2543 10.1089 10.1089 10.5178 10.5178 10.9438 10.9438 12.2196 12.2196 12.5541 12.5541 12.8372 12.8372 12.9732 12.9732 13.1475 13.1475 14.0458 14.0458 15.2111 15.2111 15.4697 15.4697 15.7025 15.7025 18.6316 18.6316 20.6252 20.6252 k = 0.2201 0.3813-0.0000 ( 3643 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5140 -34.5140 -34.4595 -34.4595 -30.7036 -30.7036 -30.5933 -30.5933 -30.5632 -30.5632 -30.5378 -30.5378 1.6592 1.6592 2.5896 2.5896 8.2357 8.2357 8.7937 8.7937 9.0673 9.0673 9.2044 9.2044 10.1381 10.1381 10.4693 10.4693 10.9228 10.9228 12.2338 12.2338 12.5176 12.5176 12.8706 12.8706 12.9750 12.9750 13.1526 13.1526 14.1119 14.1119 15.2412 15.2412 15.5113 15.5113 15.7734 15.7734 18.6957 18.6957 20.5820 20.5820 k = 0.2138 0.3704-0.0000 ( 3647 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5139 -34.5139 -34.4594 -34.4594 -30.7036 -30.7036 -30.5931 -30.5931 -30.5631 -30.5631 -30.5377 -30.5377 1.6024 1.6024 2.6050 2.6050 8.3117 8.3117 8.7882 8.7882 9.1005 9.1005 9.1653 9.1653 10.1673 10.1673 10.4257 10.4257 10.9021 10.9021 12.2491 12.2491 12.4814 12.4814 12.9016 12.9016 12.9796 12.9796 13.1587 13.1587 14.1791 14.1791 15.2746 15.2746 15.5500 15.5500 15.8397 15.8397 18.7653 18.7653 20.5397 20.5397 k = 0.2075 0.3595-0.0000 ( 3639 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5139 -34.5139 -34.4593 -34.4593 -30.7036 -30.7036 -30.5929 -30.5929 -30.5629 -30.5629 -30.5377 -30.5377 1.5452 1.5452 2.6204 2.6204 8.3904 8.3904 8.7661 8.7661 9.1334 9.1334 9.1404 9.1404 10.1949 10.1949 10.3896 10.3896 10.8821 10.8821 12.2654 12.2654 12.4459 12.4459 12.9273 12.9273 12.9895 12.9895 13.1662 13.1662 14.2469 14.2469 15.3115 15.3115 15.5859 15.5859 15.9008 15.9008 18.8406 18.8406 20.4979 20.4979 k = 0.2013 0.3486-0.0000 ( 3641 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5138 -34.5138 -34.4592 -34.4592 -30.7036 -30.7036 -30.5927 -30.5927 -30.5628 -30.5628 -30.5376 -30.5376 1.4877 1.4877 2.6359 2.6359 8.4711 8.4711 8.7278 8.7278 9.1292 9.1292 9.1662 9.1662 10.2160 10.2160 10.3661 10.3661 10.8630 10.8630 12.2823 12.2823 12.4109 12.4109 12.9444 12.9444 13.0070 13.0070 13.1755 13.1755 14.3147 14.3147 15.3520 15.3520 15.6188 15.6188 15.9560 15.9560 18.9218 18.9218 20.4552 20.4552 k = 0.1950 0.3377-0.0000 ( 3639 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5138 -34.5138 -34.4592 -34.4592 -30.7036 -30.7036 -30.5925 -30.5925 -30.5626 -30.5626 -30.5376 -30.5376 1.4301 1.4301 2.6514 2.6514 8.5525 8.5525 8.6772 8.6772 9.1294 9.1294 9.1978 9.1978 10.2240 10.2240 10.3630 10.3630 10.8450 10.8450 12.2996 12.2996 12.3771 12.3771 12.9544 12.9544 13.0298 13.0298 13.1874 13.1874 14.3820 14.3820 15.3960 15.3960 15.6490 15.6490 16.0047 16.0047 19.0090 19.0090 20.4089 20.4089 k = 0.1887 0.3268-0.0000 ( 3639 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5138 -34.5138 -34.4591 -34.4591 -30.7036 -30.7036 -30.5923 -30.5923 -30.5625 -30.5625 -30.5376 -30.5376 1.3727 1.3727 2.6669 2.6669 8.6099 8.6099 8.6418 8.6418 9.1375 9.1375 9.2277 9.2277 10.2185 10.2185 10.3814 10.3814 10.8283 10.8283 12.3152 12.3152 12.3464 12.3464 12.9609 12.9609 13.0531 13.0531 13.2026 13.2026 14.4484 14.4484 15.4436 15.4436 15.6766 15.6766 16.0466 16.0466 19.1023 19.1023 20.3533 20.3533 k = 0.1824 0.3159-0.0000 ( 3641 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5137 -34.5137 -34.4590 -34.4590 -30.7036 -30.7036 -30.5920 -30.5920 -30.5623 -30.5623 -30.5375 -30.5375 1.3156 1.3156 2.6823 2.6823 8.5503 8.5503 8.7162 8.7162 9.1515 9.1515 9.2550 9.2550 10.2084 10.2084 10.4133 10.4133 10.8132 10.8132 12.3048 12.3048 12.3432 12.3432 12.9662 12.9662 13.0739 13.0739 13.2218 13.2218 14.5135 14.5135 15.4941 15.4941 15.7023 15.7023 16.0811 16.0811 19.2018 19.2018 20.2793 20.2793 k = 0.1761 0.3050-0.0000 ( 3645 PWs) bands (ev): -63.8563 -63.8563 -63.8358 -63.8358 -34.5137 -34.5137 -34.4589 -34.4589 -30.7036 -30.7036 -30.5918 -30.5918 -30.5622 -30.5622 -30.5375 -30.5375 1.2590 1.2590 2.6977 2.6977 8.4832 8.4832 8.7907 8.7907 9.1712 9.1712 9.2794 9.2794 10.2010 10.2010 10.4520 10.4520 10.7999 10.7999 12.2747 12.2747 12.3610 12.3610 12.9710 12.9710 13.0910 13.0910 13.2448 13.2448 14.5769 14.5769 15.5470 15.5470 15.7272 15.7272 16.1080 16.1080 19.3073 19.3073 20.1836 20.1836 k = 0.1698 0.2941-0.0000 ( 3629 PWs) bands (ev): -63.8562 -63.8562 -63.8358 -63.8358 -34.5136 -34.5136 -34.4588 -34.4588 -30.7036 -30.7036 -30.5915 -30.5915 -30.5620 -30.5620 -30.5374 -30.5374 1.2031 1.2031 2.7130 2.7130 8.4144 8.4144 8.8570 8.8570 9.1972 9.1972 9.3016 9.3016 10.1999 10.1999 10.4946 10.4946 10.7889 10.7889 12.2438 12.2438 12.3812 12.3812 12.9760 12.9760 13.1047 13.1047 13.2710 13.2710 14.6384 14.6384 15.6006 15.6006 15.7531 15.7531 16.1273 16.1273 19.4185 19.4185 20.0740 20.0740 k = 0.1635 0.2832-0.0000 ( 3633 PWs) bands (ev): -63.8562 -63.8562 -63.8359 -63.8359 -34.5136 -34.5136 -34.4587 -34.4587 -30.7036 -30.7036 -30.5913 -30.5913 -30.5618 -30.5618 -30.5374 -30.5374 1.1481 1.1481 2.7281 2.7281 8.3453 8.3453 8.9109 8.9109 9.2285 9.2285 9.3247 9.3247 10.2064 10.2064 10.5395 10.5395 10.7805 10.7805 12.2134 12.2134 12.4024 12.4024 12.9812 12.9812 13.1154 13.1154 13.2992 13.2992 14.6976 14.6976 15.6510 15.6510 15.7837 15.7837 16.1390 16.1390 19.5341 19.5341 19.9594 19.9594 k = 0.1572 0.2723-0.0000 ( 3637 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5135 -34.5135 -34.4586 -34.4586 -30.7036 -30.7036 -30.5911 -30.5911 -30.5617 -30.5617 -30.5373 -30.5373 1.0942 1.0942 2.7432 2.7432 8.2765 8.2765 8.9503 8.9503 9.2569 9.2569 9.3579 9.3579 10.2213 10.2213 10.5857 10.5857 10.7753 10.7753 12.1839 12.1839 12.4244 12.4244 12.9865 12.9865 13.1239 13.1239 13.3283 13.3283 14.7545 14.7545 15.6929 15.6929 15.8247 15.8247 16.1437 16.1437 19.6463 19.6463 19.8517 19.8517 k = 0.1509 0.2614-0.0000 ( 3633 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5135 -34.5135 -34.4585 -34.4585 -30.7036 -30.7036 -30.5908 -30.5908 -30.5615 -30.5615 -30.5373 -30.5373 1.0414 1.0414 2.7580 2.7580 8.2086 8.2086 8.9760 8.9760 9.2722 9.2722 9.4102 9.4102 10.2442 10.2442 10.6321 10.6321 10.7745 10.7745 12.1552 12.1552 12.4473 12.4473 12.9921 12.9921 13.1309 13.1309 13.3573 13.3573 14.8088 14.8088 15.7226 15.7226 15.8791 15.8791 16.1423 16.1423 19.6719 19.6719 19.8360 19.8360 k = 0.1447 0.2505-0.0000 ( 3617 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5134 -34.5134 -34.4584 -34.4584 -30.7036 -30.7036 -30.5905 -30.5905 -30.5613 -30.5613 -30.5372 -30.5372 0.9898 0.9898 2.7726 2.7726 8.1419 8.1419 8.9910 8.9910 9.2750 9.2750 9.4779 9.4779 10.2744 10.2744 10.6760 10.6760 10.7807 10.7807 12.1276 12.1276 12.4710 12.4710 12.9980 12.9980 13.1370 13.1370 13.3857 13.3857 14.8606 14.8606 15.7422 15.7422 15.9439 15.9439 16.1366 16.1366 19.5718 19.5718 19.9524 19.9524 k = 0.1384 0.2397-0.0000 ( 3629 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5134 -34.5134 -34.4583 -34.4583 -30.7036 -30.7036 -30.5903 -30.5903 -30.5612 -30.5612 -30.5372 -30.5372 0.9397 0.9397 2.7869 2.7869 8.0768 8.0768 8.9980 8.9980 9.2701 9.2701 9.5533 9.5533 10.3110 10.3110 10.7125 10.7125 10.7987 10.7987 12.1009 12.1009 12.4957 12.4957 13.0040 13.0040 13.1424 13.1424 13.4127 13.4127 14.9095 14.9095 15.7544 15.7544 16.0123 16.0123 16.1313 16.1313 19.4560 19.4560 20.0907 20.0907 k = 0.1321 0.2288-0.0000 ( 3621 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5134 -34.5134 -34.4583 -34.4583 -30.7036 -30.7036 -30.5901 -30.5901 -30.5610 -30.5610 -30.5371 -30.5371 0.8912 0.8912 2.8009 2.8009 8.0136 8.0136 8.9996 8.9996 9.2603 9.2603 9.6313 9.6313 10.3528 10.3528 10.7376 10.7376 10.8330 10.8330 12.0753 12.0753 12.5215 12.5215 13.0104 13.0104 13.1473 13.1473 13.4380 13.4380 14.9557 14.9557 15.7603 15.7603 16.0653 16.0653 16.1455 16.1455 19.3388 19.3388 20.2007 20.2007 k = 0.1258 0.2179-0.0000 ( 3617 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5133 -34.5133 -34.4582 -34.4582 -30.7036 -30.7036 -30.5898 -30.5898 -30.5608 -30.5608 -30.5371 -30.5371 0.8442 0.8442 2.8146 2.8146 7.9524 7.9524 8.9971 8.9971 9.2474 9.2474 9.7088 9.7088 10.3988 10.3988 10.7561 10.7561 10.8787 10.8787 12.0508 12.0508 12.5483 12.5483 13.0170 13.0170 13.1520 13.1520 13.4614 13.4614 14.9991 14.9991 15.7588 15.7588 16.0770 16.0770 16.2070 16.2070 19.2226 19.2226 20.1868 20.1868 k = 0.1195 0.2070-0.0000 ( 3611 PWs) bands (ev): -63.8563 -63.8563 -63.8359 -63.8359 -34.5133 -34.5133 -34.4581 -34.4581 -30.7036 -30.7036 -30.5896 -30.5896 -30.5607 -30.5607 -30.5370 -30.5370 0.7990 0.7990 2.8280 2.8280 7.8933 7.8933 8.9916 8.9916 9.2325 9.2325 9.7835 9.7835 10.4481 10.4481 10.7740 10.7740 10.9300 10.9300 12.0274 12.0274 12.5762 12.5762 13.0237 13.0237 13.1566 13.1566 13.4828 13.4828 15.0397 15.0397 15.7480 15.7480 16.0770 16.0770 16.2889 16.2889 19.1080 19.1080 20.1680 20.1680 k = 0.1132 0.1961-0.0000 ( 3611 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5132 -34.5132 -34.4580 -34.4580 -30.7036 -30.7036 -30.5893 -30.5893 -30.5605 -30.5605 -30.5370 -30.5370 0.7557 0.7557 2.8409 2.8409 7.8367 7.8367 8.9838 8.9838 9.2165 9.2165 9.8538 9.8538 10.4998 10.4998 10.7944 10.7944 10.9838 10.9838 12.0052 12.0052 12.6051 12.6051 13.0305 13.0305 13.1612 13.1612 13.5020 13.5020 15.0775 15.0775 15.7265 15.7265 16.0819 16.0819 16.3767 16.3767 18.9955 18.9955 20.1496 20.1496 k = 0.1069 0.1852-0.0000 ( 3607 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5132 -34.5132 -34.4579 -34.4579 -30.7036 -30.7036 -30.5891 -30.5891 -30.5603 -30.5603 -30.5369 -30.5369 0.7142 0.7142 2.8534 2.8534 7.7825 7.7825 8.9744 8.9744 9.2000 9.2000 9.9183 9.9183 10.5532 10.5532 10.8183 10.8183 11.0391 11.0391 11.9843 11.9843 12.6348 12.6348 13.0373 13.0373 13.1658 13.1658 13.5194 13.5194 15.1126 15.1126 15.6943 15.6943 16.0958 16.0958 16.4673 16.4673 18.8854 18.8854 20.1317 20.1317 k = 0.1006 0.1743-0.0000 ( 3603 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5131 -34.5131 -34.4578 -34.4578 -30.7036 -30.7036 -30.5889 -30.5889 -30.5602 -30.5602 -30.5369 -30.5369 0.6748 0.6748 2.8654 2.8654 7.7309 7.7309 8.9637 8.9637 9.1834 9.1834 9.9761 9.9761 10.6079 10.6079 10.8458 10.8458 11.0950 11.0950 11.9648 11.9648 12.6652 12.6652 13.0441 13.0441 13.1707 13.1707 13.5351 13.5351 15.1450 15.1450 15.6528 15.6528 16.1190 16.1190 16.5593 16.5593 18.7778 18.7778 20.1143 20.1143 k = 0.0943 0.1634-0.0000 ( 3617 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5131 -34.5131 -34.4578 -34.4578 -30.7036 -30.7036 -30.5887 -30.5887 -30.5600 -30.5600 -30.5368 -30.5368 0.6374 0.6374 2.8769 2.8769 7.6820 7.6820 8.9521 8.9521 9.1670 9.1670 10.0266 10.0266 10.6632 10.6632 10.8766 10.8766 11.1510 11.1510 11.9466 11.9466 12.6958 12.6958 13.0507 13.0507 13.1759 13.1759 13.5495 13.5495 15.1748 15.1748 15.6041 15.6041 16.1509 16.1509 16.6519 16.6519 18.6728 18.6728 20.0970 20.0970 k = 0.0881 0.1525-0.0000 ( 3617 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5131 -34.5131 -34.4577 -34.4577 -30.7036 -30.7036 -30.5885 -30.5885 -30.5599 -30.5599 -30.5368 -30.5368 0.6021 0.6021 2.8879 2.8879 7.6360 7.6360 8.9401 8.9401 9.1511 9.1511 10.0700 10.0700 10.7189 10.7189 10.9100 10.9100 11.2070 11.2070 11.9300 11.9300 12.7261 12.7261 13.0570 13.0570 13.1813 13.1813 13.5633 13.5633 15.2022 15.2022 15.5505 15.5505 16.1904 16.1904 16.7440 16.7440 18.5706 18.5706 20.0795 20.0795 k = 0.0818 0.1416-0.0000 ( 3621 PWs) bands (ev): -63.8563 -63.8563 -63.8360 -63.8360 -34.5130 -34.5130 -34.4576 -34.4576 -30.7036 -30.7036 -30.5883 -30.5883 -30.5598 -30.5598 -30.5368 -30.5368 0.5691 0.5691 2.8982 2.8982 7.5928 7.5928 8.9279 8.9279 9.1359 9.1359 10.1065 10.1065 10.7743 10.7743 10.9451 10.9451 11.2625 11.2625 11.9149 11.9149 12.7556 12.7556 13.0629 13.0629 13.1872 13.1872 13.5772 13.5772 15.2270 15.2270 15.4938 15.4938 16.2365 16.2365 16.8349 16.8349 18.4713 18.4713 20.0604 20.0604 k = 0.0755 0.1307-0.0000 ( 3621 PWs) bands (ev): -63.8564 -63.8564 -63.8360 -63.8360 -34.5130 -34.5130 -34.4576 -34.4576 -30.7036 -30.7036 -30.5881 -30.5881 -30.5596 -30.5596 -30.5367 -30.5367 0.5382 0.5382 2.9080 2.9080 7.5525 7.5525 8.9157 8.9157 9.1214 9.1214 10.1367 10.1367 10.8289 10.8289 10.9806 10.9806 11.3173 11.3173 11.9016 11.9016 12.7836 12.7836 13.0682 13.0682 13.1932 13.1932 13.5919 13.5919 15.2497 15.2497 15.4357 15.4357 16.2884 16.2884 16.9236 16.9236 18.3748 18.3748 20.0355 20.0355 k = 0.0692 0.1198-0.0000 ( 3621 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5130 -34.5130 -34.4575 -34.4575 -30.7036 -30.7036 -30.5879 -30.5879 -30.5595 -30.5595 -30.5367 -30.5367 0.5097 0.5097 2.9171 2.9171 7.5153 7.5153 8.9039 8.9039 9.1079 9.1079 10.1614 10.1614 10.8819 10.8819 11.0156 11.0156 11.3707 11.3707 11.8902 11.8902 12.8094 12.8094 13.0726 13.0726 13.1992 13.1992 13.6083 13.6083 15.2702 15.2702 15.3774 15.3774 16.3455 16.3455 17.0092 17.0092 18.2813 18.2813 19.9847 19.9847 k = 0.0629 0.1089-0.0000 ( 3625 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5129 -34.5129 -34.4574 -34.4574 -30.7037 -30.7037 -30.5878 -30.5878 -30.5594 -30.5594 -30.5367 -30.5367 0.4835 0.4835 2.9255 2.9255 7.4811 7.4811 8.8925 8.8925 9.0954 9.0954 10.1815 10.1815 10.9327 10.9327 11.0493 11.0493 11.4223 11.4223 11.8808 11.8808 12.8326 12.8326 13.0762 13.0762 13.2049 13.2049 13.6268 13.6268 15.2883 15.2883 15.3205 15.3205 16.4071 16.4071 17.0906 17.0906 18.1907 18.1907 19.8763 19.8763 k = 0.0566 0.0980-0.0000 ( 3627 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5129 -34.5129 -34.4574 -34.4574 -30.7037 -30.7037 -30.5876 -30.5876 -30.5593 -30.5593 -30.5366 -30.5366 0.4597 0.4597 2.9332 2.9332 7.4500 7.4500 8.8818 8.8818 9.0839 9.0839 10.1978 10.1978 10.9806 10.9806 11.0808 11.0808 11.4713 11.4713 11.8737 11.8737 12.8526 12.8526 13.0787 13.0787 13.2099 13.2099 13.6479 13.6479 15.2651 15.2651 15.3051 15.3051 16.4724 16.4724 17.1667 17.1667 18.1033 18.1033 19.7466 19.7466 k = 0.0503 0.0871-0.0000 ( 3631 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5129 -34.5129 -34.4573 -34.4573 -30.7037 -30.7037 -30.5875 -30.5875 -30.5592 -30.5592 -30.5366 -30.5366 0.4383 0.4383 2.9401 2.9401 7.4221 7.4221 8.8719 8.8719 9.0735 9.0735 10.2108 10.2108 11.0250 11.0250 11.1097 11.1097 11.5167 11.5167 11.8690 11.8690 12.8694 12.8694 13.0803 13.0803 13.2139 13.2139 13.6714 13.6714 15.2135 15.2135 15.3193 15.3193 16.5407 16.5407 17.2363 17.2363 18.0191 18.0191 19.6209 19.6209 k = 0.0440 0.0763-0.0000 ( 3631 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5129 -34.5129 -34.4573 -34.4573 -30.7037 -30.7037 -30.5874 -30.5874 -30.5592 -30.5592 -30.5366 -30.5366 0.4193 0.4193 2.9464 2.9464 7.3974 7.3974 8.8629 8.8629 9.0642 9.0642 10.2212 10.2212 11.0652 11.0652 11.1356 11.1356 11.5577 11.5577 11.8671 11.8671 12.8828 12.8828 13.0811 13.0811 13.2170 13.2170 13.6966 13.6966 15.1659 15.1659 15.3318 15.3318 16.6112 16.6112 17.2980 17.2980 17.9386 17.9386 19.5054 19.5054 k = 0.0377 0.0654-0.0000 ( 3635 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5129 -34.5129 -34.4573 -34.4573 -30.7037 -30.7037 -30.5873 -30.5873 -30.5591 -30.5591 -30.5366 -30.5366 0.4028 0.4028 2.9518 2.9518 7.3760 7.3760 8.8549 8.8549 9.0561 9.0561 10.2294 10.2294 11.1009 11.1009 11.1584 11.1584 11.5933 11.5933 11.8683 11.8683 12.8932 12.8932 13.0811 13.0811 13.2190 13.2190 13.7225 13.7225 15.1232 15.1232 15.3425 15.3425 16.6828 16.6828 17.3503 17.3503 17.8627 17.8627 19.4026 19.4026 k = 0.0314 0.0545-0.0000 ( 3635 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5872 -30.5872 -30.5590 -30.5590 -30.5366 -30.5366 0.3888 0.3888 2.9564 2.9564 7.3577 7.3577 8.8480 8.8480 9.0492 9.0492 10.2358 10.2358 11.1315 11.1315 11.1779 11.1779 11.6227 11.6227 11.8723 11.8723 12.9007 12.9007 13.0806 13.0806 13.2202 13.2202 13.7477 13.7477 15.0861 15.0861 15.3514 15.3514 16.7542 16.7542 17.3914 17.3914 17.7930 17.7930 19.3142 19.3142 k = 0.0252 0.0436-0.0000 ( 3635 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5871 -30.5871 -30.5590 -30.5590 -30.5365 -30.5365 0.3773 0.3774 2.9602 2.9602 7.3428 7.3428 8.8423 8.8423 9.0435 9.0435 10.2407 10.2407 11.1566 11.1566 11.1942 11.1942 11.6454 11.6454 11.8785 11.8785 12.9058 12.9058 13.0799 13.0799 13.2208 13.2208 13.7708 13.7708 15.0551 15.0551 15.3587 15.3587 16.8237 16.8237 17.4188 17.4188 17.7325 17.7325 19.2410 19.2410 k = 0.0189 0.0327-0.0000 ( 3631 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5871 -30.5871 -30.5589 -30.5589 -30.5365 -30.5365 0.3684 0.3684 2.9632 2.9632 7.3312 7.3312 8.8378 8.8378 9.0390 9.0390 10.2444 10.2444 11.1759 11.1759 11.2073 11.2073 11.6619 11.6619 11.8857 11.8857 12.9090 12.9090 13.0792 13.0792 13.2211 13.2211 13.7903 13.7903 15.0306 15.0306 15.3642 15.3642 16.8886 16.8886 17.4297 17.4297 17.6858 17.6858 19.1839 19.1839 k = 0.0126 0.0218-0.0000 ( 3631 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5870 -30.5870 -30.5589 -30.5589 -30.5365 -30.5365 0.3620 0.3620 2.9653 2.9653 7.3228 7.3228 8.8346 8.8346 9.0359 9.0359 10.2468 10.2468 11.1895 11.1895 11.2171 11.2171 11.6727 11.6727 11.8925 11.8925 12.9108 12.9108 13.0785 13.0785 13.2212 13.2212 13.8052 13.8052 15.0130 15.0130 15.3682 15.3682 16.9442 16.9442 17.4244 17.4244 17.6565 17.6565 19.1430 19.1430 k = 0.0063 0.0109-0.0000 ( 3631 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5870 -30.5870 -30.5589 -30.5589 -30.5365 -30.5365 0.3582 0.3582 2.9666 2.9666 7.3178 7.3178 8.8327 8.8327 9.0339 9.0339 10.2483 10.2483 11.1974 11.1974 11.2232 11.2232 11.6788 11.6788 11.8973 11.8973 12.9117 12.9117 13.0781 13.0781 13.2211 13.2211 13.8145 13.8145 15.0024 15.0024 15.3706 15.3706 16.9838 16.9838 17.4114 17.4114 17.6427 17.6427 19.1184 19.1184 k = 0.0000 0.0000 0.0000 ( 3631 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5870 -30.5870 -30.5589 -30.5589 -30.5365 -30.5365 0.3569 0.3569 2.9670 2.9670 7.3162 7.3162 8.8320 8.8320 9.0333 9.0333 10.2488 10.2488 11.2000 11.2000 11.2253 11.2253 11.6808 11.6808 11.8990 11.8990 12.9119 12.9119 13.0779 13.0779 13.2211 13.2211 13.8177 13.8177 14.9988 14.9988 15.3713 15.3713 16.9985 16.9985 17.4047 17.4047 17.6390 17.6390 19.1103 19.1103 k = 0.0000 0.0000 0.0000 ( 3631 PWs) bands (ev): -63.8565 -63.8565 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7037 -30.7037 -30.5870 -30.5870 -30.5589 -30.5589 -30.5365 -30.5365 0.3569 0.3569 2.9670 2.9670 7.3162 7.3162 8.8320 8.8320 9.0333 9.0333 10.2488 10.2488 11.2000 11.2000 11.2253 11.2253 11.6808 11.6808 11.8990 11.8990 12.9119 12.9119 13.0779 13.0779 13.2211 13.2211 13.8177 13.8177 14.9988 14.9988 15.3713 15.3713 16.9985 16.9985 17.4047 17.4047 17.6390 17.6390 19.1103 19.1103 k = 0.0000 0.0000 0.0126 ( 3631 PWs) bands (ev): -63.8564 -63.8564 -63.8361 -63.8361 -34.5128 -34.5128 -34.4572 -34.4572 -30.7036 -30.7036 -30.5870 -30.5870 -30.5589 -30.5589 -30.5367 -30.5367 0.3582 0.3582 2.9631 2.9631 7.3218 7.3218 8.8334 8.8334 9.0346 9.0346 10.2501 10.2501 11.2007 11.2007 11.2263 11.2263 11.6767 11.6767 11.8891 11.8891 12.9047 12.9047 13.0936 13.0936 13.2122 13.2122 13.8302 13.8302 14.9915 14.9915 15.3629 15.3629 17.0058 17.0058 17.4029 17.4029 17.6374 17.6374 19.1182 19.1182 k = 0.0000 0.0000 0.0252 ( 3631 PWs) bands (ev): -63.8564 -63.8564 -63.8362 -63.8362 -34.5126 -34.5126 -34.4573 -34.4573 -30.7032 -30.7032 -30.5869 -30.5869 -30.5590 -30.5590 -30.5371 -30.5371 0.3622 0.3622 2.9512 2.9512 7.3385 7.3385 8.8374 8.8374 9.0384 9.0384 10.2542 10.2542 11.2028 11.2028 11.2293 11.2293 11.6646 11.6646 11.8601 11.8601 12.8879 12.8879 13.1348 13.1348 13.1875 13.1875 13.8657 13.8657 14.9697 14.9697 15.3382 15.3382 17.0274 17.0274 17.3975 17.3975 17.6328 17.6328 19.1417 19.1417 k = 0.0000 0.0000 0.0378 ( 3631 PWs) bands (ev): -63.8563 -63.8563 -63.8363 -63.8363 -34.5124 -34.5124 -34.4575 -34.4575 -30.7025 -30.7025 -30.5868 -30.5868 -30.5591 -30.5591 -30.5377 -30.5377 0.3688 0.3688 2.9318 2.9318 7.3662 7.3662 8.8442 8.8442 9.0447 9.0447 10.2609 10.2609 11.2062 11.2062 11.2344 11.2344 11.6449 11.6449 11.8147 11.8147 12.8679 12.8679 13.1515 13.1515 13.1926 13.1926 13.9194 13.9194 14.9343 14.9343 15.2983 15.2983 17.0620 17.0620 17.3886 17.3886 17.6252 17.6252 19.1801 19.1801 k = 0.0000 0.0000 0.0504 ( 3631 PWs) bands (ev): -63.8562 -63.8562 -63.8364 -63.8364 -34.5121 -34.5121 -34.4578 -34.4578 -30.7017 -30.7017 -30.5866 -30.5866 -30.5592 -30.5592 -30.5387 -30.5387 0.3781 0.3781 2.9050 2.9050 7.4044 7.4044 8.8537 8.8537 9.0535 9.0535 10.2701 10.2701 11.2106 11.2106 11.2414 11.2414 11.6181 11.6181 11.7560 11.7560 12.8468 12.8468 13.1085 13.1085 13.2614 13.2614 13.9866 13.9866 14.8868 14.8868 15.2451 15.2451 17.1081 17.1081 17.3762 17.3762 17.6144 17.6144 19.2322 19.2322 k = 0.0000 0.0000 0.0629 ( 3637 PWs) bands (ev): -63.8561 -63.8561 -63.8365 -63.8365 -34.5117 -34.5117 -34.4582 -34.4582 -30.7005 -30.7005 -30.5864 -30.5864 -30.5594 -30.5594 -30.5399 -30.5399 0.3900 0.3900 2.8713 2.8713 7.4528 7.4528 8.8659 8.8659 9.0649 9.0649 10.2818 10.2818 11.2157 11.2157 11.2504 11.2504 11.5853 11.5853 11.6871 11.6871 12.8248 12.8248 13.0617 13.0617 13.3372 13.3372 14.0635 14.0635 14.8289 14.8289 15.1804 15.1804 17.1634 17.1634 17.3605 17.3605 17.6006 17.6006 19.2966 19.2966 k = 0.0000 0.0000 0.0755 ( 3637 PWs) bands (ev): -63.8559 -63.8559 -63.8367 -63.8367 -34.5112 -34.5112 -34.4586 -34.4586 -30.6992 -30.6992 -30.5862 -30.5862 -30.5597 -30.5597 -30.5414 -30.5414 0.4045 0.4045 2.8312 2.8312 7.5106 7.5106 8.8809 8.8809 9.0788 9.0788 10.2958 10.2958 11.2207 11.2207 11.2614 11.2614 11.5477 11.5477 11.6106 11.6106 12.8016 12.8016 13.0132 13.0132 13.4170 13.4170 14.1478 14.1478 14.7632 14.7632 15.1062 15.1062 17.2253 17.2253 17.3427 17.3427 17.5836 17.5836 19.3717 19.3717 k = 0.0000 0.0000 0.0881 ( 3637 PWs) bands (ev): -63.8557 -63.8557 -63.8369 -63.8369 -34.5106 -34.5106 -34.4592 -34.4592 -30.6975 -30.6975 -30.5859 -30.5859 -30.5600 -30.5600 -30.5431 -30.5431 0.4217 0.4217 2.7853 2.7853 7.5774 7.5774 8.8986 8.8986 9.0952 9.0952 10.3118 10.3118 11.2241 11.2241 11.2744 11.2744 11.5076 11.5076 11.5287 11.5287 12.7768 12.7768 12.9639 12.9639 13.4975 13.4975 14.2376 14.2376 14.6928 14.6928 15.0241 15.0241 17.2816 17.2816 17.3336 17.3336 17.5634 17.5634 19.4556 19.4556 k = 0.0000 0.0000 0.1007 ( 3649 PWs) bands (ev): -63.8555 -63.8555 -63.8371 -63.8371 -34.5099 -34.5099 -34.4598 -34.4598 -30.6957 -30.6957 -30.5856 -30.5856 -30.5603 -30.5603 -30.5451 -30.5451 0.4414 0.4414 2.7341 2.7341 7.6524 7.6524 8.9190 8.9190 9.1141 9.1141 10.3292 10.3292 11.2234 11.2234 11.2893 11.2893 11.4430 11.4430 11.4682 11.4682 12.7502 12.7502 12.9145 12.9145 13.5750 13.5750 14.3317 14.3317 14.6217 14.6217 14.9357 14.9357 17.2788 17.2788 17.3852 17.3852 17.5401 17.5401 19.5465 19.5465 k = 0.0000 0.0000 0.1133 ( 3625 PWs) bands (ev): -63.8552 -63.8552 -63.8373 -63.8373 -34.5091 -34.5091 -34.4605 -34.4605 -30.6936 -30.6936 -30.5852 -30.5852 -30.5606 -30.5606 -30.5473 -30.5473 0.4637 0.4637 2.6783 2.6783 7.7350 7.7350 8.9423 8.9423 9.1355 9.1355 10.3485 10.3485 11.2139 11.2139 11.3062 11.3062 11.3549 11.3549 11.4351 11.4351 12.7218 12.7218 12.8654 12.8654 13.6444 13.6444 14.4292 14.4292 14.5558 14.5558 14.8425 14.8425 17.2507 17.2507 17.4630 17.4630 17.5136 17.5136 19.6424 19.6424 k = 0.0000 0.0000 0.1259 ( 3625 PWs) bands (ev): -63.8549 -63.8549 -63.8376 -63.8376 -34.5083 -34.5083 -34.4612 -34.4612 -30.6913 -30.6913 -30.5848 -30.5848 -30.5610 -30.5610 -30.5498 -30.5498 0.4886 0.4886 2.6185 2.6185 7.8244 7.8244 8.9683 8.9683 9.1593 9.1593 10.3687 10.3687 11.1901 11.1901 11.2651 11.2651 11.3249 11.3249 11.4141 11.4141 12.6912 12.6912 12.8163 12.8163 13.6983 13.6983 14.5032 14.5032 14.5293 14.5293 14.7450 14.7450 17.2167 17.2167 17.4838 17.4838 17.5469 17.5469 19.7414 19.7414 k = 0.0000 0.0000 0.1385 ( 3607 PWs) bands (ev): -63.8546 -63.8546 -63.8379 -63.8379 -34.5074 -34.5074 -34.4620 -34.4620 -30.6887 -30.6887 -30.5844 -30.5844 -30.5615 -30.5615 -30.5525 -30.5525 0.5161 0.5161 2.5552 2.5552 7.9199 7.9199 8.9972 8.9972 9.1856 9.1856 10.3896 10.3896 11.1502 11.1502 11.1745 11.1745 11.3456 11.3456 11.4080 11.4080 12.6587 12.6587 12.7675 12.7675 13.7275 13.7275 14.4739 14.4739 14.6316 14.6316 14.6446 14.6446 17.1783 17.1783 17.4507 17.4507 17.6346 17.6346 19.8412 19.8412 k = 0.0000 0.0000 0.1511 ( 3613 PWs) bands (ev): -63.8542 -63.8542 -63.8383 -63.8383 -34.5064 -34.5064 -34.4629 -34.4629 -30.6860 -30.6860 -30.5839 -30.5839 -30.5619 -30.5619 -30.5554 -30.5554 0.5461 0.5461 2.4889 2.4889 8.0208 8.0208 9.0289 9.0289 9.2143 9.2143 10.4103 10.4103 11.0836 11.0836 11.0974 11.0974 11.3680 11.3680 11.4138 11.4138 12.6242 12.6242 12.7187 12.7187 13.7246 13.7246 14.4764 14.4764 14.5418 14.5418 14.7355 14.7355 17.1358 17.1358 17.4142 17.4142 17.7255 17.7255 19.9396 19.9396 k = 0.0000 0.0000 0.1636 ( 3613 PWs) bands (ev): -63.8539 -63.8539 -63.8386 -63.8386 -34.5054 -34.5054 -34.4639 -34.4639 -30.6831 -30.6831 -30.5834 -30.5834 -30.5624 -30.5624 -30.5585 -30.5585 0.5786 0.5786 2.4203 2.4203 8.1264 8.1264 9.0635 9.0635 9.2454 9.2454 10.4302 10.4302 10.9929 10.9929 11.0363 11.0363 11.3922 11.3922 11.4277 11.4277 12.5880 12.5880 12.6701 12.6701 13.6899 13.6899 14.4375 14.4375 14.5115 14.5115 14.8406 14.8406 17.0895 17.0895 17.3743 17.3743 17.8192 17.8192 20.0341 20.0341 k = 0.0000 0.0000 0.1762 ( 3625 PWs) bands (ev): -63.8535 -63.8535 -63.8390 -63.8390 -34.5043 -34.5043 -34.4649 -34.4649 -30.6800 -30.6800 -30.5829 -30.5829 -30.5630 -30.5630 -30.5618 -30.5618 0.6135 0.6135 2.3497 2.3497 8.2359 8.2359 9.1012 9.1012 9.2789 9.2789 10.4482 10.4482 10.9031 10.9031 10.9700 10.9700 11.4181 11.4181 11.4470 11.4470 12.5499 12.5499 12.6213 12.6213 13.6310 13.6310 14.3323 14.3323 14.5726 14.5726 14.9465 14.9465 17.0393 17.0393 17.3310 17.3310 17.9154 17.9154 20.1217 20.1217 k = 0.0000 0.0000 0.1888 ( 3625 PWs) bands (ev): -63.8531 -63.8531 -63.8395 -63.8395 -34.5031 -34.5031 -34.4660 -34.4660 -30.6766 -30.6766 -30.5823 -30.5823 -30.5653 -30.5653 -30.5636 -30.5636 0.6509 0.6509 2.2776 2.2776 8.3487 8.3487 9.1420 9.1420 9.3148 9.3148 10.4631 10.4631 10.8147 10.8147 10.9004 10.9004 11.4457 11.4457 11.4702 11.4702 12.5104 12.5104 12.5726 12.5726 13.5577 13.5577 14.2269 14.2269 14.6513 14.6513 15.0531 15.0531 16.9854 16.9854 17.2844 17.2844 18.0141 18.0141 20.1995 20.1995 k = 0.0000 0.0000 0.2014 ( 3613 PWs) bands (ev): -63.8527 -63.8527 -63.8399 -63.8399 -34.5018 -34.5018 -34.4672 -34.4672 -30.6731 -30.6731 -30.5817 -30.5817 -30.5690 -30.5690 -30.5641 -30.5641 0.6908 0.6908 2.2043 2.2043 8.4639 8.4639 9.1861 9.1861 9.3530 9.3530 10.4728 10.4728 10.7291 10.7291 10.8290 10.8290 11.4750 11.4750 11.4963 11.4963 12.4695 12.4695 12.5238 12.5238 13.4776 13.4776 14.1220 14.1220 14.7411 14.7411 15.1599 15.1599 16.9277 16.9277 17.2342 17.2342 18.1150 18.1150 20.2644 20.2644 k = 0.0000 0.0000 0.2140 ( 3607 PWs) bands (ev): -63.8522 -63.8522 -63.8403 -63.8403 -34.5005 -34.5005 -34.4684 -34.4684 -30.6695 -30.6695 -30.5811 -30.5811 -30.5728 -30.5728 -30.5648 -30.5648 0.7330 0.7330 2.1304 2.1304 8.5807 8.5807 9.2336 9.2336 9.3935 9.3935 10.4737 10.4737 10.6490 10.6490 10.7562 10.7562 11.5059 11.5059 11.5250 11.5250 12.4273 12.4273 12.4750 12.4750 13.3963 13.3963 14.0179 14.0179 14.8379 14.8379 15.2667 15.2667 16.8663 16.8663 17.1806 17.1806 18.2182 18.2182 20.3117 20.3117 k = 0.0000 0.0000 0.2266 ( 3607 PWs) bands (ev): -63.8517 -63.8517 -63.8408 -63.8408 -34.4992 -34.4992 -34.4697 -34.4697 -30.6657 -30.6657 -30.5804 -30.5804 -30.5768 -30.5768 -30.5654 -30.5654 0.7775 0.7775 2.0559 2.0559 8.6983 8.6983 9.2850 9.2850 9.4364 9.4364 10.4562 10.4562 10.5826 10.5826 10.6828 10.6828 11.5383 11.5383 11.5558 11.5558 12.3841 12.3841 12.4262 12.4262 13.3179 13.3179 13.9153 13.9153 14.9389 14.9389 15.3732 15.3732 16.8012 16.8012 17.1236 17.1236 18.3237 18.3237 20.3342 20.3342 k = 0.0000 0.0000 0.2392 ( 3601 PWs) bands (ev): -63.8512 -63.8512 -63.8413 -63.8413 -34.4978 -34.4978 -34.4710 -34.4710 -30.6617 -30.6617 -30.5809 -30.5809 -30.5798 -30.5798 -30.5661 -30.5661 0.8244 0.8244 1.9814 1.9814 8.8156 8.8156 9.3405 9.3405 9.4814 9.4814 10.4085 10.4085 10.5406 10.5406 10.6092 10.6092 11.5722 11.5722 11.5887 11.5887 12.3399 12.3399 12.3773 12.3773 13.2456 13.2456 13.8147 13.8147 15.0425 15.0425 15.4792 15.4792 16.7326 16.7326 17.0631 17.0631 18.4313 18.4313 20.3288 20.3288 k = 0.0000 0.0000 0.2518 ( 3601 PWs) bands (ev): -63.8507 -63.8507 -63.8418 -63.8418 -34.4964 -34.4964 -34.4723 -34.4723 -30.6576 -30.6576 -30.5851 -30.5851 -30.5791 -30.5791 -30.5668 -30.5668 0.8734 0.8734 1.9070 1.9070 8.9314 8.9314 9.4007 9.4007 9.5287 9.5287 10.3384 10.3384 10.5141 10.5141 10.5357 10.5357 11.6075 11.6075 11.6232 11.6232 12.2950 12.2950 12.3285 12.3285 13.1817 13.1817 13.7169 13.7169 15.1476 15.1476 15.5844 15.5844 16.6605 16.6605 16.9991 16.9991 18.5411 18.5411 20.2958 20.2958 k = 0.0000 0.0000 0.2644 ( 3619 PWs) bands (ev): -63.8502 -63.8502 -63.8423 -63.8423 -34.4950 -34.4950 -34.4737 -34.4737 -30.6534 -30.6534 -30.5895 -30.5895 -30.5783 -30.5783 -30.5675 -30.5675 0.9247 0.9247 1.8329 1.8329 9.0444 9.0444 9.4661 9.4661 9.5781 9.5781 10.2604 10.2604 10.4627 10.4627 10.4872 10.4872 11.6441 11.6441 11.6593 11.6593 12.2495 12.2495 12.2797 12.2797 13.1284 13.1284 13.6224 13.6224 15.2532 15.2532 15.6885 15.6885 16.5849 16.5849 16.9318 16.9318 18.6530 18.6530 20.2379 20.2379 k = 0.0000 0.0000 0.2769 ( 3626 PWs) bands (ev): -63.8497 -63.8497 -63.8429 -63.8429 -34.4935 -34.4935 -34.4752 -34.4752 -30.6491 -30.6491 -30.5940 -30.5940 -30.5776 -30.5776 -30.5683 -30.5683 0.9782 0.9782 1.7594 1.7594 9.1535 9.1535 9.5374 9.5374 9.6296 9.6296 10.1802 10.1802 10.3903 10.3903 10.4537 10.4537 11.6820 11.6820 11.6970 11.6970 12.2037 12.2037 12.2312 12.2312 13.0872 13.0872 13.5319 13.5319 15.3588 15.3588 15.7915 15.7915 16.5061 16.5061 16.8611 16.8611 18.7670 18.7670 20.1594 20.1594 k = 0.0000 0.0000 0.2895 ( 3614 PWs) bands (ev): -63.8491 -63.8491 -63.8434 -63.8434 -34.4920 -34.4920 -34.4766 -34.4766 -30.6447 -30.6447 -30.5985 -30.5985 -30.5768 -30.5768 -30.5690 -30.5690 1.0337 1.0337 1.6867 1.6867 9.2573 9.2573 9.6148 9.6148 9.6833 9.6833 10.0997 10.0997 10.3189 10.3189 10.4110 10.4110 11.7212 11.7212 11.7361 11.7361 12.1578 12.1578 12.1830 12.1830 13.0592 13.0592 13.4462 13.4462 15.4640 15.4640 15.8930 15.8930 16.4240 16.4240 16.7872 16.7872 18.8830 18.8830 20.0651 20.0651 k = 0.0000 0.0000 0.3021 ( 3602 PWs) bands (ev): -63.8486 -63.8486 -63.8439 -63.8439 -34.4904 -34.4904 -34.4781 -34.4781 -30.6402 -30.6402 -30.6030 -30.6030 -30.5761 -30.5761 -30.5698 -30.5698 1.0913 1.0913 1.6149 1.6149 9.3553 9.3553 9.6982 9.6982 9.7389 9.7389 10.0195 10.0195 10.2486 10.2486 10.3584 10.3584 11.7614 11.7614 11.7765 11.7765 12.1120 12.1120 12.1353 12.1353 13.0449 13.0449 13.3661 13.3661 15.5684 15.5684 15.9929 15.9929 16.3389 16.3389 16.7101 16.7101 19.0009 19.0009 19.9597 19.9597 k = 0.0000 0.0000 0.3147 ( 3602 PWs) bands (ev): -63.8480 -63.8480 -63.8445 -63.8445 -34.4889 -34.4889 -34.4796 -34.4796 -30.6356 -30.6356 -30.6077 -30.6077 -30.5753 -30.5753 -30.5705 -30.5705 1.1508 1.1508 1.5443 1.5443 9.4476 9.4476 9.7864 9.7864 9.7965 9.7965 9.9396 9.9397 10.1795 10.1795 10.2959 10.2959 11.8026 11.8026 11.8182 11.8182 12.0663 12.0663 12.0879 12.0879 13.0444 13.0444 13.2925 13.2925 15.6715 15.6715 16.0909 16.0909 16.2509 16.2509 16.6299 16.6299 19.1204 19.1204 19.8466 19.8466 k = 0.0000 0.0000 0.3273 ( 3602 PWs) bands (ev): -63.8474 -63.8474 -63.8451 -63.8451 -34.4874 -34.4874 -34.4811 -34.4811 -30.6310 -30.6310 -30.6123 -30.6123 -30.5745 -30.5745 -30.5714 -30.5714 1.2122 1.2122 1.4749 1.4749 9.5351 9.5351 9.8561 9.8561 9.8601 9.8601 9.8776 9.8776 10.1116 10.1116 10.2244 10.2244 11.8448 11.8448 11.8609 11.8609 12.0209 12.0209 12.0410 12.0410 13.0573 13.0573 13.2262 13.2262 15.7731 15.7731 16.1602 16.1602 16.1868 16.1868 16.5467 16.5467 19.2413 19.2413 19.7286 19.7286 k = 0.0000 0.0000 0.3399 ( 3614 PWs) bands (ev): -63.8468 -63.8468 -63.8457 -63.8457 -34.4858 -34.4858 -34.4827 -34.4827 -30.6264 -30.6264 -30.6170 -30.6170 -30.5737 -30.5737 -30.5721 -30.5721 1.2754 1.2754 1.4068 1.4068 9.6189 9.6189 9.7805 9.7805 9.9174 9.9174 9.9693 9.9693 10.0452 10.0452 10.1449 10.1449 11.8878 11.8878 11.9046 11.9046 11.9759 11.9759 11.9948 11.9948 13.0830 13.0830 13.1685 13.1685 15.8731 15.8731 16.0668 16.0668 16.2805 16.2805 16.4607 16.4607 19.3632 19.3632 19.6078 19.6078 k = 0.0000 0.0000 0.3525 ( 3614 PWs) bands (ev): -63.8463 -63.8463 -63.8463 -63.8463 -34.4842 -34.4842 -34.4842 -34.4842 -30.6217 -30.6217 -30.6217 -30.6217 -30.5729 -30.5729 -30.5729 -30.5729 1.3403 1.3403 1.3403 1.3403 9.7003 9.7003 9.7003 9.7003 9.9805 9.9805 9.9805 9.9805 10.0592 10.0592 10.0592 10.0592 11.9315 11.9315 11.9315 11.9315 11.9493 11.9493 11.9493 11.9493 13.1204 13.1204 13.1204 13.1204 15.9710 15.9710 15.9710 15.9710 16.3719 16.3719 16.3719 16.3719 19.4857 19.4857 19.4857 19.4857 k = 0.0000 0.0000 0.3525 ( 3614 PWs) bands (ev): -63.8463 -63.8463 -63.8463 -63.8463 -34.4842 -34.4842 -34.4842 -34.4842 -30.6217 -30.6217 -30.6217 -30.6217 -30.5729 -30.5729 -30.5729 -30.5729 1.3403 1.3403 1.3403 1.3403 9.7003 9.7003 9.7003 9.7003 9.9805 9.9805 9.9805 9.9805 10.0592 10.0592 10.0592 10.0592 11.9315 11.9315 11.9315 11.9315 11.9493 11.9493 11.9493 11.9493 13.1204 13.1204 13.1204 13.1204 15.9710 15.9710 15.9710 15.9710 16.3719 16.3719 16.3719 16.3719 19.4857 19.4857 19.4857 19.4857 k = 0.0109 0.0063 0.3525 ( 3606 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4842 -34.4842 -34.4842 -34.4842 -30.6217 -30.6217 -30.6217 -30.6217 -30.5729 -30.5729 -30.5729 -30.5729 1.3412 1.3412 1.3412 1.3412 9.6938 9.6938 9.6938 9.6938 9.9692 9.9692 9.9692 9.9692 10.0752 10.0752 10.0752 10.0752 11.9304 11.9304 11.9304 11.9304 11.9501 11.9501 11.9501 11.9501 13.1230 13.1230 13.1230 13.1230 15.9672 15.9672 15.9672 15.9672 16.3673 16.3673 16.3673 16.3673 19.4923 19.4923 19.4923 19.4923 k = 0.0217 0.0126 0.3525 ( 3606 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4842 -34.4842 -34.4842 -34.4842 -30.6217 -30.6217 -30.6217 -30.6217 -30.5730 -30.5730 -30.5730 -30.5730 1.3439 1.3439 1.3439 1.3439 9.6746 9.6746 9.6746 9.6746 9.9493 9.9493 9.9493 9.9493 10.1090 10.1090 10.1090 10.1090 11.9274 11.9274 11.9274 11.9274 11.9521 11.9521 11.9521 11.9521 13.1308 13.1308 13.1308 13.1308 15.9553 15.9553 15.9553 15.9553 16.3540 16.3540 16.3540 16.3540 19.5119 19.5119 19.5119 19.5119 k = 0.0326 0.0188 0.3525 ( 3606 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4843 -34.4843 -34.4843 -34.4843 -30.6217 -30.6217 -30.6217 -30.6217 -30.5730 -30.5730 -30.5730 -30.5730 1.3484 1.3484 1.3484 1.3484 9.6439 9.6439 9.6439 9.6439 9.9319 9.9319 9.9319 9.9319 10.1482 10.1482 10.1482 10.1482 11.9231 11.9231 11.9231 11.9231 11.9546 11.9546 11.9546 11.9546 13.1438 13.1438 13.1438 13.1438 15.9352 15.9352 15.9352 15.9352 16.3327 16.3327 16.3327 16.3327 19.5437 19.5437 19.5437 19.5437 k = 0.0435 0.0251 0.3525 ( 3610 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4843 -34.4843 -34.4843 -34.4843 -30.6217 -30.6217 -30.6217 -30.6217 -30.5730 -30.5730 -30.5730 -30.5730 1.3547 1.3547 1.3547 1.3547 9.6035 9.6035 9.6035 9.6035 9.9190 9.9190 9.9190 9.9190 10.1891 10.1891 10.1891 10.1891 11.9178 11.9178 11.9178 11.9178 11.9575 11.9575 11.9575 11.9575 13.1618 13.1618 13.1618 13.1618 15.9064 15.9064 15.9064 15.9064 16.3051 16.3051 16.3051 16.3051 19.5866 19.5866 19.5866 19.5866 k = 0.0543 0.0314 0.3525 ( 3610 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4843 -34.4843 -34.4843 -34.4843 -30.6217 -30.6217 -30.6217 -30.6217 -30.5731 -30.5731 -30.5731 -30.5731 1.3627 1.3627 1.3627 1.3627 9.5558 9.5558 9.5558 9.5558 9.9099 9.9099 9.9099 9.9099 10.2300 10.2300 10.2300 10.2300 11.9118 11.9118 11.9118 11.9118 11.9606 11.9606 11.9606 11.9606 13.1847 13.1847 13.1847 13.1847 15.8683 15.8683 15.8683 15.8683 16.2727 16.2727 16.2727 16.2727 19.6389 19.6389 19.6389 19.6389 k = 0.0652 0.0377 0.3525 ( 3616 PWs) bands (ev): -63.8463 -63.8463 -63.8463 -63.8463 -34.4843 -34.4843 -34.4843 -34.4843 -30.6217 -30.6217 -30.6217 -30.6217 -30.5732 -30.5732 -30.5732 -30.5732 1.3725 1.3725 1.3725 1.3725 9.5028 9.5028 9.5028 9.5028 9.9037 9.9037 9.9037 9.9037 10.2701 10.2701 10.2701 10.2701 11.9049 11.9049 11.9049 11.9049 11.9638 11.9638 11.9638 11.9638 13.2122 13.2122 13.2122 13.2122 15.8208 15.8208 15.8208 15.8208 16.2373 16.2373 16.2373 16.2373 19.6983 19.6983 19.6983 19.6983 k = 0.0761 0.0439 0.3525 ( 3618 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4843 -34.4843 -34.4843 -34.4843 -30.6217 -30.6217 -30.6217 -30.6217 -30.5733 -30.5733 -30.5733 -30.5733 1.3840 1.3840 1.3840 1.3840 9.4461 9.4461 9.4461 9.4461 9.8993 9.8993 9.8993 9.8993 10.3089 10.3089 10.3089 10.3089 11.8973 11.8973 11.8973 11.8973 11.9674 11.9674 11.9674 11.9674 13.2441 13.2441 13.2441 13.2441 15.7639 15.7639 15.7639 15.7639 16.2002 16.2002 16.2002 16.2002 19.7617 19.7617 19.7617 19.7617 k = 0.0870 0.0502 0.3525 ( 3616 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4844 -34.4844 -34.4844 -34.4844 -30.6218 -30.6218 -30.6218 -30.6218 -30.5734 -30.5734 -30.5734 -30.5734 1.3972 1.3972 1.3972 1.3972 9.3866 9.3866 9.3866 9.3866 9.8961 9.8961 9.8961 9.8961 10.3462 10.3462 10.3462 10.3462 11.8889 11.8889 11.8889 11.8889 11.9712 11.9712 11.9712 11.9712 13.2802 13.2802 13.2802 13.2802 15.6983 15.6983 15.6983 15.6983 16.1623 16.1623 16.1623 16.1623 19.8243 19.8243 19.8243 19.8243 k = 0.0978 0.0565 0.3525 ( 3620 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4844 -34.4844 -34.4844 -34.4844 -30.6218 -30.6218 -30.6218 -30.6218 -30.5735 -30.5735 -30.5735 -30.5735 1.4120 1.4120 1.4120 1.4120 9.3252 9.3252 9.3252 9.3252 9.8938 9.8938 9.8938 9.8938 10.3817 10.3817 10.3817 10.3817 11.8798 11.8798 11.8798 11.8798 11.9754 11.9754 11.9754 11.9754 13.3199 13.3199 13.3199 13.3199 15.6250 15.6250 15.6250 15.6250 16.1240 16.1240 16.1240 16.1240 19.8786 19.8786 19.8786 19.8786 k = 0.1087 0.0628 0.3525 ( 3620 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4845 -34.4845 -34.4845 -34.4845 -30.6218 -30.6218 -30.6218 -30.6218 -30.5736 -30.5736 -30.5736 -30.5736 1.4285 1.4285 1.4285 1.4285 9.2625 9.2625 9.2625 9.2625 9.8919 9.8919 9.8919 9.8919 10.4153 10.4153 10.4153 10.4153 11.8700 11.8700 11.8700 11.8700 11.9801 11.9801 11.9801 11.9801 13.3629 13.3629 13.3629 13.3629 15.5454 15.5454 15.5454 15.5454 16.0855 16.0855 16.0855 16.0855 19.9137 19.9137 19.9137 19.9137 k = 0.1196 0.0690 0.3525 ( 3620 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4845 -34.4845 -34.4845 -34.4845 -30.6218 -30.6218 -30.6218 -30.6218 -30.5737 -30.5737 -30.5737 -30.5737 1.4465 1.4465 1.4465 1.4465 9.1988 9.1988 9.1988 9.1988 9.8904 9.8904 9.8905 9.8905 10.4468 10.4468 10.4468 10.4468 11.8595 11.8595 11.8595 11.8595 11.9853 11.9853 11.9853 11.9853 13.4085 13.4085 13.4085 13.4085 15.4612 15.4612 15.4612 15.4612 16.0466 16.0466 16.0466 16.0466 19.9187 19.9187 19.9187 19.9187 k = 0.1304 0.0753 0.3525 ( 3620 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4846 -34.4846 -34.4846 -34.4846 -30.6218 -30.6218 -30.6218 -30.6218 -30.5739 -30.5739 -30.5739 -30.5739 1.4660 1.4660 1.4660 1.4660 9.1345 9.1345 9.1345 9.1345 9.8891 9.8891 9.8891 9.8891 10.4763 10.4763 10.4763 10.4763 11.8485 11.8485 11.8485 11.8485 11.9911 11.9911 11.9911 11.9911 13.4562 13.4562 13.4562 13.4562 15.3739 15.3739 15.3739 15.3739 16.0072 16.0072 16.0072 16.0072 19.8914 19.8914 19.8914 19.8914 k = 0.1413 0.0816 0.3525 ( 3624 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4846 -34.4846 -34.4846 -34.4846 -30.6218 -30.6218 -30.6218 -30.6218 -30.5740 -30.5740 -30.5740 -30.5740 1.4869 1.4869 1.4869 1.4869 9.0700 9.0700 9.0700 9.0700 9.8879 9.8879 9.8879 9.8879 10.5036 10.5036 10.5036 10.5036 11.8369 11.8369 11.8369 11.8369 11.9975 11.9975 11.9975 11.9975 13.5052 13.5052 13.5052 13.5052 15.2853 15.2853 15.2853 15.2853 15.9670 15.9670 15.9670 15.9670 19.8402 19.8402 19.8402 19.8402 k = 0.1522 0.0879 0.3525 ( 3616 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4847 -34.4847 -34.4847 -34.4847 -30.6219 -30.6219 -30.6219 -30.6219 -30.5742 -30.5742 -30.5742 -30.5742 1.5092 1.5092 1.5092 1.5092 9.0054 9.0054 9.0054 9.0054 9.8867 9.8867 9.8867 9.8867 10.5289 10.5289 10.5289 10.5289 11.8249 11.8249 11.8249 11.8249 12.0047 12.0047 12.0047 12.0047 13.5543 13.5543 13.5543 13.5543 15.1970 15.1970 15.1970 15.1970 15.9261 15.9261 15.9261 15.9261 19.7748 19.7748 19.7748 19.7748 k = 0.1630 0.0941 0.3525 ( 3612 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4847 -34.4847 -34.4847 -34.4847 -30.6219 -30.6219 -30.6219 -30.6219 -30.5744 -30.5744 -30.5744 -30.5744 1.5328 1.5328 1.5328 1.5328 8.9409 8.9409 8.9409 8.9409 9.8854 9.8854 9.8854 9.8854 10.5520 10.5520 10.5520 10.5520 11.8126 11.8126 11.8126 11.8126 12.0127 12.0127 12.0127 12.0127 13.6025 13.6025 13.6025 13.6025 15.1110 15.1110 15.1110 15.1110 15.8843 15.8843 15.8843 15.8843 19.7022 19.7022 19.7022 19.7022 k = 0.1739 0.1004 0.3525 ( 3608 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4848 -34.4848 -34.4848 -34.4848 -30.6219 -30.6219 -30.6219 -30.6219 -30.5745 -30.5745 -30.5745 -30.5745 1.5576 1.5576 1.5576 1.5576 8.8768 8.8768 8.8768 8.8768 9.8840 9.8840 9.8840 9.8840 10.5729 10.5729 10.5729 10.5729 11.8001 11.8001 11.8001 11.8001 12.0216 12.0216 12.0216 12.0216 13.6480 13.6480 13.6480 13.6480 15.0294 15.0294 15.0294 15.0294 15.8417 15.8417 15.8417 15.8417 19.6261 19.6261 19.6261 19.6261 k = 0.1848 0.1067 0.3525 ( 3610 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4848 -34.4848 -34.4848 -34.4848 -30.6219 -30.6219 -30.6219 -30.6219 -30.5747 -30.5747 -30.5747 -30.5747 1.5836 1.5836 1.5836 1.5836 8.8132 8.8132 8.8132 8.8132 9.8824 9.8824 9.8824 9.8824 10.5916 10.5916 10.5916 10.5916 11.7875 11.7875 11.7875 11.7875 12.0313 12.0313 12.0313 12.0313 13.6889 13.6889 13.6889 13.6889 14.9546 14.9546 14.9546 14.9546 15.7981 15.7981 15.7981 15.7981 19.5488 19.5488 19.5488 19.5488 k = 0.1957 0.1130 0.3525 ( 3614 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4849 -34.4849 -34.4849 -34.4849 -30.6219 -30.6219 -30.6219 -30.6219 -30.5749 -30.5749 -30.5749 -30.5749 1.6106 1.6106 1.6106 1.6106 8.7503 8.7503 8.7503 8.7503 9.8807 9.8807 9.8807 9.8807 10.6080 10.6080 10.6080 10.6080 11.7752 11.7752 11.7752 11.7752 12.0420 12.0420 12.0420 12.0420 13.7225 13.7225 13.7225 13.7225 14.8894 14.8894 14.8894 14.8894 15.7538 15.7538 15.7538 15.7538 19.4714 19.4714 19.4714 19.4714 k = 0.2065 0.1192 0.3525 ( 3606 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4849 -34.4849 -34.4849 -34.4849 -30.6220 -30.6220 -30.6220 -30.6220 -30.5751 -30.5751 -30.5751 -30.5751 1.6386 1.6386 1.6386 1.6386 8.6882 8.6882 8.6882 8.6882 9.8788 9.8788 9.8788 9.8788 10.6221 10.6221 10.6221 10.6221 11.7632 11.7632 11.7632 11.7632 12.0537 12.0537 12.0537 12.0537 13.7462 13.7462 13.7462 13.7462 14.8370 14.8370 14.8370 14.8370 15.7087 15.7087 15.7087 15.7087 19.3948 19.3948 19.3948 19.3948 k = 0.2174 0.1255 0.3525 ( 3602 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4850 -34.4850 -34.4850 -34.4850 -30.6220 -30.6220 -30.6220 -30.6220 -30.5753 -30.5753 -30.5753 -30.5753 1.6675 1.6675 1.6675 1.6675 8.6270 8.6270 8.6270 8.6270 9.8767 9.8767 9.8767 9.8767 10.6338 10.6338 10.6338 10.6338 11.7517 11.7517 11.7517 11.7517 12.0663 12.0663 12.0663 12.0663 13.7571 13.7571 13.7571 13.7571 14.8001 14.8001 14.8001 14.8001 15.6631 15.6631 15.6631 15.6631 19.3192 19.3192 19.3192 19.3192 k = 0.2283 0.1318 0.3525 ( 3602 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4851 -34.4851 -34.4851 -34.4851 -30.6220 -30.6220 -30.6220 -30.6220 -30.5755 -30.5755 -30.5755 -30.5755 1.6970 1.6970 1.6970 1.6970 8.5668 8.5668 8.5668 8.5668 9.8744 9.8744 9.8744 9.8744 10.6431 10.6431 10.6431 10.6431 11.7410 11.7410 11.7410 11.7410 12.0799 12.0799 12.0799 12.0799 13.7530 13.7530 13.7530 13.7530 14.7811 14.7811 14.7811 14.7811 15.6170 15.6170 15.6170 15.6170 19.2451 19.2451 19.2451 19.2451 k = 0.2391 0.1381 0.3525 ( 3606 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4851 -34.4851 -34.4851 -34.4851 -30.6220 -30.6220 -30.6220 -30.6220 -30.5757 -30.5757 -30.5757 -30.5757 1.7273 1.7273 1.7273 1.7273 8.5079 8.5079 8.5079 8.5079 9.8718 9.8718 9.8718 9.8718 10.6499 10.6499 10.6499 10.6499 11.7312 11.7312 11.7312 11.7312 12.0945 12.0945 12.0945 12.0945 13.7335 13.7335 13.7335 13.7335 14.7804 14.7804 14.7804 14.7804 15.5707 15.5707 15.5707 15.5707 19.1725 19.1725 19.1725 19.1725 k = 0.2500 0.1443 0.3525 ( 3606 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4852 -34.4852 -34.4852 -34.4852 -30.6221 -30.6221 -30.6221 -30.6221 -30.5759 -30.5759 -30.5759 -30.5759 1.7580 1.7580 1.7580 1.7580 8.4502 8.4502 8.4502 8.4502 9.8691 9.8691 9.8691 9.8691 10.6541 10.6541 10.6541 10.6541 11.7226 11.7226 11.7226 11.7226 12.1101 12.1101 12.1101 12.1101 13.6999 13.6999 13.6999 13.6999 14.7968 14.7968 14.7968 14.7968 15.5244 15.5244 15.5244 15.5244 19.1016 19.1016 19.1016 19.1016 k = 0.2609 0.1506 0.3525 ( 3602 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4853 -34.4853 -34.4853 -34.4853 -30.6221 -30.6221 -30.6221 -30.6221 -30.5761 -30.5761 -30.5761 -30.5761 1.7891 1.7891 1.7891 1.7891 8.3940 8.3940 8.3940 8.3940 9.8662 9.8662 9.8662 9.8662 10.6558 10.6558 10.6558 10.6558 11.7155 11.7155 11.7155 11.7155 12.1266 12.1266 12.1266 12.1266 13.6546 13.6546 13.6546 13.6546 14.8274 14.8274 14.8274 14.8274 15.4785 15.4785 15.4785 15.4785 19.0324 19.0324 19.0324 19.0324 k = 0.2717 0.1569 0.3525 ( 3602 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4853 -34.4853 -34.4853 -34.4853 -30.6221 -30.6221 -30.6221 -30.6221 -30.5763 -30.5763 -30.5763 -30.5763 1.8204 1.8204 1.8204 1.8204 8.3393 8.3393 8.3393 8.3393 9.8630 9.8630 9.8630 9.8630 10.6549 10.6549 10.6549 10.6549 11.7099 11.7099 11.7099 11.7099 12.1439 12.1439 12.1439 12.1439 13.6006 13.6006 13.6006 13.6006 14.8690 14.8690 14.8690 14.8690 15.4334 15.4334 15.4334 15.4334 18.9649 18.9649 18.9649 18.9649 k = 0.2826 0.1632 0.3525 ( 3600 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4854 -34.4854 -34.4854 -34.4854 -30.6221 -30.6221 -30.6221 -30.6221 -30.5765 -30.5765 -30.5765 -30.5765 1.8518 1.8518 1.8518 1.8518 8.2861 8.2861 8.2861 8.2861 9.8597 9.8597 9.8597 9.8597 10.6515 10.6515 10.6515 10.6515 11.7060 11.7060 11.7060 11.7060 12.1620 12.1620 12.1620 12.1620 13.5408 13.5408 13.5408 13.5408 14.9179 14.9179 14.9179 14.9179 15.3901 15.3901 15.3901 15.3901 18.8993 18.8993 18.8993 18.8993 k = 0.2935 0.1694 0.3525 ( 3608 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4855 -34.4855 -34.4855 -34.4855 -30.6222 -30.6222 -30.6222 -30.6222 -30.5767 -30.5767 -30.5767 -30.5767 1.8832 1.8832 1.8832 1.8832 8.2347 8.2347 8.2347 8.2347 9.8562 9.8562 9.8562 9.8562 10.6457 10.6457 10.6457 10.6457 11.7040 11.7040 11.7040 11.7040 12.1808 12.1808 12.1808 12.1808 13.4774 13.4774 13.4774 13.4774 14.9703 14.9703 14.9703 14.9703 15.3499 15.3499 15.3499 15.3499 18.8356 18.8356 18.8356 18.8356 k = 0.3043 0.1757 0.3525 ( 3616 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4855 -34.4855 -34.4855 -34.4855 -30.6222 -30.6222 -30.6222 -30.6222 -30.5769 -30.5769 -30.5769 -30.5769 1.9144 1.9144 1.9144 1.9144 8.1851 8.1851 8.1851 8.1851 9.8526 9.8526 9.8526 9.8526 10.6376 10.6376 10.6376 10.6376 11.7039 11.7039 11.7039 11.7039 12.2002 12.2002 12.2002 12.2002 13.4122 13.4122 13.4122 13.4122 15.0212 15.0212 15.0212 15.0212 15.3163 15.3163 15.3163 15.3163 18.7737 18.7737 18.7737 18.7737 k = 0.3152 0.1820 0.3525 ( 3620 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4856 -34.4856 -34.4856 -34.4856 -30.6222 -30.6222 -30.6222 -30.6222 -30.5771 -30.5771 -30.5771 -30.5771 1.9452 1.9452 1.9452 1.9452 8.1374 8.1374 8.1374 8.1374 9.8489 9.8489 9.8489 9.8489 10.6274 10.6274 10.6274 10.6274 11.7057 11.7057 11.7057 11.7057 12.2201 12.2201 12.2201 12.2201 13.3466 13.3466 13.3466 13.3466 15.0619 15.0619 15.0619 15.0619 15.2965 15.2965 15.2965 15.2965 18.7137 18.7137 18.7137 18.7137 k = 0.3261 0.1883 0.3525 ( 3624 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4857 -34.4857 -34.4857 -34.4857 -30.6223 -30.6223 -30.6223 -30.6223 -30.5773 -30.5773 -30.5773 -30.5773 1.9755 1.9755 1.9755 1.9755 8.0917 8.0917 8.0917 8.0917 9.8452 9.8452 9.8452 9.8452 10.6153 10.6153 10.6153 10.6153 11.7095 11.7095 11.7095 11.7095 12.2403 12.2403 12.2403 12.2403 13.2817 13.2817 13.2817 13.2817 15.0796 15.0796 15.0796 15.0796 15.3024 15.3024 15.3024 15.3024 18.6558 18.6558 18.6558 18.6558 k = 0.3370 0.1945 0.3525 ( 3624 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4857 -34.4857 -34.4857 -34.4857 -30.6223 -30.6223 -30.6223 -30.6223 -30.5774 -30.5774 -30.5774 -30.5774 2.0051 2.0051 2.0051 2.0051 8.0481 8.0481 8.0481 8.0481 9.8414 9.8414 9.8414 9.8414 10.6017 10.6017 10.6017 10.6017 11.7152 11.7152 11.7152 11.7152 12.2607 12.2607 12.2607 12.2607 13.2181 13.2181 13.2181 13.2181 15.0702 15.0702 15.0702 15.0702 15.3372 15.3372 15.3372 15.3372 18.5998 18.5998 18.5998 18.5998 k = 0.3478 0.2008 0.3525 ( 3622 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4858 -34.4858 -34.4858 -34.4858 -30.6223 -30.6223 -30.6223 -30.6223 -30.5776 -30.5776 -30.5776 -30.5776 2.0339 2.0339 2.0339 2.0339 8.0067 8.0067 8.0067 8.0067 9.8376 9.8376 9.8376 9.8376 10.5868 10.5868 10.5868 10.5868 11.7226 11.7226 11.7226 11.7226 12.2812 12.2812 12.2812 12.2812 13.1566 13.1566 13.1566 13.1566 15.0443 15.0443 15.0443 15.0443 15.3896 15.3896 15.3896 15.3896 18.5460 18.5460 18.5460 18.5460 k = 0.3587 0.2071 0.3525 ( 3618 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4858 -34.4858 -34.4858 -34.4858 -30.6223 -30.6223 -30.6223 -30.6223 -30.5777 -30.5777 -30.5777 -30.5777 2.0616 2.0616 2.0616 2.0616 7.9676 7.9676 7.9676 7.9676 9.8339 9.8339 9.8339 9.8339 10.5709 10.5709 10.5709 10.5709 11.7316 11.7316 11.7316 11.7316 12.3014 12.3014 12.3014 12.3014 13.0974 13.0974 13.0974 13.0974 15.0115 15.0115 15.0115 15.0115 15.4496 15.4496 15.4496 15.4496 18.4944 18.4944 18.4944 18.4944 k = 0.3696 0.2134 0.3525 ( 3618 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4859 -34.4859 -34.4859 -34.4859 -30.6224 -30.6224 -30.6224 -30.6224 -30.5779 -30.5779 -30.5779 -30.5779 2.0882 2.0882 2.0882 2.0882 7.9309 7.9309 7.9309 7.9309 9.8302 9.8302 9.8302 9.8302 10.5545 10.5545 10.5545 10.5545 11.7419 11.7419 11.7419 11.7419 12.3211 12.3211 12.3211 12.3211 13.0410 13.0410 13.0410 13.0410 14.9764 14.9764 14.9764 14.9764 15.5121 15.5121 15.5121 15.5121 18.4452 18.4452 18.4452 18.4452 k = 0.3804 0.2196 0.3525 ( 3618 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4859 -34.4859 -34.4859 -34.4859 -30.6224 -30.6224 -30.6224 -30.6224 -30.5780 -30.5780 -30.5780 -30.5780 2.1133 2.1133 2.1133 2.1133 7.8968 7.8968 7.8968 7.8968 9.8266 9.8266 9.8266 9.8266 10.5378 10.5378 10.5378 10.5378 11.7535 11.7535 11.7535 11.7535 12.3402 12.3402 12.3402 12.3402 12.9878 12.9878 12.9878 12.9878 14.9411 14.9411 14.9411 14.9411 15.5745 15.5745 15.5745 15.5745 18.3984 18.3984 18.3984 18.3984 k = 0.3913 0.2259 0.3525 ( 3614 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4860 -34.4860 -34.4860 -34.4860 -30.6224 -30.6224 -30.6224 -30.6224 -30.5782 -30.5782 -30.5782 -30.5782 2.1370 2.1370 2.1370 2.1370 7.8652 7.8652 7.8652 7.8652 9.8232 9.8232 9.8232 9.8232 10.5212 10.5212 10.5212 10.5212 11.7660 11.7660 11.7660 11.7660 12.3582 12.3582 12.3582 12.3582 12.9381 12.9381 12.9381 12.9381 14.9069 14.9069 14.9069 14.9069 15.6353 15.6353 15.6353 15.6353 18.3543 18.3543 18.3543 18.3543 k = 0.4022 0.2322 0.3525 ( 3616 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4860 -34.4860 -34.4860 -34.4860 -30.6224 -30.6224 -30.6224 -30.6224 -30.5783 -30.5783 -30.5783 -30.5783 2.1589 2.1589 2.1589 2.1589 7.8362 7.8362 7.8362 7.8362 9.8200 9.8200 9.8200 9.8200 10.5051 10.5051 10.5051 10.5051 11.7791 11.7791 11.7791 11.7791 12.3750 12.3750 12.3750 12.3750 12.8920 12.8920 12.8920 12.8920 14.8743 14.8743 14.8743 14.8743 15.6935 15.6935 15.6935 15.6935 18.3130 18.3130 18.3130 18.3130 k = 0.4130 0.2385 0.3525 ( 3622 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4860 -34.4860 -34.4860 -34.4860 -30.6224 -30.6224 -30.6224 -30.6224 -30.5784 -30.5784 -30.5784 -30.5784 2.1791 2.1791 2.1791 2.1791 7.8101 7.8101 7.8101 7.8101 9.8170 9.8170 9.8170 9.8170 10.4897 10.4897 10.4897 10.4897 11.7925 11.7925 11.7925 11.7925 12.3902 12.3902 12.3902 12.3902 12.8501 12.8501 12.8501 12.8501 14.8439 14.8439 14.8439 14.8439 15.7481 15.7481 15.7481 15.7481 18.2749 18.2749 18.2749 18.2749 k = 0.4239 0.2447 0.3525 ( 3622 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4861 -34.4861 -34.4861 -34.4861 -30.6224 -30.6224 -30.6224 -30.6224 -30.5785 -30.5785 -30.5785 -30.5785 2.1972 2.1972 2.1972 2.1972 7.7868 7.7868 7.7868 7.7868 9.8142 9.8142 9.8142 9.8142 10.4754 10.4754 10.4754 10.4754 11.8059 11.8059 11.8059 11.8059 12.4037 12.4037 12.4037 12.4037 12.8126 12.8126 12.8126 12.8126 14.8162 14.8162 14.8162 14.8162 15.7984 15.7984 15.7984 15.7984 18.2402 18.2402 18.2402 18.2402 k = 0.4348 0.2510 0.3525 ( 3622 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4861 -34.4861 -34.4861 -34.4861 -30.6225 -30.6225 -30.6225 -30.6225 -30.5786 -30.5786 -30.5786 -30.5786 2.2132 2.2132 2.2132 2.2132 7.7664 7.7664 7.7664 7.7664 9.8118 9.8118 9.8118 9.8118 10.4625 10.4625 10.4625 10.4625 11.8189 11.8189 11.8189 11.8189 12.4151 12.4151 12.4151 12.4151 12.7798 12.7798 12.7798 12.7798 14.7914 14.7914 14.7914 14.7914 15.8438 15.8438 15.8438 15.8438 18.2091 18.2091 18.2091 18.2091 k = 0.4457 0.2573 0.3525 ( 3628 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4861 -34.4861 -34.4861 -34.4861 -30.6225 -30.6225 -30.6225 -30.6225 -30.5787 -30.5787 -30.5787 -30.5787 2.2269 2.2269 2.2269 2.2269 7.7490 7.7490 7.7490 7.7490 9.8096 9.8096 9.8096 9.8096 10.4511 10.4511 10.4511 10.4511 11.8309 11.8309 11.8309 11.8309 12.4242 12.4242 12.4242 12.4242 12.7520 12.7520 12.7520 12.7520 14.7699 14.7699 14.7699 14.7699 15.8834 15.8834 15.8834 15.8834 18.1821 18.1821 18.1821 18.1821 k = 0.4565 0.2636 0.3525 ( 3628 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5787 -30.5787 -30.5787 -30.5787 2.2383 2.2383 2.2383 2.2383 7.7347 7.7347 7.7347 7.7347 9.8078 9.8078 9.8078 9.8078 10.4415 10.4415 10.4415 10.4415 11.8416 11.8416 11.8416 11.8416 12.4311 12.4311 12.4311 12.4311 12.7295 12.7295 12.7295 12.7295 14.7519 14.7519 14.7519 14.7519 15.9168 15.9168 15.9168 15.9168 18.1594 18.1594 18.1594 18.1594 k = 0.4674 0.2698 0.3525 ( 3628 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5788 -30.5788 -30.5788 -30.5788 2.2473 2.2473 2.2473 2.2473 7.7235 7.7235 7.7235 7.7235 9.8064 9.8064 9.8064 9.8064 10.4339 10.4339 10.4339 10.4339 11.8505 11.8505 11.8505 11.8505 12.4358 12.4358 12.4358 12.4358 12.7122 12.7122 12.7122 12.7122 14.7377 14.7377 14.7377 14.7377 15.9434 15.9434 15.9434 15.9434 18.1414 18.1414 18.1414 18.1414 k = 0.4783 0.2761 0.3525 ( 3632 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5788 -30.5788 -30.5788 -30.5788 2.2538 2.2538 2.2538 2.2538 7.7155 7.7155 7.7155 7.7155 9.8054 9.8054 9.8054 9.8054 10.4284 10.4284 10.4284 10.4284 11.8573 11.8573 11.8573 11.8573 12.4387 12.4387 12.4387 12.4387 12.7001 12.7001 12.7001 12.7001 14.7274 14.7274 14.7274 14.7274 15.9628 15.9628 15.9628 15.9628 18.1283 18.1283 18.1283 18.1283 k = 0.4891 0.2824 0.3525 ( 3632 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5788 -30.5788 -30.5788 -30.5788 2.2577 2.2577 2.2577 2.2577 7.7107 7.7107 7.7107 7.7107 9.8048 9.8048 9.8048 9.8048 10.4250 10.4250 10.4250 10.4250 11.8615 11.8615 11.8615 11.8615 12.4403 12.4403 12.4403 12.4403 12.6930 12.6930 12.6930 12.6930 14.7211 14.7211 14.7211 14.7211 15.9745 15.9745 15.9745 15.9745 18.1203 18.1203 18.1203 18.1203 k = 0.5000 0.2887 0.3525 ( 3640 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5788 -30.5788 -30.5788 -30.5788 2.2590 2.2590 2.2590 2.2590 7.7091 7.7091 7.7091 7.7091 9.8046 9.8046 9.8046 9.8046 10.4238 10.4238 10.4238 10.4238 11.8629 11.8629 11.8629 11.8629 12.4408 12.4408 12.4408 12.4408 12.6906 12.6906 12.6906 12.6906 14.7190 14.7190 14.7190 14.7190 15.9785 15.9785 15.9785 15.9785 18.1176 18.1176 18.1176 18.1176 k = 0.5000 0.2887 0.3525 ( 3640 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5788 -30.5788 -30.5788 -30.5788 2.2590 2.2590 2.2590 2.2590 7.7091 7.7091 7.7091 7.7091 9.8046 9.8046 9.8046 9.8046 10.4238 10.4238 10.4238 10.4238 11.8629 11.8629 11.8629 11.8629 12.4408 12.4408 12.4408 12.4408 12.6906 12.6906 12.6906 12.6906 14.7190 14.7190 14.7190 14.7190 15.9785 15.9785 15.9785 15.9785 18.1176 18.1176 18.1176 18.1176 k = 0.4938 0.2994 0.3525 ( 3632 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5788 -30.5788 -30.5788 -30.5788 2.2586 2.2586 2.2600 2.2600 7.7095 7.7095 7.7111 7.7111 9.7988 9.7988 9.8066 9.8066 10.4228 10.4228 10.4231 10.4231 11.8610 11.8610 11.8658 11.8658 12.4329 12.4329 12.4498 12.4498 12.6850 12.6850 12.6949 12.6949 14.7037 14.7037 14.7140 14.7140 15.9774 15.9774 16.0031 16.0031 18.1178 18.1178 18.1254 18.1254 k = 0.4877 0.3101 0.3525 ( 3636 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5788 -30.5788 -30.5788 -30.5788 2.2588 2.2588 2.2616 2.2616 7.7124 7.7124 7.7156 7.7156 9.7893 9.7893 9.8050 9.8050 10.4198 10.4198 10.4206 10.4206 11.8600 11.8600 11.8694 11.8694 12.4258 12.4258 12.4599 12.4599 12.6778 12.6778 12.6979 12.6979 14.6702 14.6702 14.6890 14.6890 15.9996 15.9996 16.0490 16.0490 18.1261 18.1261 18.1413 18.1413 k = 0.4815 0.3208 0.3525 ( 3636 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5789 -30.5789 -30.5788 -30.5788 2.2597 2.2597 2.2639 2.2639 7.7177 7.7177 7.7225 7.7225 9.7761 9.7761 9.7998 9.7998 10.4149 10.4149 10.4163 10.4163 11.8599 11.8599 11.8738 11.8738 12.4196 12.4196 12.4714 12.4714 12.6691 12.6691 12.6999 12.6999 14.6224 14.6224 14.6468 14.6468 16.0421 16.0421 16.1123 16.1123 18.1426 18.1426 18.1651 18.1651 k = 0.4753 0.3314 0.3525 ( 3628 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5789 -30.5789 -30.5788 -30.5788 2.2611 2.2611 2.2668 2.2668 7.7254 7.7254 7.7320 7.7320 9.7592 9.7592 9.7913 9.7913 10.4079 10.4079 10.4104 10.4104 11.8608 11.8608 11.8788 11.8788 12.4141 12.4141 12.4842 12.4842 12.6587 12.6587 12.7012 12.7012 14.5643 14.5643 14.5913 14.5913 16.1007 16.1007 16.1883 16.1883 18.1675 18.1675 18.1971 18.1971 k = 0.4691 0.3421 0.3525 ( 3630 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5789 -30.5789 -30.5788 -30.5788 2.2632 2.2632 2.2703 2.2703 7.7354 7.7354 7.7438 7.7438 9.7387 9.7387 9.7795 9.7795 10.3990 10.3990 10.4029 10.4029 11.8624 11.8624 11.8842 11.8842 12.4090 12.4090 12.4982 12.4982 12.6470 12.6470 12.7022 12.7022 14.4995 14.4995 14.5266 14.5266 16.1708 16.1708 16.2729 16.2729 18.2011 18.2011 18.2373 18.2373 k = 0.4630 0.3528 0.3525 ( 3626 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5789 -30.5789 -30.5789 -30.5789 2.2659 2.2659 2.2743 2.2743 7.7476 7.7476 7.7582 7.7582 9.7146 9.7146 9.7647 9.7647 10.3880 10.3880 10.3938 10.3938 11.8647 11.8647 11.8899 11.8899 12.4039 12.4039 12.5134 12.5134 12.6341 12.6341 12.7033 12.7033 14.4312 14.4312 14.4563 14.4563 16.2485 16.2485 16.3625 16.3625 18.2436 18.2436 18.2859 18.2859 k = 0.4568 0.3635 0.3525 ( 3634 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4863 -34.4863 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5790 -30.5790 -30.5789 -30.5789 2.2691 2.2691 2.2788 2.2788 7.7620 7.7620 7.7749 7.7749 9.6871 9.6871 9.7469 9.7469 10.3750 10.3750 10.3832 10.3832 11.8677 11.8677 11.8957 11.8957 12.3986 12.3986 12.5291 12.5291 12.6209 12.6209 12.7052 12.7052 14.3613 14.3613 14.3830 14.3830 16.3305 16.3305 16.4542 16.4542 18.2952 18.2952 18.3428 18.3428 k = 0.4506 0.3742 0.3525 ( 3634 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4863 -34.4863 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5790 -30.5790 -30.5789 -30.5789 2.2728 2.2728 2.2838 2.2838 7.7786 7.7786 7.7939 7.7939 9.6564 9.6564 9.7264 9.7264 10.3600 10.3600 10.3713 10.3713 11.8711 11.8711 11.9014 11.9014 12.3928 12.3928 12.5433 12.5433 12.6096 12.6096 12.7084 12.7084 14.2915 14.2915 14.3086 14.3086 16.4142 16.4142 16.5458 16.5458 18.3562 18.3562 18.4081 18.4081 k = 0.4444 0.3849 0.3525 ( 3636 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4863 -34.4863 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5791 -30.5791 -30.5790 -30.5790 2.2770 2.2770 2.2893 2.2893 7.7971 7.7971 7.8153 7.8153 9.6225 9.6225 9.7034 9.7034 10.3432 10.3432 10.3580 10.3580 11.8750 11.8750 11.9071 11.9071 12.3859 12.3859 12.5495 12.5495 12.6068 12.6068 12.7136 12.7136 14.2229 14.2229 14.2348 14.2348 16.4977 16.4977 16.6354 16.6354 18.4264 18.4264 18.4816 18.4816 k = 0.4383 0.3956 0.3525 ( 3636 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4863 -34.4863 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5791 -30.5791 -30.5790 -30.5790 2.2816 2.2816 2.2951 2.2951 7.8174 7.8174 7.8389 7.8389 9.5857 9.5857 9.6781 9.6781 10.3247 10.3247 10.3437 10.3437 11.8792 11.8792 11.9125 11.9125 12.3776 12.3776 12.5419 12.5419 12.6186 12.6186 12.7212 12.7212 14.1563 14.1563 14.1625 14.1625 16.5794 16.5794 16.7218 16.7218 18.5056 18.5056 18.5629 18.5629 k = 0.4321 0.4063 0.3525 ( 3632 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4863 -34.4863 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5792 -30.5792 -30.5790 -30.5790 2.2865 2.2865 2.3013 2.3013 7.8396 7.8396 7.8647 7.8647 9.5462 9.5462 9.6507 9.6507 10.3048 10.3048 10.3283 10.3283 11.8837 11.8837 11.9177 11.9177 12.3677 12.3677 12.5257 12.5257 12.6399 12.6399 12.7317 12.7317 14.0921 14.0921 14.0923 14.0923 16.6584 16.6584 16.8039 16.8039 18.5935 18.5935 18.6515 18.6515 k = 0.4259 0.4170 0.3525 ( 3636 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4863 -34.4863 -34.4862 -34.4862 -30.6225 -30.6225 -30.6224 -30.6224 -30.5792 -30.5792 -30.5791 -30.5791 2.2919 2.2919 2.3078 2.3078 7.8632 7.8632 7.8925 7.8925 9.5042 9.5042 9.6215 9.6215 10.2836 10.2836 10.3122 10.3122 11.8884 11.8884 11.9228 11.9228 12.3560 12.3560 12.5059 12.5059 12.6659 12.6659 12.7452 12.7452 14.0246 14.0246 14.0306 14.0306 16.7338 16.7338 16.8811 16.8811 18.6893 18.6893 18.7466 18.7466 k = 0.4198 0.4277 0.3525 ( 3630 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4863 -34.4863 -34.4862 -34.4862 -30.6225 -30.6225 -30.6224 -30.6224 -30.5793 -30.5793 -30.5791 -30.5791 2.2974 2.2974 2.3144 2.3144 7.8883 7.8883 7.9223 7.9223 9.4599 9.4599 9.5907 9.5907 10.2614 10.2614 10.2955 10.2955 11.8933 11.8933 11.9278 11.9278 12.3426 12.3426 12.4845 12.4845 12.6949 12.6949 12.7620 12.7620 13.9596 13.9596 13.9721 13.9721 16.8053 16.8053 16.9532 16.9532 18.7921 18.7921 18.8473 18.8473 k = 0.4136 0.4384 0.3525 ( 3636 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5793 -30.5793 -30.5792 -30.5792 2.3032 2.3032 2.3213 2.3213 7.9144 7.9144 7.9539 7.9539 9.4136 9.4136 9.5585 9.5585 10.2386 10.2386 10.2783 10.2783 11.8984 11.8984 11.9328 11.9328 12.3274 12.3274 12.4621 12.4621 12.7261 12.7261 12.7819 12.7819 13.8973 13.8973 13.9163 13.9163 16.8723 16.8723 17.0201 17.0201 18.9008 18.9008 18.9525 18.9525 k = 0.4074 0.4491 0.3525 ( 3644 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5794 -30.5794 -30.5792 -30.5792 2.3091 2.3091 2.3281 2.3281 7.9414 7.9414 7.9871 7.9871 9.3656 9.3656 9.5254 9.5254 10.2155 10.2155 10.2611 10.2611 11.9037 11.9037 11.9380 11.9380 12.3108 12.3108 12.4392 12.4392 12.7593 12.7593 12.8045 12.8045 13.8378 13.8378 13.8634 13.8634 16.9350 16.9350 17.0818 17.0818 19.0140 19.0140 19.0607 19.0607 k = 0.4012 0.4597 0.3525 ( 3640 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5794 -30.5794 -30.5792 -30.5792 2.3150 2.3150 2.3350 2.3350 7.9690 7.9690 8.0218 8.0218 9.3164 9.3164 9.4916 9.4916 10.1925 10.1925 10.2440 10.2440 11.9093 11.9093 11.9435 11.9435 12.2930 12.2930 12.4163 12.4163 12.7944 12.7944 12.8297 12.8297 13.7808 13.7808 13.8131 13.8131 16.9932 16.9932 17.1386 17.1386 19.1303 19.1303 19.1705 19.1705 k = 0.3951 0.4704 0.3525 ( 3648 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5795 -30.5795 -30.5793 -30.5793 2.3210 2.3210 2.3418 2.3418 7.9967 7.9967 8.0576 8.0576 9.2662 9.2662 9.4575 9.4575 10.1698 10.1698 10.2272 10.2272 11.9152 11.9152 11.9495 11.9495 12.2742 12.2742 12.3935 12.3935 12.8309 12.8309 12.8570 12.8570 13.7261 13.7261 13.7654 13.7654 17.0470 17.0470 17.1907 17.1907 19.2482 19.2482 19.2803 19.2803 k = 0.3889 0.4811 0.3525 ( 3648 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5796 -30.5796 -30.5793 -30.5793 2.3268 2.3268 2.3484 2.3484 8.0243 8.0243 8.0943 8.0943 9.2157 9.2157 9.4239 9.4239 10.1480 10.1480 10.2111 10.2111 11.9214 11.9214 11.9562 11.9562 12.2547 12.2547 12.3712 12.3712 12.8687 12.8687 12.8859 12.8859 13.6737 13.6737 13.7202 13.7202 17.0963 17.0963 17.2383 17.2383 19.3662 19.3662 19.3882 19.3882 k = 0.3827 0.4918 0.3525 ( 3636 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5796 -30.5796 -30.5794 -30.5794 2.3324 2.3324 2.3547 2.3547 8.0511 8.0511 8.1315 8.1315 9.1654 9.1654 9.3910 9.3910 10.1273 10.1273 10.1958 10.1958 11.9278 11.9278 11.9637 11.9637 12.2347 12.2347 12.3496 12.3496 12.9078 12.9078 12.9160 12.9160 13.6233 13.6233 13.6774 13.6774 17.1413 17.1413 17.2814 17.2814 19.4826 19.4826 19.4924 19.4924 k = 0.3765 0.5025 0.3525 ( 3644 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5796 -30.5796 -30.5794 -30.5794 2.3377 2.3377 2.3607 2.3607 8.0767 8.0767 8.1685 8.1685 9.1161 9.1161 9.3597 9.3597 10.1080 10.1080 10.1816 10.1816 11.9344 11.9344 11.9721 11.9721 12.2143 12.2143 12.3289 12.3289 12.9467 12.9467 12.9477 12.9477 13.5745 13.5745 13.6370 13.6370 17.1818 17.1818 17.3202 17.3202 19.5908 19.5908 19.5959 19.5959 k = 0.3704 0.5132 0.3525 ( 3642 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5797 -30.5797 -30.5795 -30.5795 2.3426 2.3426 2.3662 2.3662 8.1005 8.1005 8.2048 8.2048 9.0686 9.0686 9.3306 9.3306 10.0904 10.0904 10.1687 10.1687 11.9412 11.9412 11.9815 11.9815 12.1939 12.1939 12.3095 12.3095 12.9774 12.9774 12.9883 12.9883 13.5273 13.5273 13.5992 13.5992 17.2177 17.2177 17.3546 17.3546 19.6811 19.6811 19.7041 19.7041 k = 0.3642 0.5239 0.3525 ( 3638 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5797 -30.5797 -30.5795 -30.5795 2.3470 2.3470 2.3711 2.3711 8.1219 8.1219 8.2395 8.2395 9.0241 9.0241 9.3045 9.3045 10.0750 10.0750 10.1574 10.1574 11.9479 11.9479 11.9922 11.9922 12.1736 12.1736 12.2917 12.2917 13.0073 13.0073 13.0295 13.0295 13.4814 13.4814 13.5643 13.5643 17.2489 17.2489 17.3845 17.3845 19.7610 19.7610 19.8052 19.8052 k = 0.3580 0.5346 0.3525 ( 3648 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4864 -34.4864 -30.6225 -30.6225 -30.6224 -30.6224 -30.5798 -30.5798 -30.5795 -30.5795 2.3509 2.3509 2.3754 2.3754 8.1402 8.1402 8.2713 8.2713 8.9839 8.9839 9.2820 9.2820 10.0617 10.0617 10.1477 10.1477 11.9543 11.9543 12.0039 12.0039 12.1535 12.1535 12.2760 12.2760 13.0353 13.0353 13.0707 13.0707 13.4369 13.4369 13.5328 13.5328 17.2751 17.2751 17.4096 17.4096 19.8282 19.8282 19.8965 19.8965 k = 0.3519 0.5453 0.3525 ( 3644 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4864 -34.4864 -30.6225 -30.6225 -30.6224 -30.6224 -30.5798 -30.5798 -30.5795 -30.5795 2.3540 2.3540 2.3788 2.3788 8.1550 8.1550 8.2987 8.2987 8.9496 8.9496 9.2639 9.2639 10.0511 10.0511 10.1399 10.1399 11.9601 11.9601 12.0168 12.0168 12.1339 12.1339 12.2627 12.2627 13.0602 13.0602 13.1116 13.1116 13.3940 13.3940 13.5058 13.5058 17.2961 17.2961 17.4299 17.4299 19.8805 19.8805 19.9744 19.9744 k = 0.3457 0.5560 0.3525 ( 3640 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4864 -34.4864 -30.6225 -30.6225 -30.6224 -30.6224 -30.5798 -30.5798 -30.5795 -30.5795 2.3564 2.3564 2.3815 2.3815 8.1658 8.1658 8.3201 8.3201 8.9233 8.9233 9.2507 9.2507 10.0432 10.0432 10.1342 10.1342 11.9648 11.9648 12.0304 12.0304 12.1152 12.1152 12.2526 12.2526 13.0802 13.0802 13.1510 13.1510 13.3536 13.3536 13.4845 13.4845 17.3115 17.3115 17.4448 17.4448 19.9168 19.9168 20.0343 20.0343 k = 0.3395 0.5667 0.3525 ( 3648 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4864 -34.4864 -30.6225 -30.6225 -30.6224 -30.6224 -30.5798 -30.5798 -30.5796 -30.5796 2.3579 2.3579 2.3831 2.3831 8.1723 8.1723 8.3337 8.3337 8.9066 8.9066 9.2427 9.2427 10.0383 10.0383 10.1306 10.1306 11.9679 11.9679 12.0435 12.0435 12.0990 12.0990 12.2460 12.2460 13.0934 13.0934 13.1851 13.1851 13.3190 13.3190 13.4707 13.4707 17.3210 17.3210 17.4540 17.4540 19.9372 19.9372 20.0715 20.0715 k = 0.3333 0.5774 0.3525 ( 3648 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4864 -34.4864 -30.6225 -30.6225 -30.6224 -30.6224 -30.5798 -30.5798 -30.5796 -30.5796 2.3584 2.3584 2.3837 2.3837 8.1744 8.1744 8.3383 8.3383 8.9009 8.9009 9.2401 9.2401 10.0367 10.0367 10.1294 10.1294 11.9691 11.9691 12.0505 12.0505 12.0910 12.0910 12.2437 12.2437 13.0980 13.0980 13.2014 13.2014 13.3026 13.3026 13.4660 13.4660 17.3243 17.3243 17.4572 17.4572 19.9433 19.9433 20.0835 20.0835 k = 0.3333 0.5774 0.3525 ( 3648 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4864 -34.4864 -30.6225 -30.6225 -30.6224 -30.6224 -30.5798 -30.5798 -30.5796 -30.5796 2.3584 2.3584 2.3837 2.3837 8.1744 8.1744 8.3383 8.3383 8.9009 8.9009 9.2401 9.2401 10.0367 10.0367 10.1294 10.1294 11.9691 11.9691 12.0505 12.0505 12.0910 12.0910 12.2437 12.2437 13.0980 13.0980 13.2014 13.2014 13.3026 13.3026 13.4660 13.4660 17.3243 17.3243 17.4572 17.4572 19.9433 19.9433 20.0835 20.0835 k = 0.3270 0.5665 0.3525 ( 3648 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4864 -34.4864 -30.6225 -30.6225 -30.6224 -30.6224 -30.5798 -30.5798 -30.5796 -30.5796 2.3579 2.3579 2.3830 2.3830 8.1723 8.1723 8.3337 8.3337 8.9066 8.9066 9.2427 9.2427 10.0385 10.0385 10.1307 10.1307 11.9678 11.9678 12.0428 12.0428 12.0998 12.0998 12.2462 12.2462 13.0932 13.0932 13.1846 13.1846 13.3194 13.3194 13.4709 13.4709 17.3208 17.3208 17.4538 17.4538 19.9382 19.9382 20.0732 20.0732 k = 0.3208 0.5556 0.3525 ( 3644 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4864 -34.4864 -30.6225 -30.6225 -30.6224 -30.6224 -30.5798 -30.5798 -30.5796 -30.5796 2.3561 2.3561 2.3811 2.3811 8.1663 8.1663 8.3208 8.3208 8.9229 8.9229 9.2503 9.2503 10.0440 10.0440 10.1347 10.1347 11.9640 11.9640 12.0276 12.0276 12.1184 12.1184 12.2538 12.2538 13.0793 13.0793 13.1497 13.1497 13.3544 13.3544 13.4849 13.4849 17.3102 17.3102 17.4433 17.4433 19.9255 19.9255 20.0480 20.0480 k = 0.3145 0.5447 0.3525 ( 3644 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4864 -34.4864 -30.6225 -30.6225 -30.6224 -30.6224 -30.5798 -30.5798 -30.5795 -30.5795 2.3530 2.3530 2.3778 2.3778 8.1571 8.1571 8.3016 8.3016 8.9477 8.9477 9.2622 9.2622 10.0533 10.0533 10.1414 10.1414 11.9577 11.9577 12.0107 12.0107 12.1411 12.1411 12.2664 12.2664 13.0582 13.0582 13.1095 13.1095 13.3946 13.3946 13.5062 13.5062 17.2921 17.2921 17.4254 17.4254 19.9089 19.9089 20.0163 20.0163 k = 0.3082 0.5338 0.3525 ( 3644 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5797 -30.5797 -30.5795 -30.5795 2.3485 2.3485 2.3730 2.3730 8.1454 8.1454 8.2784 8.2784 8.9789 8.9789 9.2776 9.2776 10.0666 10.0666 10.1509 10.1509 11.9493 11.9493 11.9935 11.9935 12.1663 12.1663 12.2837 12.2837 13.0318 13.0318 13.0676 13.0676 13.4364 13.4364 13.5328 13.5328 17.2665 17.2665 17.4001 17.4001 19.8917 19.8917 19.9838 19.9838 k = 0.3019 0.5229 0.3525 ( 3644 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5797 -30.5797 -30.5795 -30.5795 2.3426 2.3426 2.3667 2.3667 8.1321 8.1321 8.2531 8.2531 9.0146 9.0146 9.2957 9.2957 10.0838 10.0838 10.1633 10.1633 11.9393 11.9393 11.9767 11.9767 12.1937 12.1937 12.3055 12.3055 13.0017 13.0017 13.0249 13.0249 13.4787 13.4787 13.5630 13.5630 17.2335 17.2335 17.3672 17.3672 19.8763 19.8763 19.9543 19.9543 k = 0.2956 0.5120 0.3525 ( 3648 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5796 -30.5796 -30.5794 -30.5794 2.3352 2.3352 2.3588 2.3588 8.1179 8.1179 8.2272 8.2272 9.0530 9.0530 9.3157 9.3157 10.1049 10.1049 10.1784 10.1784 11.9280 11.9280 11.9601 11.9601 12.2230 12.2230 12.3313 12.3313 12.9693 12.9693 12.9821 12.9821 13.5209 13.5209 13.5957 13.5957 17.1931 17.1931 17.3270 17.3270 19.8641 19.8641 19.9297 19.9297 k = 0.2893 0.5011 0.3525 ( 3658 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5796 -30.5796 -30.5794 -30.5794 2.3262 2.3262 2.3492 2.3492 8.1036 8.1036 8.2020 8.2020 9.0931 9.0931 9.3369 9.3369 10.1297 10.1297 10.1963 10.1963 11.9157 11.9157 11.9441 11.9441 12.2539 12.2539 12.3607 12.3607 12.9358 12.9358 12.9395 12.9395 13.5629 13.5629 13.6298 13.6298 17.1459 17.1459 17.2797 17.2797 19.8562 19.8562 19.9109 19.9109 k = 0.2830 0.4902 0.3525 ( 3658 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5795 -30.5795 -30.5793 -30.5793 2.3155 2.3155 2.3379 2.3379 8.0900 8.0900 8.1783 8.1783 9.1338 9.1338 9.3589 9.3589 10.1582 10.1582 10.2170 10.2170 11.9029 11.9029 11.9288 11.9288 12.2861 12.2861 12.3934 12.3934 12.8976 12.8976 12.9023 12.9023 13.6045 13.6045 13.6648 13.6648 17.0922 17.0922 17.2261 17.2261 19.8530 19.8530 19.8980 19.8980 k = 0.2767 0.4793 0.3525 ( 3654 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5794 -30.5794 -30.5792 -30.5792 2.3033 2.3033 2.3249 2.3249 8.0775 8.0775 8.1568 8.1568 9.1746 9.1746 9.3811 9.3811 10.1898 10.1898 10.2401 10.2401 11.8898 11.8898 11.9140 11.9140 12.3190 12.3190 12.4286 12.4286 12.8570 12.8570 12.8697 12.8697 13.6457 13.6457 13.7003 13.7003 17.0327 17.0327 17.1665 17.1666 19.8544 19.8544 19.8909 19.8909 k = 0.2704 0.4684 0.3525 ( 3660 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4864 -34.4864 -34.4863 -34.4863 -30.6225 -30.6225 -30.6224 -30.6224 -30.5794 -30.5794 -30.5792 -30.5792 2.2894 2.2894 2.3103 2.3103 8.0668 8.0668 8.1380 8.1380 9.2149 9.2149 9.4032 9.4032 10.2241 10.2241 10.2655 10.2655 11.8765 11.8765 11.8999 11.8999 12.3516 12.3516 12.4653 12.4653 12.8187 12.8187 12.8397 12.8397 13.6861 13.6861 13.7358 13.7358 16.9680 16.9680 17.1018 17.1018 19.8601 19.8601 19.8888 19.8888 k = 0.2642 0.4575 0.3525 ( 3664 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4863 -34.4863 -34.4862 -34.4862 -30.6225 -30.6225 -30.6224 -30.6224 -30.5793 -30.5793 -30.5791 -30.5791 2.2738 2.2738 2.2939 2.2939 8.0582 8.0582 8.1223 8.1223 9.2544 9.2544 9.4251 9.4251 10.2606 10.2607 10.2929 10.2929 11.8631 11.8631 11.8865 11.8865 12.3822 12.3822 12.5015 12.5015 12.7851 12.7851 12.8141 12.8141 13.7258 13.7258 13.7713 13.7713 16.8988 16.8988 17.0327 17.0327 19.8695 19.8695 19.8908 19.8908 k = 0.2579 0.4466 0.3525 ( 3664 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4863 -34.4863 -34.4862 -34.4862 -30.6225 -30.6225 -30.6224 -30.6224 -30.5792 -30.5792 -30.5790 -30.5790 2.2566 2.2566 2.2758 2.2758 8.0521 8.0521 8.1100 8.1100 9.2929 9.2929 9.4467 9.4467 10.2989 10.2989 10.3219 10.3219 11.8498 11.8498 11.8739 11.8739 12.4085 12.4085 12.5326 12.5326 12.7609 12.7609 12.7959 12.7959 13.7648 13.7648 13.8065 13.8065 16.8258 16.8258 16.9599 16.9599 19.8819 19.8819 19.8960 19.8960 k = 0.2516 0.4357 0.3525 ( 3652 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4863 -34.4863 -34.4862 -34.4862 -30.6225 -30.6225 -30.6224 -30.6224 -30.5790 -30.5790 -30.5788 -30.5788 2.2378 2.2378 2.2561 2.2561 8.0488 8.0488 8.1012 8.1012 9.3301 9.3301 9.4679 9.4679 10.3382 10.3382 10.3522 10.3522 11.8368 11.8368 11.8620 11.8620 12.4269 12.4269 12.5499 12.5499 12.7551 12.7551 12.7889 12.7889 13.8029 13.8029 13.8413 13.8413 16.7498 16.7498 16.8843 16.8843 19.8963 19.8963 19.9033 19.9033 k = 0.2453 0.4248 0.3525 ( 3652 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4862 -34.4862 -34.4861 -34.4861 -30.6225 -30.6225 -30.6224 -30.6224 -30.5789 -30.5789 -30.5787 -30.5787 2.2175 2.2175 2.2349 2.2349 8.0485 8.0485 8.0961 8.0961 9.3661 9.3661 9.4887 9.4887 10.3781 10.3781 10.3832 10.3832 11.8239 11.8239 11.8510 11.8510 12.4341 12.4341 12.5460 12.5460 12.7749 12.7749 12.7964 12.7964 13.8400 13.8400 13.8753 13.8753 16.6715 16.6715 16.8065 16.8065 19.9115 19.9115 19.9117 19.9117 k = 0.2390 0.4139 0.3525 ( 3656 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4862 -34.4862 -34.4861 -34.4861 -30.6224 -30.6224 -30.6224 -30.6224 -30.5788 -30.5788 -30.5786 -30.5786 2.1956 2.1956 2.2121 2.2121 8.0513 8.0513 8.0947 8.0947 9.4008 9.4008 9.5092 9.5092 10.4146 10.4146 10.4178 10.4178 11.8114 11.8114 11.8408 11.8408 12.4291 12.4291 12.5251 12.5251 12.8165 12.8165 12.8199 12.8199 13.8759 13.8759 13.9086 13.9086 16.5916 16.5916 16.7274 16.7274 19.9195 19.9195 19.9270 19.9270 k = 0.2327 0.4031 0.3525 ( 3656 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4861 -34.4861 -34.4860 -34.4860 -30.6224 -30.6224 -30.6224 -30.6224 -30.5786 -30.5786 -30.5785 -30.5785 2.1723 2.1723 2.1878 2.1878 8.0575 8.0575 8.0971 8.0971 9.4342 9.4342 9.5294 9.5294 10.4457 10.4457 10.4568 10.4568 11.7993 11.7993 11.8315 11.8315 12.4138 12.4138 12.4955 12.4955 12.8576 12.8576 12.8718 12.8718 13.9106 13.9106 13.9409 13.9409 16.5109 16.5109 16.6476 16.6476 19.9263 19.9263 19.9412 19.9412 k = 0.2264 0.3922 0.3525 ( 3652 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4861 -34.4861 -34.4860 -34.4860 -30.6224 -30.6224 -30.6223 -30.6223 -30.5785 -30.5785 -30.5783 -30.5783 2.1477 2.1477 2.1622 2.1622 8.0671 8.0671 8.1033 8.1033 9.4663 9.4663 9.5494 9.5494 10.4763 10.4763 10.4945 10.4945 11.7876 11.7876 11.8232 11.8232 12.3912 12.3912 12.4622 12.4622 12.9069 12.9069 12.9360 12.9360 13.9437 13.9437 13.9721 13.9721 16.4301 16.4301 16.5680 16.5680 19.9312 19.9312 19.9533 19.9533 k = 0.2201 0.3813 0.3525 ( 3632 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4860 -34.4860 -34.4859 -34.4859 -30.6224 -30.6224 -30.6223 -30.6223 -30.5783 -30.5783 -30.5782 -30.5782 2.1218 2.1218 2.1354 2.1354 8.0801 8.0801 8.1134 8.1134 9.4973 9.4973 9.5692 9.5692 10.5057 10.5057 10.5306 10.5306 11.7766 11.7766 11.8160 11.8160 12.3641 12.3641 12.4279 12.4279 12.9649 12.9649 13.0067 13.0067 13.9751 13.9751 14.0020 14.0020 16.3500 16.3500 16.4891 16.4891 19.9336 19.9336 19.9626 19.9626 k = 0.2138 0.3704 0.3525 ( 3632 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4860 -34.4860 -34.4859 -34.4859 -30.6224 -30.6224 -30.6223 -30.6223 -30.5781 -30.5781 -30.5780 -30.5780 2.0948 2.0948 2.1075 2.1075 8.0965 8.0965 8.1272 8.1272 9.5270 9.5270 9.5887 9.5887 10.5336 10.5336 10.5645 10.5645 11.7661 11.7661 11.8098 11.8098 12.3345 12.3345 12.3935 12.3935 13.0296 13.0296 13.0826 13.0826 14.0045 14.0045 14.0303 14.0303 16.2711 16.2711 16.4117 16.4117 19.9333 19.9333 19.9685 19.9685 k = 0.2075 0.3595 0.3525 ( 3628 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4859 -34.4859 -34.4858 -34.4858 -30.6223 -30.6223 -30.6223 -30.6223 -30.5780 -30.5780 -30.5778 -30.5778 2.0668 2.0668 2.0785 2.0785 8.1164 8.1164 8.1447 8.1447 9.5556 9.5556 9.6080 9.6080 10.5596 10.5596 10.5958 10.5958 11.7563 11.7563 11.8046 11.8046 12.3037 12.3037 12.3598 12.3598 13.0997 13.0997 13.1631 13.1631 14.0315 14.0315 14.0570 14.0570 16.1943 16.1943 16.3365 16.3365 19.9303 19.9303 19.9709 19.9709 k = 0.2013 0.3486 0.3525 ( 3628 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4858 -34.4858 -34.4858 -34.4858 -30.6223 -30.6223 -30.6223 -30.6223 -30.5778 -30.5778 -30.5777 -30.5777 2.0378 2.0378 2.0486 2.0486 8.1397 8.1397 8.1658 8.1658 9.5831 9.5831 9.6270 9.6270 10.5832 10.5832 10.6241 10.6241 11.7474 11.7474 11.8006 11.8006 12.2727 12.2727 12.3274 12.3274 13.1741 13.1741 13.2477 13.2477 14.0558 14.0558 14.0817 14.0817 16.1204 16.1204 16.2642 16.2642 19.9250 19.9250 19.9700 19.9700 k = 0.1950 0.3377 0.3525 ( 3620 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4858 -34.4858 -34.4857 -34.4857 -30.6223 -30.6223 -30.6222 -30.6222 -30.5776 -30.5776 -30.5775 -30.5775 2.0081 2.0081 2.0180 2.0180 8.1662 8.1662 8.1904 8.1904 9.6095 9.6095 9.6458 9.6458 10.6043 10.6043 10.6492 10.6492 11.7395 11.7395 11.7978 11.7978 12.2421 12.2421 12.2964 12.2964 13.2520 13.2520 13.3360 13.3360 14.0769 14.0769 14.1044 14.1044 16.0503 16.0503 16.1956 16.1956 19.9180 19.9180 19.9664 19.9664 k = 0.1887 0.3268 0.3525 ( 3620 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4857 -34.4857 -34.4857 -34.4857 -30.6223 -30.6223 -30.6222 -30.6222 -30.5774 -30.5774 -30.5773 -30.5773 1.9777 1.9777 1.9868 1.9868 8.1960 8.1960 8.2185 8.2185 9.6348 9.6348 9.6643 9.6643 10.6225 10.6225 10.6707 10.6707 11.7326 11.7326 11.7961 11.7961 12.2125 12.2125 12.2672 12.2672 13.3324 13.3324 13.4275 13.4275 14.0944 14.0944 14.1250 14.1250 15.9848 15.9848 16.1315 16.1315 19.9099 19.9099 19.9606 19.9606 k = 0.1824 0.3159 0.3525 ( 3626 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4857 -34.4857 -34.4856 -34.4856 -30.6222 -30.6222 -30.6222 -30.6222 -30.5772 -30.5772 -30.5771 -30.5771 1.9468 1.9468 1.9551 1.9551 8.2290 8.2290 8.2498 8.2498 9.6590 9.6590 9.6824 9.6824 10.6377 10.6377 10.6886 10.6886 11.7268 11.7268 11.7955 11.7955 12.1840 12.1840 12.2396 12.2396 13.4141 13.4141 13.5216 13.5216 14.1080 14.1080 14.1435 14.1435 15.9248 15.9248 16.0725 16.0725 19.9014 19.9014 19.9535 19.9535 k = 0.1761 0.3050 0.3525 ( 3626 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4856 -34.4856 -34.4855 -34.4855 -30.6222 -30.6222 -30.6222 -30.6222 -30.5770 -30.5770 -30.5769 -30.5769 1.9156 1.9156 1.9231 1.9231 8.2649 8.2649 8.2842 8.2842 9.6821 9.6821 9.7000 9.7000 10.6498 10.6498 10.7027 10.7027 11.7225 11.7225 11.7962 11.7962 12.1569 12.1569 12.2141 12.2141 13.4960 13.4960 13.6175 13.6175 14.1174 14.1174 14.1607 14.1607 15.8712 15.8712 16.0195 16.0195 19.8932 19.8932 19.9460 19.9460 k = 0.1698 0.2941 0.3525 ( 3626 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4855 -34.4855 -34.4855 -34.4855 -30.6222 -30.6222 -30.6222 -30.6222 -30.5768 -30.5768 -30.5767 -30.5767 1.8841 1.8841 1.8908 1.8908 8.3038 8.3038 8.3217 8.3217 9.7041 9.7041 9.7171 9.7171 10.6587 10.6587 10.7129 10.7129 11.7195 11.7195 11.7979 11.7979 12.1315 12.1315 12.1904 12.1904 13.5759 13.5759 13.7139 13.7139 14.1233 14.1233 14.1775 14.1775 15.8248 15.8248 15.9731 15.9731 19.8862 19.8862 19.9389 19.9389 k = 0.1635 0.2832 0.3525 ( 3612 PWs) bands (ev): -63.8460 -63.8460 -63.8460 -63.8460 -34.4854 -34.4854 -34.4854 -34.4854 -30.6222 -30.6222 -30.6221 -30.6221 -30.5766 -30.5766 -30.5765 -30.5765 1.8524 1.8524 1.8585 1.8585 8.3456 8.3456 8.3621 8.3621 9.7249 9.7249 9.7337 9.7337 10.6644 10.6644 10.7192 10.7192 11.7181 11.7181 11.8008 11.8008 12.1079 12.1079 12.1688 12.1688 13.6510 13.6510 13.8079 13.8079 14.1275 14.1275 14.1963 14.1963 15.7863 15.7863 15.9339 15.9339 19.8808 19.8808 19.9330 19.9330 k = 0.1572 0.2723 0.3525 ( 3614 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4854 -34.4854 -34.4853 -34.4853 -30.6221 -30.6221 -30.6221 -30.6221 -30.5764 -30.5764 -30.5763 -30.5763 1.8208 1.8208 1.8262 1.8262 8.3899 8.3899 8.4052 8.4052 9.7445 9.7445 9.7496 9.7496 10.6670 10.6670 10.7217 10.7218 11.7182 11.7182 11.8046 11.8046 12.0861 12.0861 12.1488 12.1488 13.7170 13.7170 13.8924 13.8924 14.1365 14.1365 14.2204 14.2204 15.7563 15.7563 15.9023 15.9023 19.8778 19.8778 19.9290 19.9290 k = 0.1509 0.2614 0.3525 ( 3622 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4853 -34.4853 -34.4853 -34.4853 -30.6221 -30.6221 -30.6221 -30.6221 -30.5762 -30.5762 -30.5761 -30.5761 1.7894 1.7894 1.7942 1.7942 8.4368 8.4368 8.4509 8.4509 9.7628 9.7628 9.7648 9.7648 10.6666 10.6666 10.7206 10.7206 11.7198 11.7198 11.8093 11.8093 12.0660 12.0660 12.1307 12.1307 13.7688 13.7688 13.9509 13.9509 14.1662 14.1662 14.2547 14.2547 15.7350 15.7350 15.8785 15.8785 19.8778 19.8778 19.9275 19.9275 k = 0.1447 0.2505 0.3525 ( 3614 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4852 -34.4852 -34.4852 -34.4852 -30.6221 -30.6221 -30.6221 -30.6221 -30.5760 -30.5760 -30.5759 -30.5759 1.7582 1.7582 1.7625 1.7625 8.4860 8.4860 8.4990 8.4990 9.7792 9.7792 9.7799 9.7799 10.6632 10.6632 10.7159 10.7159 11.7230 11.7230 11.8148 11.8148 12.0479 12.0479 12.1143 12.1143 13.8021 13.8021 13.9686 13.9686 14.2315 14.2315 14.3034 14.3034 15.7224 15.7224 15.8626 15.8626 19.8812 19.8812 19.9293 19.9293 k = 0.1384 0.2397 0.3525 ( 3606 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4852 -34.4852 -34.4851 -34.4851 -30.6221 -30.6221 -30.6220 -30.6220 -30.5757 -30.5757 -30.5757 -30.5757 1.7275 1.7275 1.7312 1.7312 8.5375 8.5375 8.5493 8.5493 9.7927 9.7927 9.7957 9.7957 10.6571 10.6571 10.7080 10.7080 11.7277 11.7277 11.8211 11.8211 12.0316 12.0316 12.0994 12.0994 13.8154 13.8154 13.9556 13.9556 14.3221 14.3221 14.3677 14.3677 15.7182 15.7182 15.8542 15.8542 19.8886 19.8886 19.9346 19.9346 k = 0.1321 0.2288 0.3525 ( 3614 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4851 -34.4851 -34.4851 -34.4851 -30.6220 -30.6220 -30.6220 -30.6220 -30.5755 -30.5755 -30.5755 -30.5755 1.6973 1.6973 1.7005 1.7005 8.5909 8.5909 8.6017 8.6017 9.8053 9.8053 9.8101 9.8101 10.6483 10.6483 10.6969 10.6969 11.7337 11.7337 11.8278 11.8278 12.0169 12.0169 12.0860 12.0860 13.8110 13.8110 13.9263 13.9263 14.4238 14.4238 14.4454 14.4454 15.7219 15.7219 15.8531 15.8531 19.9004 19.9004 19.9442 19.9442 k = 0.1258 0.2179 0.3525 ( 3610 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4850 -34.4850 -34.4850 -34.4850 -30.6220 -30.6220 -30.6220 -30.6220 -30.5753 -30.5753 -30.5753 -30.5753 1.6677 1.6677 1.6705 1.6705 8.6463 8.6463 8.6561 8.6561 9.8170 9.8170 9.8233 9.8233 10.6371 10.6371 10.6830 10.6830 11.7411 11.7411 11.8350 11.8350 12.0041 12.0041 12.0738 12.0738 13.7928 13.7928 13.8875 13.8875 14.5304 14.5304 14.5333 14.5333 15.7327 15.7327 15.8585 15.8585 19.9171 19.9171 19.9582 19.9582 k = 0.1195 0.2070 0.3525 ( 3606 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4850 -34.4850 -34.4849 -34.4849 -30.6220 -30.6220 -30.6219 -30.6219 -30.5751 -30.5751 -30.5751 -30.5751 1.6388 1.6388 1.6412 1.6412 8.7035 8.7035 8.7123 8.7123 9.8277 9.8277 9.8351 9.8351 10.6236 10.6236 10.6665 10.6665 11.7496 11.7496 11.8425 11.8425 11.9929 11.9929 12.0628 12.0628 13.7641 13.7641 13.8424 13.8424 14.6279 14.6279 14.6390 14.6390 15.7499 15.7499 15.8697 15.8697 19.9389 19.9389 19.9771 19.9771 k = 0.1132 0.1961 0.3525 ( 3618 PWs) bands (ev): -63.8461 -63.8461 -63.8461 -63.8461 -34.4849 -34.4849 -34.4849 -34.4849 -30.6220 -30.6220 -30.6219 -30.6219 -30.5749 -30.5749 -30.5749 -30.5749 1.6109 1.6109 1.6129 1.6129 8.7621 8.7621 8.7699 8.7699 9.8373 9.8373 9.8455 9.8455 10.6078 10.6078 10.6475 10.6475 11.7590 11.7590 11.8502 11.8502 11.9831 11.9831 12.0527 12.0527 13.7280 13.7280 13.7928 13.7928 14.7268 14.7268 14.7484 14.7484 15.7725 15.7725 15.8860 15.8860 19.9664 19.9664 20.0011 20.0011 k = 0.1069 0.1852 0.3525 ( 3622 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4848 -34.4848 -34.4848 -34.4848 -30.6219 -30.6219 -30.6219 -30.6219 -30.5748 -30.5748 -30.5747 -30.5747 1.5839 1.5839 1.5856 1.5856 8.8221 8.8221 8.8290 8.8290 9.8460 9.8460 9.8548 9.8548 10.5900 10.5900 10.6263 10.6263 11.7693 11.7693 11.8580 11.8580 11.9748 11.9748 12.0436 12.0436 13.6866 13.6866 13.7403 13.7403 14.8284 14.8284 14.8575 14.8575 15.7997 15.7997 15.9066 15.9066 19.9996 19.9996 20.0303 20.0303 k = 0.1006 0.1743 0.3525 ( 3618 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4848 -34.4848 -34.4848 -34.4848 -30.6219 -30.6219 -30.6219 -30.6219 -30.5746 -30.5746 -30.5745 -30.5745 1.5579 1.5579 1.5593 1.5593 8.8833 8.8833 8.8893 8.8893 9.8538 9.8538 9.8628 9.8628 10.5702 10.5702 10.6030 10.6030 11.7804 11.7804 11.8657 11.8657 11.9678 11.9678 12.0352 12.0352 13.6416 13.6416 13.6860 13.6860 14.9313 14.9313 14.9657 14.9657 15.8306 15.8306 15.9306 15.9306 20.0390 20.0390 20.0644 20.0644 k = 0.0943 0.1634 0.3525 ( 3618 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4847 -34.4847 -34.4847 -34.4847 -30.6219 -30.6219 -30.6219 -30.6219 -30.5744 -30.5744 -30.5744 -30.5744 1.5331 1.5331 1.5342 1.5342 8.9454 8.9454 8.9506 8.9506 9.8606 9.8606 9.8697 9.8697 10.5484 10.5484 10.5778 10.5778 11.7919 11.7919 11.8732 11.8732 11.9621 11.9621 12.0274 12.0274 13.5943 13.5943 13.6308 13.6308 15.0345 15.0345 15.0723 15.0723 15.8646 15.8646 15.9574 15.9574 20.0846 20.0846 20.1023 20.1023 k = 0.0881 0.1525 0.3525 ( 3610 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4847 -34.4847 -34.4846 -34.4846 -30.6219 -30.6219 -30.6218 -30.6218 -30.5742 -30.5742 -30.5742 -30.5742 1.5095 1.5095 1.5104 1.5104 9.0083 9.0083 9.0127 9.0127 9.8666 9.8666 9.8755 9.8755 10.5247 10.5247 10.5507 10.5507 11.8039 11.8039 11.8804 11.8804 11.9577 11.9577 12.0201 12.0201 13.5459 13.5459 13.5757 13.5757 15.1369 15.1369 15.1766 15.1766 15.9009 15.9009 15.9863 15.9863 20.1364 20.1364 20.1400 20.1400 k = 0.0818 0.1416 0.3525 ( 3610 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4846 -34.4846 -34.4846 -34.4846 -30.6218 -30.6218 -30.6218 -30.6218 -30.5740 -30.5740 -30.5740 -30.5740 1.4871 1.4871 1.4879 1.4879 9.0717 9.0717 9.0753 9.0753 9.8719 9.8719 9.8805 9.8805 10.4992 10.4992 10.5219 10.5219 11.8161 11.8161 11.8871 11.8871 11.9543 11.9543 12.0133 12.0133 13.4974 13.4974 13.5214 13.5214 15.2378 15.2378 15.2779 15.2779 15.9390 15.9390 16.0167 16.0167 20.1614 20.1614 20.1934 20.1934 k = 0.0755 0.1307 0.3525 ( 3610 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4845 -34.4845 -34.4845 -34.4845 -30.6218 -30.6218 -30.6218 -30.6218 -30.5739 -30.5739 -30.5739 -30.5739 1.4662 1.4662 1.4668 1.4668 9.1353 9.1353 9.1383 9.1383 9.8765 9.8765 9.8846 9.8846 10.4718 10.4718 10.4913 10.4913 11.8283 11.8283 11.8932 11.8932 11.9519 11.9519 12.0067 12.0067 13.4495 13.4495 13.4686 13.4686 15.3362 15.3362 15.3754 15.3754 15.9784 15.9784 16.0481 16.0481 20.1338 20.1338 20.1677 20.1677 k = 0.0692 0.1198 0.3525 ( 3612 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4845 -34.4845 -34.4845 -34.4845 -30.6218 -30.6218 -30.6218 -30.6218 -30.5737 -30.5737 -30.5737 -30.5737 1.4467 1.4467 1.4472 1.4472 9.1989 9.1989 9.2012 9.2012 9.8806 9.8806 9.8882 9.8882 10.4425 10.4425 10.4590 10.4590 11.8406 11.8406 11.8987 11.8987 11.9505 11.9505 12.0004 12.0004 13.4030 13.4030 13.4179 13.4179 15.4311 15.4311 15.4681 15.4681 16.0189 16.0189 16.0802 16.0802 20.0700 20.0700 20.0852 20.0852 k = 0.0629 0.1089 0.3525 ( 3616 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4845 -34.4845 -34.4845 -34.4845 -30.6218 -30.6218 -30.6218 -30.6218 -30.5736 -30.5736 -30.5736 -30.5736 1.4287 1.4287 1.4290 1.4290 9.2621 9.2621 9.2639 9.2639 9.8843 9.8843 9.8913 9.8913 10.4113 10.4113 10.4250 10.4250 11.8526 11.8526 11.9035 11.9035 11.9500 11.9500 11.9943 11.9943 13.3586 13.3586 13.3699 13.3699 15.5214 15.5214 15.5551 15.5551 16.0602 16.0602 16.1128 16.1128 19.9954 19.9954 20.0029 20.0029 k = 0.0566 0.0980 0.3525 ( 3612 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4844 -34.4844 -34.4844 -34.4844 -30.6218 -30.6218 -30.6218 -30.6218 -30.5735 -30.5735 -30.5735 -30.5735 1.4122 1.4122 1.4125 1.4125 9.3247 9.3247 9.3258 9.3258 9.8879 9.8879 9.8942 9.8942 10.3782 10.3782 10.3894 10.3894 11.8644 11.8644 11.9077 11.9077 11.9501 11.9501 11.9884 11.9884 13.3167 13.3167 13.3251 13.3251 15.6061 15.6061 15.6354 15.6354 16.1022 16.1022 16.1458 16.1458 19.9186 19.9186 19.9222 19.9222 k = 0.0503 0.0871 0.3525 ( 3620 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4844 -34.4844 -34.4844 -34.4844 -30.6218 -30.6218 -30.6218 -30.6218 -30.5734 -30.5734 -30.5734 -30.5734 1.3974 1.3974 1.3976 1.3976 9.3859 9.3859 9.3867 9.3867 9.8917 9.8917 9.8972 9.8972 10.3433 10.3433 10.3521 10.3521 11.8756 11.8756 11.9113 11.9113 11.9507 11.9507 11.9826 11.9826 13.2779 13.2779 13.2839 13.2839 15.6837 15.6837 15.7078 15.7078 16.1445 16.1445 16.1790 16.1790 19.8427 19.8427 19.8442 19.8442 k = 0.0440 0.0763 0.3525 ( 3616 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4843 -34.4843 -34.4843 -34.4843 -30.6217 -30.6217 -30.6217 -30.6217 -30.5733 -30.5733 -30.5733 -30.5733 1.3842 1.3842 1.3843 1.3843 9.4454 9.4454 9.4458 9.4458 9.8959 9.8959 9.9006 9.9006 10.3066 10.3066 10.3134 10.3134 11.8863 11.8863 11.9144 11.9144 11.9515 11.9515 11.9770 11.9770 13.2427 13.2427 13.2467 13.2467 15.7532 15.7532 15.7717 15.7717 16.1867 16.1867 16.2124 16.2124 19.7698 19.7698 19.7704 19.7704 k = 0.0377 0.0654 0.3525 ( 3608 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4843 -34.4843 -34.4843 -34.4843 -30.6217 -30.6217 -30.6217 -30.6217 -30.5732 -30.5732 -30.5732 -30.5732 1.3726 1.3726 1.3727 1.3727 9.5023 9.5023 9.5024 9.5024 9.9012 9.9012 9.9051 9.9051 10.2683 10.2683 10.2734 10.2734 11.8964 11.8964 11.9174 11.9174 11.9523 11.9523 11.9716 11.9716 13.2113 13.2113 13.2139 13.2139 15.8135 15.8135 15.8264 15.8264 16.2279 16.2279 16.2456 16.2456 19.7018 19.7018 19.7019 19.7019 k = 0.0314 0.0545 0.3525 ( 3608 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4843 -34.4843 -34.4843 -34.4843 -30.6217 -30.6217 -30.6217 -30.6217 -30.5731 -30.5731 -30.5731 -30.5731 1.3628 1.3628 1.3629 1.3629 9.5553 9.5553 9.5554 9.5554 9.9082 9.9082 9.9112 9.9112 10.2287 10.2287 10.2323 10.2323 11.9055 11.9055 11.9202 11.9202 11.9527 11.9527 11.9663 11.9663 13.1842 13.1842 13.1857 13.1857 15.8637 15.8637 15.8719 15.8719 16.2668 16.2668 16.2778 16.2778 19.6403 19.6403 19.6404 19.6404 k = 0.0252 0.0436 0.3525 ( 3608 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4843 -34.4843 -34.4843 -34.4843 -30.6217 -30.6217 -30.6217 -30.6217 -30.5730 -30.5730 -30.5730 -30.5730 1.3547 1.3547 1.3548 1.3548 9.6030 9.6030 9.6032 9.6032 9.9178 9.9178 9.9199 9.9199 10.1883 10.1883 10.1906 10.1906 11.9137 11.9137 11.9229 11.9229 11.9527 11.9527 11.9613 11.9613 13.1616 13.1616 13.1624 13.1624 15.9038 15.9038 15.9083 15.9083 16.3018 16.3018 16.3077 16.3077 19.5872 19.5872 19.5873 19.5873 k = 0.0189 0.0327 0.3525 ( 3608 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4843 -34.4843 -34.4843 -34.4843 -30.6217 -30.6217 -30.6217 -30.6217 -30.5730 -30.5730 -30.5730 -30.5730 1.3484 1.3484 1.3485 1.3485 9.6435 9.6435 9.6437 9.6437 9.9311 9.9311 9.9324 9.9324 10.1478 10.1478 10.1491 10.1491 11.9208 11.9208 11.9257 11.9257 11.9522 11.9522 11.9568 11.9568 13.1437 13.1437 13.1441 13.1441 15.9341 15.9341 15.9360 15.9360 16.3313 16.3313 16.3338 16.3338 19.5439 19.5439 19.5440 19.5440 k = 0.0126 0.0218 0.3525 ( 3608 PWs) bands (ev): -63.8462 -63.8462 -63.8462 -63.8462 -34.4842 -34.4842 -34.4842 -34.4842 -30.6217 -30.6217 -30.6217 -30.6217 -30.5730 -30.5730 -30.5730 -30.5730 1.3439 1.3439 1.3439 1.3439 9.6745 9.6745 9.6746 9.6746 9.9489 9.9489 9.9495 9.9495 10.1088 10.1088 10.1094 10.1094 11.9265 11.9265 11.9283 11.9283 11.9511 11.9511 11.9529 11.9529 13.1308 13.1308 13.1309 13.1309 15.9549 15.9549 15.9555 15.9555 16.3535 16.3535 16.3543 16.3543 19.5120 19.5120 19.5120 19.5120 k = 0.0063 0.0109 0.3525 ( 3608 PWs) bands (ev): -63.8463 -63.8463 -63.8463 -63.8463 -34.4842 -34.4842 -34.4842 -34.4842 -30.6217 -30.6217 -30.6217 -30.6217 -30.5729 -30.5729 -30.5729 -30.5729 1.3412 1.3412 1.3412 1.3412 9.6938 9.6938 9.6938 9.6938 9.9691 9.9691 9.9692 9.9692 10.0752 10.0752 10.0753 10.0753 11.9303 11.9303 11.9305 11.9305 11.9499 11.9499 11.9502 11.9502 13.1230 13.1230 13.1230 13.1230 15.9671 15.9671 15.9672 15.9672 16.3673 16.3673 16.3674 16.3674 19.4923 19.4923 19.4923 19.4923 k = 0.0000 0.0000 0.3525 ( 3614 PWs) bands (ev): -63.8463 -63.8463 -63.8463 -63.8463 -34.4842 -34.4842 -34.4842 -34.4842 -30.6217 -30.6217 -30.6217 -30.6217 -30.5729 -30.5729 -30.5729 -30.5729 1.3403 1.3403 1.3403 1.3403 9.7003 9.7003 9.7003 9.7003 9.9805 9.9805 9.9805 9.9805 10.0592 10.0592 10.0592 10.0592 11.9315 11.9315 11.9315 11.9315 11.9493 11.9493 11.9493 11.9493 13.1204 13.1204 13.1204 13.1204 15.9710 15.9710 15.9710 15.9710 16.3719 16.3719 16.3719 16.3719 19.4857 19.4857 19.4857 19.4857 k = 0.5000 0.2887 0.3525 ( 3640 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4862 -34.4862 -34.4862 -34.4862 -30.6225 -30.6225 -30.6225 -30.6225 -30.5788 -30.5788 -30.5788 -30.5788 2.2590 2.2590 2.2590 2.2590 7.7091 7.7091 7.7091 7.7091 9.8046 9.8046 9.8046 9.8046 10.4238 10.4238 10.4238 10.4238 11.8629 11.8629 11.8629 11.8629 12.4408 12.4408 12.4408 12.4408 12.6906 12.6906 12.6906 12.6906 14.7190 14.7190 14.7190 14.7190 15.9785 15.9785 15.9785 15.9785 18.1176 18.1176 18.1176 18.1176 k = 0.5000 0.2887 0.3399 ( 3632 PWs) bands (ev): -63.8465 -63.8465 -63.8454 -63.8454 -34.4877 -34.4877 -34.4847 -34.4847 -30.6271 -30.6271 -30.6179 -30.6179 -30.5797 -30.5797 -30.5780 -30.5780 2.2567 2.2567 2.2608 2.2608 7.6714 7.6714 7.7495 7.7495 9.7637 9.7637 9.8457 9.8457 10.3978 10.3978 10.4497 10.4497 11.7979 11.7979 11.9270 11.9270 12.4268 12.4268 12.4548 12.4548 12.6692 12.6692 12.7128 12.7128 14.6183 14.6183 14.8219 14.8219 15.8812 15.8812 16.0750 16.0750 17.9967 17.9967 18.2397 18.2397 k = 0.5000 0.2887 0.3273 ( 3632 PWs) bands (ev): -63.8471 -63.8471 -63.8448 -63.8448 -34.4892 -34.4892 -34.4832 -34.4832 -30.6317 -30.6317 -30.6132 -30.6132 -30.5805 -30.5805 -30.5772 -30.5772 2.2542 2.2542 2.2623 2.2623 7.6364 7.6364 7.7926 7.7926 9.7233 9.7233 9.8866 9.8866 10.3720 10.3720 10.4748 10.4748 11.7323 11.7323 11.9893 11.9893 12.4134 12.4134 12.4686 12.4686 12.6489 12.6489 12.7357 12.7357 14.5197 14.5197 14.9266 14.9266 15.7839 15.7839 16.1699 16.1699 17.8787 17.8787 18.3613 18.3613 k = 0.5000 0.2887 0.3147 ( 3626 PWs) bands (ev): -63.8476 -63.8476 -63.8442 -63.8442 -34.4908 -34.4908 -34.4817 -34.4817 -30.6363 -30.6363 -30.6086 -30.6086 -30.5813 -30.5813 -30.5763 -30.5763 2.2513 2.2513 2.2635 2.2635 7.6039 7.6039 7.8384 7.8384 9.6836 9.6836 9.9270 9.9270 10.3473 10.3473 10.4988 10.4988 11.6666 11.6666 12.0492 12.0492 12.4009 12.4009 12.4818 12.4818 12.6297 12.6297 12.7591 12.7591 14.4235 14.4235 15.0331 15.0331 15.6870 15.6870 16.2626 16.2626 17.7656 17.7656 18.4806 18.4806 k = 0.5000 0.2887 0.3021 ( 3632 PWs) bands (ev): -63.8482 -63.8482 -63.8437 -63.8437 -34.4923 -34.4923 -34.4802 -34.4802 -30.6408 -30.6408 -30.6041 -30.6041 -30.5821 -30.5821 -30.5755 -30.5755 2.2481 2.2481 2.2642 2.2642 7.5740 7.5740 7.8870 7.8870 9.6448 9.6448 9.9658 9.9658 10.3246 10.3246 10.5212 10.5212 11.6009 11.6009 12.1051 12.1051 12.3901 12.3901 12.4942 12.4942 12.6122 12.6122 12.7829 12.7829 14.3296 14.3296 15.1407 15.1407 15.5914 15.5914 16.3517 16.3517 17.6595 17.6595 18.5957 18.5957 k = 0.5000 0.2887 0.2895 ( 3636 PWs) bands (ev): -63.8488 -63.8488 -63.8431 -63.8431 -34.4938 -34.4938 -34.4787 -34.4787 -30.6453 -30.6453 -30.5997 -30.5997 -30.5828 -30.5828 -30.5747 -30.5747 2.2446 2.2446 2.2647 2.2647 7.5466 7.5466 7.9383 7.9383 9.6069 9.6069 10.0019 10.0019 10.3054 10.3054 10.5418 10.5418 11.5357 11.5357 12.1549 12.1549 12.3825 12.3825 12.5054 12.5054 12.5971 12.5971 12.8071 12.8071 14.2382 14.2382 15.2475 15.2475 15.4995 15.4995 16.4355 16.4355 17.5630 17.5630 18.7052 18.7052 k = 0.5000 0.2887 0.2769 ( 3634 PWs) bands (ev): -63.8493 -63.8493 -63.8426 -63.8426 -34.4953 -34.4953 -34.4773 -34.4773 -30.6496 -30.6496 -30.5953 -30.5953 -30.5835 -30.5835 -30.5739 -30.5739 2.2409 2.2409 2.2647 2.2647 7.5216 7.5216 7.9922 7.9922 9.5701 9.5701 10.0333 10.0333 10.2917 10.2917 10.5603 10.5603 11.4712 11.4712 12.1955 12.1955 12.3804 12.3804 12.5148 12.5148 12.5856 12.5856 12.8316 12.8316 14.1495 14.1495 15.3325 15.3325 15.4325 15.4325 16.5115 16.5115 17.4795 17.4795 18.8072 18.8072 k = 0.5000 0.2887 0.2644 ( 3636 PWs) bands (ev): -63.8499 -63.8499 -63.8420 -63.8420 -34.4967 -34.4967 -34.4759 -34.4759 -30.6539 -30.6539 -30.5913 -30.5913 -30.5839 -30.5839 -30.5731 -30.5731 2.2370 2.2370 2.2644 2.2644 7.4988 7.4988 8.0487 8.0487 9.5346 9.5346 10.0571 10.0571 10.2863 10.2863 10.5764 10.5764 11.4075 11.4075 12.2226 12.2226 12.3861 12.3861 12.5219 12.5219 12.5792 12.5792 12.8563 12.8563 14.0636 14.0636 15.2896 15.2896 15.4969 15.4969 16.5758 16.5758 17.4133 17.4133 18.9006 18.9006 k = 0.5000 0.2887 0.2518 ( 3632 PWs) bands (ev): -63.8504 -63.8504 -63.8415 -63.8415 -34.4981 -34.4981 -34.4745 -34.4745 -30.6581 -30.6581 -30.5881 -30.5881 -30.5835 -30.5835 -30.5723 -30.5723 2.2329 2.2329 2.2638 2.2638 7.4782 7.4782 8.1078 8.1078 9.5002 9.5002 10.0709 10.0709 10.2916 10.2916 10.5901 10.5901 11.3448 11.3448 12.2350 12.2350 12.3983 12.3983 12.5280 12.5280 12.5791 12.5791 12.8812 12.8812 13.9805 13.9805 15.2044 15.2044 15.6070 15.6070 16.6240 16.6240 17.3699 17.3699 18.9844 18.9844 k = 0.5000 0.2887 0.2392 ( 3636 PWs) bands (ev): -63.8509 -63.8509 -63.8410 -63.8410 -34.4995 -34.4995 -34.4732 -34.4732 -30.6621 -30.6621 -30.5873 -30.5873 -30.5810 -30.5810 -30.5715 -30.5715 2.2287 2.2287 2.2629 2.2629 7.4597 7.4597 8.1693 8.1693 9.4672 9.4672 10.0744 10.0744 10.3077 10.3077 10.6013 10.6013 11.2833 11.2833 12.2361 12.2361 12.4103 12.4103 12.5363 12.5363 12.5848 12.5848 12.9060 12.9060 13.9004 13.9004 15.1173 15.1173 15.7226 15.7226 16.6515 16.6515 17.3543 17.3543 19.0578 19.0578 k = 0.5000 0.2887 0.2266 ( 3636 PWs) bands (ev): -63.8514 -63.8514 -63.8405 -63.8405 -34.5009 -34.5009 -34.4719 -34.4719 -30.6660 -30.6660 -30.5875 -30.5875 -30.5773 -30.5773 -30.5708 -30.5708 2.2244 2.2244 2.2617 2.2617 7.4431 7.4431 8.2332 8.2332 9.4357 9.4357 10.0702 10.0702 10.3314 10.3314 10.6101 10.6101 11.2234 11.2234 12.2305 12.2305 12.4158 12.4158 12.5482 12.5482 12.5962 12.5962 12.9306 12.9306 13.8236 13.8236 15.0319 15.0319 15.8405 15.8405 16.6578 16.6578 17.3677 17.3677 19.1210 19.1210 k = 0.5000 0.2887 0.2140 ( 3636 PWs) bands (ev): -63.8519 -63.8519 -63.8400 -63.8400 -34.5022 -34.5022 -34.4707 -34.4707 -30.6698 -30.6698 -30.5881 -30.5881 -30.5736 -30.5736 -30.5701 -30.5701 2.2200 2.2200 2.2603 2.2603 7.4283 7.4283 8.2993 8.2993 9.4056 9.4056 10.0618 10.0618 10.3584 10.3584 10.6170 10.6170 11.1652 11.1652 12.2215 12.2215 12.4140 12.4140 12.5598 12.5598 12.6142 12.6142 12.9550 12.9550 13.7503 13.7503 14.9490 14.9490 15.9597 15.9597 16.6468 16.6468 17.4066 17.4066 19.1742 19.1742 k = 0.5000 0.2887 0.2014 ( 3628 PWs) bands (ev): -63.8523 -63.8523 -63.8396 -63.8396 -34.5034 -34.5034 -34.4695 -34.4695 -30.6734 -30.6734 -30.5887 -30.5887 -30.5700 -30.5700 -30.5693 -30.5693 2.2156 2.2156 2.2587 2.2587 7.4152 7.4152 8.3674 8.3674 9.3770 9.3770 10.0516 10.0516 10.3850 10.3850 10.6229 10.6229 11.1092 11.1092 12.2108 12.2108 12.4076 12.4076 12.5675 12.5675 12.6380 12.6380 12.9789 12.9789 13.6808 13.6808 14.8691 14.8691 16.0793 16.0793 16.6258 16.6258 17.4646 17.4646 19.2181 19.2181 k = 0.5000 0.2887 0.1888 ( 3624 PWs) bands (ev): -63.8527 -63.8527 -63.8391 -63.8391 -34.5046 -34.5046 -34.4684 -34.4684 -30.6769 -30.6769 -30.5892 -30.5892 -30.5688 -30.5688 -30.5662 -30.5662 2.2112 2.2112 2.2570 2.2570 7.4037 7.4037 8.4374 8.4374 9.3501 9.3501 10.0414 10.0414 10.4076 10.4076 10.6289 10.6289 11.0560 11.0560 12.1994 12.1994 12.3988 12.3988 12.5714 12.5714 12.6640 12.6640 13.0022 13.0022 13.6153 13.6153 14.7926 14.7926 16.1983 16.1983 16.6020 16.6020 17.5354 17.5354 19.2536 19.2536 k = 0.5000 0.2887 0.1762 ( 3624 PWs) bands (ev): -63.8531 -63.8531 -63.8387 -63.8387 -34.5058 -34.5058 -34.4673 -34.4673 -30.6802 -30.6802 -30.5898 -30.5898 -30.5682 -30.5682 -30.5628 -30.5628 2.2069 2.2069 2.2550 2.2550 7.3935 7.3935 8.5092 8.5092 9.3248 9.3248 10.0319 10.0319 10.4228 10.4228 10.6362 10.6362 11.0067 11.0067 12.1876 12.1876 12.3888 12.3888 12.5721 12.5721 12.6897 12.6897 13.0245 13.0245 13.5540 13.5540 14.7197 14.7197 16.3131 16.3131 16.5827 16.5827 17.6148 17.6148 19.2820 19.2820 k = 0.5000 0.2887 0.1636 ( 3632 PWs) bands (ev): -63.8535 -63.8535 -63.8383 -63.8383 -34.5069 -34.5069 -34.4663 -34.4663 -30.6833 -30.6833 -30.5904 -30.5904 -30.5676 -30.5676 -30.5596 -30.5596 2.2027 2.2027 2.2530 2.2530 7.3847 7.3847 8.5823 8.5823 9.3013 9.3013 10.0239 10.0239 10.4284 10.4284 10.6447 10.6447 10.9628 10.9628 12.1759 12.1759 12.3784 12.3784 12.5699 12.5699 12.7136 12.7136 13.0456 13.0456 13.4974 13.4974 14.6507 14.6507 16.4113 16.4113 16.5827 16.5827 17.6998 17.6998 19.3041 19.3041 k = 0.5000 0.2887 0.1511 ( 3630 PWs) bands (ev): -63.8539 -63.8539 -63.8379 -63.8379 -34.5079 -34.5079 -34.4654 -34.4654 -30.6862 -30.6862 -30.5909 -30.5909 -30.5670 -30.5670 -30.5565 -30.5565 2.1987 2.1987 2.2510 2.2510 7.3770 7.3770 8.6566 8.6566 9.2796 9.2796 10.0175 10.0175 10.4237 10.4237 10.6519 10.6519 10.9275 10.9275 12.1646 12.1646 12.3681 12.3681 12.5651 12.5651 12.7353 12.7353 13.0656 13.0656 13.4456 13.4456 14.5860 14.5860 16.4596 16.4596 16.6366 16.6366 17.7885 17.7885 19.3212 19.3212 k = 0.5000 0.2887 0.1385 ( 3624 PWs) bands (ev): -63.8542 -63.8542 -63.8376 -63.8376 -34.5088 -34.5088 -34.4645 -34.4645 -30.6889 -30.6889 -30.5914 -30.5914 -30.5665 -30.5665 -30.5536 -30.5536 2.1948 2.1948 2.2490 2.2490 7.3704 7.3704 8.7316 8.7316 9.2600 9.2600 10.0127 10.0127 10.4100 10.4100 10.6525 10.6525 10.9045 10.9045 12.1537 12.1537 12.3582 12.3582 12.5576 12.5576 12.7544 12.7544 13.0840 13.0840 13.3990 13.3990 14.5257 14.5257 16.4641 16.4641 16.7383 16.7383 17.8796 17.8796 19.3341 19.3341 k = 0.5000 0.2887 0.1259 ( 3624 PWs) bands (ev): -63.8545 -63.8545 -63.8373 -63.8373 -34.5097 -34.5097 -34.4637 -34.4637 -30.6914 -30.6914 -30.5919 -30.5919 -30.5660 -30.5660 -30.5510 -30.5510 2.1911 2.1911 2.2469 2.2469 7.3647 7.3647 8.8068 8.8068 9.2426 9.2426 10.0093 10.0093 10.3890 10.3890 10.6418 10.6418 10.8971 10.8971 12.1434 12.1434 12.3487 12.3487 12.5477 12.5477 12.7709 12.7709 13.1008 13.1008 13.3576 13.3576 14.4700 14.4700 16.4583 16.4583 16.8539 16.8539 17.9720 17.9720 19.3437 19.3437 k = 0.5000 0.2887 0.1133 ( 3624 PWs) bands (ev): -63.8548 -63.8548 -63.8370 -63.8370 -34.5105 -34.5105 -34.4630 -34.4630 -30.6937 -30.6937 -30.5923 -30.5923 -30.5656 -30.5656 -30.5485 -30.5485 2.1877 2.1877 2.2450 2.2450 7.3598 7.3598 8.8814 8.8814 9.2280 9.2280 10.0067 10.0067 10.3630 10.3630 10.6191 10.6191 10.9042 10.9042 12.1338 12.1338 12.3397 12.3397 12.5358 12.5358 12.7848 12.7848 13.1158 13.1158 13.3216 13.3216 14.4192 14.4192 16.4521 16.4521 16.9724 16.9724 18.0648 18.0648 19.3505 19.3505 k = 0.5000 0.2887 0.1007 ( 3618 PWs) bands (ev): -63.8551 -63.8551 -63.8367 -63.8367 -34.5113 -34.5113 -34.4623 -34.4623 -30.6957 -30.6957 -30.5927 -30.5927 -30.5652 -30.5652 -30.5463 -30.5463 2.1845 2.1845 2.2431 2.2431 7.3557 7.3557 8.9541 8.9541 9.2171 9.2171 10.0039 10.0039 10.3342 10.3342 10.5881 10.5881 10.9211 10.9211 12.1250 12.1250 12.3314 12.3314 12.5221 12.5221 12.7965 12.7965 13.1290 13.1290 13.2910 13.2910 14.3733 14.3733 16.4477 16.4477 17.0903 17.0903 18.1570 18.1570 19.3554 19.3554 k = 0.5000 0.2887 0.0881 ( 3626 PWs) bands (ev): -63.8553 -63.8553 -63.8365 -63.8365 -34.5119 -34.5119 -34.4617 -34.4617 -30.6976 -30.6976 -30.5930 -30.5930 -30.5649 -30.5649 -30.5444 -30.5444 2.1817 2.1817 2.2414 2.2414 7.3522 7.3522 9.0217 9.0217 9.2122 9.2122 9.9993 9.9993 10.3055 10.3055 10.5523 10.5523 10.9428 10.9428 12.1170 12.1170 12.3237 12.3237 12.5074 12.5074 12.8060 12.8060 13.1399 13.1399 13.2656 13.2656 14.3325 14.3325 16.4454 16.4454 17.2053 17.2053 18.2472 18.2472 19.3587 19.3587 k = 0.5000 0.2887 0.0755 ( 3624 PWs) bands (ev): -63.8556 -63.8556 -63.8363 -63.8363 -34.5125 -34.5125 -34.4612 -34.4612 -30.6991 -30.6991 -30.5933 -30.5933 -30.5646 -30.5646 -30.5427 -30.5427 2.1791 2.1791 2.2398 2.2398 7.3494 7.3494 9.0775 9.0775 9.2197 9.2197 9.9907 9.9907 10.2802 10.2802 10.5146 10.5146 10.9662 10.9662 12.1100 12.1100 12.3168 12.3168 12.4925 12.4925 12.8137 12.8137 13.1488 13.1488 13.2455 13.2455 14.2970 14.2970 16.4448 16.4448 17.3154 17.3154 18.3339 18.3339 19.3608 19.3608 k = 0.5000 0.2887 0.0629 ( 3622 PWs) bands (ev): -63.8557 -63.8557 -63.8361 -63.8361 -34.5130 -34.5130 -34.4608 -34.4608 -30.7005 -30.7005 -30.5936 -30.5936 -30.5643 -30.5643 -30.5412 -30.5412 2.1770 2.1770 2.2384 2.2384 7.3471 7.3471 9.1106 9.1106 9.2491 9.2491 9.9757 9.9757 10.2618 10.2618 10.4764 10.4764 10.9888 10.9888 12.1040 12.1040 12.3106 12.3106 12.4780 12.4780 12.8198 12.8198 13.1552 13.1552 13.2303 13.2303 14.2667 14.2667 16.4456 16.4456 17.4183 17.4183 18.4149 18.4149 19.3621 19.3621 k = 0.5000 0.2887 0.0504 ( 3622 PWs) bands (ev): -63.8558 -63.8558 -63.8360 -63.8360 -34.5134 -34.5134 -34.4604 -34.4604 -30.7016 -30.7016 -30.5938 -30.5938 -30.5641 -30.5641 -30.5400 -30.5400 2.1752 2.1752 2.2373 2.2373 7.3453 7.3453 9.1224 9.1224 9.2976 9.2976 9.9534 9.9534 10.2530 10.2530 10.4390 10.4390 11.0091 11.0091 12.0990 12.0990 12.3053 12.3053 12.4649 12.4649 12.8245 12.8245 13.1590 13.1590 13.2201 13.2201 14.2418 14.2418 16.4470 16.4470 17.5109 17.5109 18.4875 18.4875 19.3629 19.3629 k = 0.5000 0.2887 0.0378 ( 3624 PWs) bands (ev): -63.8560 -63.8560 -63.8359 -63.8359 -34.5137 -34.5137 -34.4601 -34.4601 -30.7025 -30.7025 -30.5940 -30.5940 -30.5639 -30.5639 -30.5391 -30.5391 2.1738 2.1738 2.2363 2.2363 7.3439 7.3439 9.1247 9.1247 9.3510 9.3510 9.9253 9.9253 10.2542 10.2542 10.4030 10.4030 11.0260 11.0260 12.0951 12.0951 12.3009 12.3009 12.4539 12.4539 12.8278 12.8278 13.1605 13.1605 13.2140 13.2140 14.2225 14.2225 16.4488 16.4488 17.5897 17.5897 18.5486 18.5486 19.3633 19.3633 k = 0.5000 0.2887 0.0252 ( 3624 PWs) bands (ev): -63.8561 -63.8561 -63.8358 -63.8358 -34.5139 -34.5139 -34.4599 -34.4599 -30.7031 -30.7031 -30.5941 -30.5941 -30.5638 -30.5638 -30.5384 -30.5384 2.1727 2.1727 2.2357 2.2357 7.3430 7.3430 9.1243 9.1243 9.3988 9.3988 9.8964 9.8964 10.2641 10.2641 10.3696 10.3696 11.0387 11.0387 12.0922 12.0922 12.2976 12.2976 12.4455 12.4455 12.8301 12.8301 13.1604 13.1604 13.2110 13.2110 14.2086 14.2086 16.4504 16.4504 17.6506 17.6506 18.5951 18.5951 19.3635 19.3635 k = 0.5000 0.2887 0.0126 ( 3624 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4598 -34.4598 -30.7035 -30.7035 -30.5941 -30.5941 -30.5637 -30.5637 -30.5380 -30.5380 2.1721 2.1721 2.2353 2.2353 7.3424 7.3424 9.1235 9.1235 9.4327 9.4327 9.8736 9.8736 10.2799 10.2799 10.3401 10.3401 11.0466 11.0466 12.0905 12.0905 12.2956 12.2956 12.4403 12.4403 12.8315 12.8315 13.1598 13.1598 13.2098 13.2098 14.2003 14.2003 16.4515 16.4515 17.6892 17.6892 18.6242 18.6242 19.3636 19.3636 k = 0.5000 0.2887-0.0000 ( 3624 PWs) bands (ev): -63.8561 -63.8561 -63.8357 -63.8357 -34.5141 -34.5141 -34.4597 -34.4597 -30.7036 -30.7036 -30.5942 -30.5942 -30.5637 -30.5637 -30.5379 -30.5379 2.1719 2.1719 2.2351 2.2351 7.3422 7.3422 9.1231 9.1231 9.4452 9.4452 9.8648 9.8648 10.2923 10.2923 10.3234 10.3234 11.0492 11.0492 12.0899 12.0899 12.2949 12.2949 12.4386 12.4386 12.8319 12.8319 13.1595 13.1595 13.2095 13.2095 14.1975 14.1975 16.4518 16.4518 17.7026 17.7026 18.6340 18.6340 19.3637 19.3637 k = 0.3333 0.5774-0.0000 ( 3603 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4601 -34.4601 -30.7035 -30.7035 -30.5950 -30.5950 -30.5643 -30.5643 -30.5381 -30.5381 2.3284 2.3284 2.3539 2.3539 7.6567 7.6567 8.4080 8.4080 8.6249 8.6249 9.8817 9.8817 9.8980 9.8980 11.1027 11.1027 11.3084 11.3084 12.1312 12.1312 12.4407 12.4407 12.9594 12.9594 12.9983 12.9983 13.0847 13.0847 14.0249 14.0249 14.1814 14.1814 14.9631 14.9631 14.9666 14.9666 18.1746 18.1746 21.4840 21.4840 k = 0.3333 0.5774 0.0126 ( 3609 PWs) bands (ev): -63.8561 -63.8561 -63.8356 -63.8356 -34.5142 -34.5142 -34.4601 -34.4601 -30.7034 -30.7034 -30.5949 -30.5949 -30.5643 -30.5643 -30.5383 -30.5383 2.3285 2.3285 2.3540 2.3540 7.6587 7.6587 8.4072 8.4072 8.6240 8.6240 9.8822 9.8822 9.8985 9.8985 11.1031 11.1031 11.3040 11.3040 12.1313 12.1313 12.4403 12.4403 12.9588 12.9588 12.9983 12.9983 13.0841 13.0841 14.0200 14.0200 14.1762 14.1762 14.9717 14.9717 14.9758 14.9758 18.1792 18.1792 21.4841 21.4841 k = 0.3333 0.5774 0.0252 ( 3615 PWs) bands (ev): -63.8560 -63.8560 -63.8357 -63.8357 -34.5141 -34.5141 -34.4602 -34.4602 -30.7031 -30.7031 -30.5949 -30.5949 -30.5644 -30.5644 -30.5387 -30.5387 2.3288 2.3288 2.3542 2.3542 7.6644 7.6644 8.4049 8.4049 8.6212 8.6212 9.8834 9.8835 9.9002 9.9002 11.1037 11.1037 11.2914 11.2914 12.1316 12.1316 12.4389 12.4389 12.9570 12.9570 12.9984 12.9984 13.0821 13.0821 14.0056 14.0056 14.1612 14.1612 14.9971 14.9971 15.0029 15.0029 18.1930 18.1930 21.4843 21.4843 k = 0.3333 0.5774 0.0378 ( 3618 PWs) bands (ev): -63.8560 -63.8560 -63.8358 -63.8358 -34.5138 -34.5138 -34.4604 -34.4604 -30.7024 -30.7024 -30.5947 -30.5947 -30.5645 -30.5645 -30.5393 -30.5393 2.3292 2.3292 2.3547 2.3547 7.6740 7.6740 8.4011 8.4011 8.6167 8.6167 9.8856 9.8856 9.9030 9.9030 11.1034 11.1034 11.2723 11.2723 12.1320 12.1320 12.4365 12.4365 12.9545 12.9545 12.9984 12.9984 13.0790 13.0790 13.9833 13.9833 14.1383 14.1383 15.0377 15.0377 15.0459 15.0459 18.2159 18.2159 21.4846 21.4846 k = 0.3333 0.5774 0.0504 ( 3630 PWs) bands (ev): -63.8559 -63.8559 -63.8359 -63.8359 -34.5135 -34.5135 -34.4607 -34.4607 -30.7016 -30.7016 -30.5946 -30.5946 -30.5647 -30.5647 -30.5403 -30.5403 2.3299 2.3299 2.3553 2.3553 7.6874 7.6874 8.3958 8.3958 8.6105 8.6105 9.8885 9.8885 9.9068 9.9068 11.0990 11.0990 11.2501 11.2501 12.1326 12.1326 12.4330 12.4330 12.9513 12.9513 12.9976 12.9976 13.0747 13.0747 13.9549 13.9549 14.1097 14.1097 15.0915 15.0915 15.1024 15.1024 18.2479 18.2479 21.4849 21.4849 k = 0.3333 0.5774 0.0629 ( 3636 PWs) bands (ev): -63.8557 -63.8557 -63.8360 -63.8360 -34.5131 -34.5131 -34.4611 -34.4611 -30.7005 -30.7005 -30.5944 -30.5944 -30.5649 -30.5649 -30.5415 -30.5415 2.3307 2.3307 2.3561 2.3561 7.7046 7.7046 8.3892 8.3892 8.6026 8.6026 9.8923 9.8923 9.9116 9.9116 11.0848 11.0848 11.2314 11.2314 12.1332 12.1332 12.4282 12.4282 12.9479 12.9479 12.9957 12.9957 13.0695 13.0695 13.9222 13.9222 14.0774 14.0774 15.1568 15.1568 15.1704 15.1704 18.2890 18.2890 21.4852 21.4852 k = 0.3333 0.5774 0.0755 ( 3633 PWs) bands (ev): -63.8556 -63.8556 -63.8362 -63.8362 -34.5126 -34.5126 -34.4615 -34.4615 -30.6991 -30.6991 -30.5941 -30.5941 -30.5652 -30.5652 -30.5430 -30.5430 2.3316 2.3316 2.3571 2.3571 7.7256 7.7256 8.3812 8.3812 8.5934 8.5934 9.8969 9.8969 9.9174 9.9174 11.0546 11.0546 11.2230 11.2230 12.1337 12.1337 12.4219 12.4219 12.9442 12.9442 12.9925 12.9925 13.0637 13.0637 13.8869 13.8869 14.0430 14.0430 15.2316 15.2316 15.2478 15.2478 18.3389 18.3389 21.4854 21.4854 k = 0.3333 0.5774 0.0881 ( 3633 PWs) bands (ev): -63.8554 -63.8554 -63.8364 -63.8364 -34.5121 -34.5121 -34.4620 -34.4620 -30.6975 -30.6975 -30.5938 -30.5938 -30.5655 -30.5655 -30.5447 -30.5447 2.3327 2.3327 2.3582 2.3582 7.7503 7.7503 8.3722 8.3722 8.5827 8.5827 9.9022 9.9022 9.9240 9.9240 11.0081 11.0081 11.2263 11.2263 12.1340 12.1340 12.4140 12.4140 12.9400 12.9400 12.9882 12.9882 13.0573 13.0573 13.8501 13.8501 14.0077 14.0077 15.3145 15.3145 15.3332 15.3332 18.3975 18.3975 21.4853 21.4853 k = 0.3333 0.5774 0.1007 ( 3648 PWs) bands (ev): -63.8551 -63.8551 -63.8367 -63.8367 -34.5114 -34.5114 -34.4626 -34.4626 -30.6957 -30.6957 -30.5935 -30.5935 -30.5659 -30.5659 -30.5467 -30.5467 2.3340 2.3340 2.3594 2.3594 7.7786 7.7786 8.3621 8.3621 8.5710 8.5710 9.9081 9.9081 9.9312 9.9312 10.9492 10.9492 11.2381 11.2381 12.1340 12.1340 12.4042 12.4042 12.9345 12.9345 12.9832 12.9832 13.0505 13.0505 13.8126 13.8126 13.9720 13.9720 15.4043 15.4043 15.4255 15.4255 18.4645 18.4645 21.4848 21.4848 k = 0.3333 0.5774 0.1133 ( 3639 PWs) bands (ev): -63.8549 -63.8549 -63.8369 -63.8369 -34.5107 -34.5107 -34.4633 -34.4633 -30.6936 -30.6936 -30.5931 -30.5931 -30.5663 -30.5663 -30.5488 -30.5488 2.3354 2.3354 2.3608 2.3608 7.8106 7.8106 8.3511 8.3511 8.5583 8.5583 9.9147 9.9147 9.9391 9.9391 10.8814 10.8814 11.2558 11.2558 12.1335 12.1335 12.3927 12.3927 12.9264 12.9264 12.9791 12.9791 13.0439 13.0439 13.7755 13.7755 13.9369 13.9369 15.5001 15.5001 15.5239 15.5239 18.5399 18.5399 21.4836 21.4836 k = 0.3333 0.5774 0.1259 ( 3651 PWs) bands (ev): -63.8546 -63.8546 -63.8373 -63.8373 -34.5099 -34.5099 -34.4640 -34.4640 -30.6914 -30.6914 -30.5926 -30.5926 -30.5667 -30.5667 -30.5513 -30.5513 2.3368 2.3368 2.3622 2.3622 7.8462 7.8462 8.3393 8.3393 8.5447 8.5447 9.9219 9.9219 9.9474 9.9474 10.8071 10.8071 11.2776 11.2776 12.1325 12.1325 12.3793 12.3793 12.9139 12.9139 12.9777 12.9777 13.0376 13.0376 13.7387 13.7387 13.9022 13.9022 15.6010 15.6010 15.6275 15.6275 18.6232 18.6232 21.4815 21.4815 k = 0.3333 0.5774 0.1385 ( 3651 PWs) bands (ev): -63.8543 -63.8543 -63.8376 -63.8376 -34.5090 -34.5090 -34.4648 -34.4648 -30.6889 -30.6889 -30.5922 -30.5922 -30.5672 -30.5672 -30.5539 -30.5539 2.3384 2.3384 2.3637 2.3637 7.8852 7.8852 8.3270 8.3270 8.5307 8.5307 9.9295 9.9295 9.9558 9.9559 10.7278 10.7278 11.3028 11.3028 12.1308 12.1308 12.3642 12.3642 12.8962 12.8962 12.9795 12.9795 13.0320 13.0320 13.7028 13.7028 13.8683 13.8683 15.7066 15.7066 15.7360 15.7360 18.7140 18.7140 21.4778 21.4778 k = 0.3333 0.5774 0.1511 ( 3639 PWs) bands (ev): -63.8539 -63.8539 -63.8379 -63.8379 -34.5081 -34.5081 -34.4657 -34.4657 -30.6862 -30.6862 -30.5916 -30.5916 -30.5677 -30.5677 -30.5568 -30.5568 2.3400 2.3400 2.3654 2.3654 7.9276 7.9276 8.3142 8.3142 8.5164 8.5164 9.9376 9.9376 9.9643 9.9643 10.6448 10.6448 11.3312 11.3312 12.1283 12.1283 12.3475 12.3475 12.8735 12.8735 12.9846 12.9846 13.0273 13.0273 13.6679 13.6679 13.8353 13.8353 15.8161 15.8161 15.8486 15.8486 18.8121 18.8121 21.4720 21.4720 k = 0.3333 0.5774 0.1636 ( 3639 PWs) bands (ev): -63.8535 -63.8535 -63.8383 -63.8383 -34.5070 -34.5070 -34.4666 -34.4666 -30.6832 -30.6832 -30.5911 -30.5911 -30.5683 -30.5683 -30.5599 -30.5599 2.3416 2.3416 2.3670 2.3670 7.9733 7.9733 8.3012 8.3012 8.5020 8.5020 9.9460 9.9460 9.9721 9.9721 10.5592 10.5592 11.3622 11.3622 12.1251 12.1251 12.3295 12.3295 12.8462 12.8462 12.9924 12.9924 13.0236 13.0236 13.6340 13.6340 13.8031 13.8031 15.9289 15.9289 15.9650 15.9650 18.9168 18.9168 21.4625 21.4625 k = 0.3333 0.5774 0.1762 ( 3633 PWs) bands (ev): -63.8531 -63.8531 -63.8387 -63.8387 -34.5060 -34.5060 -34.4676 -34.4676 -30.6801 -30.6801 -30.5905 -30.5905 -30.5689 -30.5689 -30.5632 -30.5632 2.3433 2.3433 2.3687 2.3687 8.0220 8.0220 8.2881 8.2881 8.4878 8.4878 9.9545 9.9545 9.9788 9.9788 10.4723 10.4723 11.3959 11.3959 12.1210 12.1210 12.3105 12.3105 12.8150 12.8150 13.0026 13.0026 13.0213 13.0213 13.6013 13.6013 13.7717 13.7717 16.0445 16.0445 16.0845 16.0845 19.0278 19.0278 21.4460 21.4460 k = 0.3333 0.5774 0.1888 ( 3642 PWs) bands (ev): -63.8527 -63.8527 -63.8391 -63.8391 -34.5048 -34.5048 -34.4687 -34.4687 -30.6769 -30.6769 -30.5899 -30.5899 -30.5695 -30.5695 -30.5666 -30.5666 2.3450 2.3450 2.3703 2.3703 8.0736 8.0736 8.2751 8.2751 8.4741 8.4741 9.9632 9.9632 9.9831 9.9831 10.3857 10.3857 11.4319 11.4319 12.1161 12.1161 12.2907 12.2907 12.7798 12.7798 13.0146 13.0146 13.0204 13.0204 13.5696 13.5696 13.7411 13.7411 16.1622 16.1622 16.2065 16.2065 19.1444 19.1444 21.4130 21.4130 k = 0.3333 0.5774 0.2014 ( 3642 PWs) bands (ev): -63.8523 -63.8523 -63.8395 -63.8395 -34.5036 -34.5036 -34.4698 -34.4698 -30.6734 -30.6734 -30.5892 -30.5892 -30.5703 -30.5703 -30.5701 -30.5701 2.3467 2.3467 2.3720 2.3720 8.1276 8.1276 8.2623 8.2623 8.4615 8.4615 9.9719 9.9719 9.9828 9.9828 10.3021 10.3021 11.4702 11.4702 12.1105 12.1105 12.2705 12.2705 12.7414 12.7414 13.0211 13.0211 13.0284 13.0284 13.5391 13.5391 13.7113 13.7113 16.2814 16.2814 16.3306 16.3306 19.2659 19.2659 21.3385 21.3385 k = 0.3333 0.5774 0.2140 ( 3651 PWs) bands (ev): -63.8518 -63.8518 -63.8400 -63.8400 -34.5024 -34.5024 -34.4710 -34.4710 -30.6698 -30.6698 -30.5885 -30.5885 -30.5741 -30.5741 -30.5708 -30.5708 2.3483 2.3483 2.3736 2.3736 8.1833 8.1833 8.2499 8.2499 8.4508 8.4508 9.9730 9.9730 9.9805 9.9805 10.2268 10.2268 11.5104 11.5104 12.1043 12.1043 12.2503 12.2503 12.6999 12.6999 13.0234 13.0234 13.0436 13.0436 13.5097 13.5097 13.6822 13.6822 16.4013 16.4013 16.4560 16.4560 19.3918 19.3918 21.2108 21.2108 k = 0.3333 0.5774 0.2266 ( 3669 PWs) bands (ev): -63.8514 -63.8514 -63.8405 -63.8405 -34.5011 -34.5011 -34.4723 -34.4723 -30.6660 -30.6660 -30.5879 -30.5879 -30.5780 -30.5780 -30.5715 -30.5715 2.3498 2.3498 2.3751 2.3751 8.2381 8.2381 8.2392 8.2392 8.4434 8.4434 9.9450 9.9450 9.9889 9.9889 10.1688 10.1688 11.5526 11.5526 12.0976 12.0976 12.2304 12.2304 12.6557 12.6557 13.0272 13.0272 13.0598 13.0598 13.4814 13.4814 13.6540 13.6540 16.5209 16.5209 16.5818 16.5818 19.5211 19.5211 21.0578 21.0578 k = 0.3333 0.5774 0.2392 ( 3669 PWs) bands (ev): -63.8509 -63.8509 -63.8410 -63.8410 -34.4997 -34.4997 -34.4735 -34.4735 -30.6621 -30.6621 -30.5871 -30.5871 -30.5821 -30.5821 -30.5723 -30.5723 2.3513 2.3513 2.3766 2.3766 8.2269 8.2269 8.2914 8.2914 8.4433 8.4433 9.8921 9.8921 9.9969 9.9969 10.1350 10.1350 11.5966 11.5966 12.0907 12.0907 12.2111 12.2111 12.6093 12.6093 13.0326 13.0326 13.0771 13.0771 13.4544 13.4544 13.6266 13.6266 16.6393 16.6393 16.7069 16.7069 19.6529 19.6529 20.8987 20.8987 k = 0.3333 0.5774 0.2518 ( 3657 PWs) bands (ev): -63.8504 -63.8504 -63.8415 -63.8415 -34.4983 -34.4983 -34.4748 -34.4748 -30.6581 -30.6581 -30.5863 -30.5863 -30.5863 -30.5863 -30.5731 -30.5731 2.3527 2.3527 2.3780 2.3780 8.2166 8.2166 8.3307 8.3307 8.4595 8.4595 9.8195 9.8195 10.0045 10.0045 10.1208 10.1208 11.6422 11.6422 12.0839 12.0839 12.1929 12.1929 12.5612 12.5612 13.0396 13.0396 13.0952 13.0952 13.4286 13.4286 13.6001 13.6001 16.7551 16.7551 16.8302 16.8302 19.7860 19.7860 20.7415 20.7415 k = 0.3333 0.5774 0.2644 ( 3636 PWs) bands (ev): -63.8498 -63.8498 -63.8420 -63.8420 -34.4969 -34.4969 -34.4762 -34.4762 -30.6539 -30.6539 -30.5906 -30.5906 -30.5855 -30.5855 -30.5738 -30.5738 2.3540 2.3540 2.3793 2.3793 8.2071 8.2071 8.3488 8.3488 8.5003 8.5003 9.7366 9.7366 10.0115 10.0115 10.1168 10.1168 11.6893 11.6893 12.0773 12.0773 12.1759 12.1759 12.5118 12.5118 13.0478 13.0478 13.1136 13.1136 13.4041 13.4041 13.5748 13.5748 16.8666 16.8666 16.9500 16.9500 19.9185 19.9185 20.5910 20.5910 k = 0.3333 0.5774 0.2769 ( 3642 PWs) bands (ev): -63.8492 -63.8492 -63.8426 -63.8426 -34.4955 -34.4955 -34.4775 -34.4775 -30.6496 -30.6496 -30.5950 -30.5950 -30.5847 -30.5847 -30.5746 -30.5746 2.3551 2.3551 2.3804 2.3804 8.1987 8.1987 8.3523 8.3523 8.5587 8.5587 9.6495 9.6495 10.0178 10.0178 10.1173 10.1173 11.7370 11.7370 12.0709 12.0709 12.1601 12.1601 12.4617 12.4617 13.0567 13.0567 13.1317 13.1317 13.3812 13.3812 13.5507 13.5507 16.9719 16.9719 17.0641 17.0641 20.0465 20.0465 20.4533 20.4533 k = 0.3333 0.5774 0.2895 ( 3648 PWs) bands (ev): -63.8487 -63.8487 -63.8431 -63.8431 -34.4940 -34.4940 -34.4790 -34.4790 -30.6453 -30.6453 -30.5994 -30.5994 -30.5839 -30.5839 -30.5755 -30.5755 2.3561 2.3561 2.3814 2.3814 8.1915 8.1915 8.3503 8.3503 8.6251 8.6251 9.5617 9.5617 10.0234 10.0234 10.1197 10.1197 11.7851 11.7851 12.0651 12.0651 12.1456 12.1456 12.4119 12.4119 13.0661 13.0661 13.1492 13.1492 13.3602 13.3602 13.5284 13.5284 17.0687 17.0687 17.1701 17.1701 20.1524 20.1524 20.3477 20.3477 k = 0.3333 0.5774 0.3021 ( 3645 PWs) bands (ev): -63.8482 -63.8482 -63.8436 -63.8436 -34.4925 -34.4925 -34.4804 -34.4804 -30.6408 -30.6408 -30.6040 -30.6040 -30.5831 -30.5831 -30.5763 -30.5763 2.3569 2.3569 2.3822 2.3822 8.1854 8.1854 8.3469 8.3469 8.6947 8.6947 9.4755 9.4755 10.0281 10.0281 10.1226 10.1226 11.8331 11.8331 12.0601 12.0601 12.1324 12.1324 12.3635 12.3635 13.0755 13.0755 13.1655 13.1655 13.3414 13.3414 13.5083 13.5083 17.1543 17.1543 17.2649 17.2649 20.1484 20.1484 20.2885 20.2885 k = 0.3333 0.5774 0.3147 ( 3651 PWs) bands (ev): -63.8476 -63.8476 -63.8442 -63.8442 -34.4910 -34.4910 -34.4819 -34.4819 -30.6363 -30.6363 -30.6086 -30.6086 -30.5823 -30.5823 -30.5771 -30.5771 2.3576 2.3576 2.3828 2.3828 8.1807 8.1807 8.3434 8.3434 8.7641 8.7641 9.3933 9.3933 10.0318 10.0318 10.1254 10.1254 11.8795 11.8795 12.0560 12.0560 12.1200 12.1200 12.3184 12.3184 13.0842 13.0842 13.1799 13.1799 13.3255 13.3255 13.4910 13.4910 17.2255 17.2255 17.3447 17.3447 20.0707 20.0707 20.2022 20.2022 k = 0.3333 0.5774 0.3273 ( 3651 PWs) bands (ev): -63.8471 -63.8471 -63.8448 -63.8448 -34.4895 -34.4895 -34.4834 -34.4834 -30.6317 -30.6317 -30.6132 -30.6132 -30.5814 -30.5814 -30.5780 -30.5780 2.3581 2.3581 2.3833 2.3833 8.1772 8.1772 8.3407 8.3407 8.8289 8.8289 9.3194 9.3194 10.0345 10.0345 10.1275 10.1275 11.9220 11.9220 12.0530 12.0530 12.1079 12.1079 12.2801 12.2801 13.0915 13.0915 13.1913 13.1913 13.3132 13.3132 13.4776 13.4776 17.2793 17.2793 17.4057 17.4057 20.0025 20.0025 20.1374 20.1374 k = 0.3333 0.5774 0.3399 ( 3648 PWs) bands (ev): -63.8465 -63.8465 -63.8453 -63.8453 -34.4880 -34.4880 -34.4849 -34.4849 -30.6271 -30.6271 -30.6178 -30.6178 -30.5806 -30.5806 -30.5788 -30.5788 2.3583 2.3583 2.3836 2.3836 8.1751 8.1751 8.3389 8.3389 8.8800 8.8800 9.2628 9.2628 10.0361 10.0361 10.1289 10.1289 11.9554 11.9554 12.0511 12.0511 12.0966 12.0966 12.2534 12.2534 13.0963 13.0963 13.1988 13.1988 13.3053 13.3053 13.4690 13.4690 17.3129 17.3129 17.4441 17.4441 19.9585 19.9585 20.0972 20.0972 k = 0.3333 0.5774 0.3525 ( 3648 PWs) bands (ev): -63.8459 -63.8459 -63.8459 -63.8459 -34.4865 -34.4865 -34.4864 -34.4864 -30.6225 -30.6225 -30.6224 -30.6224 -30.5798 -30.5798 -30.5796 -30.5796 2.3584 2.3584 2.3837 2.3837 8.1744 8.1744 8.3383 8.3383 8.9009 8.9009 9.2401 9.2401 10.0367 10.0367 10.1294 10.1294 11.9691 11.9691 12.0505 12.0505 12.0910 12.0910 12.2437 12.2437 13.0980 13.0980 13.2014 13.2014 13.3026 13.3026 13.4660 13.4660 17.3243 17.3243 17.4572 17.4572 19.9433 19.9433 20.0835 20.0835 Writing output data file TeRh.save init_run : 0.64s CPU 0.80s WALL ( 1 calls) electrons : 126.55s CPU 128.56s 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 : 126.54s CPU 128.55s 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 : 0.06s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.04s WALL ( 345 calls) cegterg : 114.50s CPU 116.05s WALL ( 359 calls) Called by sum_band: Called by *egterg: h_psi : 62.93s CPU 64.21s WALL ( 6058 calls) s_psi : 4.62s CPU 4.54s WALL ( 6058 calls) g_psi : 0.18s CPU 0.19s WALL ( 5354 calls) cdiaghg : 41.14s CPU 41.64s WALL ( 5699 calls) cegterg:over : 4.99s CPU 5.01s WALL ( 5354 calls) cegterg:upda : 3.70s CPU 3.69s WALL ( 5354 calls) cegterg:last : 2.50s CPU 2.54s WALL ( 1049 calls) cdiaghg:chol : 2.34s CPU 2.30s WALL ( 5699 calls) cdiaghg:inve : 1.50s CPU 1.57s WALL ( 5699 calls) cdiaghg:para : 2.48s CPU 2.47s WALL ( 11398 calls) Called by h_psi: h_psi:vloc : 52.97s CPU 54.01s WALL ( 6058 calls) h_psi:vnl : 9.79s CPU 10.01s WALL ( 6058 calls) add_vuspsi : 5.14s CPU 5.21s WALL ( 6058 calls) General routines calbec : 4.64s CPU 4.78s WALL ( 6058 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 49.56s CPU 50.80s WALL ( 731980 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.16s CPU 0.20s WALL ( 690 calls) Parallel routines fft_scatter : 19.66s CPU 20.55s WALL ( 732003 calls) PWSCF : 2m23.27s CPU 2m45.79s WALL This run was terminated on: 21:13:23 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=