Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:16:14 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: ./Li2Pt.save/ file Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 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 52 49 14 1152 1059 168 Max 53 50 15 1154 1076 171 Sum 1879 1789 511 41499 38505 6107 bravais-lattice index = 14 lattice parameter (alat) = 7.9104 a.u. unit-cell volume = 272.5025 (a.u.)^3 number of atoms/cell = 3 number of atomic types = 2 number of electrons = 16.00 number of Kohn-Sham states= 24 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.910393 celldm(2)= 1.000000 celldm(3)= 0.635690 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 0.635690 ) 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 1.573093 ) PseudoPot. # 1 for Li read from file: /users/gautes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Pt read from file: /users/gautes/Pseudo/Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5a767c0d250ba2b616d7addddc548ecc Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1277 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 Li 3.00 6.94100 Li( 1.00) Pt 10.00 195.08400 Pt( 1.00) 24 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( -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 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 5) = ( 0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 6 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s( 6) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 9) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(10) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) 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 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(14) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(17) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 18 inv. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(18) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s(18) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) 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 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(21) = ( -0.5000000 0.8660254 0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 22 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(22) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s(22) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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= 431 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023202 k( 2) = ( 0.0113636 0.0065608 -0.0000000), wk = 0.0023202 k( 3) = ( 0.0227273 0.0131216 -0.0000000), wk = 0.0023202 k( 4) = ( 0.0340909 0.0196824 -0.0000000), wk = 0.0023202 k( 5) = ( 0.0454546 0.0262432 -0.0000000), wk = 0.0023202 k( 6) = ( 0.0568182 0.0328040 -0.0000000), wk = 0.0023202 k( 7) = ( 0.0681818 0.0393648 -0.0000000), wk = 0.0023202 k( 8) = ( 0.0795455 0.0459256 -0.0000000), wk = 0.0023202 k( 9) = ( 0.0909091 0.0524864 -0.0000000), wk = 0.0023202 k( 10) = ( 0.1022727 0.0590472 -0.0000000), wk = 0.0023202 k( 11) = ( 0.1136364 0.0656080 -0.0000000), wk = 0.0023202 k( 12) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0023202 k( 13) = ( 0.1363636 0.0787296 -0.0000000), wk = 0.0023202 k( 14) = ( 0.1477273 0.0852904 -0.0000000), wk = 0.0023202 k( 15) = ( 0.1590909 0.0918512 -0.0000000), wk = 0.0023202 k( 16) = ( 0.1704546 0.0984120 -0.0000000), wk = 0.0023202 k( 17) = ( 0.1818182 0.1049728 -0.0000000), wk = 0.0023202 k( 18) = ( 0.1931818 0.1115336 -0.0000000), wk = 0.0023202 k( 19) = ( 0.2045454 0.1180944 -0.0000000), wk = 0.0023202 k( 20) = ( 0.2159091 0.1246552 -0.0000000), wk = 0.0023202 k( 21) = ( 0.2272727 0.1312160 -0.0000000), wk = 0.0023202 k( 22) = ( 0.2386364 0.1377768 -0.0000000), wk = 0.0023202 k( 23) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0023202 k( 24) = ( 0.2613636 0.1508984 -0.0000000), wk = 0.0023202 k( 25) = ( 0.2727273 0.1574592 -0.0000000), wk = 0.0023202 k( 26) = ( 0.2840909 0.1640200 -0.0000000), wk = 0.0023202 k( 27) = ( 0.2954545 0.1705808 -0.0000000), wk = 0.0023202 k( 28) = ( 0.3068182 0.1771416 -0.0000000), wk = 0.0023202 k( 29) = ( 0.3181818 0.1837024 -0.0000000), wk = 0.0023202 k( 30) = ( 0.3295455 0.1902632 -0.0000000), wk = 0.0023202 k( 31) = ( 0.3409091 0.1968240 -0.0000000), wk = 0.0023202 k( 32) = ( 0.3522727 0.2033848 -0.0000000), wk = 0.0023202 k( 33) = ( 0.3636364 0.2099456 -0.0000000), wk = 0.0023202 k( 34) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0023202 k( 35) = ( 0.3863636 0.2230672 -0.0000000), wk = 0.0023202 k( 36) = ( 0.3977273 0.2296279 -0.0000000), wk = 0.0023202 k( 37) = ( 0.4090909 0.2361887 -0.0000000), wk = 0.0023202 k( 38) = ( 0.4204545 0.2427495 -0.0000000), wk = 0.0023202 k( 39) = ( 0.4318182 0.2493103 -0.0000000), wk = 0.0023202 k( 40) = ( 0.4431818 0.2558711 -0.0000000), wk = 0.0023202 k( 41) = ( 0.4545455 0.2624319 -0.0000000), wk = 0.0023202 k( 42) = ( 0.4659091 0.2689927 -0.0000000), wk = 0.0023202 k( 43) = ( 0.4772727 0.2755535 -0.0000000), wk = 0.0023202 k( 44) = ( 0.4886364 0.2821143 -0.0000000), wk = 0.0023202 k( 45) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0023202 k( 46) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0023202 k( 47) = ( 0.4935897 0.2997780 -0.0000000), wk = 0.0023202 k( 48) = ( 0.4871795 0.3108809 -0.0000000), wk = 0.0023202 k( 49) = ( 0.4807692 0.3219838 -0.0000000), wk = 0.0023202 k( 50) = ( 0.4743590 0.3330867 -0.0000000), wk = 0.0023202 k( 51) = ( 0.4679487 0.3441896 -0.0000000), wk = 0.0023202 k( 52) = ( 0.4615385 0.3552925 -0.0000000), wk = 0.0023202 k( 53) = ( 0.4551282 0.3663954 -0.0000000), wk = 0.0023202 k( 54) = ( 0.4487179 0.3774983 -0.0000000), wk = 0.0023202 k( 55) = ( 0.4423077 0.3886011 -0.0000000), wk = 0.0023202 k( 56) = ( 0.4358974 0.3997040 -0.0000000), wk = 0.0023202 k( 57) = ( 0.4294872 0.4108069 -0.0000000), wk = 0.0023202 k( 58) = ( 0.4230769 0.4219098 -0.0000000), wk = 0.0023202 k( 59) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0023202 k( 60) = ( 0.4102564 0.4441156 -0.0000000), wk = 0.0023202 k( 61) = ( 0.4038462 0.4552185 -0.0000000), wk = 0.0023202 k( 62) = ( 0.3974359 0.4663214 -0.0000000), wk = 0.0023202 k( 63) = ( 0.3910256 0.4774243 -0.0000000), wk = 0.0023202 k( 64) = ( 0.3846154 0.4885271 -0.0000000), wk = 0.0023202 k( 65) = ( 0.3782051 0.4996300 -0.0000000), wk = 0.0023202 k( 66) = ( 0.3717949 0.5107329 -0.0000000), wk = 0.0023202 k( 67) = ( 0.3653846 0.5218358 -0.0000000), wk = 0.0023202 k( 68) = ( 0.3589744 0.5329387 -0.0000000), wk = 0.0023202 k( 69) = ( 0.3525641 0.5440416 -0.0000000), wk = 0.0023202 k( 70) = ( 0.3461538 0.5551445 -0.0000000), wk = 0.0023202 k( 71) = ( 0.3397436 0.5662474 -0.0000000), wk = 0.0023202 k( 72) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0023202 k( 73) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0023202 k( 74) = ( 0.3267974 0.5660297 -0.0000000), wk = 0.0023202 k( 75) = ( 0.3202614 0.5547091 -0.0000000), wk = 0.0023202 k( 76) = ( 0.3137255 0.5433885 -0.0000000), wk = 0.0023202 k( 77) = ( 0.3071895 0.5320679 -0.0000000), wk = 0.0023202 k( 78) = ( 0.3006536 0.5207473 -0.0000000), wk = 0.0023202 k( 79) = ( 0.2941177 0.5094267 -0.0000000), wk = 0.0023202 k( 80) = ( 0.2875817 0.4981061 -0.0000000), wk = 0.0023202 k( 81) = ( 0.2810457 0.4867855 -0.0000000), wk = 0.0023202 k( 82) = ( 0.2745098 0.4754649 -0.0000000), wk = 0.0023202 k( 83) = ( 0.2679739 0.4641443 -0.0000000), wk = 0.0023202 k( 84) = ( 0.2614379 0.4528237 -0.0000000), wk = 0.0023202 k( 85) = ( 0.2549020 0.4415031 -0.0000000), wk = 0.0023202 k( 86) = ( 0.2483660 0.4301825 -0.0000000), wk = 0.0023202 k( 87) = ( 0.2418301 0.4188620 -0.0000000), wk = 0.0023202 k( 88) = ( 0.2352941 0.4075414 -0.0000000), wk = 0.0023202 k( 89) = ( 0.2287582 0.3962208 -0.0000000), wk = 0.0023202 k( 90) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0023202 k( 91) = ( 0.2156863 0.3735796 -0.0000000), wk = 0.0023202 k( 92) = ( 0.2091503 0.3622590 -0.0000000), wk = 0.0023202 k( 93) = ( 0.2026144 0.3509384 -0.0000000), wk = 0.0023202 k( 94) = ( 0.1960784 0.3396178 -0.0000000), wk = 0.0023202 k( 95) = ( 0.1895425 0.3282972 -0.0000000), wk = 0.0023202 k( 96) = ( 0.1830065 0.3169766 -0.0000000), wk = 0.0023202 k( 97) = ( 0.1764706 0.3056560 -0.0000000), wk = 0.0023202 k( 98) = ( 0.1699346 0.2943354 -0.0000000), wk = 0.0023202 k( 99) = ( 0.1633987 0.2830148 -0.0000000), wk = 0.0023202 k( 100) = ( 0.1568627 0.2716943 -0.0000000), wk = 0.0023202 k( 101) = ( 0.1503268 0.2603737 -0.0000000), wk = 0.0023202 k( 102) = ( 0.1437908 0.2490531 -0.0000000), wk = 0.0023202 k( 103) = ( 0.1372549 0.2377325 -0.0000000), wk = 0.0023202 k( 104) = ( 0.1307190 0.2264119 -0.0000000), wk = 0.0023202 k( 105) = ( 0.1241830 0.2150913 -0.0000000), wk = 0.0023202 k( 106) = ( 0.1176471 0.2037707 -0.0000000), wk = 0.0023202 k( 107) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0023202 k( 108) = ( 0.1045752 0.1811295 -0.0000000), wk = 0.0023202 k( 109) = ( 0.0980392 0.1698089 -0.0000000), wk = 0.0023202 k( 110) = ( 0.0915033 0.1584883 -0.0000000), wk = 0.0023202 k( 111) = ( 0.0849673 0.1471677 -0.0000000), wk = 0.0023202 k( 112) = ( 0.0784314 0.1358471 -0.0000000), wk = 0.0023202 k( 113) = ( 0.0718954 0.1245265 -0.0000000), wk = 0.0023202 k( 114) = ( 0.0653595 0.1132059 -0.0000000), wk = 0.0023202 k( 115) = ( 0.0588235 0.1018853 -0.0000000), wk = 0.0023202 k( 116) = ( 0.0522876 0.0905647 -0.0000000), wk = 0.0023202 k( 117) = ( 0.0457516 0.0792441 -0.0000000), wk = 0.0023202 k( 118) = ( 0.0392157 0.0679236 -0.0000000), wk = 0.0023202 k( 119) = ( 0.0326797 0.0566030 -0.0000000), wk = 0.0023202 k( 120) = ( 0.0261438 0.0452824 -0.0000000), wk = 0.0023202 k( 121) = ( 0.0196078 0.0339618 -0.0000000), wk = 0.0023202 k( 122) = ( 0.0130719 0.0226412 -0.0000000), wk = 0.0023202 k( 123) = ( 0.0065359 0.0113206 -0.0000000), wk = 0.0023202 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023202 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023202 k( 126) = ( 0.0000000 0.0000000 0.0131091), wk = 0.0023202 k( 127) = ( 0.0000000 0.0000000 0.0262182), wk = 0.0023202 k( 128) = ( 0.0000000 0.0000000 0.0393273), wk = 0.0023202 k( 129) = ( 0.0000000 0.0000000 0.0524364), wk = 0.0023202 k( 130) = ( 0.0000000 0.0000000 0.0655455), wk = 0.0023202 k( 131) = ( 0.0000000 0.0000000 0.0786546), wk = 0.0023202 k( 132) = ( 0.0000000 0.0000000 0.0917637), wk = 0.0023202 k( 133) = ( 0.0000000 0.0000000 0.1048729), wk = 0.0023202 k( 134) = ( 0.0000000 0.0000000 0.1179820), wk = 0.0023202 k( 135) = ( 0.0000000 0.0000000 0.1310911), wk = 0.0023202 k( 136) = ( 0.0000000 0.0000000 0.1442002), wk = 0.0023202 k( 137) = ( 0.0000000 0.0000000 0.1573093), wk = 0.0023202 k( 138) = ( 0.0000000 0.0000000 0.1704184), wk = 0.0023202 k( 139) = ( 0.0000000 0.0000000 0.1835275), wk = 0.0023202 k( 140) = ( 0.0000000 0.0000000 0.1966366), wk = 0.0023202 k( 141) = ( 0.0000000 0.0000000 0.2097457), wk = 0.0023202 k( 142) = ( 0.0000000 0.0000000 0.2228548), wk = 0.0023202 k( 143) = ( 0.0000000 0.0000000 0.2359639), wk = 0.0023202 k( 144) = ( 0.0000000 0.0000000 0.2490730), wk = 0.0023202 k( 145) = ( 0.0000000 0.0000000 0.2621821), wk = 0.0023202 k( 146) = ( 0.0000000 0.0000000 0.2752912), wk = 0.0023202 k( 147) = ( 0.0000000 0.0000000 0.2884003), wk = 0.0023202 k( 148) = ( 0.0000000 0.0000000 0.3015095), wk = 0.0023202 k( 149) = ( 0.0000000 0.0000000 0.3146186), wk = 0.0023202 k( 150) = ( 0.0000000 0.0000000 0.3277277), wk = 0.0023202 k( 151) = ( 0.0000000 0.0000000 0.3408368), wk = 0.0023202 k( 152) = ( 0.0000000 0.0000000 0.3539459), wk = 0.0023202 k( 153) = ( 0.0000000 0.0000000 0.3670550), wk = 0.0023202 k( 154) = ( 0.0000000 0.0000000 0.3801641), wk = 0.0023202 k( 155) = ( 0.0000000 0.0000000 0.3932732), wk = 0.0023202 k( 156) = ( 0.0000000 0.0000000 0.4063823), wk = 0.0023202 k( 157) = ( 0.0000000 0.0000000 0.4194914), wk = 0.0023202 k( 158) = ( 0.0000000 0.0000000 0.4326005), wk = 0.0023202 k( 159) = ( 0.0000000 0.0000000 0.4457096), wk = 0.0023202 k( 160) = ( 0.0000000 0.0000000 0.4588187), wk = 0.0023202 k( 161) = ( 0.0000000 0.0000000 0.4719278), wk = 0.0023202 k( 162) = ( 0.0000000 0.0000000 0.4850369), wk = 0.0023202 k( 163) = ( 0.0000000 0.0000000 0.4981461), wk = 0.0023202 k( 164) = ( 0.0000000 0.0000000 0.5112552), wk = 0.0023202 k( 165) = ( 0.0000000 0.0000000 0.5243643), wk = 0.0023202 k( 166) = ( 0.0000000 0.0000000 0.5374734), wk = 0.0023202 k( 167) = ( 0.0000000 0.0000000 0.5505825), wk = 0.0023202 k( 168) = ( 0.0000000 0.0000000 0.5636916), wk = 0.0023202 k( 169) = ( 0.0000000 0.0000000 0.5768007), wk = 0.0023202 k( 170) = ( 0.0000000 0.0000000 0.5899098), wk = 0.0023202 k( 171) = ( 0.0000000 0.0000000 0.6030189), wk = 0.0023202 k( 172) = ( 0.0000000 0.0000000 0.6161280), wk = 0.0023202 k( 173) = ( 0.0000000 0.0000000 0.6292371), wk = 0.0023202 k( 174) = ( 0.0000000 0.0000000 0.6423462), wk = 0.0023202 k( 175) = ( 0.0000000 0.0000000 0.6554553), wk = 0.0023202 k( 176) = ( 0.0000000 0.0000000 0.6685644), wk = 0.0023202 k( 177) = ( 0.0000000 0.0000000 0.6816736), wk = 0.0023202 k( 178) = ( 0.0000000 0.0000000 0.6947827), wk = 0.0023202 k( 179) = ( 0.0000000 0.0000000 0.7078918), wk = 0.0023202 k( 180) = ( 0.0000000 0.0000000 0.7210009), wk = 0.0023202 k( 181) = ( 0.0000000 0.0000000 0.7341100), wk = 0.0023202 k( 182) = ( 0.0000000 0.0000000 0.7472191), wk = 0.0023202 k( 183) = ( 0.0000000 0.0000000 0.7603282), wk = 0.0023202 k( 184) = ( 0.0000000 0.0000000 0.7734373), wk = 0.0023202 k( 185) = ( 0.0000000 0.0000000 0.7865464), wk = 0.0023202 k( 186) = ( 0.0000000 0.0000000 0.7865464), wk = 0.0023202 k( 187) = ( 0.0113636 0.0065608 0.7865464), wk = 0.0023202 k( 188) = ( 0.0227273 0.0131216 0.7865464), wk = 0.0023202 k( 189) = ( 0.0340909 0.0196824 0.7865464), wk = 0.0023202 k( 190) = ( 0.0454546 0.0262432 0.7865464), wk = 0.0023202 k( 191) = ( 0.0568182 0.0328040 0.7865464), wk = 0.0023202 k( 192) = ( 0.0681818 0.0393648 0.7865464), wk = 0.0023202 k( 193) = ( 0.0795455 0.0459256 0.7865464), wk = 0.0023202 k( 194) = ( 0.0909091 0.0524864 0.7865464), wk = 0.0023202 k( 195) = ( 0.1022727 0.0590472 0.7865464), wk = 0.0023202 k( 196) = ( 0.1136364 0.0656080 0.7865464), wk = 0.0023202 k( 197) = ( 0.1250000 0.0721688 0.7865464), wk = 0.0023202 k( 198) = ( 0.1363636 0.0787296 0.7865464), wk = 0.0023202 k( 199) = ( 0.1477273 0.0852904 0.7865464), wk = 0.0023202 k( 200) = ( 0.1590909 0.0918512 0.7865464), wk = 0.0023202 k( 201) = ( 0.1704546 0.0984120 0.7865464), wk = 0.0023202 k( 202) = ( 0.1818182 0.1049728 0.7865464), wk = 0.0023202 k( 203) = ( 0.1931818 0.1115336 0.7865464), wk = 0.0023202 k( 204) = ( 0.2045454 0.1180944 0.7865464), wk = 0.0023202 k( 205) = ( 0.2159091 0.1246552 0.7865464), wk = 0.0023202 k( 206) = ( 0.2272727 0.1312160 0.7865464), wk = 0.0023202 k( 207) = ( 0.2386364 0.1377768 0.7865464), wk = 0.0023202 k( 208) = ( 0.2500000 0.1443376 0.7865464), wk = 0.0023202 k( 209) = ( 0.2613636 0.1508984 0.7865464), wk = 0.0023202 k( 210) = ( 0.2727273 0.1574592 0.7865464), wk = 0.0023202 k( 211) = ( 0.2840909 0.1640200 0.7865464), wk = 0.0023202 k( 212) = ( 0.2954545 0.1705808 0.7865464), wk = 0.0023202 k( 213) = ( 0.3068182 0.1771416 0.7865464), wk = 0.0023202 k( 214) = ( 0.3181818 0.1837024 0.7865464), wk = 0.0023202 k( 215) = ( 0.3295455 0.1902632 0.7865464), wk = 0.0023202 k( 216) = ( 0.3409091 0.1968240 0.7865464), wk = 0.0023202 k( 217) = ( 0.3522727 0.2033848 0.7865464), wk = 0.0023202 k( 218) = ( 0.3636364 0.2099456 0.7865464), wk = 0.0023202 k( 219) = ( 0.3750000 0.2165064 0.7865464), wk = 0.0023202 k( 220) = ( 0.3863636 0.2230672 0.7865464), wk = 0.0023202 k( 221) = ( 0.3977273 0.2296279 0.7865464), wk = 0.0023202 k( 222) = ( 0.4090909 0.2361887 0.7865464), wk = 0.0023202 k( 223) = ( 0.4204545 0.2427495 0.7865464), wk = 0.0023202 k( 224) = ( 0.4318182 0.2493103 0.7865464), wk = 0.0023202 k( 225) = ( 0.4431818 0.2558711 0.7865464), wk = 0.0023202 k( 226) = ( 0.4545455 0.2624319 0.7865464), wk = 0.0023202 k( 227) = ( 0.4659091 0.2689927 0.7865464), wk = 0.0023202 k( 228) = ( 0.4772727 0.2755535 0.7865464), wk = 0.0023202 k( 229) = ( 0.4886364 0.2821143 0.7865464), wk = 0.0023202 k( 230) = ( 0.5000000 0.2886751 0.7865464), wk = 0.0023202 k( 231) = ( 0.5000000 0.2886751 0.7865464), wk = 0.0023202 k( 232) = ( 0.4935897 0.2997780 0.7865464), wk = 0.0023202 k( 233) = ( 0.4871795 0.3108809 0.7865464), wk = 0.0023202 k( 234) = ( 0.4807692 0.3219838 0.7865464), wk = 0.0023202 k( 235) = ( 0.4743590 0.3330867 0.7865464), wk = 0.0023202 k( 236) = ( 0.4679487 0.3441896 0.7865464), wk = 0.0023202 k( 237) = ( 0.4615385 0.3552925 0.7865464), wk = 0.0023202 k( 238) = ( 0.4551282 0.3663954 0.7865464), wk = 0.0023202 k( 239) = ( 0.4487179 0.3774983 0.7865464), wk = 0.0023202 k( 240) = ( 0.4423077 0.3886011 0.7865464), wk = 0.0023202 k( 241) = ( 0.4358974 0.3997040 0.7865464), wk = 0.0023202 k( 242) = ( 0.4294872 0.4108069 0.7865464), wk = 0.0023202 k( 243) = ( 0.4230769 0.4219098 0.7865464), wk = 0.0023202 k( 244) = ( 0.4166667 0.4330127 0.7865464), wk = 0.0023202 k( 245) = ( 0.4102564 0.4441156 0.7865464), wk = 0.0023202 k( 246) = ( 0.4038462 0.4552185 0.7865464), wk = 0.0023202 k( 247) = ( 0.3974359 0.4663214 0.7865464), wk = 0.0023202 k( 248) = ( 0.3910256 0.4774243 0.7865464), wk = 0.0023202 k( 249) = ( 0.3846154 0.4885271 0.7865464), wk = 0.0023202 k( 250) = ( 0.3782051 0.4996300 0.7865464), wk = 0.0023202 k( 251) = ( 0.3717949 0.5107329 0.7865464), wk = 0.0023202 k( 252) = ( 0.3653846 0.5218358 0.7865464), wk = 0.0023202 k( 253) = ( 0.3589744 0.5329387 0.7865464), wk = 0.0023202 k( 254) = ( 0.3525641 0.5440416 0.7865464), wk = 0.0023202 k( 255) = ( 0.3461538 0.5551445 0.7865464), wk = 0.0023202 k( 256) = ( 0.3397436 0.5662474 0.7865464), wk = 0.0023202 k( 257) = ( 0.3333333 0.5773503 0.7865464), wk = 0.0023202 k( 258) = ( 0.3333333 0.5773503 0.7865464), wk = 0.0023202 k( 259) = ( 0.3267974 0.5660297 0.7865464), wk = 0.0023202 k( 260) = ( 0.3202614 0.5547091 0.7865464), wk = 0.0023202 k( 261) = ( 0.3137255 0.5433885 0.7865464), wk = 0.0023202 k( 262) = ( 0.3071895 0.5320679 0.7865464), wk = 0.0023202 k( 263) = ( 0.3006536 0.5207473 0.7865464), wk = 0.0023202 k( 264) = ( 0.2941177 0.5094267 0.7865464), wk = 0.0023202 k( 265) = ( 0.2875817 0.4981061 0.7865464), wk = 0.0023202 k( 266) = ( 0.2810457 0.4867855 0.7865464), wk = 0.0023202 k( 267) = ( 0.2745098 0.4754649 0.7865464), wk = 0.0023202 k( 268) = ( 0.2679739 0.4641443 0.7865464), wk = 0.0023202 k( 269) = ( 0.2614379 0.4528237 0.7865464), wk = 0.0023202 k( 270) = ( 0.2549020 0.4415031 0.7865464), wk = 0.0023202 k( 271) = ( 0.2483660 0.4301825 0.7865464), wk = 0.0023202 k( 272) = ( 0.2418301 0.4188620 0.7865464), wk = 0.0023202 k( 273) = ( 0.2352941 0.4075414 0.7865464), wk = 0.0023202 k( 274) = ( 0.2287582 0.3962208 0.7865464), wk = 0.0023202 k( 275) = ( 0.2222222 0.3849002 0.7865464), wk = 0.0023202 k( 276) = ( 0.2156863 0.3735796 0.7865464), wk = 0.0023202 k( 277) = ( 0.2091503 0.3622590 0.7865464), wk = 0.0023202 k( 278) = ( 0.2026144 0.3509384 0.7865464), wk = 0.0023202 k( 279) = ( 0.1960784 0.3396178 0.7865464), wk = 0.0023202 k( 280) = ( 0.1895425 0.3282972 0.7865464), wk = 0.0023202 k( 281) = ( 0.1830065 0.3169766 0.7865464), wk = 0.0023202 k( 282) = ( 0.1764706 0.3056560 0.7865464), wk = 0.0023202 k( 283) = ( 0.1699346 0.2943354 0.7865464), wk = 0.0023202 k( 284) = ( 0.1633987 0.2830148 0.7865464), wk = 0.0023202 k( 285) = ( 0.1568627 0.2716943 0.7865464), wk = 0.0023202 k( 286) = ( 0.1503268 0.2603737 0.7865464), wk = 0.0023202 k( 287) = ( 0.1437908 0.2490531 0.7865464), wk = 0.0023202 k( 288) = ( 0.1372549 0.2377325 0.7865464), wk = 0.0023202 k( 289) = ( 0.1307190 0.2264119 0.7865464), wk = 0.0023202 k( 290) = ( 0.1241830 0.2150913 0.7865464), wk = 0.0023202 k( 291) = ( 0.1176471 0.2037707 0.7865464), wk = 0.0023202 k( 292) = ( 0.1111111 0.1924501 0.7865464), wk = 0.0023202 k( 293) = ( 0.1045752 0.1811295 0.7865464), wk = 0.0023202 k( 294) = ( 0.0980392 0.1698089 0.7865464), wk = 0.0023202 k( 295) = ( 0.0915033 0.1584883 0.7865464), wk = 0.0023202 k( 296) = ( 0.0849673 0.1471677 0.7865464), wk = 0.0023202 k( 297) = ( 0.0784314 0.1358471 0.7865464), wk = 0.0023202 k( 298) = ( 0.0718954 0.1245265 0.7865464), wk = 0.0023202 k( 299) = ( 0.0653595 0.1132059 0.7865464), wk = 0.0023202 k( 300) = ( 0.0588235 0.1018853 0.7865464), wk = 0.0023202 k( 301) = ( 0.0522876 0.0905647 0.7865464), wk = 0.0023202 k( 302) = ( 0.0457516 0.0792441 0.7865464), wk = 0.0023202 k( 303) = ( 0.0392157 0.0679236 0.7865464), wk = 0.0023202 k( 304) = ( 0.0326797 0.0566030 0.7865464), wk = 0.0023202 k( 305) = ( 0.0261438 0.0452824 0.7865464), wk = 0.0023202 k( 306) = ( 0.0196078 0.0339618 0.7865464), wk = 0.0023202 k( 307) = ( 0.0130719 0.0226412 0.7865464), wk = 0.0023202 k( 308) = ( 0.0065359 0.0113206 0.7865464), wk = 0.0023202 k( 309) = ( 0.0000000 0.0000000 0.7865464), wk = 0.0023202 k( 310) = ( 0.5000000 0.2886751 0.7865464), wk = 0.0023202 k( 311) = ( 0.5000000 0.2886751 0.7734373), wk = 0.0023202 k( 312) = ( 0.5000000 0.2886751 0.7603282), wk = 0.0023202 k( 313) = ( 0.5000000 0.2886751 0.7472191), wk = 0.0023202 k( 314) = ( 0.5000000 0.2886751 0.7341100), wk = 0.0023202 k( 315) = ( 0.5000000 0.2886751 0.7210009), wk = 0.0023202 k( 316) = ( 0.5000000 0.2886751 0.7078918), wk = 0.0023202 k( 317) = ( 0.5000000 0.2886751 0.6947827), wk = 0.0023202 k( 318) = ( 0.5000000 0.2886751 0.6816736), wk = 0.0023202 k( 319) = ( 0.5000000 0.2886751 0.6685644), wk = 0.0023202 k( 320) = ( 0.5000000 0.2886751 0.6554553), wk = 0.0023202 k( 321) = ( 0.5000000 0.2886751 0.6423462), wk = 0.0023202 k( 322) = ( 0.5000000 0.2886751 0.6292371), wk = 0.0023202 k( 323) = ( 0.5000000 0.2886751 0.6161280), wk = 0.0023202 k( 324) = ( 0.5000000 0.2886751 0.6030189), wk = 0.0023202 k( 325) = ( 0.5000000 0.2886751 0.5899098), wk = 0.0023202 k( 326) = ( 0.5000000 0.2886751 0.5768007), wk = 0.0023202 k( 327) = ( 0.5000000 0.2886751 0.5636916), wk = 0.0023202 k( 328) = ( 0.5000000 0.2886751 0.5505825), wk = 0.0023202 k( 329) = ( 0.5000000 0.2886751 0.5374734), wk = 0.0023202 k( 330) = ( 0.5000000 0.2886751 0.5243643), wk = 0.0023202 k( 331) = ( 0.5000000 0.2886751 0.5112552), wk = 0.0023202 k( 332) = ( 0.5000000 0.2886751 0.4981461), wk = 0.0023202 k( 333) = ( 0.5000000 0.2886751 0.4850369), wk = 0.0023202 k( 334) = ( 0.5000000 0.2886751 0.4719278), wk = 0.0023202 k( 335) = ( 0.5000000 0.2886751 0.4588187), wk = 0.0023202 k( 336) = ( 0.5000000 0.2886751 0.4457096), wk = 0.0023202 k( 337) = ( 0.5000000 0.2886751 0.4326005), wk = 0.0023202 k( 338) = ( 0.5000000 0.2886751 0.4194914), wk = 0.0023202 k( 339) = ( 0.5000000 0.2886751 0.4063823), wk = 0.0023202 k( 340) = ( 0.5000000 0.2886751 0.3932732), wk = 0.0023202 k( 341) = ( 0.5000000 0.2886751 0.3801641), wk = 0.0023202 k( 342) = ( 0.5000000 0.2886751 0.3670550), wk = 0.0023202 k( 343) = ( 0.5000000 0.2886751 0.3539459), wk = 0.0023202 k( 344) = ( 0.5000000 0.2886751 0.3408368), wk = 0.0023202 k( 345) = ( 0.5000000 0.2886751 0.3277277), wk = 0.0023202 k( 346) = ( 0.5000000 0.2886751 0.3146186), wk = 0.0023202 k( 347) = ( 0.5000000 0.2886751 0.3015095), wk = 0.0023202 k( 348) = ( 0.5000000 0.2886751 0.2884003), wk = 0.0023202 k( 349) = ( 0.5000000 0.2886751 0.2752912), wk = 0.0023202 k( 350) = ( 0.5000000 0.2886751 0.2621821), wk = 0.0023202 k( 351) = ( 0.5000000 0.2886751 0.2490730), wk = 0.0023202 k( 352) = ( 0.5000000 0.2886751 0.2359639), wk = 0.0023202 k( 353) = ( 0.5000000 0.2886751 0.2228548), wk = 0.0023202 k( 354) = ( 0.5000000 0.2886751 0.2097457), wk = 0.0023202 k( 355) = ( 0.5000000 0.2886751 0.1966366), wk = 0.0023202 k( 356) = ( 0.5000000 0.2886751 0.1835275), wk = 0.0023202 k( 357) = ( 0.5000000 0.2886751 0.1704184), wk = 0.0023202 k( 358) = ( 0.5000000 0.2886751 0.1573093), wk = 0.0023202 k( 359) = ( 0.5000000 0.2886751 0.1442002), wk = 0.0023202 k( 360) = ( 0.5000000 0.2886751 0.1310911), wk = 0.0023202 k( 361) = ( 0.5000000 0.2886751 0.1179820), wk = 0.0023202 k( 362) = ( 0.5000000 0.2886751 0.1048729), wk = 0.0023202 k( 363) = ( 0.5000000 0.2886751 0.0917637), wk = 0.0023202 k( 364) = ( 0.5000000 0.2886751 0.0786546), wk = 0.0023202 k( 365) = ( 0.5000000 0.2886751 0.0655455), wk = 0.0023202 k( 366) = ( 0.5000000 0.2886751 0.0524364), wk = 0.0023202 k( 367) = ( 0.5000000 0.2886751 0.0393273), wk = 0.0023202 k( 368) = ( 0.5000000 0.2886751 0.0262182), wk = 0.0023202 k( 369) = ( 0.5000000 0.2886751 0.0131091), wk = 0.0023202 k( 370) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0023202 k( 371) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0023202 k( 372) = ( 0.3333333 0.5773503 0.0131091), wk = 0.0023202 k( 373) = ( 0.3333333 0.5773503 0.0262182), wk = 0.0023202 k( 374) = ( 0.3333333 0.5773503 0.0393273), wk = 0.0023202 k( 375) = ( 0.3333333 0.5773503 0.0524364), wk = 0.0023202 k( 376) = ( 0.3333333 0.5773503 0.0655455), wk = 0.0023202 k( 377) = ( 0.3333333 0.5773503 0.0786546), wk = 0.0023202 k( 378) = ( 0.3333333 0.5773503 0.0917637), wk = 0.0023202 k( 379) = ( 0.3333333 0.5773503 0.1048729), wk = 0.0023202 k( 380) = ( 0.3333333 0.5773503 0.1179820), wk = 0.0023202 k( 381) = ( 0.3333333 0.5773503 0.1310911), wk = 0.0023202 k( 382) = ( 0.3333333 0.5773503 0.1442002), wk = 0.0023202 k( 383) = ( 0.3333333 0.5773503 0.1573093), wk = 0.0023202 k( 384) = ( 0.3333333 0.5773503 0.1704184), wk = 0.0023202 k( 385) = ( 0.3333333 0.5773503 0.1835275), wk = 0.0023202 k( 386) = ( 0.3333333 0.5773503 0.1966366), wk = 0.0023202 k( 387) = ( 0.3333333 0.5773503 0.2097457), wk = 0.0023202 k( 388) = ( 0.3333333 0.5773503 0.2228548), wk = 0.0023202 k( 389) = ( 0.3333333 0.5773503 0.2359639), wk = 0.0023202 k( 390) = ( 0.3333333 0.5773503 0.2490730), wk = 0.0023202 k( 391) = ( 0.3333333 0.5773503 0.2621821), wk = 0.0023202 k( 392) = ( 0.3333333 0.5773503 0.2752912), wk = 0.0023202 k( 393) = ( 0.3333333 0.5773503 0.2884003), wk = 0.0023202 k( 394) = ( 0.3333333 0.5773503 0.3015095), wk = 0.0023202 k( 395) = ( 0.3333333 0.5773503 0.3146186), wk = 0.0023202 k( 396) = ( 0.3333333 0.5773503 0.3277277), wk = 0.0023202 k( 397) = ( 0.3333333 0.5773503 0.3408368), wk = 0.0023202 k( 398) = ( 0.3333333 0.5773503 0.3539459), wk = 0.0023202 k( 399) = ( 0.3333333 0.5773503 0.3670550), wk = 0.0023202 k( 400) = ( 0.3333333 0.5773503 0.3801641), wk = 0.0023202 k( 401) = ( 0.3333333 0.5773503 0.3932732), wk = 0.0023202 k( 402) = ( 0.3333333 0.5773503 0.4063823), wk = 0.0023202 k( 403) = ( 0.3333333 0.5773503 0.4194914), wk = 0.0023202 k( 404) = ( 0.3333333 0.5773503 0.4326005), wk = 0.0023202 k( 405) = ( 0.3333333 0.5773503 0.4457096), wk = 0.0023202 k( 406) = ( 0.3333333 0.5773503 0.4588187), wk = 0.0023202 k( 407) = ( 0.3333333 0.5773503 0.4719278), wk = 0.0023202 k( 408) = ( 0.3333333 0.5773503 0.4850369), wk = 0.0023202 k( 409) = ( 0.3333333 0.5773503 0.4981461), wk = 0.0023202 k( 410) = ( 0.3333333 0.5773503 0.5112552), wk = 0.0023202 k( 411) = ( 0.3333333 0.5773503 0.5243643), wk = 0.0023202 k( 412) = ( 0.3333333 0.5773503 0.5374734), wk = 0.0023202 k( 413) = ( 0.3333333 0.5773503 0.5505825), wk = 0.0023202 k( 414) = ( 0.3333333 0.5773503 0.5636916), wk = 0.0023202 k( 415) = ( 0.3333333 0.5773503 0.5768007), wk = 0.0023202 k( 416) = ( 0.3333333 0.5773503 0.5899098), wk = 0.0023202 k( 417) = ( 0.3333333 0.5773503 0.6030189), wk = 0.0023202 k( 418) = ( 0.3333333 0.5773503 0.6161280), wk = 0.0023202 k( 419) = ( 0.3333333 0.5773503 0.6292371), wk = 0.0023202 k( 420) = ( 0.3333333 0.5773503 0.6423462), wk = 0.0023202 k( 421) = ( 0.3333333 0.5773503 0.6554553), wk = 0.0023202 k( 422) = ( 0.3333333 0.5773503 0.6685644), wk = 0.0023202 k( 423) = ( 0.3333333 0.5773503 0.6816736), wk = 0.0023202 k( 424) = ( 0.3333333 0.5773503 0.6947827), wk = 0.0023202 k( 425) = ( 0.3333333 0.5773503 0.7078918), wk = 0.0023202 k( 426) = ( 0.3333333 0.5773503 0.7210009), wk = 0.0023202 k( 427) = ( 0.3333333 0.5773503 0.7341100), wk = 0.0023202 k( 428) = ( 0.3333333 0.5773503 0.7472191), wk = 0.0023202 k( 429) = ( 0.3333333 0.5773503 0.7603282), wk = 0.0023202 k( 430) = ( 0.3333333 0.5773503 0.7734373), wk = 0.0023202 k( 431) = ( 0.3333333 0.5773503 0.7865464), wk = 0.0023202 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023202 k( 2) = ( 0.0113636 0.0000000 0.0000000), wk = 0.0023202 k( 3) = ( 0.0227273 -0.0000000 0.0000000), wk = 0.0023202 k( 4) = ( 0.0340909 -0.0000000 0.0000000), wk = 0.0023202 k( 5) = ( 0.0454546 -0.0000000 0.0000000), wk = 0.0023202 k( 6) = ( 0.0568182 -0.0000000 -0.0000000), wk = 0.0023202 k( 7) = ( 0.0681818 -0.0000000 0.0000000), wk = 0.0023202 k( 8) = ( 0.0795455 0.0000000 0.0000000), wk = 0.0023202 k( 9) = ( 0.0909091 -0.0000000 0.0000000), wk = 0.0023202 k( 10) = ( 0.1022727 0.0000000 -0.0000000), wk = 0.0023202 k( 11) = ( 0.1136364 -0.0000000 -0.0000000), wk = 0.0023202 k( 12) = ( 0.1250000 0.0000000 -0.0000000), wk = 0.0023202 k( 13) = ( 0.1363636 -0.0000000 0.0000000), wk = 0.0023202 k( 14) = ( 0.1477273 -0.0000000 0.0000000), wk = 0.0023202 k( 15) = ( 0.1590909 0.0000000 -0.0000000), wk = 0.0023202 k( 16) = ( 0.1704546 0.0000000 0.0000000), wk = 0.0023202 k( 17) = ( 0.1818182 -0.0000000 0.0000000), wk = 0.0023202 k( 18) = ( 0.1931818 -0.0000000 0.0000000), wk = 0.0023202 k( 19) = ( 0.2045454 0.0000000 -0.0000000), wk = 0.0023202 k( 20) = ( 0.2159091 -0.0000000 -0.0000000), wk = 0.0023202 k( 21) = ( 0.2272727 0.0000000 0.0000000), wk = 0.0023202 k( 22) = ( 0.2386364 -0.0000000 0.0000000), wk = 0.0023202 k( 23) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0023202 k( 24) = ( 0.2613636 0.0000000 -0.0000000), wk = 0.0023202 k( 25) = ( 0.2727273 -0.0000000 -0.0000000), wk = 0.0023202 k( 26) = ( 0.2840909 -0.0000000 -0.0000000), wk = 0.0023202 k( 27) = ( 0.2954545 -0.0000000 0.0000000), wk = 0.0023202 k( 28) = ( 0.3068182 0.0000000 0.0000000), wk = 0.0023202 k( 29) = ( 0.3181818 0.0000000 -0.0000000), wk = 0.0023202 k( 30) = ( 0.3295455 0.0000000 0.0000000), wk = 0.0023202 k( 31) = ( 0.3409091 -0.0000000 -0.0000000), wk = 0.0023202 k( 32) = ( 0.3522727 0.0000000 0.0000000), wk = 0.0023202 k( 33) = ( 0.3636364 -0.0000000 0.0000000), wk = 0.0023202 k( 34) = ( 0.3750000 0.0000000 -0.0000000), wk = 0.0023202 k( 35) = ( 0.3863636 -0.0000000 0.0000000), wk = 0.0023202 k( 36) = ( 0.3977273 -0.0000000 -0.0000000), wk = 0.0023202 k( 37) = ( 0.4090909 0.0000000 0.0000000), wk = 0.0023202 k( 38) = ( 0.4204545 -0.0000000 0.0000000), wk = 0.0023202 k( 39) = ( 0.4318182 -0.0000000 -0.0000000), wk = 0.0023202 k( 40) = ( 0.4431818 0.0000000 0.0000000), wk = 0.0023202 k( 41) = ( 0.4545455 0.0000000 -0.0000000), wk = 0.0023202 k( 42) = ( 0.4659091 -0.0000000 -0.0000000), wk = 0.0023202 k( 43) = ( 0.4772727 0.0000000 0.0000000), wk = 0.0023202 k( 44) = ( 0.4886364 0.0000000 -0.0000000), wk = 0.0023202 k( 45) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0023202 k( 46) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0023202 k( 47) = ( 0.4935897 0.0128205 -0.0000000), wk = 0.0023202 k( 48) = ( 0.4871795 0.0256410 0.0000000), wk = 0.0023202 k( 49) = ( 0.4807692 0.0384615 -0.0000000), wk = 0.0023202 k( 50) = ( 0.4743590 0.0512821 0.0000000), wk = 0.0023202 k( 51) = ( 0.4679487 0.0641026 -0.0000000), wk = 0.0023202 k( 52) = ( 0.4615385 0.0769231 0.0000000), wk = 0.0023202 k( 53) = ( 0.4551282 0.0897436 0.0000000), wk = 0.0023202 k( 54) = ( 0.4487179 0.1025641 0.0000000), wk = 0.0023202 k( 55) = ( 0.4423077 0.1153846 -0.0000000), wk = 0.0023202 k( 56) = ( 0.4358974 0.1282051 0.0000000), wk = 0.0023202 k( 57) = ( 0.4294872 0.1410256 0.0000000), wk = 0.0023202 k( 58) = ( 0.4230769 0.1538461 -0.0000000), wk = 0.0023202 k( 59) = ( 0.4166667 0.1666667 0.0000000), wk = 0.0023202 k( 60) = ( 0.4102564 0.1794872 0.0000000), wk = 0.0023202 k( 61) = ( 0.4038462 0.1923077 -0.0000000), wk = 0.0023202 k( 62) = ( 0.3974359 0.2051282 -0.0000000), wk = 0.0023202 k( 63) = ( 0.3910256 0.2179487 -0.0000000), wk = 0.0023202 k( 64) = ( 0.3846154 0.2307692 -0.0000000), wk = 0.0023202 k( 65) = ( 0.3782051 0.2435897 0.0000000), wk = 0.0023202 k( 66) = ( 0.3717949 0.2564103 -0.0000000), wk = 0.0023202 k( 67) = ( 0.3653846 0.2692308 0.0000000), wk = 0.0023202 k( 68) = ( 0.3589744 0.2820513 -0.0000000), wk = 0.0023202 k( 69) = ( 0.3525641 0.2948718 0.0000000), wk = 0.0023202 k( 70) = ( 0.3461538 0.3076923 0.0000000), wk = 0.0023202 k( 71) = ( 0.3397436 0.3205128 0.0000000), wk = 0.0023202 k( 72) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0023202 k( 73) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0023202 k( 74) = ( 0.3267974 0.3267974 -0.0000000), wk = 0.0023202 k( 75) = ( 0.3202614 0.3202614 0.0000000), wk = 0.0023202 k( 76) = ( 0.3137255 0.3137255 0.0000000), wk = 0.0023202 k( 77) = ( 0.3071895 0.3071895 0.0000000), wk = 0.0023202 k( 78) = ( 0.3006536 0.3006536 0.0000000), wk = 0.0023202 k( 79) = ( 0.2941177 0.2941177 0.0000000), wk = 0.0023202 k( 80) = ( 0.2875817 0.2875817 0.0000000), wk = 0.0023202 k( 81) = ( 0.2810457 0.2810457 0.0000000), wk = 0.0023202 k( 82) = ( 0.2745098 0.2745098 0.0000000), wk = 0.0023202 k( 83) = ( 0.2679739 0.2679739 0.0000000), wk = 0.0023202 k( 84) = ( 0.2614379 0.2614379 0.0000000), wk = 0.0023202 k( 85) = ( 0.2549020 0.2549020 0.0000000), wk = 0.0023202 k( 86) = ( 0.2483660 0.2483660 -0.0000000), wk = 0.0023202 k( 87) = ( 0.2418301 0.2418301 -0.0000000), wk = 0.0023202 k( 88) = ( 0.2352941 0.2352941 0.0000000), wk = 0.0023202 k( 89) = ( 0.2287582 0.2287582 0.0000000), wk = 0.0023202 k( 90) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0023202 k( 91) = ( 0.2156863 0.2156863 0.0000000), wk = 0.0023202 k( 92) = ( 0.2091503 0.2091503 0.0000000), wk = 0.0023202 k( 93) = ( 0.2026144 0.2026144 0.0000000), wk = 0.0023202 k( 94) = ( 0.1960784 0.1960784 0.0000000), wk = 0.0023202 k( 95) = ( 0.1895425 0.1895425 0.0000000), wk = 0.0023202 k( 96) = ( 0.1830065 0.1830065 0.0000000), wk = 0.0023202 k( 97) = ( 0.1764706 0.1764706 0.0000000), wk = 0.0023202 k( 98) = ( 0.1699346 0.1699346 -0.0000000), wk = 0.0023202 k( 99) = ( 0.1633987 0.1633987 -0.0000000), wk = 0.0023202 k( 100) = ( 0.1568627 0.1568628 -0.0000000), wk = 0.0023202 k( 101) = ( 0.1503268 0.1503268 0.0000000), wk = 0.0023202 k( 102) = ( 0.1437908 0.1437908 0.0000000), wk = 0.0023202 k( 103) = ( 0.1372549 0.1372549 0.0000000), wk = 0.0023202 k( 104) = ( 0.1307190 0.1307190 0.0000000), wk = 0.0023202 k( 105) = ( 0.1241830 0.1241830 -0.0000000), wk = 0.0023202 k( 106) = ( 0.1176471 0.1176471 0.0000000), wk = 0.0023202 k( 107) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0023202 k( 108) = ( 0.1045752 0.1045752 0.0000000), wk = 0.0023202 k( 109) = ( 0.0980392 0.0980392 0.0000000), wk = 0.0023202 k( 110) = ( 0.0915033 0.0915033 0.0000000), wk = 0.0023202 k( 111) = ( 0.0849673 0.0849673 -0.0000000), wk = 0.0023202 k( 112) = ( 0.0784314 0.0784314 -0.0000000), wk = 0.0023202 k( 113) = ( 0.0718954 0.0718954 0.0000000), wk = 0.0023202 k( 114) = ( 0.0653595 0.0653595 0.0000000), wk = 0.0023202 k( 115) = ( 0.0588235 0.0588235 0.0000000), wk = 0.0023202 k( 116) = ( 0.0522876 0.0522876 0.0000000), wk = 0.0023202 k( 117) = ( 0.0457516 0.0457516 0.0000000), wk = 0.0023202 k( 118) = ( 0.0392157 0.0392157 0.0000000), wk = 0.0023202 k( 119) = ( 0.0326797 0.0326797 0.0000000), wk = 0.0023202 k( 120) = ( 0.0261438 0.0261438 0.0000000), wk = 0.0023202 k( 121) = ( 0.0196078 0.0196078 0.0000000), wk = 0.0023202 k( 122) = ( 0.0130719 0.0130719 0.0000000), wk = 0.0023202 k( 123) = ( 0.0065359 0.0065360 0.0000000), wk = 0.0023202 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023202 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023202 k( 126) = ( 0.0000000 0.0000000 0.0083333), wk = 0.0023202 k( 127) = ( 0.0000000 0.0000000 0.0166667), wk = 0.0023202 k( 128) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0023202 k( 129) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0023202 k( 130) = ( 0.0000000 0.0000000 0.0416667), wk = 0.0023202 k( 131) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0023202 k( 132) = ( 0.0000000 0.0000000 0.0583333), wk = 0.0023202 k( 133) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0023202 k( 134) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0023202 k( 135) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0023202 k( 136) = ( 0.0000000 0.0000000 0.0916667), wk = 0.0023202 k( 137) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0023202 k( 138) = ( 0.0000000 0.0000000 0.1083333), wk = 0.0023202 k( 139) = ( 0.0000000 0.0000000 0.1166667), wk = 0.0023202 k( 140) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0023202 k( 141) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0023202 k( 142) = ( 0.0000000 0.0000000 0.1416667), wk = 0.0023202 k( 143) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0023202 k( 144) = ( 0.0000000 0.0000000 0.1583333), wk = 0.0023202 k( 145) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0023202 k( 146) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0023202 k( 147) = ( 0.0000000 0.0000000 0.1833333), wk = 0.0023202 k( 148) = ( 0.0000000 0.0000000 0.1916667), wk = 0.0023202 k( 149) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0023202 k( 150) = ( 0.0000000 0.0000000 0.2083333), wk = 0.0023202 k( 151) = ( 0.0000000 0.0000000 0.2166667), wk = 0.0023202 k( 152) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0023202 k( 153) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0023202 k( 154) = ( 0.0000000 0.0000000 0.2416667), wk = 0.0023202 k( 155) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0023202 k( 156) = ( 0.0000000 0.0000000 0.2583333), wk = 0.0023202 k( 157) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0023202 k( 158) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0023202 k( 159) = ( 0.0000000 0.0000000 0.2833333), wk = 0.0023202 k( 160) = ( 0.0000000 0.0000000 0.2916667), wk = 0.0023202 k( 161) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0023202 k( 162) = ( 0.0000000 0.0000000 0.3083333), wk = 0.0023202 k( 163) = ( 0.0000000 0.0000000 0.3166667), wk = 0.0023202 k( 164) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0023202 k( 165) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0023202 k( 166) = ( 0.0000000 0.0000000 0.3416667), wk = 0.0023202 k( 167) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0023202 k( 168) = ( 0.0000000 0.0000000 0.3583333), wk = 0.0023202 k( 169) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0023202 k( 170) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0023202 k( 171) = ( 0.0000000 0.0000000 0.3833333), wk = 0.0023202 k( 172) = ( 0.0000000 0.0000000 0.3916667), wk = 0.0023202 k( 173) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0023202 k( 174) = ( 0.0000000 0.0000000 0.4083333), wk = 0.0023202 k( 175) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0023202 k( 176) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0023202 k( 177) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0023202 k( 178) = ( 0.0000000 0.0000000 0.4416667), wk = 0.0023202 k( 179) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0023202 k( 180) = ( 0.0000000 0.0000000 0.4583333), wk = 0.0023202 k( 181) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0023202 k( 182) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0023202 k( 183) = ( 0.0000000 0.0000000 0.4833333), wk = 0.0023202 k( 184) = ( 0.0000000 0.0000000 0.4916667), wk = 0.0023202 k( 185) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023202 k( 186) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023202 k( 187) = ( 0.0113636 0.0000000 0.5000000), wk = 0.0023202 k( 188) = ( 0.0227273 -0.0000000 0.5000000), wk = 0.0023202 k( 189) = ( 0.0340909 -0.0000000 0.5000000), wk = 0.0023202 k( 190) = ( 0.0454546 -0.0000000 0.5000000), wk = 0.0023202 k( 191) = ( 0.0568182 -0.0000000 0.5000000), wk = 0.0023202 k( 192) = ( 0.0681818 -0.0000000 0.5000000), wk = 0.0023202 k( 193) = ( 0.0795455 0.0000000 0.5000000), wk = 0.0023202 k( 194) = ( 0.0909091 -0.0000000 0.5000000), wk = 0.0023202 k( 195) = ( 0.1022727 0.0000000 0.5000000), wk = 0.0023202 k( 196) = ( 0.1136364 -0.0000000 0.5000000), wk = 0.0023202 k( 197) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0023202 k( 198) = ( 0.1363636 -0.0000000 0.5000000), wk = 0.0023202 k( 199) = ( 0.1477273 -0.0000000 0.5000000), wk = 0.0023202 k( 200) = ( 0.1590909 0.0000000 0.5000000), wk = 0.0023202 k( 201) = ( 0.1704546 0.0000000 0.5000000), wk = 0.0023202 k( 202) = ( 0.1818182 -0.0000000 0.5000000), wk = 0.0023202 k( 203) = ( 0.1931818 -0.0000000 0.5000000), wk = 0.0023202 k( 204) = ( 0.2045454 0.0000000 0.5000000), wk = 0.0023202 k( 205) = ( 0.2159091 -0.0000000 0.5000000), wk = 0.0023202 k( 206) = ( 0.2272727 0.0000000 0.5000000), wk = 0.0023202 k( 207) = ( 0.2386364 -0.0000000 0.5000000), wk = 0.0023202 k( 208) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0023202 k( 209) = ( 0.2613636 0.0000000 0.5000000), wk = 0.0023202 k( 210) = ( 0.2727273 -0.0000000 0.5000000), wk = 0.0023202 k( 211) = ( 0.2840909 -0.0000000 0.5000000), wk = 0.0023202 k( 212) = ( 0.2954545 -0.0000000 0.5000000), wk = 0.0023202 k( 213) = ( 0.3068182 0.0000000 0.5000000), wk = 0.0023202 k( 214) = ( 0.3181818 0.0000000 0.5000000), wk = 0.0023202 k( 215) = ( 0.3295455 0.0000000 0.5000000), wk = 0.0023202 k( 216) = ( 0.3409091 -0.0000000 0.5000000), wk = 0.0023202 k( 217) = ( 0.3522727 0.0000000 0.5000000), wk = 0.0023202 k( 218) = ( 0.3636364 -0.0000000 0.5000000), wk = 0.0023202 k( 219) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0023202 k( 220) = ( 0.3863636 -0.0000000 0.5000000), wk = 0.0023202 k( 221) = ( 0.3977273 -0.0000000 0.5000000), wk = 0.0023202 k( 222) = ( 0.4090909 0.0000000 0.5000000), wk = 0.0023202 k( 223) = ( 0.4204545 -0.0000000 0.5000000), wk = 0.0023202 k( 224) = ( 0.4318182 -0.0000000 0.5000000), wk = 0.0023202 k( 225) = ( 0.4431818 0.0000000 0.5000000), wk = 0.0023202 k( 226) = ( 0.4545455 0.0000000 0.5000000), wk = 0.0023202 k( 227) = ( 0.4659091 -0.0000000 0.5000000), wk = 0.0023202 k( 228) = ( 0.4772727 0.0000000 0.5000000), wk = 0.0023202 k( 229) = ( 0.4886364 0.0000000 0.5000000), wk = 0.0023202 k( 230) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023202 k( 231) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023202 k( 232) = ( 0.4935897 0.0128205 0.5000000), wk = 0.0023202 k( 233) = ( 0.4871795 0.0256410 0.5000000), wk = 0.0023202 k( 234) = ( 0.4807692 0.0384615 0.5000000), wk = 0.0023202 k( 235) = ( 0.4743590 0.0512821 0.5000000), wk = 0.0023202 k( 236) = ( 0.4679487 0.0641026 0.5000000), wk = 0.0023202 k( 237) = ( 0.4615385 0.0769231 0.5000000), wk = 0.0023202 k( 238) = ( 0.4551282 0.0897436 0.5000000), wk = 0.0023202 k( 239) = ( 0.4487179 0.1025641 0.5000000), wk = 0.0023202 k( 240) = ( 0.4423077 0.1153846 0.5000000), wk = 0.0023202 k( 241) = ( 0.4358974 0.1282051 0.5000000), wk = 0.0023202 k( 242) = ( 0.4294872 0.1410256 0.5000000), wk = 0.0023202 k( 243) = ( 0.4230769 0.1538461 0.5000000), wk = 0.0023202 k( 244) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0023202 k( 245) = ( 0.4102564 0.1794872 0.5000000), wk = 0.0023202 k( 246) = ( 0.4038462 0.1923077 0.5000000), wk = 0.0023202 k( 247) = ( 0.3974359 0.2051282 0.5000000), wk = 0.0023202 k( 248) = ( 0.3910256 0.2179487 0.5000000), wk = 0.0023202 k( 249) = ( 0.3846154 0.2307692 0.5000000), wk = 0.0023202 k( 250) = ( 0.3782051 0.2435897 0.5000000), wk = 0.0023202 k( 251) = ( 0.3717949 0.2564103 0.5000000), wk = 0.0023202 k( 252) = ( 0.3653846 0.2692308 0.5000000), wk = 0.0023202 k( 253) = ( 0.3589744 0.2820513 0.5000000), wk = 0.0023202 k( 254) = ( 0.3525641 0.2948718 0.5000000), wk = 0.0023202 k( 255) = ( 0.3461538 0.3076923 0.5000000), wk = 0.0023202 k( 256) = ( 0.3397436 0.3205128 0.5000000), wk = 0.0023202 k( 257) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0023202 k( 258) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0023202 k( 259) = ( 0.3267974 0.3267974 0.5000000), wk = 0.0023202 k( 260) = ( 0.3202614 0.3202614 0.5000000), wk = 0.0023202 k( 261) = ( 0.3137255 0.3137255 0.5000000), wk = 0.0023202 k( 262) = ( 0.3071895 0.3071895 0.5000000), wk = 0.0023202 k( 263) = ( 0.3006536 0.3006536 0.5000000), wk = 0.0023202 k( 264) = ( 0.2941177 0.2941177 0.5000000), wk = 0.0023202 k( 265) = ( 0.2875817 0.2875817 0.5000000), wk = 0.0023202 k( 266) = ( 0.2810457 0.2810457 0.5000000), wk = 0.0023202 k( 267) = ( 0.2745098 0.2745098 0.5000000), wk = 0.0023202 k( 268) = ( 0.2679739 0.2679739 0.5000000), wk = 0.0023202 k( 269) = ( 0.2614379 0.2614379 0.5000000), wk = 0.0023202 k( 270) = ( 0.2549020 0.2549020 0.5000000), wk = 0.0023202 k( 271) = ( 0.2483660 0.2483660 0.5000000), wk = 0.0023202 k( 272) = ( 0.2418301 0.2418301 0.5000000), wk = 0.0023202 k( 273) = ( 0.2352941 0.2352941 0.5000000), wk = 0.0023202 k( 274) = ( 0.2287582 0.2287582 0.5000000), wk = 0.0023202 k( 275) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0023202 k( 276) = ( 0.2156863 0.2156863 0.5000000), wk = 0.0023202 k( 277) = ( 0.2091503 0.2091503 0.5000000), wk = 0.0023202 k( 278) = ( 0.2026144 0.2026144 0.5000000), wk = 0.0023202 k( 279) = ( 0.1960784 0.1960784 0.5000000), wk = 0.0023202 k( 280) = ( 0.1895425 0.1895425 0.5000000), wk = 0.0023202 k( 281) = ( 0.1830065 0.1830065 0.5000000), wk = 0.0023202 k( 282) = ( 0.1764706 0.1764706 0.5000000), wk = 0.0023202 k( 283) = ( 0.1699346 0.1699346 0.5000000), wk = 0.0023202 k( 284) = ( 0.1633987 0.1633987 0.5000000), wk = 0.0023202 k( 285) = ( 0.1568627 0.1568628 0.5000000), wk = 0.0023202 k( 286) = ( 0.1503268 0.1503268 0.5000000), wk = 0.0023202 k( 287) = ( 0.1437908 0.1437908 0.5000000), wk = 0.0023202 k( 288) = ( 0.1372549 0.1372549 0.5000000), wk = 0.0023202 k( 289) = ( 0.1307190 0.1307190 0.5000000), wk = 0.0023202 k( 290) = ( 0.1241830 0.1241830 0.5000000), wk = 0.0023202 k( 291) = ( 0.1176471 0.1176471 0.5000000), wk = 0.0023202 k( 292) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0023202 k( 293) = ( 0.1045752 0.1045752 0.5000000), wk = 0.0023202 k( 294) = ( 0.0980392 0.0980392 0.5000000), wk = 0.0023202 k( 295) = ( 0.0915033 0.0915033 0.5000000), wk = 0.0023202 k( 296) = ( 0.0849673 0.0849673 0.5000000), wk = 0.0023202 k( 297) = ( 0.0784314 0.0784314 0.5000000), wk = 0.0023202 k( 298) = ( 0.0718954 0.0718954 0.5000000), wk = 0.0023202 k( 299) = ( 0.0653595 0.0653595 0.5000000), wk = 0.0023202 k( 300) = ( 0.0588235 0.0588235 0.5000000), wk = 0.0023202 k( 301) = ( 0.0522876 0.0522876 0.5000000), wk = 0.0023202 k( 302) = ( 0.0457516 0.0457516 0.5000000), wk = 0.0023202 k( 303) = ( 0.0392157 0.0392157 0.5000000), wk = 0.0023202 k( 304) = ( 0.0326797 0.0326797 0.5000000), wk = 0.0023202 k( 305) = ( 0.0261438 0.0261438 0.5000000), wk = 0.0023202 k( 306) = ( 0.0196078 0.0196078 0.5000000), wk = 0.0023202 k( 307) = ( 0.0130719 0.0130719 0.5000000), wk = 0.0023202 k( 308) = ( 0.0065359 0.0065360 0.5000000), wk = 0.0023202 k( 309) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023202 k( 310) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023202 k( 311) = ( 0.5000000 0.0000000 0.4916667), wk = 0.0023202 k( 312) = ( 0.5000000 0.0000000 0.4833333), wk = 0.0023202 k( 313) = ( 0.5000000 0.0000000 0.4750000), wk = 0.0023202 k( 314) = ( 0.5000000 0.0000000 0.4666667), wk = 0.0023202 k( 315) = ( 0.5000000 0.0000000 0.4583333), wk = 0.0023202 k( 316) = ( 0.5000000 0.0000000 0.4500000), wk = 0.0023202 k( 317) = ( 0.5000000 0.0000000 0.4416667), wk = 0.0023202 k( 318) = ( 0.5000000 0.0000000 0.4333333), wk = 0.0023202 k( 319) = ( 0.5000000 0.0000000 0.4250000), wk = 0.0023202 k( 320) = ( 0.5000000 0.0000000 0.4166667), wk = 0.0023202 k( 321) = ( 0.5000000 0.0000000 0.4083333), wk = 0.0023202 k( 322) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0023202 k( 323) = ( 0.5000000 0.0000000 0.3916667), wk = 0.0023202 k( 324) = ( 0.5000000 0.0000000 0.3833333), wk = 0.0023202 k( 325) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0023202 k( 326) = ( 0.5000000 0.0000000 0.3666667), wk = 0.0023202 k( 327) = ( 0.5000000 0.0000000 0.3583333), wk = 0.0023202 k( 328) = ( 0.5000000 0.0000000 0.3500000), wk = 0.0023202 k( 329) = ( 0.5000000 0.0000000 0.3416667), wk = 0.0023202 k( 330) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0023202 k( 331) = ( 0.5000000 0.0000000 0.3250000), wk = 0.0023202 k( 332) = ( 0.5000000 0.0000000 0.3166667), wk = 0.0023202 k( 333) = ( 0.5000000 0.0000000 0.3083333), wk = 0.0023202 k( 334) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0023202 k( 335) = ( 0.5000000 0.0000000 0.2916667), wk = 0.0023202 k( 336) = ( 0.5000000 0.0000000 0.2833333), wk = 0.0023202 k( 337) = ( 0.5000000 0.0000000 0.2750000), wk = 0.0023202 k( 338) = ( 0.5000000 0.0000000 0.2666667), wk = 0.0023202 k( 339) = ( 0.5000000 0.0000000 0.2583333), wk = 0.0023202 k( 340) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0023202 k( 341) = ( 0.5000000 0.0000000 0.2416667), wk = 0.0023202 k( 342) = ( 0.5000000 0.0000000 0.2333333), wk = 0.0023202 k( 343) = ( 0.5000000 0.0000000 0.2250000), wk = 0.0023202 k( 344) = ( 0.5000000 0.0000000 0.2166667), wk = 0.0023202 k( 345) = ( 0.5000000 0.0000000 0.2083333), wk = 0.0023202 k( 346) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0023202 k( 347) = ( 0.5000000 0.0000000 0.1916667), wk = 0.0023202 k( 348) = ( 0.5000000 0.0000000 0.1833333), wk = 0.0023202 k( 349) = ( 0.5000000 0.0000000 0.1750000), wk = 0.0023202 k( 350) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0023202 k( 351) = ( 0.5000000 0.0000000 0.1583333), wk = 0.0023202 k( 352) = ( 0.5000000 0.0000000 0.1500000), wk = 0.0023202 k( 353) = ( 0.5000000 0.0000000 0.1416667), wk = 0.0023202 k( 354) = ( 0.5000000 0.0000000 0.1333333), wk = 0.0023202 k( 355) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0023202 k( 356) = ( 0.5000000 0.0000000 0.1166667), wk = 0.0023202 k( 357) = ( 0.5000000 0.0000000 0.1083333), wk = 0.0023202 k( 358) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0023202 k( 359) = ( 0.5000000 0.0000000 0.0916667), wk = 0.0023202 k( 360) = ( 0.5000000 0.0000000 0.0833333), wk = 0.0023202 k( 361) = ( 0.5000000 0.0000000 0.0750000), wk = 0.0023202 k( 362) = ( 0.5000000 0.0000000 0.0666667), wk = 0.0023202 k( 363) = ( 0.5000000 0.0000000 0.0583333), wk = 0.0023202 k( 364) = ( 0.5000000 0.0000000 0.0500000), wk = 0.0023202 k( 365) = ( 0.5000000 0.0000000 0.0416667), wk = 0.0023202 k( 366) = ( 0.5000000 0.0000000 0.0333333), wk = 0.0023202 k( 367) = ( 0.5000000 0.0000000 0.0250000), wk = 0.0023202 k( 368) = ( 0.5000000 0.0000000 0.0166667), wk = 0.0023202 k( 369) = ( 0.5000000 0.0000000 0.0083333), wk = 0.0023202 k( 370) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0023202 k( 371) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0023202 k( 372) = ( 0.3333333 0.3333333 0.0083333), wk = 0.0023202 k( 373) = ( 0.3333333 0.3333333 0.0166667), wk = 0.0023202 k( 374) = ( 0.3333333 0.3333333 0.0250000), wk = 0.0023202 k( 375) = ( 0.3333333 0.3333333 0.0333333), wk = 0.0023202 k( 376) = ( 0.3333333 0.3333333 0.0416667), wk = 0.0023202 k( 377) = ( 0.3333333 0.3333333 0.0500000), wk = 0.0023202 k( 378) = ( 0.3333333 0.3333333 0.0583333), wk = 0.0023202 k( 379) = ( 0.3333333 0.3333333 0.0666667), wk = 0.0023202 k( 380) = ( 0.3333333 0.3333333 0.0750000), wk = 0.0023202 k( 381) = ( 0.3333333 0.3333333 0.0833333), wk = 0.0023202 k( 382) = ( 0.3333333 0.3333333 0.0916667), wk = 0.0023202 k( 383) = ( 0.3333333 0.3333333 0.1000000), wk = 0.0023202 k( 384) = ( 0.3333333 0.3333333 0.1083333), wk = 0.0023202 k( 385) = ( 0.3333333 0.3333333 0.1166667), wk = 0.0023202 k( 386) = ( 0.3333333 0.3333333 0.1250000), wk = 0.0023202 k( 387) = ( 0.3333333 0.3333333 0.1333333), wk = 0.0023202 k( 388) = ( 0.3333333 0.3333333 0.1416667), wk = 0.0023202 k( 389) = ( 0.3333333 0.3333333 0.1500000), wk = 0.0023202 k( 390) = ( 0.3333333 0.3333333 0.1583333), wk = 0.0023202 k( 391) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0023202 k( 392) = ( 0.3333333 0.3333333 0.1750000), wk = 0.0023202 k( 393) = ( 0.3333333 0.3333333 0.1833333), wk = 0.0023202 k( 394) = ( 0.3333333 0.3333333 0.1916667), wk = 0.0023202 k( 395) = ( 0.3333333 0.3333333 0.2000000), wk = 0.0023202 k( 396) = ( 0.3333333 0.3333333 0.2083333), wk = 0.0023202 k( 397) = ( 0.3333333 0.3333333 0.2166667), wk = 0.0023202 k( 398) = ( 0.3333333 0.3333333 0.2250000), wk = 0.0023202 k( 399) = ( 0.3333333 0.3333333 0.2333333), wk = 0.0023202 k( 400) = ( 0.3333333 0.3333333 0.2416667), wk = 0.0023202 k( 401) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0023202 k( 402) = ( 0.3333333 0.3333333 0.2583333), wk = 0.0023202 k( 403) = ( 0.3333333 0.3333333 0.2666667), wk = 0.0023202 k( 404) = ( 0.3333333 0.3333333 0.2750000), wk = 0.0023202 k( 405) = ( 0.3333333 0.3333333 0.2833333), wk = 0.0023202 k( 406) = ( 0.3333333 0.3333333 0.2916667), wk = 0.0023202 k( 407) = ( 0.3333333 0.3333333 0.3000000), wk = 0.0023202 k( 408) = ( 0.3333333 0.3333333 0.3083333), wk = 0.0023202 k( 409) = ( 0.3333333 0.3333333 0.3166667), wk = 0.0023202 k( 410) = ( 0.3333333 0.3333333 0.3250000), wk = 0.0023202 k( 411) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0023202 k( 412) = ( 0.3333333 0.3333333 0.3416667), wk = 0.0023202 k( 413) = ( 0.3333333 0.3333333 0.3500000), wk = 0.0023202 k( 414) = ( 0.3333333 0.3333333 0.3583333), wk = 0.0023202 k( 415) = ( 0.3333333 0.3333333 0.3666667), wk = 0.0023202 k( 416) = ( 0.3333333 0.3333333 0.3750000), wk = 0.0023202 k( 417) = ( 0.3333333 0.3333333 0.3833333), wk = 0.0023202 k( 418) = ( 0.3333333 0.3333333 0.3916667), wk = 0.0023202 k( 419) = ( 0.3333333 0.3333333 0.4000000), wk = 0.0023202 k( 420) = ( 0.3333333 0.3333333 0.4083333), wk = 0.0023202 k( 421) = ( 0.3333333 0.3333333 0.4166667), wk = 0.0023202 k( 422) = ( 0.3333333 0.3333333 0.4250000), wk = 0.0023202 k( 423) = ( 0.3333333 0.3333333 0.4333333), wk = 0.0023202 k( 424) = ( 0.3333333 0.3333333 0.4416667), wk = 0.0023202 k( 425) = ( 0.3333333 0.3333333 0.4500000), wk = 0.0023202 k( 426) = ( 0.3333333 0.3333333 0.4583333), wk = 0.0023202 k( 427) = ( 0.3333333 0.3333333 0.4666667), wk = 0.0023202 k( 428) = ( 0.3333333 0.3333333 0.4750000), wk = 0.0023202 k( 429) = ( 0.3333333 0.3333333 0.4833333), wk = 0.0023202 k( 430) = ( 0.3333333 0.3333333 0.4916667), wk = 0.0023202 k( 431) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0023202 Dense grid: 41499 G-vectors FFT dimensions: ( 54, 54, 36) Smooth grid: 38505 G-vectors FFT dimensions: ( 54, 54, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.10 Mb ( 276, 24) NL pseudopotentials 0.13 Mb ( 138, 62) Each V/rho on FFT grid 0.04 Mb ( 2916) Each G-vector array 0.01 Mb ( 1154) G-vector shells 0.00 Mb ( 548) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.40 Mb ( 276, 96) Each subspace H/S matrix 0.01 Mb ( 24, 24) Each matrix 0.05 Mb ( 62, 2, 24) The potential is recalculated from file : ./Li2Pt.save/charge-density.dat Starting wfc are 38 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.7 secs Computing kpt #: 2 total cpu time spent up to now is 1.8 secs Computing kpt #: 3 total cpu time spent up to now is 1.9 secs Computing kpt #: 4 total cpu time spent up to now is 2.1 secs Computing kpt #: 5 total cpu time spent up to now is 2.2 secs Computing kpt #: 6 total cpu time spent up to now is 2.4 secs Computing kpt #: 7 total cpu time spent up to now is 2.5 secs Computing kpt #: 8 total cpu time spent up to now is 2.7 secs Computing kpt #: 9 total cpu time spent up to now is 2.8 secs Computing kpt #: 10 total cpu time spent up to now is 3.0 secs Computing kpt #: 11 total cpu time spent up to now is 3.1 secs Computing kpt #: 12 total cpu time spent up to now is 3.3 secs Computing kpt #: 13 total cpu time spent up to now is 3.4 secs Computing kpt #: 14 total cpu time spent up to now is 3.6 secs Computing kpt #: 15 total cpu time spent up to now is 3.7 secs Computing kpt #: 16 total cpu time spent up to now is 3.9 secs Computing kpt #: 17 total cpu time spent up to now is 4.1 secs Computing kpt #: 18 total cpu time spent up to now is 4.2 secs Computing kpt #: 19 total cpu time spent up to now is 4.4 secs Computing kpt #: 20 total cpu time spent up to now is 4.5 secs Computing kpt #: 21 total cpu time spent up to now is 4.7 secs Computing kpt #: 22 total cpu time spent up to now is 4.8 secs Computing kpt #: 23 total cpu time spent up to now is 5.0 secs Computing kpt #: 24 total cpu time spent up to now is 5.2 secs Computing kpt #: 25 total cpu time spent up to now is 5.3 secs Computing kpt #: 26 total cpu time spent up to now is 5.5 secs Computing kpt #: 27 total cpu time spent up to now is 5.6 secs Computing kpt #: 28 total cpu time spent up to now is 5.8 secs Computing kpt #: 29 total cpu time spent up to now is 6.0 secs Computing kpt #: 30 total cpu time spent up to now is 6.1 secs Computing kpt #: 31 total cpu time spent up to now is 6.3 secs Computing kpt #: 32 total cpu time spent up to now is 6.4 secs Computing kpt #: 33 total cpu time spent up to now is 6.6 secs Computing kpt #: 34 total cpu time spent up to now is 6.8 secs Computing kpt #: 35 total cpu time spent up to now is 6.9 secs Computing kpt #: 36 total cpu time spent up to now is 7.1 secs Computing kpt #: 37 total cpu time spent up to now is 7.3 secs Computing kpt #: 38 total cpu time spent up to now is 7.4 secs Computing kpt #: 39 total cpu time spent up to now is 7.6 secs Computing kpt #: 40 total cpu time spent up to now is 7.8 secs Computing kpt #: 41 total cpu time spent up to now is 8.0 secs Computing kpt #: 42 total cpu time spent up to now is 8.2 secs Computing kpt #: 43 total cpu time spent up to now is 8.3 secs Computing kpt #: 44 total cpu time spent up to now is 8.5 secs Computing kpt #: 45 total cpu time spent up to now is 8.7 secs Computing kpt #: 46 total cpu time spent up to now is 8.9 secs Computing kpt #: 47 total cpu time spent up to now is 9.0 secs Computing kpt #: 48 total cpu time spent up to now is 9.2 secs Computing kpt #: 49 total cpu time spent up to now is 9.4 secs Computing kpt #: 50 total cpu time spent up to now is 9.6 secs Computing kpt #: 51 total cpu time spent up to now is 9.8 secs Computing kpt #: 52 total cpu time spent up to now is 9.9 secs Computing kpt #: 53 total cpu time spent up to now is 10.1 secs Computing kpt #: 54 total cpu time spent up to now is 10.3 secs Computing kpt #: 55 total cpu time spent up to now is 10.4 secs Computing kpt #: 56 total cpu time spent up to now is 10.6 secs Computing kpt #: 57 total cpu time spent up to now is 10.8 secs Computing kpt #: 58 total cpu time spent up to now is 10.9 secs Computing kpt #: 59 total cpu time spent up to now is 11.1 secs Computing kpt #: 60 total cpu time spent up to now is 11.3 secs Computing kpt #: 61 total cpu time spent up to now is 11.5 secs Computing kpt #: 62 total cpu time spent up to now is 11.6 secs Computing kpt #: 63 total cpu time spent up to now is 11.8 secs Computing kpt #: 64 total cpu time spent up to now is 12.0 secs Computing kpt #: 65 total cpu time spent up to now is 12.1 secs Computing kpt #: 66 total cpu time spent up to now is 12.3 secs Computing kpt #: 67 total cpu time spent up to now is 12.5 secs Computing kpt #: 68 total cpu time spent up to now is 12.6 secs Computing kpt #: 69 total cpu time spent up to now is 12.8 secs Computing kpt #: 70 total cpu time spent up to now is 13.0 secs Computing kpt #: 71 total cpu time spent up to now is 13.2 secs Computing kpt #: 72 total cpu time spent up to now is 13.3 secs Computing kpt #: 73 total cpu time spent up to now is 13.5 secs Computing kpt #: 74 total cpu time spent up to now is 13.7 secs Computing kpt #: 75 total cpu time spent up to now is 13.9 secs Computing kpt #: 76 total cpu time spent up to now is 14.0 secs Computing kpt #: 77 total cpu time spent up to now is 14.2 secs Computing kpt #: 78 total cpu time spent up to now is 14.4 secs Computing kpt #: 79 total cpu time spent up to now is 14.5 secs Computing kpt #: 80 total cpu time spent up to now is 14.7 secs Computing kpt #: 81 total cpu time spent up to now is 14.9 secs Computing kpt #: 82 total cpu time spent up to now is 15.0 secs Computing kpt #: 83 total cpu time spent up to now is 15.2 secs Computing kpt #: 84 total cpu time spent up to now is 15.3 secs Computing kpt #: 85 total cpu time spent up to now is 15.5 secs Computing kpt #: 86 total cpu time spent up to now is 15.6 secs Computing kpt #: 87 total cpu time spent up to now is 15.8 secs Computing kpt #: 88 total cpu time spent up to now is 15.9 secs Computing kpt #: 89 total cpu time spent up to now is 16.1 secs Computing kpt #: 90 total cpu time spent up to now is 16.2 secs Computing kpt #: 91 total cpu time spent up to now is 16.4 secs Computing kpt #: 92 total cpu time spent up to now is 16.5 secs Computing kpt #: 93 total cpu time spent up to now is 16.7 secs Computing kpt #: 94 total cpu time spent up to now is 16.8 secs Computing kpt #: 95 total cpu time spent up to now is 17.0 secs Computing kpt #: 96 total cpu time spent up to now is 17.1 secs Computing kpt #: 97 total cpu time spent up to now is 17.3 secs Computing kpt #: 98 total cpu time spent up to now is 17.4 secs Computing kpt #: 99 total cpu time spent up to now is 17.6 secs Computing kpt #: 100 total cpu time spent up to now is 17.7 secs Computing kpt #: 101 total cpu time spent up to now is 17.9 secs Computing kpt #: 102 total cpu time spent up to now is 18.0 secs Computing kpt #: 103 total cpu time spent up to now is 18.2 secs Computing kpt #: 104 total cpu time spent up to now is 18.3 secs Computing kpt #: 105 total cpu time spent up to now is 18.5 secs Computing kpt #: 106 total cpu time spent up to now is 18.6 secs Computing kpt #: 107 total cpu time spent up to now is 18.8 secs Computing kpt #: 108 total cpu time spent up to now is 18.9 secs Computing kpt #: 109 total cpu time spent up to now is 19.1 secs Computing kpt #: 110 total cpu time spent up to now is 19.3 secs Computing kpt #: 111 total cpu time spent up to now is 19.4 secs Computing kpt #: 112 total cpu time spent up to now is 19.6 secs Computing kpt #: 113 total cpu time spent up to now is 19.7 secs Computing kpt #: 114 total cpu time spent up to now is 19.9 secs Computing kpt #: 115 total cpu time spent up to now is 20.0 secs Computing kpt #: 116 total cpu time spent up to now is 20.2 secs Computing kpt #: 117 total cpu time spent up to now is 20.3 secs Computing kpt #: 118 total cpu time spent up to now is 20.5 secs Computing kpt #: 119 total cpu time spent up to now is 20.6 secs Computing kpt #: 120 total cpu time spent up to now is 20.8 secs Computing kpt #: 121 total cpu time spent up to now is 20.9 secs Computing kpt #: 122 total cpu time spent up to now is 21.1 secs Computing kpt #: 123 total cpu time spent up to now is 21.2 secs Computing kpt #: 124 total cpu time spent up to now is 21.3 secs Computing kpt #: 125 total cpu time spent up to now is 21.5 secs Computing kpt #: 126 total cpu time spent up to now is 21.6 secs Computing kpt #: 127 total cpu time spent up to now is 21.8 secs Computing kpt #: 128 total cpu time spent up to now is 21.9 secs Computing kpt #: 129 total cpu time spent up to now is 22.0 secs Computing kpt #: 130 total cpu time spent up to now is 22.2 secs Computing kpt #: 131 total cpu time spent up to now is 22.3 secs Computing kpt #: 132 total cpu time spent up to now is 22.5 secs Computing kpt #: 133 total cpu time spent up to now is 22.6 secs Computing kpt #: 134 total cpu time spent up to now is 22.8 secs Computing kpt #: 135 total cpu time spent up to now is 22.9 secs Computing kpt #: 136 total cpu time spent up to now is 23.1 secs Computing kpt #: 137 total cpu time spent up to now is 23.2 secs Computing kpt #: 138 total cpu time spent up to now is 23.4 secs Computing kpt #: 139 total cpu time spent up to now is 23.5 secs Computing kpt #: 140 total cpu time spent up to now is 23.7 secs Computing kpt #: 141 total cpu time spent up to now is 23.9 secs Computing kpt #: 142 total cpu time spent up to now is 24.0 secs Computing kpt #: 143 total cpu time spent up to now is 24.2 secs Computing kpt #: 144 total cpu time spent up to now is 24.3 secs Computing kpt #: 145 total cpu time spent up to now is 24.5 secs Computing kpt #: 146 total cpu time spent up to now is 24.7 secs Computing kpt #: 147 total cpu time spent up to now is 24.8 secs Computing kpt #: 148 total cpu time spent up to now is 25.0 secs Computing kpt #: 149 total cpu time spent up to now is 25.2 secs Computing kpt #: 150 total cpu time spent up to now is 25.4 secs Computing kpt #: 151 total cpu time spent up to now is 25.6 secs Computing kpt #: 152 total cpu time spent up to now is 25.8 secs Computing kpt #: 153 total cpu time spent up to now is 26.0 secs Computing kpt #: 154 total cpu time spent up to now is 26.2 secs Computing kpt #: 155 total cpu time spent up to now is 26.4 secs Computing kpt #: 156 total cpu time spent up to now is 26.6 secs Computing kpt #: 157 total cpu time spent up to now is 26.7 secs Computing kpt #: 158 total cpu time spent up to now is 26.9 secs Computing kpt #: 159 total cpu time spent up to now is 27.1 secs Computing kpt #: 160 total cpu time spent up to now is 27.2 secs Computing kpt #: 161 total cpu time spent up to now is 27.4 secs Computing kpt #: 162 total cpu time spent up to now is 27.6 secs Computing kpt #: 163 total cpu time spent up to now is 27.7 secs Computing kpt #: 164 total cpu time spent up to now is 27.9 secs Computing kpt #: 165 total cpu time spent up to now is 28.1 secs Computing kpt #: 166 total cpu time spent up to now is 28.3 secs Computing kpt #: 167 total cpu time spent up to now is 28.7 secs Computing kpt #: 168 total cpu time spent up to now is 29.0 secs Computing kpt #: 169 total cpu time spent up to now is 29.3 secs Computing kpt #: 170 total cpu time spent up to now is 29.5 secs Computing kpt #: 171 total cpu time spent up to now is 29.8 secs Computing kpt #: 172 total cpu time spent up to now is 30.0 secs Computing kpt #: 173 total cpu time spent up to now is 30.2 secs Computing kpt #: 174 total cpu time spent up to now is 30.3 secs Computing kpt #: 175 total cpu time spent up to now is 30.5 secs Computing kpt #: 176 total cpu time spent up to now is 30.7 secs Computing kpt #: 177 total cpu time spent up to now is 30.8 secs Computing kpt #: 178 total cpu time spent up to now is 31.0 secs Computing kpt #: 179 total cpu time spent up to now is 31.1 secs Computing kpt #: 180 total cpu time spent up to now is 31.3 secs Computing kpt #: 181 total cpu time spent up to now is 31.4 secs Computing kpt #: 182 total cpu time spent up to now is 31.6 secs Computing kpt #: 183 total cpu time spent up to now is 31.7 secs Computing kpt #: 184 total cpu time spent up to now is 31.9 secs Computing kpt #: 185 total cpu time spent up to now is 32.0 secs Computing kpt #: 186 total cpu time spent up to now is 32.1 secs Computing kpt #: 187 total cpu time spent up to now is 32.3 secs Computing kpt #: 188 total cpu time spent up to now is 32.5 secs Computing kpt #: 189 total cpu time spent up to now is 32.6 secs Computing kpt #: 190 total cpu time spent up to now is 32.8 secs Computing kpt #: 191 total cpu time spent up to now is 32.9 secs Computing kpt #: 192 total cpu time spent up to now is 33.1 secs Computing kpt #: 193 total cpu time spent up to now is 33.2 secs Computing kpt #: 194 total cpu time spent up to now is 33.4 secs Computing kpt #: 195 total cpu time spent up to now is 33.5 secs Computing kpt #: 196 total cpu time spent up to now is 33.7 secs Computing kpt #: 197 total cpu time spent up to now is 33.9 secs Computing kpt #: 198 total cpu time spent up to now is 34.1 secs Computing kpt #: 199 total cpu time spent up to now is 34.2 secs Computing kpt #: 200 total cpu time spent up to now is 34.4 secs Computing kpt #: 201 total cpu time spent up to now is 34.6 secs Computing kpt #: 202 total cpu time spent up to now is 34.7 secs Computing kpt #: 203 total cpu time spent up to now is 34.9 secs Computing kpt #: 204 total cpu time spent up to now is 35.1 secs Computing kpt #: 205 total cpu time spent up to now is 35.2 secs Computing kpt #: 206 total cpu time spent up to now is 35.4 secs Computing kpt #: 207 total cpu time spent up to now is 35.6 secs Computing kpt #: 208 total cpu time spent up to now is 35.8 secs Computing kpt #: 209 total cpu time spent up to now is 35.9 secs Computing kpt #: 210 total cpu time spent up to now is 36.1 secs Computing kpt #: 211 total cpu time spent up to now is 36.3 secs Computing kpt #: 212 total cpu time spent up to now is 36.4 secs Computing kpt #: 213 total cpu time spent up to now is 36.6 secs Computing kpt #: 214 total cpu time spent up to now is 36.8 secs Computing kpt #: 215 total cpu time spent up to now is 37.0 secs Computing kpt #: 216 total cpu time spent up to now is 37.1 secs Computing kpt #: 217 total cpu time spent up to now is 37.3 secs Computing kpt #: 218 total cpu time spent up to now is 37.6 secs Computing kpt #: 219 total cpu time spent up to now is 37.8 secs Computing kpt #: 220 total cpu time spent up to now is 38.0 secs Computing kpt #: 221 total cpu time spent up to now is 38.2 secs Computing kpt #: 222 total cpu time spent up to now is 38.4 secs Computing kpt #: 223 total cpu time spent up to now is 38.6 secs Computing kpt #: 224 total cpu time spent up to now is 38.8 secs Computing kpt #: 225 total cpu time spent up to now is 39.1 secs Computing kpt #: 226 total cpu time spent up to now is 39.3 secs Computing kpt #: 227 total cpu time spent up to now is 39.6 secs Computing kpt #: 228 total cpu time spent up to now is 39.8 secs Computing kpt #: 229 total cpu time spent up to now is 40.1 secs Computing kpt #: 230 total cpu time spent up to now is 40.4 secs Computing kpt #: 231 total cpu time spent up to now is 40.6 secs Computing kpt #: 232 total cpu time spent up to now is 40.9 secs Computing kpt #: 233 total cpu time spent up to now is 41.1 secs Computing kpt #: 234 total cpu time spent up to now is 41.3 secs Computing kpt #: 235 total cpu time spent up to now is 41.5 secs Computing kpt #: 236 total cpu time spent up to now is 41.7 secs Computing kpt #: 237 total cpu time spent up to now is 41.9 secs Computing kpt #: 238 total cpu time spent up to now is 42.1 secs Computing kpt #: 239 total cpu time spent up to now is 42.3 secs Computing kpt #: 240 total cpu time spent up to now is 42.5 secs Computing kpt #: 241 total cpu time spent up to now is 42.7 secs Computing kpt #: 242 total cpu time spent up to now is 42.9 secs Computing kpt #: 243 total cpu time spent up to now is 43.1 secs Computing kpt #: 244 total cpu time spent up to now is 43.3 secs Computing kpt #: 245 total cpu time spent up to now is 43.5 secs Computing kpt #: 246 total cpu time spent up to now is 43.7 secs Computing kpt #: 247 total cpu time spent up to now is 43.9 secs Computing kpt #: 248 total cpu time spent up to now is 44.1 secs Computing kpt #: 249 total cpu time spent up to now is 44.2 secs Computing kpt #: 250 total cpu time spent up to now is 44.4 secs Computing kpt #: 251 total cpu time spent up to now is 44.6 secs Computing kpt #: 252 total cpu time spent up to now is 44.8 secs Computing kpt #: 253 total cpu time spent up to now is 45.0 secs Computing kpt #: 254 total cpu time spent up to now is 45.2 secs Computing kpt #: 255 total cpu time spent up to now is 45.4 secs Computing kpt #: 256 total cpu time spent up to now is 45.5 secs Computing kpt #: 257 total cpu time spent up to now is 45.7 secs Computing kpt #: 258 total cpu time spent up to now is 45.9 secs Computing kpt #: 259 total cpu time spent up to now is 46.1 secs Computing kpt #: 260 total cpu time spent up to now is 46.2 secs Computing kpt #: 261 total cpu time spent up to now is 46.4 secs Computing kpt #: 262 total cpu time spent up to now is 46.6 secs Computing kpt #: 263 total cpu time spent up to now is 46.8 secs Computing kpt #: 264 total cpu time spent up to now is 47.0 secs Computing kpt #: 265 total cpu time spent up to now is 47.2 secs Computing kpt #: 266 total cpu time spent up to now is 47.4 secs Computing kpt #: 267 total cpu time spent up to now is 47.5 secs Computing kpt #: 268 total cpu time spent up to now is 47.7 secs Computing kpt #: 269 total cpu time spent up to now is 47.9 secs Computing kpt #: 270 total cpu time spent up to now is 48.1 secs Computing kpt #: 271 total cpu time spent up to now is 48.3 secs Computing kpt #: 272 total cpu time spent up to now is 48.5 secs Computing kpt #: 273 total cpu time spent up to now is 48.7 secs Computing kpt #: 274 total cpu time spent up to now is 48.9 secs Computing kpt #: 275 total cpu time spent up to now is 49.0 secs Computing kpt #: 276 total cpu time spent up to now is 49.2 secs Computing kpt #: 277 total cpu time spent up to now is 49.4 secs Computing kpt #: 278 total cpu time spent up to now is 49.6 secs Computing kpt #: 279 total cpu time spent up to now is 49.8 secs Computing kpt #: 280 total cpu time spent up to now is 50.0 secs Computing kpt #: 281 total cpu time spent up to now is 50.2 secs Computing kpt #: 282 total cpu time spent up to now is 50.4 secs Computing kpt #: 283 total cpu time spent up to now is 50.5 secs Computing kpt #: 284 total cpu time spent up to now is 50.8 secs Computing kpt #: 285 total cpu time spent up to now is 51.0 secs Computing kpt #: 286 total cpu time spent up to now is 51.2 secs Computing kpt #: 287 total cpu time spent up to now is 51.4 secs Computing kpt #: 288 total cpu time spent up to now is 51.7 secs Computing kpt #: 289 total cpu time spent up to now is 52.0 secs Computing kpt #: 290 total cpu time spent up to now is 52.2 secs Computing kpt #: 291 total cpu time spent up to now is 52.5 secs Computing kpt #: 292 total cpu time spent up to now is 52.7 secs Computing kpt #: 293 total cpu time spent up to now is 52.8 secs Computing kpt #: 294 total cpu time spent up to now is 53.1 secs Computing kpt #: 295 total cpu time spent up to now is 53.3 secs Computing kpt #: 296 total cpu time spent up to now is 53.5 secs Computing kpt #: 297 total cpu time spent up to now is 53.6 secs Computing kpt #: 298 total cpu time spent up to now is 53.8 secs Computing kpt #: 299 total cpu time spent up to now is 54.0 secs Computing kpt #: 300 total cpu time spent up to now is 54.1 secs Computing kpt #: 301 total cpu time spent up to now is 54.3 secs Computing kpt #: 302 total cpu time spent up to now is 54.4 secs Computing kpt #: 303 total cpu time spent up to now is 54.6 secs Computing kpt #: 304 total cpu time spent up to now is 54.8 secs Computing kpt #: 305 total cpu time spent up to now is 54.9 secs Computing kpt #: 306 total cpu time spent up to now is 55.1 secs Computing kpt #: 307 total cpu time spent up to now is 55.2 secs Computing kpt #: 308 total cpu time spent up to now is 55.3 secs Computing kpt #: 309 total cpu time spent up to now is 55.5 secs Computing kpt #: 310 total cpu time spent up to now is 55.7 secs Computing kpt #: 311 total cpu time spent up to now is 56.0 secs Computing kpt #: 312 total cpu time spent up to now is 56.1 secs Computing kpt #: 313 total cpu time spent up to now is 56.3 secs Computing kpt #: 314 total cpu time spent up to now is 56.5 secs Computing kpt #: 315 total cpu time spent up to now is 56.7 secs Computing kpt #: 316 total cpu time spent up to now is 56.8 secs Computing kpt #: 317 total cpu time spent up to now is 57.0 secs Computing kpt #: 318 total cpu time spent up to now is 57.2 secs Computing kpt #: 319 total cpu time spent up to now is 57.4 secs Computing kpt #: 320 total cpu time spent up to now is 57.6 secs Computing kpt #: 321 total cpu time spent up to now is 57.8 secs Computing kpt #: 322 total cpu time spent up to now is 58.0 secs Computing kpt #: 323 total cpu time spent up to now is 58.2 secs Computing kpt #: 324 total cpu time spent up to now is 58.3 secs Computing kpt #: 325 total cpu time spent up to now is 58.5 secs Computing kpt #: 326 total cpu time spent up to now is 58.7 secs Computing kpt #: 327 total cpu time spent up to now is 58.9 secs Computing kpt #: 328 total cpu time spent up to now is 59.0 secs Computing kpt #: 329 total cpu time spent up to now is 59.2 secs Computing kpt #: 330 total cpu time spent up to now is 59.4 secs Computing kpt #: 331 total cpu time spent up to now is 59.5 secs Computing kpt #: 332 total cpu time spent up to now is 59.7 secs Computing kpt #: 333 total cpu time spent up to now is 59.9 secs Computing kpt #: 334 total cpu time spent up to now is 60.0 secs Computing kpt #: 335 total cpu time spent up to now is 60.2 secs Computing kpt #: 336 total cpu time spent up to now is 60.3 secs Computing kpt #: 337 total cpu time spent up to now is 60.5 secs Computing kpt #: 338 total cpu time spent up to now is 60.7 secs Computing kpt #: 339 total cpu time spent up to now is 60.8 secs Computing kpt #: 340 total cpu time spent up to now is 61.0 secs Computing kpt #: 341 total cpu time spent up to now is 61.2 secs Computing kpt #: 342 total cpu time spent up to now is 61.3 secs Computing kpt #: 343 total cpu time spent up to now is 61.5 secs Computing kpt #: 344 total cpu time spent up to now is 61.7 secs Computing kpt #: 345 total cpu time spent up to now is 61.8 secs Computing kpt #: 346 total cpu time spent up to now is 62.0 secs Computing kpt #: 347 total cpu time spent up to now is 62.2 secs Computing kpt #: 348 total cpu time spent up to now is 62.4 secs Computing kpt #: 349 total cpu time spent up to now is 62.6 secs Computing kpt #: 350 total cpu time spent up to now is 62.8 secs Computing kpt #: 351 total cpu time spent up to now is 63.0 secs Computing kpt #: 352 total cpu time spent up to now is 63.2 secs Computing kpt #: 353 total cpu time spent up to now is 63.4 secs Computing kpt #: 354 total cpu time spent up to now is 63.6 secs Computing kpt #: 355 total cpu time spent up to now is 63.9 secs Computing kpt #: 356 total cpu time spent up to now is 64.1 secs Computing kpt #: 357 total cpu time spent up to now is 64.3 secs Computing kpt #: 358 total cpu time spent up to now is 64.5 secs Computing kpt #: 359 total cpu time spent up to now is 64.7 secs Computing kpt #: 360 total cpu time spent up to now is 65.0 secs Computing kpt #: 361 total cpu time spent up to now is 65.2 secs Computing kpt #: 362 total cpu time spent up to now is 65.4 secs Computing kpt #: 363 total cpu time spent up to now is 65.6 secs Computing kpt #: 364 total cpu time spent up to now is 65.8 secs Computing kpt #: 365 total cpu time spent up to now is 66.0 secs Computing kpt #: 366 total cpu time spent up to now is 66.2 secs Computing kpt #: 367 total cpu time spent up to now is 66.4 secs Computing kpt #: 368 total cpu time spent up to now is 66.6 secs Computing kpt #: 369 total cpu time spent up to now is 66.7 secs Computing kpt #: 370 total cpu time spent up to now is 66.9 secs Computing kpt #: 371 total cpu time spent up to now is 67.1 secs Computing kpt #: 372 total cpu time spent up to now is 67.3 secs Computing kpt #: 373 total cpu time spent up to now is 67.4 secs Computing kpt #: 374 total cpu time spent up to now is 67.6 secs Computing kpt #: 375 total cpu time spent up to now is 67.8 secs Computing kpt #: 376 total cpu time spent up to now is 68.0 secs Computing kpt #: 377 total cpu time spent up to now is 68.2 secs Computing kpt #: 378 total cpu time spent up to now is 68.4 secs Computing kpt #: 379 total cpu time spent up to now is 68.6 secs Computing kpt #: 380 total cpu time spent up to now is 68.8 secs Computing kpt #: 381 total cpu time spent up to now is 69.0 secs Computing kpt #: 382 total cpu time spent up to now is 69.2 secs Computing kpt #: 383 total cpu time spent up to now is 69.3 secs Computing kpt #: 384 total cpu time spent up to now is 69.6 secs Computing kpt #: 385 total cpu time spent up to now is 69.8 secs Computing kpt #: 386 total cpu time spent up to now is 70.0 secs Computing kpt #: 387 total cpu time spent up to now is 70.2 secs Computing kpt #: 388 total cpu time spent up to now is 70.4 secs Computing kpt #: 389 total cpu time spent up to now is 70.6 secs Computing kpt #: 390 total cpu time spent up to now is 70.8 secs Computing kpt #: 391 total cpu time spent up to now is 71.1 secs Computing kpt #: 392 total cpu time spent up to now is 71.3 secs Computing kpt #: 393 total cpu time spent up to now is 71.5 secs Computing kpt #: 394 total cpu time spent up to now is 71.7 secs Computing kpt #: 395 total cpu time spent up to now is 71.9 secs Computing kpt #: 396 total cpu time spent up to now is 72.2 secs Computing kpt #: 397 total cpu time spent up to now is 72.3 secs Computing kpt #: 398 total cpu time spent up to now is 72.5 secs Computing kpt #: 399 total cpu time spent up to now is 72.7 secs Computing kpt #: 400 total cpu time spent up to now is 72.9 secs Computing kpt #: 401 total cpu time spent up to now is 73.1 secs Computing kpt #: 402 total cpu time spent up to now is 73.3 secs Computing kpt #: 403 total cpu time spent up to now is 73.5 secs Computing kpt #: 404 total cpu time spent up to now is 73.7 secs Computing kpt #: 405 total cpu time spent up to now is 73.8 secs Computing kpt #: 406 total cpu time spent up to now is 74.0 secs Computing kpt #: 407 total cpu time spent up to now is 74.2 secs Computing kpt #: 408 total cpu time spent up to now is 74.4 secs Computing kpt #: 409 total cpu time spent up to now is 74.6 secs Computing kpt #: 410 total cpu time spent up to now is 74.7 secs Computing kpt #: 411 total cpu time spent up to now is 74.9 secs Computing kpt #: 412 total cpu time spent up to now is 75.1 secs Computing kpt #: 413 total cpu time spent up to now is 75.3 secs Computing kpt #: 414 total cpu time spent up to now is 75.5 secs Computing kpt #: 415 total cpu time spent up to now is 75.6 secs Computing kpt #: 416 total cpu time spent up to now is 75.8 secs Computing kpt #: 417 total cpu time spent up to now is 76.0 secs Computing kpt #: 418 total cpu time spent up to now is 76.2 secs Computing kpt #: 419 total cpu time spent up to now is 76.3 secs Computing kpt #: 420 total cpu time spent up to now is 76.5 secs Computing kpt #: 421 total cpu time spent up to now is 76.7 secs Computing kpt #: 422 total cpu time spent up to now is 76.9 secs Computing kpt #: 423 total cpu time spent up to now is 77.0 secs Computing kpt #: 424 total cpu time spent up to now is 77.2 secs Computing kpt #: 425 total cpu time spent up to now is 77.4 secs Computing kpt #: 426 total cpu time spent up to now is 77.6 secs Computing kpt #: 427 total cpu time spent up to now is 77.7 secs Computing kpt #: 428 total cpu time spent up to now is 77.9 secs Computing kpt #: 429 total cpu time spent up to now is 78.1 secs Computing kpt #: 430 total cpu time spent up to now is 78.2 secs Computing kpt #: 431 total cpu time spent up to now is 78.4 secs ethr = 6.25E-08, avg # of iterations = 16.9 total cpu time spent up to now is 78.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4811 PWs) bands (ev): -37.7606 -37.7606 -37.6538 -37.6538 1.2974 1.2974 3.4181 3.4181 4.0892 4.0892 4.9608 4.9608 7.0244 7.0244 7.6107 7.6107 11.2430 11.2430 12.1981 12.1981 14.1218 14.1218 14.6095 14.6095 k = 0.0114 0.0066-0.0000 ( 4803 PWs) bands (ev): -37.7605 -37.7605 -37.6538 -37.6538 1.2982 1.2982 3.4186 3.4186 4.0896 4.0896 4.9612 4.9612 7.0243 7.0243 7.6106 7.6106 11.2337 11.2337 12.1863 12.1863 14.1302 14.1302 14.6196 14.6196 k = 0.0227 0.0131-0.0000 ( 4809 PWs) bands (ev): -37.7605 -37.7605 -37.6539 -37.6539 1.3006 1.3006 3.4199 3.4199 4.0908 4.0908 4.9626 4.9626 7.0240 7.0240 7.6102 7.6102 11.2061 11.2061 12.1518 12.1518 14.1549 14.1549 14.6492 14.6492 k = 0.0341 0.0197-0.0000 ( 4809 PWs) bands (ev): -37.7603 -37.7603 -37.6541 -37.6541 1.3046 1.3046 3.4221 3.4221 4.0927 4.0927 4.9649 4.9649 7.0235 7.0235 7.6097 7.6097 11.1610 11.1610 12.0966 12.0966 14.1948 14.1948 14.6964 14.6964 k = 0.0455 0.0262-0.0000 ( 4809 PWs) bands (ev): -37.7601 -37.7601 -37.6543 -37.6543 1.3102 1.3102 3.4253 3.4253 4.0954 4.0954 4.9682 4.9682 7.0228 7.0228 7.6089 7.6089 11.0998 11.0998 12.0236 12.0236 14.2482 14.2482 14.7584 14.7584 k = 0.0568 0.0328-0.0000 ( 4809 PWs) bands (ev): -37.7598 -37.7598 -37.6545 -37.6545 1.3173 1.3173 3.4293 3.4293 4.0989 4.0989 4.9724 4.9724 7.0219 7.0219 7.6078 7.6078 11.0241 11.0241 11.9359 11.9359 14.3131 14.3131 14.8325 14.8325 k = 0.0682 0.0394-0.0000 ( 4808 PWs) bands (ev): -37.7595 -37.7595 -37.6549 -37.6549 1.3260 1.3260 3.4343 3.4343 4.1031 4.1031 4.9776 4.9776 7.0208 7.0208 7.6066 7.6066 10.9354 10.9354 11.8368 11.8368 14.3870 14.3870 14.9159 14.9159 k = 0.0795 0.0459-0.0000 ( 4802 PWs) bands (ev): -37.7591 -37.7591 -37.6553 -37.6553 1.3361 1.3361 3.4401 3.4401 4.1080 4.1080 4.9839 4.9839 7.0195 7.0195 7.6052 7.6052 10.8355 10.8355 11.7288 11.7288 14.4677 14.4677 15.0064 15.0064 k = 0.0909 0.0525-0.0000 ( 4808 PWs) bands (ev): -37.7586 -37.7586 -37.6557 -37.6557 1.3477 1.3477 3.4470 3.4470 4.1136 4.1136 4.9912 4.9912 7.0181 7.0181 7.6035 7.6035 10.7258 10.7258 11.6145 11.6145 14.5527 14.5527 15.1025 15.1025 k = 0.1023 0.0590-0.0000 ( 4808 PWs) bands (ev): -37.7581 -37.7581 -37.6562 -37.6562 1.3606 1.3606 3.4548 3.4548 4.1199 4.1199 4.9997 4.9997 7.0164 7.0164 7.6017 7.6017 10.6077 10.6077 11.4956 11.4956 14.6396 14.6396 15.2035 15.2035 k = 0.1136 0.0656-0.0000 ( 4806 PWs) bands (ev): -37.7575 -37.7575 -37.6568 -37.6568 1.3749 1.3749 3.4635 3.4635 4.1269 4.1269 5.0093 5.0093 7.0146 7.0146 7.5997 7.5997 10.4825 10.4825 11.3738 11.3738 14.7260 14.7260 15.3091 15.3091 k = 0.1250 0.0722-0.0000 ( 4802 PWs) bands (ev): -37.7569 -37.7569 -37.6574 -37.6574 1.3904 1.3904 3.4732 3.4732 4.1345 4.1345 5.0200 5.0200 7.0126 7.0126 7.5975 7.5975 10.3512 10.3512 11.2503 11.2503 14.8097 14.8097 15.4195 15.4195 k = 0.1364 0.0787-0.0000 ( 4804 PWs) bands (ev): -37.7562 -37.7562 -37.6580 -37.6580 1.4071 1.4071 3.4840 3.4840 4.1428 4.1428 5.0321 5.0321 7.0104 7.0104 7.5952 7.5952 10.2149 10.2149 11.1259 11.1259 14.8889 14.8889 15.5351 15.5351 k = 0.1477 0.0853-0.0000 ( 4804 PWs) bands (ev): -37.7555 -37.7555 -37.6587 -37.6587 1.4250 1.4250 3.4957 3.4957 4.1516 4.1516 5.0454 5.0454 7.0080 7.0080 7.5927 7.5927 10.0743 10.0743 11.0014 11.0014 14.9623 14.9623 15.6564 15.6564 k = 0.1591 0.0919-0.0000 ( 4804 PWs) bands (ev): -37.7547 -37.7547 -37.6595 -37.6595 1.4438 1.4438 3.5084 3.5084 4.1612 4.1612 5.0600 5.0600 7.0055 7.0055 7.5901 7.5901 9.9304 9.9304 10.8774 10.8774 15.0291 15.0291 15.7835 15.7835 k = 0.1705 0.0984-0.0000 ( 4800 PWs) bands (ev): -37.7539 -37.7539 -37.6603 -37.6603 1.4635 1.4635 3.5221 3.5221 4.1714 4.1714 5.0760 5.0760 7.0028 7.0028 7.5873 7.5873 9.7838 9.7838 10.7542 10.7542 15.0890 15.0890 15.9164 15.9164 k = 0.1818 0.1050-0.0000 ( 4804 PWs) bands (ev): -37.7530 -37.7530 -37.6612 -37.6612 1.4840 1.4840 3.5368 3.5368 4.1823 4.1823 5.0933 5.0933 6.9999 6.9999 7.5844 7.5844 9.6351 9.6351 10.6323 10.6323 15.1422 15.1422 16.0548 16.0548 k = 0.1932 0.1115-0.0000 ( 4800 PWs) bands (ev): -37.7520 -37.7520 -37.6621 -37.6621 1.5052 1.5052 3.5524 3.5524 4.1940 4.1940 5.1121 5.1121 6.9968 6.9968 7.5814 7.5814 9.4850 9.4850 10.5118 10.5118 15.1891 15.1891 16.1983 16.1983 k = 0.2045 0.1181-0.0000 ( 4806 PWs) bands (ev): -37.7511 -37.7511 -37.6631 -37.6631 1.5270 1.5270 3.5689 3.5689 4.2066 4.2066 5.1322 5.1322 6.9936 6.9936 7.5782 7.5782 9.3340 9.3340 10.3930 10.3930 15.2303 15.2303 16.3464 16.3464 k = 0.2159 0.1247-0.0000 ( 4794 PWs) bands (ev): -37.7500 -37.7500 -37.6641 -37.6641 1.5493 1.5493 3.5863 3.5863 4.2201 4.2201 5.1537 5.1537 6.9901 6.9901 7.5749 7.5749 9.1826 9.1826 10.2760 10.2760 15.2665 15.2665 16.4985 16.4985 k = 0.2273 0.1312-0.0000 ( 4798 PWs) bands (ev): -37.7490 -37.7490 -37.6651 -37.6651 1.5719 1.5719 3.6045 3.6045 4.2347 4.2347 5.1766 5.1766 6.9864 6.9864 7.5715 7.5715 9.0313 9.0313 10.1610 10.1610 15.2982 15.2982 16.6543 16.6543 k = 0.2386 0.1378-0.0000 ( 4804 PWs) bands (ev): -37.7478 -37.7478 -37.6662 -37.6662 1.5947 1.5947 3.6233 3.6233 4.2505 4.2505 5.2008 5.2008 6.9825 6.9825 7.5678 7.5678 8.8806 8.8806 10.0481 10.0481 15.3261 15.3261 16.8134 16.8134 k = 0.2500 0.1443-0.0000 ( 4810 PWs) bands (ev): -37.7467 -37.7467 -37.6674 -37.6674 1.6176 1.6176 3.6427 3.6427 4.2678 4.2678 5.2263 5.2263 6.9783 6.9783 7.5639 7.5639 8.7309 8.7309 9.9375 9.9375 15.3506 15.3506 16.9753 16.9753 k = 0.2614 0.1509-0.0000 ( 4808 PWs) bands (ev): -37.7455 -37.7455 -37.6685 -37.6685 1.6405 1.6405 3.6624 3.6624 4.2867 4.2867 5.2531 5.2531 6.9738 6.9738 7.5595 7.5595 8.5828 8.5828 9.8293 9.8293 15.3722 15.3722 17.1396 17.1396 k = 0.2727 0.1575-0.0000 ( 4808 PWs) bands (ev): -37.7443 -37.7443 -37.6697 -37.6697 1.6631 1.6631 3.6824 3.6824 4.3075 4.3075 5.2809 5.2809 6.9688 6.9688 7.5546 7.5546 8.4368 8.4368 9.7236 9.7236 15.3913 15.3913 17.3062 17.3062 k = 0.2841 0.1640-0.0000 ( 4810 PWs) bands (ev): -37.7431 -37.7431 -37.6709 -37.6709 1.6855 1.6855 3.7023 3.7023 4.3305 4.3305 5.3099 5.3099 6.9633 6.9633 7.5488 7.5488 8.2937 8.2937 9.6205 9.6205 15.4082 15.4082 17.4747 17.4747 k = 0.2955 0.1706-0.0000 ( 4810 PWs) bands (ev): -37.7419 -37.7419 -37.6721 -37.6721 1.7074 1.7074 3.7220 3.7220 4.3559 4.3559 5.3397 5.3397 6.9570 6.9570 7.5415 7.5415 8.1546 8.1546 9.5203 9.5203 15.4232 15.4232 17.6449 17.6449 k = 0.3068 0.1771-0.0000 ( 4806 PWs) bands (ev): -37.7406 -37.7406 -37.6733 -37.6733 1.7288 1.7288 3.7413 3.7413 4.3840 4.3840 5.3704 5.3704 6.9497 6.9497 7.5315 7.5315 8.0211 8.0211 9.4230 9.4230 15.4365 15.4365 17.8163 17.8163 k = 0.3182 0.1837-0.0000 ( 4812 PWs) bands (ev): -37.7393 -37.7393 -37.6746 -37.6746 1.7495 1.7495 3.7599 3.7599 4.4149 4.4149 5.4018 5.4018 6.9410 6.9410 7.5162 7.5162 7.8966 7.8966 9.3289 9.3289 15.4484 15.4484 17.9888 17.9888 k = 0.3295 0.1903-0.0000 ( 4812 PWs) bands (ev): -37.7380 -37.7380 -37.6759 -37.6759 1.7694 1.7694 3.7776 3.7776 4.4490 4.4490 5.4336 5.4336 6.9301 6.9301 7.4904 7.4904 7.7873 7.7873 9.2381 9.2381 15.4590 15.4590 18.1621 18.1621 k = 0.3409 0.1968-0.0000 ( 4808 PWs) bands (ev): -37.7367 -37.7367 -37.6771 -37.6771 1.7885 1.7885 3.7942 3.7942 4.4863 4.4863 5.4658 5.4658 6.9159 6.9159 7.4452 7.4452 7.7035 7.7035 9.1509 9.1509 15.4685 15.4685 18.3357 18.3357 k = 0.3523 0.2034-0.0000 ( 4808 PWs) bands (ev): -37.7355 -37.7355 -37.6784 -37.6784 1.8066 1.8066 3.8097 3.8097 4.5268 4.5268 5.4982 5.4982 6.8963 6.8963 7.3767 7.3767 7.6513 7.6513 9.0676 9.0676 15.4769 15.4769 18.5092 18.5092 k = 0.3636 0.2099-0.0000 ( 4806 PWs) bands (ev): -37.7342 -37.7342 -37.6797 -37.6797 1.8236 1.8236 3.8238 3.8238 4.5706 4.5706 5.5306 5.5306 6.8682 6.8682 7.2960 7.2960 7.6230 7.6230 8.9883 8.9883 15.4844 15.4844 18.6822 18.6822 k = 0.3750 0.2165-0.0000 ( 4806 PWs) bands (ev): -37.7329 -37.7329 -37.6809 -37.6809 1.8395 1.8395 3.8367 3.8367 4.6175 4.6175 5.5627 5.5627 6.8274 6.8274 7.2188 7.2188 7.6075 7.6075 8.9134 8.9134 15.4911 15.4911 18.8540 18.8540 k = 0.3864 0.2231-0.0000 ( 4802 PWs) bands (ev): -37.7317 -37.7317 -37.6821 -37.6821 1.8542 1.8542 3.8482 3.8482 4.6671 4.6671 5.5946 5.5946 6.7699 6.7699 7.1557 7.1557 7.5984 7.5984 8.8432 8.8432 15.4970 15.4970 19.0238 19.0238 k = 0.3977 0.2296-0.0000 ( 4808 PWs) bands (ev): -37.7305 -37.7305 -37.6833 -37.6833 1.8677 1.8677 3.8583 3.8583 4.7191 4.7191 5.6260 5.6260 6.6958 6.6958 7.1100 7.1100 7.5928 7.5928 8.7779 8.7779 15.5023 15.5023 19.1908 19.1908 k = 0.4091 0.2362-0.0000 ( 4816 PWs) bands (ev): -37.7294 -37.7294 -37.6844 -37.6844 1.8798 1.8798 3.8672 3.8672 4.7728 4.7728 5.6569 5.6569 6.6096 6.6096 7.0790 7.0790 7.5892 7.5892 8.7181 8.7181 15.5068 15.5068 19.3535 19.3535 k = 0.4205 0.2427-0.0000 ( 4812 PWs) bands (ev): -37.7284 -37.7284 -37.6854 -37.6854 1.8906 1.8906 3.8748 3.8748 4.8274 4.8274 5.6873 5.6873 6.5168 6.5168 7.0582 7.0582 7.5869 7.5869 8.6640 8.6640 15.5108 15.5108 19.5104 19.5104 k = 0.4318 0.2493-0.0000 ( 4808 PWs) bands (ev): -37.7274 -37.7274 -37.6864 -37.6864 1.9001 1.9001 3.8812 3.8812 4.8818 4.8818 5.7176 5.7176 6.4221 6.4221 7.0441 7.0441 7.5855 7.5855 8.6160 8.6160 15.5142 15.5142 19.6594 19.6594 k = 0.4432 0.2559-0.0000 ( 4808 PWs) bands (ev): -37.7265 -37.7265 -37.6872 -37.6872 1.9081 1.9081 3.8866 3.8866 4.9343 4.9343 5.7483 5.7483 6.3288 6.3288 7.0342 7.0342 7.5847 7.5847 8.5746 8.5746 15.5170 15.5170 19.7975 19.7975 k = 0.4545 0.2624-0.0000 ( 4808 PWs) bands (ev): -37.7258 -37.7258 -37.6880 -37.6880 1.9147 1.9147 3.8908 3.8908 4.9831 4.9831 5.7800 5.7800 6.2392 6.2392 7.0273 7.0273 7.5843 7.5843 8.5400 8.5400 15.5193 15.5193 19.9213 19.9213 k = 0.4659 0.2690-0.0000 ( 4810 PWs) bands (ev): -37.7252 -37.7252 -37.6886 -37.6886 1.9198 1.9198 3.8941 3.8941 5.0257 5.0257 5.8142 5.8142 6.1551 6.1551 7.0225 7.0225 7.5842 7.5842 8.5128 8.5128 15.5210 15.5210 20.0262 20.0262 k = 0.4773 0.2756-0.0000 ( 4804 PWs) bands (ev): -37.7247 -37.7247 -37.6890 -37.6890 1.9235 1.9235 3.8964 3.8964 5.0591 5.0591 5.8523 5.8523 6.0781 6.0781 7.0194 7.0194 7.5842 7.5842 8.4930 8.4930 15.5223 15.5223 20.1069 20.1069 k = 0.4886 0.2821-0.0000 ( 4808 PWs) bands (ev): -37.7245 -37.7245 -37.6893 -37.6893 1.9257 1.9257 3.8978 3.8978 5.0807 5.0807 5.8958 5.8958 6.0097 6.0097 7.0176 7.0176 7.5842 7.5842 8.4811 8.4811 15.5230 15.5230 20.1581 20.1581 k = 0.5000 0.2887-0.0000 ( 4806 PWs) bands (ev): -37.7244 -37.7244 -37.6894 -37.6894 1.9264 1.9264 3.8982 3.8982 5.0881 5.0881 5.9375 5.9375 5.9595 5.9595 7.0170 7.0170 7.5843 7.5843 8.4771 8.4771 15.5233 15.5233 20.1758 20.1758 k = 0.5000 0.2887-0.0000 ( 4806 PWs) bands (ev): -37.7244 -37.7244 -37.6894 -37.6894 1.9264 1.9264 3.8982 3.8982 5.0881 5.0881 5.9375 5.9375 5.9595 5.9595 7.0170 7.0170 7.5843 7.5843 8.4771 8.4771 15.5233 15.5233 20.1758 20.1758 k = 0.4936 0.2998-0.0000 ( 4806 PWs) bands (ev): -37.7244 -37.7244 -37.6894 -37.6894 1.9268 1.9268 3.8993 3.8993 5.0868 5.0868 5.9135 5.9135 5.9844 5.9844 7.0170 7.0170 7.5841 7.5841 8.4751 8.4751 15.5258 15.5258 20.1587 20.1587 k = 0.4872 0.3109-0.0000 ( 4802 PWs) bands (ev): -37.7243 -37.7243 -37.6895 -37.6895 1.9280 1.9280 3.9024 3.9024 5.0830 5.0830 5.8819 5.8819 6.0187 6.0187 7.0168 7.0168 7.5835 7.5835 8.4690 8.4690 15.5332 15.5332 20.1105 20.1105 k = 0.4808 0.3220-0.0000 ( 4796 PWs) bands (ev): -37.7241 -37.7241 -37.6896 -37.6896 1.9298 1.9298 3.9077 3.9077 5.0766 5.0766 5.8503 5.8503 6.0547 6.0547 7.0165 7.0165 7.5826 7.5826 8.4589 8.4589 15.5456 15.5456 20.0383 20.0383 k = 0.4744 0.3331-0.0000 ( 4796 PWs) bands (ev): -37.7239 -37.7239 -37.6898 -37.6898 1.9325 1.9325 3.9150 3.9150 5.0678 5.0678 5.8189 5.8189 6.0920 6.0920 7.0161 7.0161 7.5813 7.5813 8.4448 8.4448 15.5628 15.5628 19.9502 19.9502 k = 0.4679 0.3442-0.0000 ( 4800 PWs) bands (ev): -37.7237 -37.7237 -37.6901 -37.6901 1.9357 1.9357 3.9245 3.9245 5.0569 5.0569 5.7877 5.7877 6.1308 6.1308 7.0155 7.0155 7.5796 7.5796 8.4268 8.4268 15.5846 15.5846 19.8528 19.8528 k = 0.4615 0.3553-0.0000 ( 4800 PWs) bands (ev): -37.7234 -37.7234 -37.6904 -37.6904 1.9397 1.9397 3.9362 3.9362 5.0439 5.0439 5.7565 5.7565 6.1709 6.1709 7.0149 7.0149 7.5776 7.5776 8.4050 8.4050 15.6108 15.6108 19.7511 19.7511 k = 0.4551 0.3664-0.0000 ( 4804 PWs) bands (ev): -37.7230 -37.7230 -37.6907 -37.6907 1.9442 1.9442 3.9500 3.9500 5.0291 5.0291 5.7252 5.7252 6.2123 6.2123 7.0142 7.0142 7.5751 7.5751 8.3795 8.3795 15.6412 15.6412 19.6486 19.6486 k = 0.4487 0.3775-0.0000 ( 4804 PWs) bands (ev): -37.7226 -37.7226 -37.6911 -37.6911 1.9492 1.9492 3.9660 3.9660 5.0128 5.0128 5.6935 5.6935 6.2551 6.2551 7.0134 7.0134 7.5723 7.5723 8.3504 8.3504 15.6754 15.6754 19.5476 19.5476 k = 0.4423 0.3886-0.0000 ( 4800 PWs) bands (ev): -37.7221 -37.7221 -37.6916 -37.6916 1.9547 1.9547 3.9842 3.9842 4.9951 4.9951 5.6615 5.6615 6.2993 6.2993 7.0126 7.0126 7.5691 7.5691 8.3179 8.3179 15.7131 15.7131 19.4501 19.4501 k = 0.4359 0.3997-0.0000 ( 4796 PWs) bands (ev): -37.7216 -37.7216 -37.6921 -37.6921 1.9606 1.9606 4.0046 4.0046 4.9763 4.9763 5.6290 5.6290 6.3449 6.3449 7.0117 7.0117 7.5654 7.5654 8.2822 8.2822 15.7539 15.7539 19.3572 19.3572 k = 0.4295 0.4108-0.0000 ( 4796 PWs) bands (ev): -37.7210 -37.7210 -37.6927 -37.6927 1.9668 1.9668 4.0272 4.0272 4.9566 4.9566 5.5959 5.5959 6.3917 6.3917 7.0107 7.0107 7.5612 7.5612 8.2436 8.2436 15.7971 15.7971 19.2702 19.2702 k = 0.4231 0.4219-0.0000 ( 4800 PWs) bands (ev): -37.7204 -37.7204 -37.6933 -37.6933 1.9732 1.9732 4.0519 4.0519 4.9362 4.9362 5.5623 5.5623 6.4398 6.4398 7.0097 7.0097 7.5565 7.5565 8.2022 8.2022 15.8423 15.8423 19.1900 19.1900 k = 0.4167 0.4330-0.0000 ( 4800 PWs) bands (ev): -37.7197 -37.7197 -37.6940 -37.6940 1.9797 1.9797 4.0789 4.0789 4.9154 4.9154 5.5281 5.5281 6.4892 6.4892 7.0088 7.0088 7.5510 7.5510 8.1584 8.1584 15.8889 15.8889 19.1174 19.1174 k = 0.4103 0.4441-0.0000 ( 4810 PWs) bands (ev): -37.7190 -37.7190 -37.6947 -37.6947 1.9862 1.9862 4.1078 4.1078 4.8943 4.8943 5.4934 5.4934 6.5397 6.5397 7.0078 7.0078 7.5448 7.5448 8.1126 8.1126 15.9360 15.9360 19.0532 19.0532 k = 0.4038 0.4552-0.0000 ( 4816 PWs) bands (ev): -37.7182 -37.7182 -37.6955 -37.6955 1.9927 1.9927 4.1388 4.1388 4.8731 4.8731 5.4583 5.4583 6.5914 6.5914 7.0068 7.0068 7.5374 7.5374 8.0654 8.0654 15.9829 15.9829 18.9983 18.9983 k = 0.3974 0.4663-0.0000 ( 4820 PWs) bands (ev): -37.7174 -37.7174 -37.6963 -37.6963 1.9991 1.9991 4.1716 4.1716 4.8521 4.8521 5.4228 5.4228 6.6442 6.6442 7.0059 7.0059 7.5286 7.5286 8.0173 8.0173 16.0289 16.0289 18.9535 18.9535 k = 0.3910 0.4774-0.0000 ( 4816 PWs) bands (ev): -37.7165 -37.7165 -37.6972 -37.6972 2.0052 2.0052 4.2059 4.2059 4.8315 4.8315 5.3871 5.3871 6.6980 6.6980 7.0050 7.0050 7.5178 7.5178 7.9690 7.9690 16.0730 16.0730 18.9195 18.9195 k = 0.3846 0.4885-0.0000 ( 4809 PWs) bands (ev): -37.7156 -37.7156 -37.6981 -37.6981 2.0110 2.0110 4.2414 4.2414 4.8116 4.8116 5.3516 5.3516 6.7527 6.7527 7.0042 7.0042 7.5045 7.5045 7.9217 7.9217 16.1144 16.1144 18.8971 18.8971 k = 0.3782 0.4996-0.0000 ( 4809 PWs) bands (ev): -37.7146 -37.7146 -37.6991 -37.6991 2.0163 2.0163 4.2775 4.2775 4.7927 4.7927 5.3164 5.3164 6.8083 6.8083 7.0034 7.0034 7.4877 7.4877 7.8765 7.8765 16.1522 16.1522 18.8868 18.8868 k = 0.3718 0.5107-0.0000 ( 4809 PWs) bands (ev): -37.7136 -37.7136 -37.7001 -37.7001 2.0212 2.0212 4.3135 4.3135 4.7754 4.7754 5.2821 5.2821 6.8645 6.8645 7.0028 7.0028 7.4664 7.4664 7.8349 7.8349 16.1859 16.1859 18.8892 18.8892 k = 0.3654 0.5218-0.0000 ( 4803 PWs) bands (ev): -37.7126 -37.7126 -37.7011 -37.7011 2.0255 2.0255 4.3483 4.3483 4.7603 4.7603 5.2491 5.2491 6.9211 6.9211 7.0025 7.0025 7.4395 7.4395 7.7984 7.7984 16.2147 16.2147 18.9047 18.9047 k = 0.3590 0.5329-0.0000 ( 4805 PWs) bands (ev): -37.7115 -37.7115 -37.7022 -37.7022 2.0291 2.0291 4.3803 4.3803 4.7480 4.7480 5.2184 5.2184 6.9768 6.9768 7.0035 7.0035 7.4064 7.4064 7.7682 7.7682 16.2383 16.2383 18.9333 18.9333 k = 0.3526 0.5440-0.0000 ( 4809 PWs) bands (ev): -37.7104 -37.7104 -37.7033 -37.7033 2.0320 2.0320 4.4078 4.4078 4.7395 4.7395 5.1910 5.1910 6.9995 6.9995 7.0373 7.0373 7.3673 7.3673 7.7450 7.7450 16.2564 16.2564 18.9749 18.9749 k = 0.3462 0.5551-0.0000 ( 4813 PWs) bands (ev): -37.7092 -37.7092 -37.7044 -37.7044 2.0342 2.0342 4.4286 4.4286 4.7351 4.7351 5.1685 5.1685 7.0001 7.0001 7.0923 7.0923 7.3233 7.3233 7.7287 7.7287 16.2690 16.2690 19.0286 19.0286 k = 0.3397 0.5662-0.0000 ( 4819 PWs) bands (ev): -37.7081 -37.7081 -37.7056 -37.7056 2.0355 2.0355 4.4412 4.4412 4.7343 4.7343 5.1532 5.1532 7.0002 7.0002 7.1438 7.1438 7.2782 7.2782 7.7191 7.7191 16.2764 16.2764 19.0916 19.0916 k = 0.3333 0.5774-0.0000 ( 4821 PWs) bands (ev): -37.7069 -37.7069 -37.7068 -37.7068 2.0360 2.0360 4.4453 4.4453 4.7347 4.7347 5.1476 5.1476 7.0002 7.0002 7.1734 7.1734 7.2506 7.2506 7.7159 7.7159 16.2787 16.2787 19.1378 19.1378 k = 0.3333 0.5774-0.0000 ( 4821 PWs) bands (ev): -37.7069 -37.7069 -37.7068 -37.7068 2.0360 2.0360 4.4453 4.4453 4.7347 4.7347 5.1476 5.1476 7.0002 7.0002 7.1734 7.1734 7.2506 7.2506 7.7159 7.7159 16.2787 16.2787 19.1378 19.1378 k = 0.3268 0.5660-0.0000 ( 4819 PWs) bands (ev): -37.7081 -37.7081 -37.7056 -37.7056 2.0355 2.0355 4.4415 4.4415 4.7331 4.7331 5.1541 5.1541 7.0001 7.0001 7.1431 7.1431 7.2789 7.2789 7.7194 7.7194 16.2765 16.2765 19.0846 19.0846 k = 0.3203 0.5547-0.0000 ( 4815 PWs) bands (ev): -37.7094 -37.7094 -37.7043 -37.7043 2.0340 2.0340 4.4313 4.4313 4.7265 4.7265 5.1742 5.1742 6.9994 6.9994 7.0916 7.0916 7.3248 7.3248 7.7301 7.7301 16.2700 16.2700 19.0010 19.0010 k = 0.3137 0.5434-0.0000 ( 4803 PWs) bands (ev): -37.7107 -37.7107 -37.7029 -37.7029 2.0315 2.0315 4.4161 4.4161 4.7138 4.7138 5.2071 5.2071 6.9948 6.9948 7.0411 7.0411 7.3689 7.3689 7.7492 7.7492 16.2598 16.2598 18.9132 18.9132 k = 0.3072 0.5321-0.0000 ( 4807 PWs) bands (ev): -37.7121 -37.7121 -37.7016 -37.7016 2.0279 2.0279 4.3972 4.3972 4.6959 4.6959 5.2503 5.2503 6.9662 6.9662 7.0153 7.0153 7.4075 7.4075 7.7777 7.7777 16.2466 16.2466 18.8240 18.8240 k = 0.3007 0.5207-0.0000 ( 4809 PWs) bands (ev): -37.7134 -37.7134 -37.7002 -37.7002 2.0233 2.0233 4.3754 4.3754 4.6742 4.6742 5.3010 5.3010 6.9171 6.9171 7.0124 7.0124 7.4391 7.4391 7.8162 7.8162 16.2308 16.2308 18.7339 18.7339 k = 0.2941 0.5094-0.0000 ( 4809 PWs) bands (ev): -37.7148 -37.7148 -37.6989 -37.6989 2.0175 2.0175 4.3512 4.3512 4.6502 4.6502 5.3563 5.3563 6.8677 6.8677 7.0137 7.0137 7.4638 7.4638 7.8641 7.8641 16.2128 16.2128 18.6432 18.6432 k = 0.2876 0.4981-0.0000 ( 4809 PWs) bands (ev): -37.7162 -37.7162 -37.6975 -37.6975 2.0107 2.0107 4.3249 4.3249 4.6251 4.6251 5.4137 5.4137 6.8223 6.8223 7.0165 7.0165 7.4825 7.4825 7.9204 7.9204 16.1932 16.1932 18.5521 18.5521 k = 0.2810 0.4868-0.0000 ( 4813 PWs) bands (ev): -37.7177 -37.7177 -37.6960 -37.6960 2.0027 2.0027 4.2968 4.2968 4.5997 4.5997 5.4704 5.4704 6.7829 6.7829 7.0205 7.0205 7.4967 7.4967 7.9834 7.9834 16.1722 16.1722 18.4606 18.4606 k = 0.2745 0.4755-0.0000 ( 4815 PWs) bands (ev): -37.7191 -37.7191 -37.6946 -37.6946 1.9936 1.9936 4.2671 4.2671 4.5747 4.5747 5.5240 5.5240 6.7516 6.7516 7.0259 7.0259 7.5076 7.5076 8.0518 8.0518 16.1501 16.1501 18.3688 18.3688 k = 0.2680 0.4641-0.0000 ( 4807 PWs) bands (ev): -37.7205 -37.7205 -37.6932 -37.6932 1.9834 1.9834 4.2361 4.2361 4.5504 4.5504 5.5718 5.5718 6.7301 6.7301 7.0329 7.0329 7.5162 7.5162 8.1245 8.1245 16.1273 16.1273 18.2767 18.2767 k = 0.2614 0.4528-0.0000 ( 4809 PWs) bands (ev): -37.7220 -37.7220 -37.6917 -37.6917 1.9720 1.9720 4.2039 4.2039 4.5271 4.5271 5.6112 5.6112 6.7204 6.7204 7.0423 7.0423 7.5233 7.5233 8.2008 8.2008 16.1038 16.1038 18.1844 18.1844 k = 0.2549 0.4415-0.0000 ( 4809 PWs) bands (ev): -37.7234 -37.7234 -37.6903 -37.6903 1.9596 1.9596 4.1708 4.1708 4.5049 4.5049 5.6402 5.6402 6.7233 6.7233 7.0547 7.0547 7.5294 7.5294 8.2800 8.2800 16.0799 16.0799 18.0919 18.0919 k = 0.2484 0.4302-0.0000 ( 4805 PWs) bands (ev): -37.7249 -37.7249 -37.6888 -37.6888 1.9460 1.9460 4.1371 4.1371 4.4838 4.4838 5.6574 5.6574 6.7385 6.7385 7.0718 7.0718 7.5350 7.5350 8.3619 8.3619 16.0556 16.0556 17.9993 17.9993 k = 0.2418 0.4189-0.0000 ( 4801 PWs) bands (ev): -37.7264 -37.7264 -37.6874 -37.6874 1.9314 1.9314 4.1029 4.1029 4.4638 4.4638 5.6628 5.6628 6.7640 6.7640 7.0955 7.0955 7.5404 7.5404 8.4462 8.4462 16.0310 16.0310 17.9065 17.9065 k = 0.2353 0.4075-0.0000 ( 4803 PWs) bands (ev): -37.7278 -37.7278 -37.6859 -37.6859 1.9158 1.9158 4.0685 4.0685 4.4448 4.4448 5.6573 5.6573 6.7956 6.7956 7.1285 7.1285 7.5460 7.5460 8.5326 8.5326 16.0061 16.0061 17.8135 17.8135 k = 0.2288 0.3962-0.0000 ( 4807 PWs) bands (ev): -37.7293 -37.7293 -37.6845 -37.6845 1.8992 1.8992 4.0342 4.0342 4.4267 4.4267 5.6427 5.6427 6.8283 6.8283 7.1737 7.1737 7.5522 7.5522 8.6211 8.6211 15.9810 15.9810 17.7203 17.7203 k = 0.2222 0.3849-0.0000 ( 4801 PWs) bands (ev): -37.7307 -37.7307 -37.6831 -37.6831 1.8816 1.8816 4.0000 4.0000 4.4094 4.4094 5.6210 5.6210 6.8581 6.8581 7.2327 7.2327 7.5600 7.5600 8.7115 8.7115 15.9556 15.9556 17.6270 17.6270 k = 0.2157 0.3736-0.0000 ( 4797 PWs) bands (ev): -37.7322 -37.7322 -37.6816 -37.6816 1.8630 1.8630 3.9662 3.9662 4.3929 4.3929 5.5939 5.5939 6.8826 6.8826 7.3037 7.3037 7.5710 7.5710 8.8038 8.8038 15.9298 15.9298 17.5335 17.5335 k = 0.2092 0.3623-0.0000 ( 4797 PWs) bands (ev): -37.7336 -37.7336 -37.6802 -37.6802 1.8436 1.8436 3.9330 3.9330 4.3772 4.3772 5.5632 5.5632 6.9020 6.9020 7.3809 7.3809 7.5898 7.5898 8.8979 8.8979 15.9037 15.9037 17.4397 17.4397 k = 0.2026 0.3509-0.0000 ( 4793 PWs) bands (ev): -37.7350 -37.7350 -37.6788 -37.6788 1.8235 1.8235 3.9004 3.9004 4.3620 4.3620 5.5300 5.5300 6.9171 6.9171 7.4505 7.4505 7.6275 7.6275 8.9938 8.9938 15.8769 15.8769 17.3457 17.3457 k = 0.1961 0.3396-0.0000 ( 4795 PWs) bands (ev): -37.7364 -37.7364 -37.6775 -37.6775 1.8025 1.8025 3.8686 3.8686 4.3473 4.3473 5.4954 5.4954 6.9291 6.9291 7.4958 7.4958 7.6989 7.6989 9.0915 9.0915 15.8496 15.8496 17.2513 17.2513 k = 0.1895 0.3283-0.0000 ( 4801 PWs) bands (ev): -37.7378 -37.7378 -37.6761 -37.6761 1.7810 1.7810 3.8377 3.8377 4.3332 4.3332 5.4603 5.4603 6.9388 6.9388 7.5191 7.5191 7.7997 7.7997 9.1909 9.1909 15.8213 15.8213 17.1566 17.1566 k = 0.1830 0.3170-0.0000 ( 4805 PWs) bands (ev): -37.7392 -37.7392 -37.6748 -37.6748 1.7588 1.7588 3.8077 3.8077 4.3194 4.3194 5.4251 5.4251 6.9469 6.9469 7.5320 7.5320 7.9171 7.9171 9.2921 9.2921 15.7921 15.7921 17.0614 17.0614 k = 0.1765 0.3057-0.0000 ( 4793 PWs) bands (ev): -37.7405 -37.7405 -37.6734 -37.6734 1.7361 1.7361 3.7788 3.7788 4.3061 4.3061 5.3904 5.3904 6.9539 6.9539 7.5404 7.5404 8.0440 8.0440 9.3950 9.3950 15.7616 15.7616 16.9658 16.9658 k = 0.1699 0.2943-0.0000 ( 4791 PWs) bands (ev): -37.7418 -37.7418 -37.6721 -37.6721 1.7131 1.7131 3.7510 3.7510 4.2931 4.2931 5.3564 5.3564 6.9600 6.9600 7.5468 7.5468 8.1771 8.1771 9.4997 9.4997 15.7296 15.7296 16.8695 16.8695 k = 0.1634 0.2830-0.0000 ( 4791 PWs) bands (ev): -37.7431 -37.7431 -37.6709 -37.6709 1.6897 1.6897 3.7243 3.7243 4.2804 4.2804 5.3235 5.3235 6.9654 6.9654 7.5520 7.5520 8.3149 8.3149 9.6060 9.6060 15.6958 15.6958 16.7726 16.7726 k = 0.1569 0.2717-0.0000 ( 4783 PWs) bands (ev): -37.7443 -37.7443 -37.6697 -37.6697 1.6662 1.6662 3.6987 3.6987 4.2680 4.2680 5.2919 5.2919 6.9704 6.9704 7.5566 7.5566 8.4563 8.4563 9.7141 9.7141 15.6598 15.6598 16.6750 16.6750 k = 0.1503 0.2604-0.0000 ( 4783 PWs) bands (ev): -37.7455 -37.7455 -37.6685 -37.6685 1.6425 1.6425 3.6744 3.6744 4.2558 4.2558 5.2616 5.2616 6.9750 6.9750 7.5608 7.5608 8.6005 8.6005 9.8238 9.8238 15.6214 15.6214 16.5767 16.5767 k = 0.1438 0.2491-0.0000 ( 4793 PWs) bands (ev): -37.7467 -37.7467 -37.6673 -37.6673 1.6189 1.6189 3.6512 3.6512 4.2439 4.2439 5.2329 5.2329 6.9793 6.9793 7.5647 7.5647 8.7470 8.7470 9.9353 9.9353 15.5800 15.5800 16.4778 16.4778 k = 0.1373 0.2377-0.0000 ( 4789 PWs) bands (ev): -37.7479 -37.7479 -37.6662 -37.6662 1.5954 1.5954 3.6292 3.6292 4.2323 4.2323 5.2057 5.2057 6.9832 6.9832 7.5684 7.5684 8.8951 8.8951 10.0484 10.0484 15.5353 15.5353 16.3782 16.3782 k = 0.1307 0.2264-0.0000 ( 4797 PWs) bands (ev): -37.7490 -37.7490 -37.6651 -37.6651 1.5720 1.5720 3.6085 3.6085 4.2209 4.2209 5.1801 5.1801 6.9870 6.9870 7.5719 7.5719 9.0445 9.0445 10.1631 10.1631 15.4867 15.4867 16.2781 16.2781 k = 0.1242 0.2151-0.0000 ( 4793 PWs) bands (ev): -37.7501 -37.7501 -37.6640 -37.6640 1.5491 1.5491 3.5889 3.5889 4.2098 4.2098 5.1561 5.1561 6.9906 6.9906 7.5752 7.5752 9.1946 9.1946 10.2795 10.2795 15.4337 15.4337 16.1777 16.1777 k = 0.1176 0.2038-0.0000 ( 4799 PWs) bands (ev): -37.7511 -37.7511 -37.6630 -37.6630 1.5266 1.5266 3.5705 3.5705 4.1990 4.1990 5.1337 5.1337 6.9939 6.9939 7.5785 7.5785 9.3449 9.3449 10.3975 10.3975 15.3760 15.3760 16.0771 16.0771 k = 0.1111 0.1925-0.0000 ( 4803 PWs) bands (ev): -37.7521 -37.7521 -37.6621 -37.6621 1.5046 1.5046 3.5532 3.5532 4.1885 4.1885 5.1129 5.1129 6.9971 6.9971 7.5816 7.5816 9.4950 9.4950 10.5169 10.5169 15.3131 15.3131 15.9766 15.9766 k = 0.1046 0.1811-0.0000 ( 4805 PWs) bands (ev): -37.7530 -37.7530 -37.6612 -37.6612 1.4833 1.4833 3.5371 3.5371 4.1784 4.1784 5.0937 5.0937 7.0001 7.0001 7.5846 7.5846 9.6443 9.6443 10.6377 10.6377 15.2448 15.2448 15.8764 15.8764 k = 0.0980 0.1698-0.0000 ( 4809 PWs) bands (ev): -37.7539 -37.7539 -37.6603 -37.6603 1.4627 1.4627 3.5221 3.5221 4.1686 4.1686 5.0761 5.0761 7.0030 7.0030 7.5875 7.5875 9.7921 9.7921 10.7598 10.7598 15.1709 15.1709 15.7767 15.7767 k = 0.0915 0.1585-0.0000 ( 4809 PWs) bands (ev): -37.7548 -37.7548 -37.6595 -37.6595 1.4430 1.4430 3.5082 3.5082 4.1592 4.1592 5.0599 5.0599 7.0057 7.0057 7.5902 7.5902 9.9380 9.9380 10.8829 10.8829 15.0918 15.0918 15.6774 15.6774 k = 0.0850 0.1472-0.0000 ( 4805 PWs) bands (ev): -37.7555 -37.7555 -37.6587 -37.6587 1.4242 1.4242 3.4954 3.4954 4.1503 4.1503 5.0451 5.0451 7.0082 7.0082 7.5928 7.5928 10.0812 10.0812 11.0068 11.0068 15.0079 15.0079 15.5787 15.5787 k = 0.0784 0.1358-0.0000 ( 4813 PWs) bands (ev): -37.7563 -37.7563 -37.6580 -37.6580 1.4065 1.4065 3.4837 3.4837 4.1418 4.1418 5.0318 5.0318 7.0105 7.0105 7.5953 7.5953 10.2211 10.2211 11.1310 11.1310 14.9201 14.9201 15.4805 15.4805 k = 0.0719 0.1245-0.0000 ( 4809 PWs) bands (ev): -37.7569 -37.7569 -37.6573 -37.6573 1.3898 1.3898 3.4729 3.4729 4.1338 4.1338 5.0197 5.0197 7.0127 7.0127 7.5976 7.5976 10.3567 10.3567 11.2550 11.2550 14.8295 14.8295 15.3826 15.3826 k = 0.0654 0.1132-0.0000 ( 4809 PWs) bands (ev): -37.7576 -37.7576 -37.6567 -37.6567 1.3744 1.3744 3.4632 3.4632 4.1264 4.1264 5.0090 5.0090 7.0147 7.0147 7.5998 7.5998 10.4873 10.4873 11.3782 11.3782 14.7373 14.7373 15.2852 15.2852 k = 0.0588 0.1019-0.0000 ( 4811 PWs) bands (ev): -37.7581 -37.7581 -37.6562 -37.6562 1.3602 1.3602 3.4545 3.4545 4.1196 4.1196 4.9994 4.9994 7.0165 7.0165 7.6018 7.6018 10.6119 10.6119 11.4996 11.4996 14.6452 14.6452 15.1886 15.1886 k = 0.0523 0.0906-0.0000 ( 4807 PWs) bands (ev): -37.7586 -37.7586 -37.6557 -37.6557 1.3473 1.3473 3.4468 3.4468 4.1134 4.1134 4.9910 4.9910 7.0181 7.0181 7.6036 7.6036 10.7293 10.7293 11.6179 11.6179 14.5547 14.5547 15.0935 15.0935 k = 0.0458 0.0792-0.0000 ( 4805 PWs) bands (ev): -37.7591 -37.7591 -37.6552 -37.6552 1.3358 1.3358 3.4400 3.4400 4.1079 4.1079 4.9837 4.9837 7.0196 7.0196 7.6052 7.6052 10.8383 10.8383 11.7317 11.7317 14.4678 14.4678 15.0010 15.0010 k = 0.0392 0.0679-0.0000 ( 4805 PWs) bands (ev): -37.7595 -37.7595 -37.6549 -37.6549 1.3257 1.3257 3.4341 3.4341 4.1030 4.1030 4.9775 4.9775 7.0208 7.0208 7.6066 7.6066 10.9376 10.9376 11.8391 11.8391 14.3863 14.3863 14.9126 14.9126 k = 0.0327 0.0566-0.0000 ( 4811 PWs) bands (ev): -37.7598 -37.7598 -37.6545 -37.6545 1.3171 1.3171 3.4292 3.4292 4.0988 4.0988 4.9723 4.9723 7.0219 7.0219 7.6079 7.6079 11.0256 11.0256 11.9377 11.9377 14.3121 14.3121 14.8306 14.8306 k = 0.0261 0.0453-0.0000 ( 4815 PWs) bands (ev): -37.7601 -37.7601 -37.6543 -37.6543 1.3101 1.3101 3.4252 3.4252 4.0954 4.0954 4.9681 4.9681 7.0228 7.0228 7.6089 7.6089 11.1009 11.1009 12.0248 12.0248 14.2475 14.2475 14.7573 14.7573 k = 0.0196 0.0340-0.0000 ( 4811 PWs) bands (ev): -37.7603 -37.7603 -37.6541 -37.6541 1.3045 1.3045 3.4221 3.4221 4.0927 4.0927 4.9649 4.9649 7.0235 7.0235 7.6097 7.6097 11.1616 11.1616 12.0973 12.0973 14.1943 14.1943 14.6957 14.6957 k = 0.0131 0.0226-0.0000 ( 4811 PWs) bands (ev): -37.7605 -37.7605 -37.6539 -37.6539 1.3006 1.3006 3.4199 3.4199 4.0908 4.0908 4.9626 4.9626 7.0240 7.0240 7.6102 7.6102 11.2064 11.2064 12.1522 12.1522 14.1547 14.1547 14.6489 14.6489 k = 0.0065 0.0113-0.0000 ( 4799 PWs) bands (ev): -37.7605 -37.7605 -37.6538 -37.6538 1.2982 1.2982 3.4186 3.4186 4.0896 4.0896 4.9612 4.9612 7.0243 7.0243 7.6106 7.6106 11.2338 11.2338 12.1864 12.1864 14.1302 14.1302 14.6196 14.6196 k = 0.0000 0.0000 0.0000 ( 4811 PWs) bands (ev): -37.7606 -37.7606 -37.6538 -37.6538 1.2974 1.2974 3.4181 3.4181 4.0892 4.0892 4.9608 4.9608 7.0244 7.0244 7.6107 7.6107 11.2430 11.2430 12.1981 12.1981 14.1218 14.1218 14.6095 14.6095 k = 0.0000 0.0000 0.0000 ( 4811 PWs) bands (ev): -37.7606 -37.7606 -37.6538 -37.6538 1.2974 1.2974 3.4181 3.4181 4.0892 4.0892 4.9608 4.9608 7.0244 7.0244 7.6107 7.6107 11.2430 11.2430 12.1981 12.1981 14.1218 14.1218 14.6095 14.6095 k = 0.0000 0.0000 0.0131 ( 4799 PWs) bands (ev): -37.7606 -37.7606 -37.6538 -37.6538 1.2996 1.2996 3.4193 3.4193 4.0898 4.0898 4.9615 4.9615 7.0205 7.0205 7.6068 7.6068 11.2480 11.2480 12.2030 12.2030 14.1222 14.1222 14.6097 14.6097 k = 0.0000 0.0000 0.0262 ( 4805 PWs) bands (ev): -37.7605 -37.7605 -37.6537 -37.6537 1.3061 1.3061 3.4230 3.4230 4.0914 4.0914 4.9637 4.9637 7.0091 7.0091 7.5950 7.5950 11.2627 11.2627 12.2177 12.2177 14.1231 14.1231 14.6100 14.6100 k = 0.0000 0.0000 0.0393 ( 4799 PWs) bands (ev): -37.7604 -37.7604 -37.6536 -37.6536 1.3171 1.3171 3.4292 3.4292 4.0942 4.0942 4.9673 4.9673 6.9902 6.9902 7.5756 7.5756 11.2871 11.2871 12.2419 12.2419 14.1247 14.1247 14.6106 14.6106 k = 0.0000 0.0000 0.0524 ( 4799 PWs) bands (ev): -37.7602 -37.7602 -37.6535 -37.6535 1.3323 1.3323 3.4378 3.4378 4.0980 4.0980 4.9724 4.9724 6.9643 6.9643 7.5489 7.5489 11.3208 11.3208 12.2755 12.2755 14.1269 14.1269 14.6114 14.6114 k = 0.0000 0.0000 0.0655 ( 4799 PWs) bands (ev): -37.7601 -37.7601 -37.6534 -37.6534 1.3519 1.3519 3.4489 3.4489 4.1029 4.1029 4.9789 4.9789 6.9315 6.9315 7.5152 7.5152 11.3635 11.3635 12.3181 12.3181 14.1297 14.1297 14.6125 14.6125 k = 0.0000 0.0000 0.0787 ( 4799 PWs) bands (ev): -37.7598 -37.7598 -37.6532 -37.6532 1.3756 1.3756 3.4626 3.4626 4.1089 4.1089 4.9869 4.9869 6.8925 6.8925 7.4749 7.4749 11.4147 11.4147 12.3692 12.3692 14.1331 14.1331 14.6137 14.6137 k = 0.0000 0.0000 0.0918 ( 4793 PWs) bands (ev): -37.7595 -37.7595 -37.6530 -37.6530 1.4035 1.4035 3.4787 3.4787 4.1159 4.1159 4.9963 4.9963 6.8477 6.8477 7.4285 7.4285 11.4740 11.4740 12.4284 12.4284 14.1372 14.1372 14.6152 14.6152 k = 0.0000 0.0000 0.1049 ( 4805 PWs) bands (ev): -37.7592 -37.7592 -37.6527 -37.6527 1.4354 1.4354 3.4975 3.4975 4.1239 4.1239 5.0071 5.0071 6.7977 6.7977 7.3766 7.3766 11.5408 11.5408 12.4951 12.4951 14.1419 14.1419 14.6168 14.6168 k = 0.0000 0.0000 0.1180 ( 4805 PWs) bands (ev): -37.7589 -37.7589 -37.6524 -37.6524 1.4713 1.4713 3.5189 3.5189 4.1330 4.1330 5.0192 5.0192 6.7431 6.7431 7.3198 7.3198 11.6145 11.6145 12.5689 12.5689 14.1472 14.1472 14.6187 14.6187 k = 0.0000 0.0000 0.1311 ( 4805 PWs) bands (ev): -37.7585 -37.7585 -37.6521 -37.6521 1.5109 1.5109 3.5429 3.5429 4.1430 4.1430 5.0327 5.0327 6.6844 6.6844 7.2585 7.2585 11.6948 11.6948 12.6491 12.6491 14.1532 14.1532 14.6207 14.6207 k = 0.0000 0.0000 0.1442 ( 4799 PWs) bands (ev): -37.7581 -37.7581 -37.6518 -37.6518 1.5542 1.5542 3.5696 3.5696 4.1539 4.1539 5.0476 5.0476 6.6222 6.6222 7.1933 7.1933 11.7809 11.7809 12.7353 12.7353 14.1598 14.1598 14.6228 14.6228 k = 0.0000 0.0000 0.1573 ( 4799 PWs) bands (ev): -37.7576 -37.7576 -37.6514 -37.6514 1.6010 1.6010 3.5991 3.5991 4.1657 4.1657 5.0638 5.0638 6.5570 6.5570 7.1248 7.1248 11.8726 11.8726 12.8270 12.8270 14.1670 14.1670 14.6251 14.6251 k = 0.0000 0.0000 0.1704 ( 4799 PWs) bands (ev): -37.7571 -37.7571 -37.6510 -37.6510 1.6511 1.6511 3.6313 3.6313 4.1784 4.1784 5.0813 5.0813 6.4893 6.4893 7.0534 7.0534 11.9691 11.9691 12.9237 12.9237 14.1749 14.1749 14.6275 14.6275 k = 0.0000 0.0000 0.1835 ( 4787 PWs) bands (ev): -37.7566 -37.7566 -37.6505 -37.6505 1.7042 1.7042 3.6664 3.6664 4.1919 4.1919 5.1000 5.1000 6.4198 6.4198 6.9797 6.9797 12.0703 12.0703 13.0249 13.0249 14.1836 14.1836 14.6300 14.6300 k = 0.0000 0.0000 0.1966 ( 4792 PWs) bands (ev): -37.7560 -37.7560 -37.6501 -37.6501 1.7603 1.7603 3.7044 3.7044 4.2061 4.2061 5.1200 5.1200 6.3488 6.3488 6.9040 6.9040 12.1756 12.1756 13.1301 13.1301 14.1929 14.1929 14.6325 14.6325 k = 0.0000 0.0000 0.2097 ( 4792 PWs) bands (ev): -37.7554 -37.7554 -37.6496 -37.6496 1.8191 1.8191 3.7453 3.7453 4.2210 4.2210 5.1412 5.1412 6.2768 6.2768 6.8269 6.8269 12.2846 12.2846 13.2389 13.2389 14.2031 14.2031 14.6352 14.6352 k = 0.0000 0.0000 0.2229 ( 4780 PWs) bands (ev): -37.7548 -37.7548 -37.6491 -37.6491 1.8802 1.8802 3.7891 3.7891 4.2366 4.2366 5.1635 5.1635 6.2044 6.2044 6.7487 6.7487 12.3971 12.3971 13.3508 13.3508 14.2143 14.2143 14.6378 14.6378 k = 0.0000 0.0000 0.2360 ( 4780 PWs) bands (ev): -37.7541 -37.7541 -37.6486 -37.6486 1.9434 1.9434 3.8360 3.8360 4.2527 4.2527 5.1869 5.1869 6.1319 6.1319 6.6697 6.6697 12.5127 12.5127 13.4653 13.4653 14.2266 14.2266 14.6404 14.6404 k = 0.0000 0.0000 0.2491 ( 4780 PWs) bands (ev): -37.7534 -37.7534 -37.6480 -37.6480 2.0086 2.0086 3.8857 3.8857 4.2692 4.2692 5.2114 5.2114 6.0598 6.0598 6.5905 6.5905 12.6310 12.6310 13.5818 13.5818 14.2404 14.2404 14.6431 14.6431 k = 0.0000 0.0000 0.2622 ( 4768 PWs) bands (ev): -37.7527 -37.7527 -37.6475 -37.6475 2.0752 2.0752 3.9383 3.9383 4.2862 4.2862 5.2370 5.2370 5.9886 5.9886 6.5112 6.5112 12.7520 12.7520 13.6993 13.6993 14.2563 14.2563 14.6456 14.6456 k = 0.0000 0.0000 0.2753 ( 4762 PWs) bands (ev): -37.7520 -37.7520 -37.6469 -37.6469 2.1432 2.1432 3.9937 3.9937 4.3034 4.3034 5.2635 5.2635 5.9188 5.9188 6.4323 6.4323 12.8752 12.8752 13.8163 13.8163 14.2757 14.2757 14.6481 14.6481 k = 0.0000 0.0000 0.2884 ( 4774 PWs) bands (ev): -37.7513 -37.7513 -37.6463 -37.6463 2.2120 2.2120 4.0515 4.0515 4.3208 4.3208 5.2909 5.2909 5.8511 5.8511 6.3540 6.3540 13.0004 13.0004 13.9302 13.9302 14.3009 14.3009 14.6505 14.6505 k = 0.0000 0.0000 0.3015 ( 4774 PWs) bands (ev): -37.7505 -37.7505 -37.6457 -37.6457 2.2815 2.2815 4.1115 4.1115 4.3382 4.3382 5.3192 5.3192 5.7861 5.7861 6.2766 6.2766 13.1274 13.1274 14.0355 14.0355 14.3372 14.3372 14.6528 14.6528 k = 0.0000 0.0000 0.3146 ( 4774 PWs) bands (ev): -37.7497 -37.7497 -37.6451 -37.6451 2.3513 2.3513 4.1732 4.1732 4.3556 4.3556 5.3484 5.3484 5.7247 5.7247 6.2004 6.2004 13.2558 13.2558 14.1230 14.1230 14.3937 14.3937 14.6549 14.6549 k = 0.0000 0.0000 0.3277 ( 4774 PWs) bands (ev): -37.7489 -37.7489 -37.6444 -37.6444 2.4212 2.4212 4.2356 4.2356 4.3727 4.3727 5.3782 5.3782 5.6679 5.6679 6.1258 6.1258 13.3854 13.3854 14.1853 14.1853 14.4774 14.4774 14.6568 14.6568 k = 0.0000 0.0000 0.3408 ( 4792 PWs) bands (ev): -37.7482 -37.7482 -37.6438 -37.6438 2.4907 2.4907 4.2978 4.2978 4.3895 4.3895 5.4088 5.4088 5.6171 5.6171 6.0529 6.0529 13.5156 13.5156 14.2263 14.2263 14.5846 14.5846 14.6585 14.6585 k = 0.0000 0.0000 0.3539 ( 4792 PWs) bands (ev): -37.7474 -37.7474 -37.6432 -37.6432 2.5598 2.5598 4.3581 4.3581 4.4056 4.4056 5.4400 5.4400 5.5739 5.5739 5.9821 5.9821 13.6457 13.6457 14.2549 14.2549 14.6600 14.6600 14.7059 14.7059 k = 0.0000 0.0000 0.3671 ( 4792 PWs) bands (ev): -37.7465 -37.7465 -37.6425 -37.6425 2.6280 2.6280 4.4146 4.4146 4.4209 4.4209 5.4717 5.4717 5.5407 5.5407 5.9138 5.9138 13.7746 13.7746 14.2772 14.2772 14.6612 14.6612 14.8354 14.8354 k = 0.0000 0.0000 0.3802 ( 4780 PWs) bands (ev): -37.7457 -37.7457 -37.6418 -37.6418 2.6953 2.6953 4.4351 4.4351 4.4647 4.4647 5.5039 5.5039 5.5200 5.5200 5.8481 5.8481 13.8993 13.8993 14.2961 14.2961 14.6622 14.6622 14.8052 14.8052 k = 0.0000 0.0000 0.3933 ( 4786 PWs) bands (ev): -37.7449 -37.7449 -37.6412 -37.6412 2.7613 2.7613 4.4481 4.4481 4.5055 4.5055 5.5147 5.5147 5.5365 5.5365 5.7854 5.7854 14.0125 14.0125 14.3132 14.3132 14.6520 14.6520 14.6628 14.6628 k = 0.0000 0.0000 0.4064 ( 4786 PWs) bands (ev): -37.7441 -37.7441 -37.6405 -37.6405 2.8259 2.8259 4.4594 4.4594 4.5347 4.5347 5.5272 5.5272 5.5694 5.5694 5.7261 5.7261 14.0906 14.0906 14.3291 14.3291 14.5366 14.5366 14.6632 14.6632 k = 0.0000 0.0000 0.4195 ( 4786 PWs) bands (ev): -37.7432 -37.7432 -37.6399 -37.6399 2.8889 2.8889 4.4689 4.4689 4.5507 4.5507 5.5590 5.5590 5.6025 5.6025 5.6705 5.6705 14.0787 14.0787 14.3443 14.3443 14.5139 14.5139 14.6632 14.6632 k = 0.0000 0.0000 0.4326 ( 4792 PWs) bands (ev): -37.7424 -37.7424 -37.6392 -37.6392 2.9502 2.9502 4.4762 4.4762 4.5538 4.5538 5.6099 5.6099 5.6189 5.6189 5.6358 5.6358 13.9731 13.9731 14.3590 14.3590 14.5877 14.5877 14.6629 14.6629 k = 0.0000 0.0000 0.4457 ( 4792 PWs) bands (ev): -37.7416 -37.7416 -37.6386 -37.6386 3.0096 3.0096 4.4811 4.4811 4.5456 4.5456 5.5716 5.5716 5.6691 5.6691 5.6780 5.6780 13.8296 13.8296 14.3733 14.3733 14.6622 14.6622 14.7021 14.7021 k = 0.0000 0.0000 0.4588 ( 4792 PWs) bands (ev): -37.7408 -37.7408 -37.6379 -37.6379 3.0671 3.0671 4.4832 4.4832 4.5283 4.5283 5.5290 5.5290 5.7024 5.7024 5.7610 5.7610 13.6746 13.6746 14.3872 14.3872 14.6612 14.6612 14.8306 14.8306 k = 0.0000 0.0000 0.4719 ( 4816 PWs) bands (ev): -37.7401 -37.7401 -37.6373 -37.6373 3.1224 3.1224 4.4823 4.4823 4.5045 4.5045 5.4912 5.4912 5.7355 5.7355 5.8562 5.8562 13.5164 13.5164 14.4009 14.4009 14.6599 14.6599 14.9651 14.9651 k = 0.0000 0.0000 0.4850 ( 4816 PWs) bands (ev): -37.7393 -37.7393 -37.6367 -37.6367 3.1754 3.1754 4.4764 4.4764 4.4783 4.4783 5.4583 5.4583 5.7684 5.7684 5.9611 5.9611 13.3579 13.3579 14.4142 14.4142 14.6582 14.6582 15.1026 15.1026 k = 0.0000 0.0000 0.4981 ( 4828 PWs) bands (ev): -37.7386 -37.7386 -37.6361 -37.6361 3.2261 3.2261 4.4457 4.4457 4.4712 4.4712 5.4306 5.4306 5.8010 5.8010 6.0739 6.0739 13.2005 13.2005 14.4273 14.4273 14.6561 14.6561 15.2415 15.2415 k = 0.0000 0.0000 0.5113 ( 4840 PWs) bands (ev): -37.7378 -37.7378 -37.6355 -37.6355 3.2742 3.2742 4.4140 4.4140 4.4610 4.4610 5.4077 5.4077 5.8331 5.8331 6.1928 6.1928 13.0448 13.0448 14.4401 14.4401 14.6538 14.6538 15.3812 15.3812 k = 0.0000 0.0000 0.5244 ( 4834 PWs) bands (ev): -37.7371 -37.7371 -37.6349 -37.6349 3.3196 3.3196 4.3822 4.3822 4.4479 4.4479 5.3896 5.3896 5.8647 5.8647 6.3165 6.3165 12.8912 12.8912 14.4527 14.4527 14.6511 14.6511 15.5211 15.5211 k = 0.0000 0.0000 0.5375 ( 4846 PWs) bands (ev): -37.7364 -37.7364 -37.6344 -37.6344 3.3621 3.3621 4.3512 4.3512 4.4323 4.4323 5.3759 5.3759 5.8956 5.8956 6.4440 6.4440 12.7401 12.7401 14.4648 14.4648 14.6481 14.6481 15.6608 15.6608 k = 0.0000 0.0000 0.5506 ( 4846 PWs) bands (ev): -37.7357 -37.7357 -37.6338 -37.6338 3.4015 3.4015 4.3219 4.3219 4.4145 4.4145 5.3661 5.3661 5.9258 5.9258 6.5742 6.5742 12.5916 12.5916 14.4767 14.4767 14.6449 14.6449 15.6485 15.6485 k = 0.0000 0.0000 0.5637 ( 4846 PWs) bands (ev): -37.7351 -37.7351 -37.6333 -37.6333 3.4377 3.4377 4.2947 4.2947 4.3949 4.3949 5.3599 5.3599 5.9551 5.9551 6.7063 6.7063 12.4460 12.4460 14.4881 14.4881 14.6415 14.6415 15.6156 15.6156 k = 0.0000 0.0000 0.5768 ( 4846 PWs) bands (ev): -37.7344 -37.7344 -37.6328 -37.6328 3.4703 3.4703 4.2701 4.2701 4.3741 4.3741 5.3566 5.3566 5.9835 5.9835 6.8394 6.8394 12.3034 12.3034 14.4991 14.4991 14.6379 14.6379 15.5843 15.5843 k = 0.0000 0.0000 0.5899 ( 4834 PWs) bands (ev): -37.7338 -37.7338 -37.6323 -37.6323 3.4992 3.4992 4.2486 4.2486 4.3525 4.3525 5.3558 5.3558 6.0108 6.0108 6.9730 6.9730 12.1641 12.1641 14.5097 14.5097 14.6341 14.6341 15.5546 15.5546 k = 0.0000 0.0000 0.6030 ( 4834 PWs) bands (ev): -37.7333 -37.7333 -37.6319 -37.6319 3.5242 3.5242 4.2303 4.2303 4.3306 4.3306 5.3571 5.3571 6.0369 6.0369 7.1061 7.1061 12.0282 12.0282 14.5198 14.5198 14.6303 14.6303 15.5265 15.5265 k = 0.0000 0.0000 0.6161 ( 4840 PWs) bands (ev): -37.7327 -37.7327 -37.6314 -37.6314 3.5454 3.5454 4.2155 4.2155 4.3087 4.3087 5.3599 5.3599 6.0617 6.0617 7.2381 7.2381 11.8960 11.8960 14.5294 14.5294 14.6264 14.6264 15.5002 15.5002 k = 0.0000 0.0000 0.6292 ( 4828 PWs) bands (ev): -37.7322 -37.7322 -37.6310 -37.6310 3.5626 3.5626 4.2042 4.2042 4.2873 4.2873 5.3639 5.3639 6.0852 6.0852 7.3681 7.3681 11.7679 11.7679 14.5385 14.5385 14.6225 14.6225 15.4756 15.4756 k = 0.0000 0.0000 0.6423 ( 4828 PWs) bands (ev): -37.7317 -37.7317 -37.6307 -37.6307 3.5761 3.5761 4.1963 4.1963 4.2666 4.2666 5.3686 5.3686 6.1071 6.1071 7.4954 7.4954 11.6442 11.6442 14.5470 14.5470 14.6186 14.6186 15.4528 15.4528 k = 0.0000 0.0000 0.6555 ( 4828 PWs) bands (ev): -37.7313 -37.7313 -37.6303 -37.6303 3.5862 3.5862 4.1914 4.1914 4.2470 4.2470 5.3739 5.3739 6.1276 6.1276 7.6191 7.6191 11.5253 11.5253 14.5548 14.5548 14.6149 14.6149 15.4318 15.4318 k = 0.0000 0.0000 0.6686 ( 4828 PWs) bands (ev): -37.7309 -37.7309 -37.6300 -37.6300 3.5933 3.5933 4.1892 4.1892 4.2286 4.2286 5.3794 5.3794 6.1463 6.1463 7.7380 7.7380 11.4120 11.4120 14.5621 14.5621 14.6113 14.6113 15.4128 15.4128 k = 0.0000 0.0000 0.6817 ( 4834 PWs) bands (ev): -37.7306 -37.7306 -37.6297 -37.6297 3.5978 3.5978 4.1891 4.1891 4.2117 4.2117 5.3849 5.3849 6.1633 6.1633 7.8512 7.8512 11.3050 11.3050 14.5686 14.5686 14.6079 14.6079 15.3956 15.3956 k = 0.0000 0.0000 0.6948 ( 4834 PWs) bands (ev): -37.7302 -37.7302 -37.6295 -37.6295 3.6003 3.6003 4.1906 4.1906 4.1965 4.1965 5.3901 5.3901 6.1785 6.1785 7.9572 7.9572 11.2052 11.2052 14.5745 14.5745 14.6048 14.6048 15.3804 15.3804 k = 0.0000 0.0000 0.7079 ( 4846 PWs) bands (ev): -37.7300 -37.7300 -37.6293 -37.6293 3.6013 3.6013 4.1830 4.1830 4.1932 4.1932 5.3950 5.3950 6.1918 6.1918 8.0547 8.0547 11.1139 11.1139 14.5796 14.5796 14.6020 14.6020 15.3672 15.3672 k = 0.0000 0.0000 0.7210 ( 4858 PWs) bands (ev): -37.7298 -37.7298 -37.6291 -37.6291 3.6014 3.6014 4.1714 4.1714 4.1962 4.1962 5.3993 5.3993 6.2032 6.2032 8.1419 8.1419 11.0323 11.0323 14.5840 14.5840 14.5995 14.5995 15.3559 15.3559 k = 0.0000 0.0000 0.7341 ( 4834 PWs) bands (ev): -37.7296 -37.7296 -37.6289 -37.6289 3.6008 3.6008 4.1618 4.1618 4.1994 4.1994 5.4030 5.4030 6.2126 6.2126 8.2171 8.2171 10.9621 10.9621 14.5876 14.5876 14.5975 14.5975 15.3467 15.3467 k = 0.0000 0.0000 0.7472 ( 4834 PWs) bands (ev): -37.7294 -37.7294 -37.6288 -37.6288 3.6001 3.6001 4.1543 4.1543 4.2022 4.2022 5.4060 5.4060 6.2200 6.2200 8.2783 8.2783 10.9050 10.9050 14.5904 14.5904 14.5958 14.5958 15.3395 15.3395 k = 0.0000 0.0000 0.7603 ( 4816 PWs) bands (ev): -37.7293 -37.7293 -37.6287 -37.6287 3.5993 3.5993 4.1489 4.1489 4.2044 4.2044 5.4082 5.4082 6.2252 6.2252 8.3236 8.3236 10.8627 10.8627 14.5925 14.5925 14.5947 14.5947 15.3344 15.3344 k = 0.0000 0.0000 0.7734 ( 4816 PWs) bands (ev): -37.7292 -37.7292 -37.6286 -37.6286 3.5988 3.5988 4.1456 4.1456 4.2058 4.2058 5.4095 5.4095 6.2284 6.2284 8.3516 8.3516 10.8366 10.8366 14.5937 14.5937 14.5939 14.5939 15.3313 15.3313 k = 0.0000 0.0000 0.7865 ( 4816 PWs) bands (ev): -37.7292 -37.7292 -37.6286 -37.6286 3.5986 3.5986 4.1445 4.1445 4.2063 4.2063 5.4099 5.4099 6.2295 6.2295 8.3610 8.3610 10.8278 10.8278 14.5937 14.5937 14.5941 14.5941 15.3303 15.3303 k = 0.0000 0.0000 0.7865 ( 4816 PWs) bands (ev): -37.7292 -37.7292 -37.6286 -37.6286 3.5986 3.5986 4.1445 4.1445 4.2063 4.2063 5.4099 5.4099 6.2295 6.2295 8.3610 8.3610 10.8278 10.8278 14.5937 14.5937 14.5941 14.5941 15.3303 15.3303 k = 0.0114 0.0066 0.7865 ( 4820 PWs) bands (ev): -37.7292 -37.7292 -37.6286 -37.6286 3.5991 3.5991 4.1442 4.1442 4.2071 4.2071 5.4099 5.4099 6.2295 6.2295 8.3618 8.3618 10.8269 10.8269 14.5949 14.5949 14.5954 14.5954 15.3296 15.3296 k = 0.0227 0.0131 0.7865 ( 4830 PWs) bands (ev): -37.7291 -37.7291 -37.6287 -37.6287 3.6004 3.6004 4.1431 4.1431 4.2093 4.2093 5.4096 5.4096 6.2295 6.2295 8.3643 8.3643 10.8242 10.8242 14.5979 14.5979 14.5996 14.5996 15.3274 15.3274 k = 0.0341 0.0197 0.7865 ( 4834 PWs) bands (ev): -37.7290 -37.7290 -37.6289 -37.6289 3.6027 3.6027 4.1413 4.1413 4.2132 4.2132 5.4092 5.4092 6.2297 6.2297 8.3684 8.3684 10.8197 10.8197 14.6028 14.6028 14.6068 14.6068 15.3235 15.3235 k = 0.0455 0.0262 0.7865 ( 4836 PWs) bands (ev): -37.7288 -37.7288 -37.6291 -37.6291 3.6057 3.6057 4.1387 4.1387 4.2188 4.2188 5.4086 5.4086 6.2299 6.2299 8.3741 8.3741 10.8134 10.8134 14.6097 14.6097 14.6169 14.6169 15.3173 15.3173 k = 0.0568 0.0328 0.7865 ( 4832 PWs) bands (ev): -37.7285 -37.7285 -37.6293 -37.6293 3.6093 3.6093 4.1354 4.1354 4.2262 4.2262 5.4078 5.4078 6.2302 6.2302 8.3814 8.3814 10.8053 10.8053 14.6186 14.6186 14.6297 14.6297 15.3080 15.3080 k = 0.0682 0.0394 0.7865 ( 4836 PWs) bands (ev): -37.7282 -37.7282 -37.6297 -37.6297 3.6133 3.6133 4.1314 4.1314 4.2357 4.2357 5.4069 5.4069 6.2307 6.2307 8.3902 8.3902 10.7953 10.7953 14.6294 14.6294 14.6453 14.6453 15.2944 15.2944 k = 0.0795 0.0459 0.7865 ( 4832 PWs) bands (ev): -37.7278 -37.7278 -37.6300 -37.6300 3.6177 3.6177 4.1266 4.1266 4.2474 4.2474 5.4058 5.4058 6.2314 6.2314 8.4003 8.4003 10.7833 10.7833 14.6421 14.6421 14.6635 14.6635 15.2751 15.2751 k = 0.0909 0.0525 0.7865 ( 4824 PWs) bands (ev): -37.7274 -37.7274 -37.6304 -37.6304 3.6221 3.6221 4.1212 4.1212 4.2615 4.2615 5.4046 5.4046 6.2324 6.2324 8.4119 8.4119 10.7694 10.7694 14.6567 14.6567 14.6842 14.6842 15.2482 15.2482 k = 0.1023 0.0590 0.7865 ( 4824 PWs) bands (ev): -37.7269 -37.7269 -37.6309 -37.6309 3.6265 3.6265 4.1151 4.1151 4.2781 4.2781 5.4032 5.4032 6.2337 6.2337 8.4246 8.4246 10.7533 10.7533 14.6732 14.6732 14.7074 14.7074 15.2116 15.2116 k = 0.1136 0.0656 0.7865 ( 4820 PWs) bands (ev): -37.7264 -37.7264 -37.6314 -37.6314 3.6305 3.6305 4.1084 4.1084 4.2976 4.2976 5.4017 5.4017 6.2354 6.2354 8.4385 8.4385 10.7351 10.7351 14.6916 14.6916 14.7329 14.7329 15.1629 15.1629 k = 0.1250 0.0722 0.7865 ( 4826 PWs) bands (ev): -37.7258 -37.7258 -37.6320 -37.6320 3.6340 3.6340 4.1012 4.1012 4.3199 4.3199 5.4000 5.4000 6.2375 6.2375 8.4535 8.4535 10.7146 10.7146 14.7117 14.7117 14.7603 14.7603 15.1000 15.1000 k = 0.1364 0.0787 0.7865 ( 4822 PWs) bands (ev): -37.7252 -37.7252 -37.6326 -37.6326 3.6368 3.6368 4.0935 4.0935 4.3452 4.3452 5.3984 5.3984 6.2402 6.2402 8.4694 8.4694 10.6917 10.6917 14.7336 14.7336 14.7890 14.7890 15.0221 15.0221 k = 0.1477 0.0853 0.7865 ( 4824 PWs) bands (ev): -37.7245 -37.7245 -37.6333 -37.6333 3.6389 3.6389 4.0854 4.0854 4.3736 4.3736 5.3967 5.3967 6.2434 6.2434 8.4861 8.4861 10.6663 10.6663 14.7569 14.7569 14.8152 14.8152 14.9324 14.9324 k = 0.1591 0.0919 0.7865 ( 4820 PWs) bands (ev): -37.7238 -37.7238 -37.6341 -37.6341 3.6401 3.6401 4.0768 4.0768 4.4051 4.4051 5.3952 5.3952 6.2473 6.2473 8.5035 8.5035 10.6381 10.6381 14.7762 14.7762 14.7974 14.7974 14.8791 14.8791 k = 0.1705 0.0984 0.7865 ( 4824 PWs) bands (ev): -37.7230 -37.7230 -37.6348 -37.6348 3.6404 3.6404 4.0680 4.0680 4.4395 4.4395 5.3938 5.3938 6.2519 6.2519 8.5215 8.5215 10.6070 10.6070 14.6771 14.6771 14.8111 14.8111 14.9030 14.9030 k = 0.1818 0.1050 0.7865 ( 4824 PWs) bands (ev): -37.7222 -37.7222 -37.6357 -37.6357 3.6397 3.6397 4.0588 4.0588 4.4769 4.4769 5.3929 5.3929 6.2572 6.2572 8.5399 8.5399 10.5728 10.5728 14.5452 14.5452 14.8394 14.8394 14.9383 14.9383 k = 0.1932 0.1115 0.7865 ( 4820 PWs) bands (ev): -37.7214 -37.7214 -37.6365 -37.6365 3.6381 3.6381 4.0495 4.0495 4.5169 4.5169 5.3925 5.3925 6.2632 6.2632 8.5586 8.5586 10.5353 10.5353 14.4045 14.4045 14.8694 14.8694 14.9765 14.9765 k = 0.2045 0.1181 0.7865 ( 4812 PWs) bands (ev): -37.7205 -37.7205 -37.6374 -37.6374 3.6356 3.6356 4.0400 4.0400 4.5593 4.5593 5.3929 5.3929 6.2701 6.2701 8.5774 8.5774 10.4942 10.4942 14.2591 14.2591 14.9010 14.9010 15.0164 15.0164 k = 0.2159 0.1247 0.7865 ( 4810 PWs) bands (ev): -37.7195 -37.7195 -37.6384 -37.6384 3.6323 3.6323 4.0303 4.0303 4.6037 4.6037 5.3945 5.3945 6.2777 6.2777 8.5962 8.5962 10.4494 10.4494 14.1118 14.1118 14.9339 14.9339 15.0576 15.0576 k = 0.2273 0.1312 0.7865 ( 4806 PWs) bands (ev): -37.7185 -37.7185 -37.6393 -37.6393 3.6283 3.6283 4.0207 4.0207 4.6496 4.6496 5.3976 5.3976 6.2862 6.2862 8.6149 8.6149 10.4005 10.4005 13.9649 13.9649 14.9681 14.9681 15.0998 15.0998 k = 0.2386 0.1378 0.7865 ( 4802 PWs) bands (ev): -37.7175 -37.7175 -37.6404 -37.6404 3.6236 3.6236 4.0110 4.0110 4.6964 4.6964 5.4029 5.4029 6.2955 6.2955 8.6333 8.6333 10.3473 10.3473 13.8201 13.8201 15.0035 15.0035 15.1428 15.1428 k = 0.2500 0.1443 0.7865 ( 4800 PWs) bands (ev): -37.7165 -37.7165 -37.6414 -37.6414 3.6183 3.6183 4.0013 4.0013 4.7432 4.7432 5.4111 5.4111 6.3056 6.3056 8.6513 8.6513 10.2897 10.2897 13.6789 13.6789 15.0399 15.0399 15.1863 15.1863 k = 0.2614 0.1509 0.7865 ( 4816 PWs) bands (ev): -37.7154 -37.7154 -37.6425 -37.6425 3.6126 3.6126 3.9918 3.9918 4.7891 4.7891 5.4229 5.4229 6.3165 6.3165 8.6686 8.6686 10.2276 10.2276 13.5426 13.5426 15.0773 15.0773 15.2302 15.2302 k = 0.2727 0.1575 0.7865 ( 4820 PWs) bands (ev): -37.7143 -37.7143 -37.6437 -37.6437 3.6065 3.6065 3.9823 3.9823 4.8330 4.8330 5.4393 5.4393 6.3283 6.3283 8.6851 8.6851 10.1608 10.1608 13.4121 13.4121 15.1153 15.1153 15.2741 15.2741 k = 0.2841 0.1640 0.7865 ( 4816 PWs) bands (ev): -37.7132 -37.7132 -37.6448 -37.6448 3.6001 3.6001 3.9731 3.9731 4.8737 4.8737 5.4613 5.4613 6.3410 6.3410 8.7006 8.7006 10.0895 10.0895 13.2883 13.2883 15.1540 15.1540 15.3180 15.3180 k = 0.2955 0.1706 0.7865 ( 4816 PWs) bands (ev): -37.7120 -37.7120 -37.6459 -37.6459 3.5935 3.5935 3.9641 3.9641 4.9101 4.9101 5.4899 5.4899 6.3546 6.3546 8.7148 8.7148 10.0137 10.0137 13.1716 13.1716 15.1930 15.1930 15.3615 15.3615 k = 0.3068 0.1771 0.7865 ( 4820 PWs) bands (ev): -37.7108 -37.7108 -37.6471 -37.6471 3.5867 3.5867 3.9553 3.9553 4.9414 4.9414 5.5255 5.5255 6.3691 6.3691 8.7275 8.7275 9.9339 9.9339 13.0625 13.0625 15.2323 15.2323 15.4045 15.4045 k = 0.3182 0.1837 0.7865 ( 4820 PWs) bands (ev): -37.7097 -37.7097 -37.6483 -37.6483 3.5800 3.5800 3.9468 3.9468 4.9673 4.9673 5.5682 5.5682 6.3847 6.3847 8.7382 8.7382 9.8505 9.8505 12.9613 12.9613 15.2714 15.2714 15.4467 15.4467 k = 0.3295 0.1903 0.7865 ( 4820 PWs) bands (ev): -37.7085 -37.7085 -37.6495 -37.6495 3.5733 3.5733 3.9387 3.9387 4.9878 4.9878 5.6174 5.6174 6.4015 6.4015 8.7466 8.7466 9.7644 9.7644 12.8681 12.8681 15.3102 15.3102 15.4880 15.4880 k = 0.3409 0.1968 0.7865 ( 4820 PWs) bands (ev): -37.7073 -37.7073 -37.6507 -37.6507 3.5667 3.5667 3.9309 3.9309 5.0034 5.0034 5.6723 5.6723 6.4197 6.4197 8.7519 8.7519 9.6765 9.6765 12.7828 12.7828 15.3482 15.3482 15.5282 15.5282 k = 0.3523 0.2034 0.7865 ( 4824 PWs) bands (ev): -37.7061 -37.7061 -37.6519 -37.6519 3.5603 3.5603 3.9236 3.9236 5.0150 5.0150 5.7313 5.7313 6.4396 6.4396 8.7534 8.7534 9.5884 9.5884 12.7053 12.7053 15.3847 15.3847 15.5656 15.5657 k = 0.3636 0.2099 0.7865 ( 4824 PWs) bands (ev): -37.7049 -37.7049 -37.6531 -37.6531 3.5542 3.5542 3.9166 3.9166 5.0232 5.0232 5.7928 5.7928 6.4616 6.4616 8.7498 8.7498 9.5018 9.5018 12.6354 12.6354 15.4172 15.4172 15.5079 15.5079 k = 0.3750 0.2165 0.7865 ( 4822 PWs) bands (ev): -37.7038 -37.7038 -37.6542 -37.6542 3.5483 3.5483 3.9101 3.9101 5.0288 5.0288 5.8552 5.8552 6.4863 6.4863 8.7396 8.7396 9.4191 9.4191 12.5728 12.5728 15.4235 15.4235 15.4785 15.4785 k = 0.3864 0.2231 0.7865 ( 4814 PWs) bands (ev): -37.7026 -37.7026 -37.6553 -37.6553 3.5428 3.5428 3.9041 3.9041 5.0324 5.0324 5.9166 5.9166 6.5142 6.5142 8.7211 8.7211 9.3430 9.3430 12.5171 12.5171 15.3814 15.3814 15.5003 15.5003 k = 0.3977 0.2296 0.7865 ( 4818 PWs) bands (ev): -37.7016 -37.7016 -37.6564 -37.6564 3.5376 3.5376 3.8986 3.8986 5.0345 5.0345 5.9751 5.9751 6.5460 6.5460 8.6925 8.6925 9.2765 9.2765 12.4681 12.4681 15.3343 15.3343 15.5296 15.5296 k = 0.4091 0.2362 0.7865 ( 4822 PWs) bands (ev): -37.7005 -37.7005 -37.6575 -37.6575 3.5329 3.5329 3.8936 3.8936 5.0356 5.0356 6.0289 6.0289 6.5820 6.5820 8.6529 8.6529 9.2217 9.2217 12.4253 12.4253 15.2907 15.2907 15.5580 15.5580 k = 0.4205 0.2427 0.7865 ( 4818 PWs) bands (ev): -37.6995 -37.6995 -37.6585 -37.6585 3.5287 3.5287 3.8892 3.8892 5.0359 5.0359 6.0767 6.0767 6.6222 6.6222 8.6030 8.6030 9.1793 9.1793 12.3885 12.3885 15.2515 15.2515 15.5842 15.5842 k = 0.4318 0.2493 0.7865 ( 4826 PWs) bands (ev): -37.6987 -37.6987 -37.6594 -37.6594 3.5250 3.5250 3.8853 3.8853 5.0358 5.0358 6.1175 6.1175 6.6658 6.6658 8.5456 8.5456 9.1483 9.1483 12.3572 12.3572 15.2173 15.2173 15.6076 15.6076 k = 0.4432 0.2559 0.7865 ( 4818 PWs) bands (ev): -37.6979 -37.6979 -37.6601 -37.6601 3.5218 3.5218 3.8820 3.8820 5.0354 5.0354 6.1510 6.1510 6.7111 6.7111 8.4851 8.4851 9.1265 9.1265 12.3313 12.3313 15.1880 15.1880 15.6280 15.6280 k = 0.4545 0.2624 0.7865 ( 4818 PWs) bands (ev): -37.6972 -37.6972 -37.6608 -37.6608 3.5191 3.5191 3.8793 3.8793 5.0349 5.0349 6.1772 6.1772 6.7554 6.7554 8.4262 8.4262 9.1117 9.1117 12.3104 12.3104 15.1640 15.1640 15.6450 15.6450 k = 0.4659 0.2690 0.7865 ( 4818 PWs) bands (ev): -37.6966 -37.6966 -37.6614 -37.6614 3.5171 3.5171 3.8771 3.8771 5.0344 5.0344 6.1968 6.1968 6.7956 6.7956 8.3737 8.3737 9.1020 9.1020 12.2944 12.2944 15.1452 15.1452 15.6584 15.6584 k = 0.4773 0.2756 0.7865 ( 4828 PWs) bands (ev): -37.6962 -37.6962 -37.6618 -37.6618 3.5156 3.5156 3.8756 3.8756 5.0340 5.0340 6.2103 6.2103 6.8279 6.8279 8.3321 8.3321 9.0960 9.0960 12.2830 12.2830 15.1318 15.1318 15.6681 15.6681 k = 0.4886 0.2821 0.7865 ( 4824 PWs) bands (ev): -37.6960 -37.6960 -37.6621 -37.6621 3.5147 3.5147 3.8747 3.8747 5.0337 5.0337 6.2182 6.2182 6.8490 6.8490 8.3053 8.3053 9.0927 9.0927 12.2763 12.2763 15.1237 15.1237 15.6739 15.6739 k = 0.5000 0.2887 0.7865 ( 4820 PWs) bands (ev): -37.6959 -37.6959 -37.6621 -37.6621 3.5144 3.5144 3.8744 3.8744 5.0336 5.0336 6.2208 6.2208 6.8563 6.8563 8.2961 8.2961 9.0916 9.0916 12.2740 12.2740 15.1210 15.1210 15.6759 15.6759 k = 0.5000 0.2887 0.7865 ( 4820 PWs) bands (ev): -37.6959 -37.6959 -37.6621 -37.6621 3.5144 3.5144 3.8744 3.8744 5.0336 5.0336 6.2208 6.2208 6.8563 6.8563 8.2961 8.2961 9.0916 9.0916 12.2740 12.2740 15.1210 15.1210 15.6759 15.6759 k = 0.4936 0.2998 0.7865 ( 4828 PWs) bands (ev): -37.6959 -37.6959 -37.6622 -37.6622 3.5143 3.5143 3.8743 3.8743 5.0346 5.0346 6.2199 6.2199 6.8555 6.8555 8.2991 8.2991 9.0925 9.0925 12.2722 12.2722 15.0879 15.0879 15.6778 15.6778 k = 0.4872 0.3109 0.7865 ( 4828 PWs) bands (ev): -37.6958 -37.6958 -37.6622 -37.6622 3.5142 3.5142 3.8740 3.8740 5.0373 5.0373 6.2170 6.2170 6.8529 6.8529 8.3082 8.3082 9.0953 9.0953 12.2666 12.2666 14.9984 14.9984 15.6813 15.6813 k = 0.4808 0.3220 0.7865 ( 4824 PWs) bands (ev): -37.6956 -37.6956 -37.6624 -37.6624 3.5140 3.5140 3.8736 3.8736 5.0419 5.0419 6.2123 6.2123 6.8488 6.8488 8.3230 8.3230 9.1001 9.1001 12.2570 12.2570 14.8720 14.8720 15.6832 15.6832 k = 0.4744 0.3331 0.7865 ( 4820 PWs) bands (ev): -37.6955 -37.6955 -37.6626 -37.6626 3.5136 3.5136 3.8730 3.8730 5.0483 5.0483 6.2059 6.2059 6.8431 6.8431 8.3434 8.3434 9.1068 9.1068 12.2433 12.2433 14.7249 14.7249 15.6826 15.6826 k = 0.4679 0.3442 0.7865 ( 4820 PWs) bands (ev): -37.6952 -37.6952 -37.6628 -37.6628 3.5132 3.5132 3.8722 3.8722 5.0564 5.0564 6.1979 6.1979 6.8362 6.8362 8.3688 8.3688 9.1157 9.1157 12.2248 12.2248 14.5679 14.5679 15.6794 15.6794 k = 0.4615 0.3553 0.7865 ( 4824 PWs) bands (ev): -37.6949 -37.6949 -37.6631 -37.6631 3.5128 3.5128 3.8712 3.8712 5.0662 5.0662 6.1885 6.1885 6.8282 6.8282 8.3987 8.3987 9.1269 9.1269 12.2010 12.2010 14.4078 14.4078 15.6741 15.6741 k = 0.4551 0.3664 0.7865 ( 4824 PWs) bands (ev): -37.6946 -37.6946 -37.6635 -37.6635 3.5122 3.5122 3.8701 3.8701 5.0776 5.0776 6.1779 6.1779 6.8192 6.8192 8.4324 8.4324 9.1406 9.1406 12.1712 12.1712 14.2490 14.2490 15.6671 15.6671 k = 0.4487 0.3775 0.7865 ( 4822 PWs) bands (ev): -37.6942 -37.6942 -37.6639 -37.6639 3.5116 3.5116 3.8688 3.8688 5.0903 5.0903 6.1665 6.1665 6.8095 6.8095 8.4693 8.4693 9.1572 9.1572 12.1346 12.1346 14.0949 14.0949 15.6586 15.6586 k = 0.4423 0.3886 0.7865 ( 4818 PWs) bands (ev): -37.6937 -37.6937 -37.6643 -37.6643 3.5108 3.5108 3.8674 3.8674 5.1044 5.1044 6.1543 6.1543 6.7993 6.7993 8.5084 8.5084 9.1770 9.1770 12.0901 12.0901 13.9479 13.9479 15.6489 15.6489 k = 0.4359 0.3997 0.7865 ( 4818 PWs) bands (ev): -37.6932 -37.6932 -37.6648 -37.6648 3.5101 3.5101 3.8658 3.8658 5.1196 5.1196 6.1419 6.1419 6.7887 6.7887 8.5491 8.5491 9.2006 9.2006 12.0368 12.0368 13.8103 13.8103 15.6385 15.6385 k = 0.4295 0.4108 0.7865 ( 4818 PWs) bands (ev): -37.6926 -37.6926 -37.6654 -37.6654 3.5092 3.5092 3.8641 3.8641 5.1357 5.1357 6.1294 6.1294 6.7778 6.7778 8.5901 8.5901 9.2284 9.2284 11.9738 11.9738 13.6838 13.6838 15.6277 15.6277 k = 0.4231 0.4219 0.7865 ( 4802 PWs) bands (ev): -37.6920 -37.6920 -37.6660 -37.6660 3.5083 3.5083 3.8623 3.8623 5.1525 5.1525 6.1172 6.1172 6.7667 6.7667 8.6307 8.6307 9.2611 9.2611 11.9004 11.9004 13.5695 13.5695 15.6169 15.6169 k = 0.4167 0.4330 0.7865 ( 4814 PWs) bands (ev): -37.6913 -37.6913 -37.6667 -37.6667 3.5074 3.5074 3.8605 3.8605 5.1697 5.1697 6.1057 6.1057 6.7556 6.7556 8.6699 8.6699 9.2993 9.2993 11.8166 11.8166 13.4684 13.4684 15.6064 15.6064 k = 0.4103 0.4441 0.7865 ( 4814 PWs) bands (ev): -37.6906 -37.6906 -37.6674 -37.6674 3.5065 3.5065 3.8586 3.8586 5.1871 5.1871 6.0951 6.0951 6.7445 6.7445 8.7067 8.7067 9.3433 9.3433 11.7227 11.7227 13.3805 13.3805 15.5966 15.5966 k = 0.4038 0.4552 0.7865 ( 4818 PWs) bands (ev): -37.6899 -37.6899 -37.6681 -37.6681 3.5055 3.5055 3.8567 3.8567 5.2043 5.2043 6.0858 6.0858 6.7336 6.7336 8.7406 8.7406 9.3937 9.3937 11.6194 11.6194 13.3053 13.3053 15.5877 15.5877 k = 0.3974 0.4663 0.7865 ( 4822 PWs) bands (ev): -37.6891 -37.6891 -37.6689 -37.6689 3.5045 3.5045 3.8547 3.8547 5.2209 5.2209 6.0779 6.0779 6.7229 6.7229 8.7711 8.7711 9.4504 9.4504 11.5083 11.5083 13.2421 13.2421 15.5799 15.5799 k = 0.3910 0.4774 0.7865 ( 4822 PWs) bands (ev): -37.6883 -37.6883 -37.6698 -37.6698 3.5035 3.5035 3.8528 3.8528 5.2367 5.2367 6.0718 6.0718 6.7125 6.7125 8.7980 8.7980 9.5135 9.5135 11.3908 11.3908 13.1895 13.1895 15.5734 15.5734 k = 0.3846 0.4885 0.7865 ( 4818 PWs) bands (ev): -37.6874 -37.6874 -37.6706 -37.6706 3.5026 3.5026 3.8510 3.8510 5.2514 5.2514 6.0675 6.0675 6.7026 6.7026 8.8213 8.8213 9.5827 9.5827 11.2687 11.2687 13.1462 13.1462 15.5682 15.5682 k = 0.3782 0.4996 0.7865 ( 4818 PWs) bands (ev): -37.6865 -37.6865 -37.6716 -37.6716 3.5016 3.5016 3.8493 3.8493 5.2645 5.2645 6.0651 6.0651 6.6933 6.6933 8.8411 8.8411 9.6576 9.6576 11.1438 11.1438 13.1111 13.1111 15.5645 15.5645 k = 0.3718 0.5107 0.7865 ( 4816 PWs) bands (ev): -37.6855 -37.6855 -37.6725 -37.6725 3.5008 3.5008 3.8477 3.8477 5.2760 5.2760 6.0645 6.0645 6.6847 6.6847 8.8577 8.8577 9.7377 9.7377 11.0175 11.0175 13.0830 13.0830 15.5621 15.5621 k = 0.3654 0.5218 0.7865 ( 4820 PWs) bands (ev): -37.6845 -37.6845 -37.6735 -37.6735 3.5000 3.5000 3.8463 3.8463 5.2857 5.2857 6.0655 6.0655 6.6770 6.6770 8.8712 8.8712 9.8225 9.8225 10.8913 10.8913 13.0608 13.0608 15.5610 15.5610 k = 0.3590 0.5329 0.7865 ( 4812 PWs) bands (ev): -37.6835 -37.6835 -37.6745 -37.6745 3.4993 3.4993 3.8450 3.8450 5.2934 5.2934 6.0677 6.0677 6.6704 6.6704 8.8818 8.8818 9.9118 9.9118 10.7667 10.7667 13.0438 13.0438 15.5610 15.5610 k = 0.3526 0.5440 0.7865 ( 4808 PWs) bands (ev): -37.6824 -37.6824 -37.6756 -37.6756 3.4987 3.4987 3.8440 3.8440 5.2991 5.2991 6.0706 6.0706 6.6650 6.6650 8.8899 8.8899 10.0049 10.0049 10.6447 10.6447 13.0314 13.0314 15.5617 15.5617 k = 0.3462 0.5551 0.7865 ( 4808 PWs) bands (ev): -37.6813 -37.6813 -37.6767 -37.6767 3.4983 3.4983 3.8433 3.8433 5.3031 5.3031 6.0735 6.0735 6.6612 6.6612 8.8954 8.8954 10.1017 10.1017 10.5265 10.5265 13.0229 13.0229 15.5629 15.5629 k = 0.3397 0.5662 0.7865 ( 4804 PWs) bands (ev): -37.6802 -37.6802 -37.6778 -37.6778 3.4980 3.4980 3.8428 3.8428 5.3053 5.3053 6.0757 6.0757 6.6588 6.6588 8.8987 8.8987 10.2017 10.2017 10.4132 10.4132 13.0180 13.0180 15.5639 15.5639 k = 0.3333 0.5774 0.7865 ( 4800 PWs) bands (ev): -37.6790 -37.6790 -37.6790 -37.6790 3.4979 3.4979 3.8426 3.8426 5.3060 5.3060 6.0767 6.0767 6.6580 6.6580 8.8997 8.8997 10.2971 10.2971 10.3131 10.3131 13.0164 13.0164 15.5644 15.5644 k = 0.3333 0.5774 0.7865 ( 4800 PWs) bands (ev): -37.6790 -37.6790 -37.6790 -37.6790 3.4979 3.4979 3.8426 3.8426 5.3060 5.3060 6.0767 6.0767 6.6580 6.6580 8.8997 8.8997 10.2971 10.2971 10.3131 10.3131 13.0164 13.0164 15.5644 15.5644 k = 0.3268 0.5660 0.7865 ( 4808 PWs) bands (ev): -37.6802 -37.6802 -37.6778 -37.6778 3.4980 3.4980 3.8428 3.8428 5.3053 5.3053 6.0755 6.0755 6.6588 6.6588 8.8987 8.8987 10.2017 10.2017 10.4136 10.4136 13.0180 13.0180 15.5637 15.5637 k = 0.3203 0.5547 0.7865 ( 4812 PWs) bands (ev): -37.6815 -37.6815 -37.6766 -37.6766 3.4984 3.4984 3.8434 3.8434 5.3036 5.3036 6.0716 6.0716 6.6608 6.6608 8.8957 8.8957 10.1064 10.1064 10.5243 10.5243 13.0226 13.0226 15.5614 15.5614 k = 0.3137 0.5434 0.7865 ( 4814 PWs) bands (ev): -37.6827 -37.6827 -37.6753 -37.6753 3.4990 3.4990 3.8443 3.8443 5.3009 5.3009 6.0645 6.0645 6.6637 6.6637 8.8910 8.8910 10.0192 10.0192 10.6376 10.6376 13.0302 13.0302 15.5571 15.5571 k = 0.3072 0.5321 0.7865 ( 4818 PWs) bands (ev): -37.6840 -37.6840 -37.6740 -37.6740 3.4998 3.4998 3.8456 3.8456 5.2975 5.2975 6.0538 6.0538 6.6670 6.6670 8.8848 8.8848 9.9410 9.9410 10.7534 10.7534 13.0407 13.0407 15.5507 15.5507 k = 0.3007 0.5207 0.7865 ( 4818 PWs) bands (ev): -37.6853 -37.6853 -37.6727 -37.6727 3.5010 3.5010 3.8473 3.8473 5.2936 5.2936 6.0395 6.0395 6.6698 6.6698 8.8777 8.8777 9.8722 9.8722 10.8714 10.8714 13.0542 13.0542 15.5422 15.5422 k = 0.2941 0.5094 0.7865 ( 4816 PWs) bands (ev): -37.6866 -37.6866 -37.6714 -37.6714 3.5026 3.5026 3.8495 3.8495 5.2893 5.2893 6.0213 6.0213 6.6716 6.6716 8.8699 8.8699 9.8129 9.8129 10.9915 10.9915 13.0706 13.0706 15.5319 15.5319 k = 0.2876 0.4981 0.7865 ( 4804 PWs) bands (ev): -37.6880 -37.6880 -37.6700 -37.6700 3.5044 3.5044 3.8520 3.8520 5.2848 5.2848 5.9994 5.9994 6.6717 6.6717 8.8620 8.8620 9.7633 9.7633 11.1136 11.1136 13.0900 13.0900 15.5197 15.5197 k = 0.2810 0.4868 0.7865 ( 4812 PWs) bands (ev): -37.6893 -37.6893 -37.6687 -37.6687 3.5066 3.5066 3.8550 3.8550 5.2802 5.2802 5.9738 5.9738 6.6694 6.6694 8.8545 8.8545 9.7234 9.7234 11.2375 11.2375 13.1127 13.1127 15.5060 15.5060 k = 0.2745 0.4755 0.7865 ( 4818 PWs) bands (ev): -37.6907 -37.6907 -37.6673 -37.6673 3.5092 3.5092 3.8585 3.8585 5.2756 5.2756 5.9446 5.9446 6.6644 6.6644 8.8477 8.8477 9.6929 9.6929 11.3632 11.3632 13.1386 13.1386 15.4909 15.4909 k = 0.2680 0.4641 0.7865 ( 4830 PWs) bands (ev): -37.6920 -37.6920 -37.6660 -37.6660 3.5122 3.5122 3.8623 3.8623 5.2708 5.2708 5.9119 5.9119 6.6564 6.6564 8.8419 8.8419 9.6716 9.6716 11.4904 11.4904 13.1681 13.1681 15.4744 15.4744 k = 0.2614 0.4528 0.7865 ( 4822 PWs) bands (ev): -37.6934 -37.6934 -37.6646 -37.6646 3.5155 3.5155 3.8666 3.8666 5.2661 5.2661 5.8759 5.8759 6.6455 6.6455 8.8371 8.8371 9.6593 9.6593 11.6192 11.6192 13.2012 13.2012 15.4566 15.4566 k = 0.2549 0.4415 0.7865 ( 4822 PWs) bands (ev): -37.6948 -37.6948 -37.6632 -37.6632 3.5192 3.5192 3.8713 3.8714 5.2612 5.2612 5.8368 5.8368 6.6317 6.6317 8.8331 8.8331 9.6555 9.6555 11.7493 11.7493 13.2383 13.2383 15.4377 15.4377 k = 0.2484 0.4302 0.7865 ( 4826 PWs) bands (ev): -37.6962 -37.6962 -37.6619 -37.6619 3.5233 3.5233 3.8765 3.8765 5.2561 5.2561 5.7950 5.7950 6.6155 6.6155 8.8298 8.8298 9.6599 9.6599 11.8806 11.8806 13.2796 13.2796 15.4177 15.4177 k = 0.2418 0.4189 0.7865 ( 4818 PWs) bands (ev): -37.6975 -37.6975 -37.6605 -37.6605 3.5278 3.5278 3.8820 3.8820 5.2505 5.2505 5.7509 5.7509 6.5971 6.5971 8.8265 8.8265 9.6723 9.6723 12.0130 12.0130 13.3254 13.3254 15.3966 15.3966 k = 0.2353 0.4075 0.7865 ( 4822 PWs) bands (ev): -37.6989 -37.6989 -37.6591 -37.6591 3.5326 3.5326 3.8880 3.8880 5.2442 5.2442 5.7050 5.7050 6.5771 6.5771 8.8230 8.8230 9.6920 9.6920 12.1463 12.1463 13.3759 13.3759 15.3745 15.3745 k = 0.2288 0.3962 0.7865 ( 4820 PWs) bands (ev): -37.7003 -37.7003 -37.6577 -37.6577 3.5378 3.5378 3.8943 3.8943 5.2366 5.2366 5.6580 5.6580 6.5560 6.5560 8.8188 8.8188 9.7186 9.7186 12.2804 12.2804 13.4315 13.4315 15.3514 15.3514 k = 0.2222 0.3849 0.7865 ( 4816 PWs) bands (ev): -37.7016 -37.7016 -37.6564 -37.6564 3.5433 3.5433 3.9010 3.9010 5.2271 5.2271 5.6110 5.6110 6.5341 6.5341 8.8135 8.8135 9.7513 9.7513 12.4150 12.4150 13.4924 13.4924 15.3275 15.3275 k = 0.2157 0.3736 0.7865 ( 4820 PWs) bands (ev): -37.7030 -37.7030 -37.6550 -37.6550 3.5491 3.5491 3.9081 3.9081 5.2148 5.2148 5.5652 5.5652 6.5120 6.5120 8.8070 8.8070 9.7894 9.7894 12.5501 12.5501 13.5591 13.5591 15.3028 15.3028 k = 0.2092 0.3623 0.7865 ( 4816 PWs) bands (ev): -37.7043 -37.7043 -37.6537 -37.6537 3.5552 3.5552 3.9155 3.9155 5.1982 5.1982 5.5224 5.5224 6.4899 6.4899 8.7990 8.7990 9.8322 9.8322 12.6854 12.6854 13.6317 13.6317 15.2773 15.2773 k = 0.2026 0.3509 0.7865 ( 4808 PWs) bands (ev): -37.7056 -37.7056 -37.6523 -37.6523 3.5615 3.5615 3.9233 3.9233 5.1761 5.1761 5.4842 5.4842 6.4682 6.4682 8.7896 8.7896 9.8787 9.8787 12.8207 12.8207 13.7106 13.7106 15.2511 15.2511 k = 0.1961 0.3396 0.7865 ( 4812 PWs) bands (ev): -37.7069 -37.7069 -37.6510 -37.6510 3.5680 3.5680 3.9313 3.9313 5.1471 5.1471 5.4523 5.4523 6.4470 6.4470 8.7788 8.7788 9.9280 9.9280 12.9560 12.9560 13.7959 13.7959 15.2243 15.2243 k = 0.1895 0.3283 0.7865 ( 4816 PWs) bands (ev): -37.7082 -37.7082 -37.6497 -37.6497 3.5746 3.5746 3.9396 3.9396 5.1110 5.1110 5.4274 5.4274 6.4266 6.4266 8.7667 8.7667 9.9794 9.9794 13.0909 13.0909 13.8879 13.8879 15.1969 15.1969 k = 0.1830 0.3170 0.7865 ( 4812 PWs) bands (ev): -37.7095 -37.7095 -37.6485 -37.6485 3.5813 3.5813 3.9482 3.9482 5.0683 5.0683 5.4092 5.4092 6.4072 6.4072 8.7533 8.7533 10.0321 10.0321 13.2254 13.2254 13.9865 13.9865 15.1692 15.1692 k = 0.1765 0.3057 0.7865 ( 4816 PWs) bands (ev): -37.7107 -37.7107 -37.6472 -37.6472 3.5880 3.5880 3.9570 3.9570 5.0206 5.0206 5.3966 5.3966 6.3887 6.3887 8.7387 8.7387 10.0853 10.0853 13.3594 13.3594 14.0916 14.0916 15.1412 15.1412 k = 0.1699 0.2943 0.7865 ( 4812 PWs) bands (ev): -37.7119 -37.7119 -37.6460 -37.6460 3.5947 3.5947 3.9660 3.9660 4.9695 4.9695 5.3883 5.3883 6.3712 6.3712 8.7231 8.7231 10.1385 10.1385 13.4928 13.4928 14.2030 14.2030 15.1130 15.1130 k = 0.1634 0.2830 0.7865 ( 4814 PWs) bands (ev): -37.7131 -37.7131 -37.6448 -37.6448 3.6012 3.6012 3.9752 3.9752 4.9164 4.9164 5.3831 5.3831 6.3549 6.3549 8.7067 8.7067 10.1910 10.1910 13.6254 13.6254 14.3204 14.3204 15.0848 15.0848 k = 0.1569 0.2717 0.7865 ( 4810 PWs) bands (ev): -37.7143 -37.7143 -37.6436 -37.6436 3.6075 3.6075 3.9845 3.9845 4.8624 4.8624 5.3801 5.3801 6.3397 6.3397 8.6895 8.6895 10.2425 10.2425 13.7573 13.7573 14.4431 14.4431 15.0571 15.0571 k = 0.1503 0.2604 0.7865 ( 4814 PWs) bands (ev): -37.7154 -37.7154 -37.6425 -37.6425 3.6135 3.6135 3.9939 3.9939 4.8084 4.8084 5.3788 5.3788 6.3257 6.3257 8.6716 8.6716 10.2925 10.2925 13.8882 13.8882 14.5700 14.5700 15.0302 15.0302 k = 0.1438 0.2491 0.7865 ( 4814 PWs) bands (ev): -37.7165 -37.7165 -37.6414 -37.6414 3.6192 3.6192 4.0035 4.0035 4.7552 4.7552 5.3787 5.3787 6.3128 6.3128 8.6533 8.6533 10.3406 10.3406 14.0178 14.0178 14.6986 14.6986 15.0059 15.0059 k = 0.1373 0.2377 0.7865 ( 4818 PWs) bands (ev): -37.7176 -37.7176 -37.6404 -37.6404 3.6243 3.6243 4.0130 4.0130 4.7032 4.7032 5.3795 5.3795 6.3011 6.3011 8.6345 8.6345 10.3867 10.3867 14.1456 14.1456 14.8204 14.8204 14.9907 14.9907 k = 0.1307 0.2264 0.7865 ( 4830 PWs) bands (ev): -37.7186 -37.7186 -37.6393 -37.6393 3.6289 3.6289 4.0226 4.0226 4.6530 4.6530 5.3808 5.3808 6.2904 6.2904 8.6155 8.6155 10.4306 10.4306 14.2711 14.2711 14.8924 14.8924 15.0181 15.0181 k = 0.1242 0.2151 0.7865 ( 4822 PWs) bands (ev): -37.7196 -37.7196 -37.6383 -37.6383 3.6328 3.6328 4.0321 4.0321 4.6048 4.6048 5.3826 5.3826 6.2808 6.2808 8.5963 8.5963 10.4721 10.4721 14.3932 14.3932 14.8907 14.8907 15.0514 15.0514 k = 0.1176 0.2038 0.7865 ( 4826 PWs) bands (ev): -37.7205 -37.7205 -37.6374 -37.6374 3.6360 3.6360 4.0416 4.0416 4.5589 4.5589 5.3846 5.3846 6.2723 6.2723 8.5772 8.5772 10.5112 10.5112 14.5109 14.5109 14.8709 14.8709 15.0235 15.0235 k = 0.1111 0.1925 0.7865 ( 4830 PWs) bands (ev): -37.7214 -37.7214 -37.6365 -37.6365 3.6384 3.6384 4.0509 4.0509 4.5157 4.5157 5.3868 5.3868 6.2648 6.2648 8.5581 8.5581 10.5478 10.5478 14.6225 14.6225 14.8486 14.8486 14.9844 14.9844 k = 0.1046 0.1811 0.7865 ( 4826 PWs) bands (ev): -37.7223 -37.7223 -37.6356 -37.6356 3.6399 3.6399 4.0601 4.0601 4.4753 4.4753 5.3891 5.3891 6.2583 6.2583 8.5393 8.5393 10.5819 10.5819 14.7235 14.7235 14.8295 14.8295 14.9444 14.9444 k = 0.0980 0.1698 0.7865 ( 4818 PWs) bands (ev): -37.7231 -37.7231 -37.6348 -37.6348 3.6405 3.6405 4.0691 4.0691 4.4378 4.4378 5.3914 5.3914 6.2526 6.2526 8.5208 8.5208 10.6136 10.6136 14.7784 14.7784 14.8473 14.8473 14.9070 14.9070 k = 0.0915 0.1585 0.7865 ( 4822 PWs) bands (ev): -37.7239 -37.7239 -37.6340 -37.6340 3.6401 3.6401 4.0778 4.0778 4.4034 4.4034 5.3936 5.3936 6.2478 6.2478 8.5029 8.5029 10.6428 10.6428 14.7664 14.7664 14.8628 14.8628 14.9321 14.9321 k = 0.0850 0.1472 0.7865 ( 4826 PWs) bands (ev): -37.7246 -37.7246 -37.6333 -37.6333 3.6389 3.6389 4.0861 4.0861 4.3721 4.3721 5.3958 5.3958 6.2437 6.2437 8.4855 8.4855 10.6696 10.6696 14.7462 14.7462 14.8287 14.8287 15.0081 15.0081 k = 0.0784 0.1358 0.7865 ( 4828 PWs) bands (ev): -37.7252 -37.7252 -37.6326 -37.6326 3.6367 3.6367 4.0941 4.0941 4.3439 4.3439 5.3978 5.3978 6.2403 6.2403 8.4688 8.4688 10.6940 10.6940 14.7258 14.7258 14.7953 14.7953 15.0766 15.0766 k = 0.0719 0.1245 0.7865 ( 4828 PWs) bands (ev): -37.7259 -37.7259 -37.6320 -37.6320 3.6339 3.6339 4.1017 4.1017 4.3188 4.3188 5.3997 5.3997 6.2376 6.2376 8.4529 8.4529 10.7162 10.7162 14.7061 14.7061 14.7640 14.7640 15.1352 15.1352 k = 0.0654 0.1132 0.7865 ( 4824 PWs) bands (ev): -37.7264 -37.7264 -37.6314 -37.6314 3.6303 3.6303 4.1088 4.1088 4.2967 4.2967 5.4015 5.4015 6.2354 6.2354 8.4380 8.4380 10.7362 10.7362 14.6877 14.6877 14.7351 14.7351 15.1839 15.1839 k = 0.0588 0.1019 0.7865 ( 4820 PWs) bands (ev): -37.7270 -37.7270 -37.6309 -37.6309 3.6263 3.6263 4.1154 4.1154 4.2775 4.2775 5.4031 5.4031 6.2337 6.2337 8.4242 8.4242 10.7541 10.7541 14.6706 14.6706 14.7087 14.7087 15.2232 15.2232 k = 0.0523 0.0906 0.7865 ( 4816 PWs) bands (ev): -37.7274 -37.7274 -37.6304 -37.6304 3.6220 3.6220 4.1214 4.1214 4.2610 4.2610 5.4046 5.4046 6.2324 6.2324 8.4115 8.4115 10.7699 10.7699 14.6550 14.6550 14.6849 14.6849 15.2542 15.2542 k = 0.0458 0.0792 0.7865 ( 4824 PWs) bands (ev): -37.7278 -37.7278 -37.6300 -37.6300 3.6176 3.6176 4.1268 4.1268 4.2470 4.2470 5.4058 5.4058 6.2314 6.2314 8.4000 8.4000 10.7837 10.7837 14.6410 14.6410 14.6637 14.6637 15.2779 15.2779 k = 0.0392 0.0679 0.7865 ( 4824 PWs) bands (ev): -37.7282 -37.7282 -37.6296 -37.6296 3.6132 3.6132 4.1315 4.1315 4.2355 4.2355 5.4069 5.4069 6.2307 6.2307 8.3899 8.3899 10.7956 10.7956 14.6287 14.6287 14.6453 14.6453 15.2956 15.2956 k = 0.0327 0.0566 0.7865 ( 4828 PWs) bands (ev): -37.7285 -37.7285 -37.6293 -37.6293 3.6092 3.6092 4.1355 4.1355 4.2261 4.2261 5.4079 5.4079 6.2302 6.2302 8.3812 8.3812 10.8055 10.8055 14.6182 14.6182 14.6296 14.6296 15.3085 15.3085 k = 0.0261 0.0453 0.7865 ( 4832 PWs) bands (ev): -37.7288 -37.7288 -37.6291 -37.6291 3.6056 3.6056 4.1388 4.1388 4.2187 4.2187 5.4086 5.4086 6.2299 6.2299 8.3740 8.3740 10.8136 10.8136 14.6095 14.6095 14.6168 14.6168 15.3175 15.3175 k = 0.0196 0.0340 0.7865 ( 4828 PWs) bands (ev): -37.7290 -37.7290 -37.6289 -37.6289 3.6026 3.6026 4.1413 4.1413 4.2131 4.2131 5.4092 5.4092 6.2297 6.2297 8.3684 8.3684 10.8198 10.8198 14.6027 14.6027 14.6068 14.6068 15.3236 15.3236 k = 0.0131 0.0226 0.7865 ( 4828 PWs) bands (ev): -37.7291 -37.7291 -37.6287 -37.6287 3.6004 3.6004 4.1431 4.1431 4.2093 4.2093 5.4096 5.4096 6.2295 6.2295 8.3643 8.3643 10.8242 10.8242 14.5979 14.5979 14.5996 14.5996 15.3275 15.3275 k = 0.0065 0.0113 0.7865 ( 4824 PWs) bands (ev): -37.7292 -37.7292 -37.6286 -37.6286 3.5991 3.5991 4.1442 4.1442 4.2071 4.2071 5.4099 5.4099 6.2295 6.2295 8.3618 8.3618 10.8269 10.8269 14.5948 14.5948 14.5954 14.5954 15.3296 15.3296 k = 0.0000 0.0000 0.7865 ( 4816 PWs) bands (ev): -37.7292 -37.7292 -37.6286 -37.6286 3.5986 3.5986 4.1445 4.1445 4.2063 4.2063 5.4099 5.4099 6.2295 6.2295 8.3610 8.3610 10.8278 10.8278 14.5937 14.5937 14.5941 14.5941 15.3303 15.3303 k = 0.5000 0.2887 0.7865 ( 4820 PWs) bands (ev): -37.6959 -37.6959 -37.6621 -37.6621 3.5144 3.5144 3.8744 3.8744 5.0336 5.0336 6.2208 6.2208 6.8563 6.8563 8.2961 8.2961 9.0916 9.0916 12.2740 12.2740 15.1210 15.1210 15.6759 15.6759 k = 0.5000 0.2887 0.7734 ( 4832 PWs) bands (ev): -37.6959 -37.6959 -37.6622 -37.6622 3.5155 3.5155 3.8755 3.8755 5.0330 5.0330 6.2200 6.2200 6.8555 6.8555 8.2932 8.2932 9.0820 9.0820 12.2848 12.2848 15.0805 15.0805 15.6895 15.6895 k = 0.5000 0.2887 0.7603 ( 4828 PWs) bands (ev): -37.6960 -37.6960 -37.6622 -37.6622 3.5188 3.5188 3.8787 3.8787 5.0309 5.0309 6.2176 6.2176 6.8528 6.8528 8.2843 8.2843 9.0539 9.0539 12.3167 12.3167 14.9801 14.9801 15.7122 15.7122 k = 0.5000 0.2887 0.7472 ( 4828 PWs) bands (ev): -37.6961 -37.6961 -37.6623 -37.6623 3.5243 3.5243 3.8840 3.8840 5.0275 5.0275 6.2136 6.2136 6.8484 6.8484 8.2688 8.2688 9.0091 9.0091 12.3685 12.3685 14.8502 14.8502 15.7318 15.7318 k = 0.5000 0.2887 0.7341 ( 4830 PWs) bands (ev): -37.6962 -37.6962 -37.6624 -37.6624 3.5321 3.5321 3.8914 3.8914 5.0228 5.0228 6.2080 6.2080 6.8424 6.8424 8.2455 8.2455 8.9510 8.9510 12.4383 12.4383 14.7071 14.7071 15.7509 15.7509 k = 0.5000 0.2887 0.7210 ( 4822 PWs) bands (ev): -37.6964 -37.6964 -37.6626 -37.6626 3.5420 3.5420 3.9009 3.9009 5.0168 5.0168 6.2009 6.2009 6.8347 6.8347 8.2126 8.2126 8.8836 8.8836 12.5238 12.5238 14.5581 14.5581 15.7720 15.7720 k = 0.5000 0.2887 0.7079 ( 4818 PWs) bands (ev): -37.6966 -37.6966 -37.6628 -37.6628 3.5540 3.5540 3.9124 3.9124 5.0096 5.0096 6.1922 6.1922 6.8253 6.8253 8.1679 8.1679 8.8115 8.8115 12.6230 12.6230 14.4066 14.4066 15.7959 15.7959 k = 0.5000 0.2887 0.6948 ( 4826 PWs) bands (ev): -37.6968 -37.6968 -37.6630 -37.6630 3.5683 3.5683 3.9259 3.9259 5.0011 5.0011 6.1821 6.1821 6.8145 6.8145 8.1087 8.1087 8.7399 8.7399 12.7335 12.7335 14.2542 14.2542 15.8231 15.8231 k = 0.5000 0.2887 0.6817 ( 4824 PWs) bands (ev): -37.6971 -37.6971 -37.6633 -37.6633 3.5846 3.5846 3.9412 3.9412 4.9914 4.9914 6.1705 6.1705 6.8023 6.8023 8.0330 8.0330 8.6729 8.6729 12.8537 12.8537 14.1019 14.1019 15.8536 15.8536 k = 0.5000 0.2887 0.6686 ( 4826 PWs) bands (ev): -37.6975 -37.6975 -37.6636 -37.6636 3.6030 3.6030 3.9582 3.9582 4.9807 4.9807 6.1575 6.1575 6.7886 6.7886 7.9399 7.9399 8.6134 8.6134 12.9817 12.9817 13.9504 13.9504 15.8868 15.8868 k = 0.5000 0.2887 0.6555 ( 4824 PWs) bands (ev): -37.6978 -37.6978 -37.6640 -37.6640 3.6235 3.6235 3.9769 3.9769 4.9689 4.9689 6.1431 6.1431 6.7737 6.7737 7.8307 7.8307 8.5619 8.5619 13.1161 13.1161 13.7998 13.7998 15.9221 15.9221 k = 0.5000 0.2887 0.6423 ( 4824 PWs) bands (ev): -37.6982 -37.6982 -37.6643 -37.6643 3.6460 3.6460 3.9970 3.9970 4.9563 4.9563 6.1275 6.1275 6.7576 6.7576 7.7077 7.7077 8.5174 8.5174 13.2559 13.2559 13.6507 13.6507 15.9578 15.9578 k = 0.5000 0.2887 0.6292 ( 4824 PWs) bands (ev): -37.6986 -37.6986 -37.6647 -37.6647 3.6704 3.6704 4.0183 4.0183 4.9428 4.9428 6.1106 6.1106 6.7404 6.7404 7.5739 7.5739 8.4785 8.4785 13.3994 13.3994 13.5036 13.5036 15.9900 15.9900 k = 0.5000 0.2887 0.6161 ( 4824 PWs) bands (ev): -37.6991 -37.6991 -37.6652 -37.6652 3.6968 3.6968 4.0407 4.0407 4.9288 4.9288 6.0925 6.0925 6.7220 6.7220 7.4322 7.4322 8.4436 8.4436 13.3557 13.3557 13.5486 13.5486 16.0120 16.0120 k = 0.5000 0.2887 0.6030 ( 4816 PWs) bands (ev): -37.6996 -37.6996 -37.6656 -37.6656 3.7250 3.7250 4.0638 4.0638 4.9143 4.9143 6.0734 6.0734 6.7024 6.7024 7.2850 7.2850 8.4113 8.4113 13.2113 13.2113 13.6988 13.6988 16.0179 16.0179 k = 0.5000 0.2887 0.5899 ( 4812 PWs) bands (ev): -37.7001 -37.7001 -37.6661 -37.6661 3.7551 3.7551 4.0872 4.0872 4.8996 4.8996 6.0532 6.0532 6.6815 6.6815 7.1347 7.1347 8.3809 8.3809 13.0684 13.0684 13.8514 13.8514 16.0109 16.0109 k = 0.5000 0.2887 0.5768 ( 4812 PWs) bands (ev): -37.7006 -37.7006 -37.6666 -37.6666 3.7868 3.7868 4.1105 4.1105 4.8851 4.8851 6.0319 6.0319 6.6583 6.6583 6.9839 6.9839 8.3515 8.3515 12.9272 12.9272 14.0054 14.0054 15.9984 15.9984 k = 0.5000 0.2887 0.5637 ( 4808 PWs) bands (ev): -37.7012 -37.7012 -37.6672 -37.6672 3.8202 3.8202 4.1331 4.1331 4.8709 4.8709 6.0096 6.0096 6.6301 6.6301 6.8369 6.8369 8.3228 8.3228 12.7876 12.7876 14.1602 14.1602 15.9852 15.9852 k = 0.5000 0.2887 0.5506 ( 4816 PWs) bands (ev): -37.7018 -37.7018 -37.6677 -37.6677 3.8551 3.8551 4.1542 4.1542 4.8575 4.8575 5.9861 5.9861 6.5830 6.5830 6.7094 6.7094 8.2944 8.2944 12.6498 12.6498 14.3150 14.3150 15.9742 15.9742 k = 0.5000 0.2887 0.5375 ( 4816 PWs) bands (ev): -37.7024 -37.7024 -37.6683 -37.6683 3.8914 3.8914 4.1732 4.1732 4.8454 4.8454 5.9611 5.9611 6.4823 6.4823 6.6377 6.6377 8.2661 8.2661 12.5138 12.5138 14.4688 14.4688 15.9671 15.9671 k = 0.5000 0.2887 0.5244 ( 4816 PWs) bands (ev): -37.7030 -37.7030 -37.6689 -37.6689 3.9290 3.9290 4.1889 4.1889 4.8348 4.8348 5.9340 5.9340 6.3492 6.3492 6.6026 6.6026 8.2377 8.2377 12.3795 12.3795 14.6202 14.6202 15.9654 15.9654 k = 0.5000 0.2887 0.5113 ( 4820 PWs) bands (ev): -37.7037 -37.7037 -37.6696 -37.6696 3.9677 3.9677 4.2003 4.2003 4.8263 4.8263 5.9029 5.9029 6.2153 6.2153 6.5762 6.5762 8.2092 8.2092 12.2470 12.2470 14.7674 14.7674 15.9710 15.9710 k = 0.5000 0.2887 0.4981 ( 4828 PWs) bands (ev): -37.7044 -37.7044 -37.6702 -37.6702 4.0072 4.0072 4.2063 4.2063 4.8197 4.8197 5.8636 5.8636 6.0929 6.0929 6.5521 6.5521 8.1805 8.1805 12.1162 12.1162 14.9080 14.9080 15.9865 15.9865 k = 0.5000 0.2887 0.4850 ( 4832 PWs) bands (ev): -37.7051 -37.7051 -37.6709 -37.6709 4.0471 4.0471 4.2061 4.2061 4.8149 4.8149 5.8068 5.8068 5.9948 5.9948 6.5291 6.5291 8.1515 8.1515 11.9872 11.9872 15.0385 15.0385 16.0151 16.0151 k = 0.5000 0.2887 0.4719 ( 4828 PWs) bands (ev): -37.7058 -37.7058 -37.6716 -37.6716 4.0864 4.0864 4.1993 4.1993 4.8106 4.8106 5.7274 5.7274 5.9296 5.9296 6.5066 6.5066 8.1224 8.1224 11.8598 11.8598 15.1549 15.1549 16.0608 16.0608 k = 0.5000 0.2887 0.4588 ( 4826 PWs) bands (ev): -37.7065 -37.7065 -37.6723 -37.6723 4.1209 4.1209 4.1890 4.1890 4.8052 4.8052 5.6383 5.6383 5.8878 5.8878 6.4845 6.4845 8.0930 8.0930 11.7342 11.7342 15.2531 15.2531 16.1274 16.1274 k = 0.5000 0.2887 0.4457 ( 4822 PWs) bands (ev): -37.7072 -37.7072 -37.6729 -37.6729 4.1301 4.1301 4.1944 4.1944 4.7961 4.7961 5.5558 5.5558 5.8571 5.8571 6.4627 6.4627 8.0633 8.0633 11.6102 11.6102 15.3309 15.3309 16.2172 16.2172 k = 0.5000 0.2887 0.4326 ( 4814 PWs) bands (ev): -37.7079 -37.7079 -37.6736 -37.6736 4.1029 4.1029 4.2256 4.2256 4.7808 4.7808 5.4896 5.4896 5.8320 5.8320 6.4413 6.4413 8.0335 8.0335 11.4878 11.4878 15.3891 15.3891 16.3292 16.3292 k = 0.5000 0.2887 0.4195 ( 4818 PWs) bands (ev): -37.7087 -37.7087 -37.6743 -37.6743 4.0583 4.0583 4.2620 4.2620 4.7584 4.7584 5.4444 5.4444 5.8104 5.8104 6.4202 6.4202 8.0034 8.0034 11.3671 11.3671 15.4307 15.4307 16.4601 16.4601 k = 0.5000 0.2887 0.4064 ( 4822 PWs) bands (ev): -37.7094 -37.7094 -37.6751 -37.6751 4.0016 4.0016 4.2969 4.2969 4.7308 4.7308 5.4207 5.4207 5.7918 5.7918 6.3995 6.3995 7.9733 7.9733 11.2479 11.2479 15.4598 15.4598 16.6059 16.6059 k = 0.5000 0.2887 0.3933 ( 4822 PWs) bands (ev): -37.7102 -37.7102 -37.6758 -37.6758 3.9339 3.9339 4.3268 4.3268 4.7028 4.7028 5.4158 5.4158 5.7762 5.7762 6.3792 6.3792 7.9430 7.9430 11.1303 11.1303 15.4799 15.4799 16.7627 16.7627 k = 0.5000 0.2887 0.3802 ( 4814 PWs) bands (ev): -37.7109 -37.7109 -37.6765 -37.6765 3.8563 3.8563 4.3480 4.3480 4.6813 4.6813 5.4253 5.4253 5.7643 5.7643 6.3595 6.3595 7.9126 7.9126 11.0142 11.0142 15.4938 15.4938 16.9277 16.9277 k = 0.5000 0.2887 0.3671 ( 4812 PWs) bands (ev): -37.7116 -37.7116 -37.6772 -37.6772 3.7703 3.7703 4.3570 4.3570 4.6723 4.6723 5.4441 5.4441 5.7571 5.7571 6.3405 6.3405 7.8821 7.8821 10.8996 10.8996 15.5034 15.5034 17.0988 17.0988 k = 0.5000 0.2887 0.3539 ( 4816 PWs) bands (ev): -37.7124 -37.7124 -37.6779 -37.6779 3.6776 3.6776 4.3525 4.3525 4.6786 4.6786 5.4674 5.4674 5.7562 5.7562 6.3222 6.3222 7.8517 7.8517 10.7864 10.7864 15.5101 15.5101 17.2744 17.2744 k = 0.5000 0.2887 0.3408 ( 4820 PWs) bands (ev): -37.7131 -37.7131 -37.6786 -37.6786 3.5800 3.5800 4.3368 4.3368 4.6982 4.6982 5.4910 5.4910 5.7636 5.7636 6.3048 6.3048 7.8213 7.8213 10.6746 10.6746 15.5148 15.5148 17.4536 17.4536 k = 0.5000 0.2887 0.3277 ( 4816 PWs) bands (ev): -37.7138 -37.7138 -37.6793 -37.6793 3.4792 3.4792 4.3143 4.3143 4.7269 4.7269 5.5113 5.5113 5.7811 5.7811 6.2886 6.2886 7.7910 7.7910 10.5642 10.5642 15.5180 15.5180 17.6355 17.6355 k = 0.5000 0.2887 0.3146 ( 4808 PWs) bands (ev): -37.7146 -37.7146 -37.6800 -37.6800 3.3769 3.3769 4.2882 4.2882 4.7607 4.7607 5.5263 5.5263 5.8093 5.8093 6.2739 6.2739 7.7609 7.7609 10.4552 10.4552 15.5202 15.5202 17.8194 17.8194 k = 0.5000 0.2887 0.3015 ( 4808 PWs) bands (ev): -37.7153 -37.7153 -37.6806 -37.6806 3.2742 3.2742 4.2607 4.2607 4.7970 4.7970 5.5366 5.5366 5.8467 5.8467 6.2612 6.2612 7.7309 7.7309 10.3475 10.3475 15.5217 15.5217 18.0050 18.0050 k = 0.5000 0.2887 0.2884 ( 4804 PWs) bands (ev): -37.7159 -37.7159 -37.6813 -37.6813 3.1722 3.1722 4.2329 4.2329 4.8340 4.8340 5.5436 5.5436 5.8902 5.8902 6.2516 6.2516 7.7013 7.7013 10.2411 10.2411 15.5227 15.5227 18.1917 18.1917 k = 0.5000 0.2887 0.2753 ( 4804 PWs) bands (ev): -37.7166 -37.7166 -37.6819 -37.6819 3.0718 3.0718 4.2054 4.2054 4.8703 4.8703 5.5493 5.5493 5.9361 5.9361 6.2467 6.2467 7.6720 7.6720 10.1360 10.1360 15.5233 15.5233 18.3792 18.3792 k = 0.5000 0.2887 0.2622 ( 4804 PWs) bands (ev): -37.7173 -37.7173 -37.6826 -37.6826 2.9736 2.9736 4.1786 4.1786 4.9051 4.9051 5.5553 5.5553 5.9799 5.9799 6.2492 6.2492 7.6431 7.6431 10.0322 10.0322 15.5237 15.5237 18.5671 18.5671 k = 0.5000 0.2887 0.2491 ( 4810 PWs) bands (ev): -37.7179 -37.7179 -37.6832 -37.6832 2.8782 2.8782 4.1527 4.1527 4.9375 4.9375 5.5628 5.5628 6.0163 6.0163 6.2633 6.2633 7.6149 7.6149 9.9296 9.9296 15.5239 15.5239 18.7548 18.7548 k = 0.5000 0.2887 0.2360 ( 4810 PWs) bands (ev): -37.7185 -37.7185 -37.6838 -37.6838 2.7861 2.7861 4.1278 4.1278 4.9669 4.9669 5.5726 5.5726 6.0408 6.0408 6.2923 6.2923 7.5873 7.5873 9.8282 9.8282 15.5240 15.5240 18.9412 18.9412 k = 0.5000 0.2887 0.2229 ( 4814 PWs) bands (ev): -37.7191 -37.7191 -37.6843 -37.6843 2.6976 2.6976 4.1040 4.1040 4.9930 4.9930 5.5853 5.5853 6.0532 6.0532 6.3360 6.3360 7.5606 7.5606 9.7281 9.7281 15.5240 15.5240 19.1064 19.1064 k = 0.5000 0.2887 0.2097 ( 4806 PWs) bands (ev): -37.7197 -37.7197 -37.6849 -37.6849 2.6131 2.6131 4.0813 4.0813 5.0154 5.0154 5.6011 5.6011 6.0565 6.0565 6.3905 6.3905 7.5350 7.5350 9.6293 9.6293 15.5240 15.5240 19.2362 19.2362 k = 0.5000 0.2887 0.1966 ( 4812 PWs) bands (ev): -37.7202 -37.7202 -37.6854 -37.6854 2.5327 2.5327 4.0598 4.0598 5.0340 5.0340 5.6199 5.6199 6.0543 6.0543 6.4517 6.4517 7.5107 7.5107 9.5318 9.5318 15.5240 15.5240 19.3627 19.3627 k = 0.5000 0.2887 0.1835 ( 4808 PWs) bands (ev): -37.7207 -37.7207 -37.6859 -37.6859 2.4568 2.4568 4.0395 4.0395 5.0492 5.0492 5.6416 5.6416 6.0492 6.0492 6.5164 6.5164 7.4881 7.4881 9.4357 9.4357 15.5239 15.5239 19.4875 19.4875 k = 0.5000 0.2887 0.1704 ( 4810 PWs) bands (ev): -37.7212 -37.7212 -37.6863 -37.6863 2.3854 2.3854 4.0205 4.0205 5.0611 5.0611 5.6657 5.6657 6.0426 6.0426 6.5826 6.5826 7.4676 7.4676 9.3411 9.3411 15.5238 15.5238 19.6104 19.6104 k = 0.5000 0.2887 0.1573 ( 4808 PWs) bands (ev): -37.7217 -37.7217 -37.6868 -37.6868 2.3189 2.3189 4.0027 4.0027 5.0701 5.0701 5.6916 5.6916 6.0352 6.0352 6.6487 6.6487 7.4499 7.4499 9.2481 9.2481 15.5237 15.5237 19.7305 19.7305 k = 0.5000 0.2887 0.1442 ( 4802 PWs) bands (ev): -37.7221 -37.7221 -37.6872 -37.6872 2.2572 2.2572 3.9863 3.9863 5.0768 5.0768 5.7187 5.7187 6.0275 6.0275 6.7131 6.7131 7.4356 7.4356 9.1569 9.1569 15.5236 15.5236 19.8470 19.8470 k = 0.5000 0.2887 0.1311 ( 4812 PWs) bands (ev): -37.7225 -37.7225 -37.6876 -37.6876 2.2005 2.2005 3.9712 3.9712 5.0815 5.0815 5.7463 5.7463 6.0199 6.0199 6.7745 6.7745 7.4258 7.4258 9.0677 9.0677 15.5236 15.5236 19.9582 19.9582 k = 0.5000 0.2887 0.1180 ( 4812 PWs) bands (ev): -37.7228 -37.7228 -37.6879 -37.6879 2.1490 2.1490 3.9575 3.9575 5.0847 5.0847 5.7738 5.7738 6.0125 6.0125 6.8310 6.8310 7.4215 7.4215 8.9809 8.9809 15.5235 15.5235 20.0617 20.0617 k = 0.5000 0.2887 0.1049 ( 4800 PWs) bands (ev): -37.7231 -37.7231 -37.6882 -37.6882 2.1026 2.1026 3.9452 3.9452 5.0868 5.0868 5.8006 5.8006 6.0055 6.0055 6.8811 6.8811 7.4242 7.4242 8.8970 8.8970 15.5234 15.5234 20.1511 20.1511 k = 0.5000 0.2887 0.0918 ( 4812 PWs) bands (ev): -37.7234 -37.7234 -37.6885 -37.6885 2.0616 2.0616 3.9342 3.9342 5.0880 5.0880 5.8262 5.8262 5.9987 5.9987 6.9231 6.9231 7.4345 7.4345 8.8167 8.8167 15.5234 15.5234 20.2100 20.2100 k = 0.5000 0.2887 0.0787 ( 4808 PWs) bands (ev): -37.7237 -37.7237 -37.6887 -37.6887 2.0259 2.0259 3.9247 3.9247 5.0885 5.0885 5.8501 5.8501 5.9923 5.9923 6.9560 6.9560 7.4528 7.4528 8.7407 8.7407 15.5234 15.5234 20.2250 20.2250 k = 0.5000 0.2887 0.0655 ( 4824 PWs) bands (ev): -37.7239 -37.7239 -37.6889 -37.6889 1.9956 1.9956 3.9166 3.9166 5.0887 5.0887 5.8720 5.8720 5.9861 5.9861 6.9802 6.9802 7.4778 7.4778 8.6704 8.6704 15.5233 15.5233 20.2173 20.2173 k = 0.5000 0.2887 0.0524 ( 4816 PWs) bands (ev): -37.7241 -37.7241 -37.6891 -37.6891 1.9707 1.9707 3.9100 3.9100 5.0887 5.0887 5.8915 5.8915 5.9801 5.9801 6.9965 6.9965 7.5067 7.5067 8.6074 8.6074 15.5233 15.5233 20.2046 20.2046 k = 0.5000 0.2887 0.0393 ( 4810 PWs) bands (ev): -37.7242 -37.7242 -37.6892 -37.6892 1.9514 1.9514 3.9049 3.9049 5.0885 5.0885 5.9084 5.9084 5.9741 5.9741 7.0069 7.0069 7.5358 7.5358 8.5539 8.5539 15.5233 15.5233 20.1927 20.1927 k = 0.5000 0.2887 0.0262 ( 4810 PWs) bands (ev): -37.7243 -37.7243 -37.6893 -37.6893 1.9375 1.9375 3.9012 3.9012 5.0883 5.0883 5.9224 5.9224 5.9681 5.9681 7.0130 7.0130 7.5610 7.5610 8.5125 8.5125 15.5233 15.5233 20.1835 20.1835 k = 0.5000 0.2887 0.0131 ( 4810 PWs) bands (ev): -37.7244 -37.7244 -37.6893 -37.6893 1.9292 1.9292 3.8989 3.8989 5.0882 5.0882 5.9329 5.9329 5.9624 5.9624 7.0161 7.0161 7.5782 7.5782 8.4862 8.4862 15.5233 15.5233 20.1777 20.1777 k = 0.5000 0.2887-0.0000 ( 4806 PWs) bands (ev): -37.7244 -37.7244 -37.6894 -37.6894 1.9264 1.9264 3.8982 3.8982 5.0881 5.0881 5.9375 5.9375 5.9595 5.9595 7.0170 7.0170 7.5843 7.5843 8.4771 8.4771 15.5233 15.5233 20.1758 20.1758 k = 0.3333 0.5774-0.0000 ( 4821 PWs) bands (ev): -37.7069 -37.7069 -37.7068 -37.7068 2.0360 2.0360 4.4453 4.4453 4.7347 4.7347 5.1476 5.1476 7.0002 7.0002 7.1734 7.1734 7.2506 7.2506 7.7159 7.7159 16.2787 16.2787 19.1378 19.1378 k = 0.3333 0.5774 0.0131 ( 4821 PWs) bands (ev): -37.7069 -37.7069 -37.7068 -37.7068 2.0389 2.0389 4.4455 4.4455 4.7352 4.7352 5.1477 5.1477 6.9838 6.9838 7.1644 7.1644 7.2672 7.2672 7.7244 7.7244 16.2795 16.2795 19.1366 19.1366 k = 0.3333 0.5774 0.0262 ( 4827 PWs) bands (ev): -37.7068 -37.7068 -37.7067 -37.7067 2.0476 2.0476 4.4460 4.4460 4.7369 4.7369 5.1481 5.1481 6.9436 6.9436 7.1390 7.1390 7.3084 7.3084 7.7483 7.7483 16.2819 16.2819 19.1328 19.1328 k = 0.3333 0.5774 0.0393 ( 4833 PWs) bands (ev): -37.7067 -37.7067 -37.7066 -37.7066 2.0621 2.0621 4.4470 4.4470 4.7395 4.7395 5.1488 5.1488 6.8919 6.8919 7.1005 7.1005 7.3616 7.3616 7.7841 7.7841 16.2859 16.2859 19.1264 19.1264 k = 0.3333 0.5774 0.0524 ( 4842 PWs) bands (ev): -37.7066 -37.7066 -37.7065 -37.7065 2.0824 2.0824 4.4484 4.4484 4.7431 4.7431 5.1497 5.1497 6.8352 6.8352 7.0527 7.0527 7.4205 7.4205 7.8283 7.8283 16.2915 16.2915 19.1174 19.1174 k = 0.3333 0.5774 0.0655 ( 4836 PWs) bands (ev): -37.7064 -37.7064 -37.7063 -37.7063 2.1085 2.1085 4.4501 4.4501 4.7476 4.7476 5.1510 5.1510 6.7765 6.7765 6.9985 6.9985 7.4823 7.4823 7.8780 7.8780 16.2986 16.2986 19.1057 19.1057 k = 0.3333 0.5774 0.0787 ( 4818 PWs) bands (ev): -37.7062 -37.7062 -37.7061 -37.7061 2.1404 2.1404 4.4522 4.4522 4.7528 4.7528 5.1526 5.1526 6.7171 6.7171 6.9397 6.9397 7.5455 7.5455 7.9313 7.9313 16.3072 16.3072 19.0910 19.0910 k = 0.3333 0.5774 0.0918 ( 4815 PWs) bands (ev): -37.7060 -37.7060 -37.7059 -37.7059 2.1779 2.1779 4.4546 4.4546 4.7586 4.7586 5.1546 5.1546 6.6579 6.6579 6.8777 6.8777 7.6097 7.6097 7.9869 7.9869 16.3174 16.3174 19.0732 19.0732 k = 0.3333 0.5774 0.1049 ( 4806 PWs) bands (ev): -37.7057 -37.7057 -37.7056 -37.7056 2.2212 2.2212 4.4573 4.4573 4.7647 4.7647 5.1571 5.1571 6.5994 6.5994 6.8135 6.8135 7.6744 7.6744 8.0440 8.0440 16.3290 16.3290 19.0523 19.0523 k = 0.3333 0.5774 0.1180 ( 4809 PWs) bands (ev): -37.7054 -37.7054 -37.7053 -37.7053 2.2701 2.2701 4.4603 4.4603 4.7709 4.7709 5.1603 5.1603 6.5420 6.5420 6.7477 6.7477 7.7394 7.7394 8.1020 8.1020 16.3420 16.3420 19.0278 19.0278 k = 0.3333 0.5774 0.1311 ( 4812 PWs) bands (ev): -37.7050 -37.7050 -37.7049 -37.7049 2.3246 2.3246 4.4635 4.4635 4.7768 4.7768 5.1641 5.1641 6.4860 6.4860 6.6807 6.6807 7.8044 7.8044 8.1606 8.1606 16.3564 16.3564 18.9998 18.9998 k = 0.3333 0.5774 0.1442 ( 4800 PWs) bands (ev): -37.7046 -37.7046 -37.7045 -37.7045 2.3847 2.3847 4.4668 4.4668 4.7821 4.7821 5.1689 5.1689 6.4319 6.4319 6.6130 6.6130 7.8695 7.8695 8.2194 8.2194 16.3722 16.3722 18.9678 18.9678 k = 0.3333 0.5774 0.1573 ( 4800 PWs) bands (ev): -37.7042 -37.7042 -37.7041 -37.7041 2.4503 2.4503 4.4703 4.4703 4.7862 4.7862 5.1749 5.1749 6.3798 6.3798 6.5449 6.5449 7.9346 7.9346 8.2784 8.2784 16.3891 16.3891 18.9318 18.9318 k = 0.3333 0.5774 0.1704 ( 4806 PWs) bands (ev): -37.7038 -37.7038 -37.7037 -37.7037 2.5213 2.5213 4.4739 4.4739 4.7887 4.7887 5.1823 5.1823 6.3302 6.3302 6.4765 6.4765 7.9996 7.9996 8.3373 8.3373 16.4073 16.4073 18.8916 18.8916 k = 0.3333 0.5774 0.1835 ( 4809 PWs) bands (ev): -37.7033 -37.7033 -37.7032 -37.7032 2.5977 2.5977 4.4775 4.4775 4.7891 4.7891 5.1914 5.1914 6.2833 6.2833 6.4081 6.4081 8.0644 8.0644 8.3961 8.3961 16.4265 16.4265 18.8469 18.8469 k = 0.3333 0.5774 0.1966 ( 4809 PWs) bands (ev): -37.7028 -37.7028 -37.7027 -37.7027 2.6795 2.6795 4.4811 4.4811 4.7868 4.7868 5.2026 5.2026 6.2394 6.2394 6.3400 6.3400 8.1291 8.1291 8.4548 8.4548 16.4467 16.4467 18.7976 18.7976 k = 0.3333 0.5774 0.2097 ( 4809 PWs) bands (ev): -37.7023 -37.7023 -37.7022 -37.7022 2.7664 2.7664 4.4845 4.4845 4.7814 4.7814 5.2160 5.2160 6.1988 6.1988 6.2723 6.2723 8.1936 8.1936 8.5132 8.5132 16.4676 16.4676 18.7437 18.7437 k = 0.3333 0.5774 0.2229 ( 4809 PWs) bands (ev): -37.7017 -37.7017 -37.7016 -37.7016 2.8585 2.8585 4.4876 4.4876 4.7725 4.7725 5.2318 5.2318 6.1618 6.1618 6.2053 6.2053 8.2579 8.2579 8.5714 8.5714 16.4893 16.4893 18.6852 18.6852 k = 0.3333 0.5774 0.2360 ( 4803 PWs) bands (ev): -37.7011 -37.7011 -37.7011 -37.7011 2.9556 2.9556 4.4904 4.4904 4.7599 4.7599 5.2502 5.2502 6.1284 6.1284 6.1391 6.1391 8.3219 8.3219 8.6293 8.6293 16.5114 16.5114 18.6220 18.6220 k = 0.3333 0.5774 0.2491 ( 4803 PWs) bands (ev): -37.7005 -37.7005 -37.7005 -37.7005 3.0576 3.0576 4.4928 4.4928 4.7436 4.7436 5.2710 5.2710 6.0739 6.0739 6.0989 6.0989 8.3858 8.3858 8.6869 8.6869 16.5338 16.5338 18.5543 18.5543 k = 0.3333 0.5774 0.2622 ( 4800 PWs) bands (ev): -37.6999 -37.6999 -37.6998 -37.6998 3.1643 3.1643 4.4946 4.4946 4.7235 4.7235 5.2943 5.2943 6.0100 6.0100 6.0733 6.0733 8.4493 8.4493 8.7442 8.7442 16.5562 16.5562 18.4823 18.4823 k = 0.3333 0.5774 0.2753 ( 4800 PWs) bands (ev): -37.6993 -37.6993 -37.6992 -37.6992 3.2757 3.2757 4.4957 4.4957 4.6999 4.6999 5.3198 5.3198 5.9476 5.9476 6.0516 6.0516 8.5127 8.5127 8.8012 8.8012 16.5783 16.5783 18.4061 18.4061 k = 0.3333 0.5774 0.2884 ( 4800 PWs) bands (ev): -37.6986 -37.6986 -37.6985 -37.6985 3.3915 3.3915 4.4959 4.4959 4.6731 4.6731 5.3474 5.3474 5.8869 5.8869 6.0339 6.0339 8.5757 8.5757 8.8579 8.8579 16.5998 16.5998 18.3261 18.3261 k = 0.3333 0.5774 0.3015 ( 4812 PWs) bands (ev): -37.6980 -37.6980 -37.6979 -37.6979 3.5114 3.5114 4.4950 4.4950 4.6434 4.6434 5.3769 5.3769 5.8281 5.8281 6.0200 6.0200 8.6384 8.6384 8.9142 8.9142 16.6200 16.6200 18.2426 18.2426 k = 0.3333 0.5774 0.3146 ( 4800 PWs) bands (ev): -37.6973 -37.6973 -37.6972 -37.6972 3.6351 3.6351 4.4930 4.4930 4.6115 4.6115 5.4081 5.4081 5.7715 5.7715 6.0098 6.0098 8.7009 8.7009 8.9702 8.9702 16.6386 16.6386 18.1511 18.1511 k = 0.3333 0.5774 0.3277 ( 4800 PWs) bands (ev): -37.6966 -37.6966 -37.6965 -37.6965 3.7620 3.7620 4.4895 4.4895 4.5781 4.5781 5.4406 5.4406 5.7174 5.7174 6.0033 6.0033 8.7630 8.7630 9.0258 9.0258 16.6548 16.6548 18.0519 18.0519 k = 0.3333 0.5774 0.3408 ( 4806 PWs) bands (ev): -37.6959 -37.6959 -37.6958 -37.6958 3.8912 3.8912 4.4844 4.4844 4.5445 4.5445 5.4744 5.4744 5.6660 5.6660 6.0003 6.0003 8.8248 8.8248 9.0810 9.0810 16.6678 16.6678 17.9501 17.9501 k = 0.3333 0.5774 0.3539 ( 4800 PWs) bands (ev): -37.6951 -37.6951 -37.6951 -37.6951 4.0202 4.0202 4.4776 4.4776 4.5130 4.5130 5.5090 5.5090 5.6176 5.6176 6.0006 6.0006 8.8861 8.8861 9.1358 9.1358 16.6765 16.6765 17.8463 17.8463 k = 0.3333 0.5774 0.3671 ( 4818 PWs) bands (ev): -37.6944 -37.6944 -37.6944 -37.6944 4.1430 4.1430 4.4688 4.4688 4.4901 4.4901 5.5443 5.5443 5.5723 5.5723 6.0044 6.0044 8.9471 8.9471 9.1902 9.1902 16.6797 16.6797 17.7408 17.7408 k = 0.3333 0.5774 0.3802 ( 4818 PWs) bands (ev): -37.6937 -37.6937 -37.6936 -37.6936 4.2397 4.2397 4.4579 4.4579 4.4956 4.4956 5.5304 5.5304 5.5798 5.5798 6.0114 6.0114 9.0077 9.0077 9.2441 9.2441 16.6759 16.6759 17.6341 17.6341 k = 0.3333 0.5774 0.3933 ( 4821 PWs) bands (ev): -37.6930 -37.6930 -37.6929 -37.6929 4.2759 4.2759 4.4448 4.4448 4.5640 4.5640 5.4921 5.4921 5.6154 5.6154 6.0219 6.0219 9.0678 9.0678 9.2975 9.2975 16.6633 16.6633 17.5268 17.5268 k = 0.3333 0.5774 0.4064 ( 4821 PWs) bands (ev): -37.6922 -37.6922 -37.6922 -37.6922 4.2630 4.2630 4.4294 4.4294 4.6839 4.6839 5.4574 5.4574 5.6506 5.6506 6.0359 6.0359 9.1274 9.1274 9.3504 9.3504 16.6397 16.6397 17.4195 17.4195 k = 0.3333 0.5774 0.4195 ( 4821 PWs) bands (ev): -37.6915 -37.6915 -37.6915 -37.6915 4.2318 4.2318 4.4117 4.4117 4.8243 4.8243 5.4264 5.4264 5.6850 5.6850 6.0536 6.0536 9.1864 9.1864 9.4028 9.4028 16.6031 16.6031 17.3129 17.3129 k = 0.3333 0.5774 0.4326 ( 4815 PWs) bands (ev): -37.6908 -37.6908 -37.6907 -37.6907 4.1941 4.1941 4.3918 4.3918 4.9732 4.9732 5.3991 5.3991 5.7183 5.7183 6.0755 6.0755 9.2448 9.2448 9.4545 9.4545 16.5511 16.5511 17.2077 17.2077 k = 0.3333 0.5774 0.4457 ( 4809 PWs) bands (ev): -37.6901 -37.6901 -37.6900 -37.6900 4.1538 4.1538 4.3698 4.3698 5.1260 5.1260 5.3754 5.3754 5.7503 5.7503 6.1021 6.1021 9.3026 9.3026 9.5055 9.5055 16.4819 16.4819 17.1047 17.1047 k = 0.3333 0.5774 0.4588 ( 4809 PWs) bands (ev): -37.6894 -37.6894 -37.6893 -37.6893 4.1125 4.1125 4.3459 4.3459 5.2804 5.2804 5.3551 5.3551 5.7806 5.7806 6.1340 6.1340 9.3597 9.3597 9.5559 9.5559 16.3947 16.3947 17.0044 17.0044 k = 0.3333 0.5774 0.4719 ( 4809 PWs) bands (ev): -37.6887 -37.6887 -37.6886 -37.6886 4.0710 4.0710 4.3203 4.3203 5.3380 5.3380 5.4342 5.4342 5.8094 5.8094 6.1723 6.1723 9.4159 9.4159 9.6054 9.6054 16.2897 16.2897 16.9070 16.9070 k = 0.3333 0.5774 0.4850 ( 4809 PWs) bands (ev): -37.6880 -37.6880 -37.6879 -37.6879 4.0298 4.0298 4.2934 4.2934 5.3239 5.3239 5.5841 5.5841 5.8370 5.8370 6.2189 6.2189 9.4714 9.4714 9.6542 9.6542 16.1681 16.1681 16.8124 16.8124 k = 0.3333 0.5774 0.4981 ( 4809 PWs) bands (ev): -37.6873 -37.6873 -37.6873 -37.6873 3.9892 3.9892 4.2654 4.2654 5.3125 5.3125 5.7242 5.7242 5.8658 5.8658 6.2767 6.2767 9.5259 9.5259 9.7019 9.7019 16.0320 16.0320 16.7203 16.7203 k = 0.3333 0.5774 0.5113 ( 4815 PWs) bands (ev): -37.6866 -37.6866 -37.6866 -37.6866 3.9495 3.9495 4.2366 4.2366 5.3035 5.3035 5.8350 5.8350 5.9100 5.9100 6.3502 6.3502 9.5794 9.5794 9.7487 9.7487 15.8839 15.8839 16.6304 16.6304 k = 0.3333 0.5774 0.5244 ( 4815 PWs) bands (ev): -37.6860 -37.6860 -37.6860 -37.6860 3.9107 3.9107 4.2074 4.2074 5.2967 5.2967 5.8835 5.8835 5.9970 5.9970 6.4444 6.4444 9.6319 9.6319 9.7944 9.7944 15.7263 15.7263 16.5428 16.5428 k = 0.3333 0.5774 0.5375 ( 4809 PWs) bands (ev): -37.6854 -37.6854 -37.6853 -37.6853 3.8732 3.8732 4.1780 4.1780 5.2917 5.2917 5.9079 5.9079 6.0857 6.0857 6.5615 6.5615 9.6832 9.6832 9.8389 9.8389 15.5614 15.5614 16.4574 16.4574 k = 0.3333 0.5774 0.5506 ( 4800 PWs) bands (ev): -37.6848 -37.6848 -37.6847 -37.6847 3.8370 3.8370 4.1487 4.1487 5.2882 5.2882 5.9273 5.9273 6.1597 6.1597 6.6983 6.6983 9.7333 9.7333 9.8821 9.8821 15.3910 15.3910 16.3746 16.3746 k = 0.3333 0.5774 0.5637 ( 4812 PWs) bands (ev): -37.6842 -37.6842 -37.6842 -37.6842 3.8022 3.8022 4.1198 4.1198 5.2861 5.2861 5.9443 5.9443 6.2212 6.2212 6.8488 6.8488 9.7820 9.7820 9.9239 9.9239 15.2169 15.2169 16.2945 16.2945 k = 0.3333 0.5774 0.5768 ( 4812 PWs) bands (ev): -37.6836 -37.6836 -37.6836 -37.6836 3.7690 3.7690 4.0916 4.0916 5.2851 5.2851 5.9598 5.9598 6.2742 6.2742 7.0077 7.0077 9.8294 9.8294 9.9642 9.9642 15.0406 15.0406 16.2173 16.2173 k = 0.3333 0.5774 0.5899 ( 4812 PWs) bands (ev): -37.6831 -37.6831 -37.6831 -37.6831 3.7374 3.7374 4.0642 4.0642 5.2849 5.2849 5.9741 5.9741 6.3213 6.3213 7.1711 7.1711 9.8752 9.8752 10.0030 10.0030 14.8633 14.8633 16.1435 16.1435 k = 0.3333 0.5774 0.6030 ( 4809 PWs) bands (ev): -37.6826 -37.6826 -37.6826 -37.6826 3.7075 3.7075 4.0378 4.0378 5.2855 5.2855 5.9873 5.9873 6.3642 6.3642 7.3365 7.3365 9.9194 9.9194 10.0400 10.0400 14.6862 14.6862 16.0731 16.0731 k = 0.3333 0.5774 0.6161 ( 4815 PWs) bands (ev): -37.6821 -37.6821 -37.6821 -37.6821 3.6794 3.6794 4.0126 4.0126 5.2867 5.2867 5.9996 5.9996 6.4036 6.4036 7.5018 7.5018 9.9620 9.9620 10.0751 10.0751 14.5106 14.5106 16.0066 16.0066 k = 0.3333 0.5774 0.6292 ( 4815 PWs) bands (ev): -37.6817 -37.6817 -37.6817 -37.6817 3.6532 3.6532 3.9888 3.9888 5.2883 5.2883 6.0109 6.0109 6.4400 6.4400 7.6655 7.6655 10.0028 10.0028 10.1083 10.1083 14.3374 14.3374 15.9439 15.9439 k = 0.3333 0.5774 0.6423 ( 4815 PWs) bands (ev): -37.6813 -37.6813 -37.6813 -37.6813 3.6289 3.6289 3.9664 3.9664 5.2901 5.2901 6.0213 6.0213 6.4737 6.4737 7.8261 7.8261 10.0418 10.0418 10.1394 10.1394 14.1678 14.1678 15.8855 15.8855 k = 0.3333 0.5774 0.6555 ( 4803 PWs) bands (ev): -37.6809 -37.6809 -37.6809 -37.6809 3.6065 3.6065 3.9457 3.9457 5.2922 5.2922 6.0308 6.0308 6.5047 6.5047 7.9821 7.9821 10.0788 10.0788 10.1683 10.1683 14.0031 14.0031 15.8315 15.8315 k = 0.3333 0.5774 0.6686 ( 4797 PWs) bands (ev): -37.6805 -37.6805 -37.6805 -37.6805 3.5861 3.5861 3.9266 3.9266 5.2943 5.2943 6.0394 6.0394 6.5330 6.5330 8.1321 8.1321 10.1139 10.1139 10.1949 10.1949 13.8446 13.8446 15.7820 15.7820 k = 0.3333 0.5774 0.6817 ( 4803 PWs) bands (ev): -37.6802 -37.6802 -37.6802 -37.6802 3.5678 3.5678 3.9094 3.9094 5.2964 5.2964 6.0471 6.0471 6.5587 6.5587 8.2743 8.2743 10.1469 10.1469 10.2190 10.2190 13.6939 13.6939 15.7372 15.7372 k = 0.3333 0.5774 0.6948 ( 4812 PWs) bands (ev): -37.6799 -37.6799 -37.6799 -37.6799 3.5515 3.5515 3.8940 3.8940 5.2984 5.2984 6.0540 6.0540 6.5815 6.5815 8.4069 8.4069 10.1776 10.1776 10.2406 10.2406 13.5526 13.5526 15.6973 15.6973 k = 0.3333 0.5774 0.7079 ( 4818 PWs) bands (ev): -37.6797 -37.6797 -37.6797 -37.6797 3.5374 3.5374 3.8805 3.8805 5.3003 5.3003 6.0600 6.0600 6.6015 6.6015 8.5280 8.5280 10.2059 10.2059 10.2595 10.2595 13.4229 13.4229 15.6625 15.6625 k = 0.3333 0.5774 0.7210 ( 4815 PWs) bands (ev): -37.6795 -37.6795 -37.6795 -37.6795 3.5253 3.5253 3.8690 3.8690 5.3019 5.3019 6.0651 6.0651 6.6186 6.6186 8.6354 8.6354 10.2313 10.2313 10.2757 10.2757 13.3069 13.3069 15.6327 15.6327 k = 0.3333 0.5774 0.7341 ( 4815 PWs) bands (ev): -37.6793 -37.6793 -37.6793 -37.6793 3.5155 3.5155 3.8596 3.8596 5.3033 5.3033 6.0692 6.0692 6.6327 6.6327 8.7272 8.7272 10.2535 10.2535 10.2891 10.2891 13.2071 13.2071 15.6083 15.6083 k = 0.3333 0.5774 0.7472 ( 4818 PWs) bands (ev): -37.6792 -37.6792 -37.6792 -37.6792 3.5078 3.5078 3.8522 3.8522 5.3045 5.3045 6.0725 6.0725 6.6438 6.6438 8.8011 8.8011 10.2718 10.2718 10.2996 10.2996 13.1260 13.1260 15.5891 15.5891 k = 0.3333 0.5774 0.7603 ( 4818 PWs) bands (ev): -37.6791 -37.6791 -37.6791 -37.6791 3.5023 3.5023 3.8469 3.8469 5.3053 5.3053 6.0748 6.0748 6.6517 6.6517 8.8554 8.8554 10.2856 10.2856 10.3071 10.3071 13.0659 13.0659 15.5754 15.5754 k = 0.3333 0.5774 0.7734 ( 4806 PWs) bands (ev): -37.6790 -37.6790 -37.6790 -37.6790 3.4990 3.4990 3.8437 3.8437 5.3058 5.3058 6.0762 6.0762 6.6564 6.6564 8.8885 8.8885 10.2942 10.2942 10.3116 10.3116 13.0289 13.0289 15.5672 15.5672 k = 0.3333 0.5774 0.7865 ( 4800 PWs) bands (ev): -37.6790 -37.6790 -37.6790 -37.6790 3.4979 3.4979 3.8426 3.8426 5.3060 5.3060 6.0767 6.0767 6.6580 6.6580 8.8997 8.8997 10.2971 10.2971 10.3131 10.3131 13.0164 13.0164 15.5644 15.5644 Writing output data file Li2Pt.save init_run : 0.16s CPU 0.31s WALL ( 1 calls) electrons : 75.29s CPU 76.90s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.04s WALL ( 1 calls) potinit : 0.01s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 75.28s CPU 76.90s 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 : 0.02s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.05s WALL ( 431 calls) cegterg : 67.05s CPU 68.10s WALL ( 501 calls) Called by sum_band: Called by *egterg: h_psi : 44.12s CPU 44.95s WALL ( 8237 calls) s_psi : 1.08s CPU 1.20s WALL ( 8237 calls) g_psi : 0.14s CPU 0.16s WALL ( 7305 calls) cdiaghg : 21.95s CPU 22.48s WALL ( 7736 calls) cegterg:over : 2.27s CPU 2.19s WALL ( 7305 calls) cegterg:upda : 1.84s CPU 1.90s WALL ( 7305 calls) cegterg:last : 1.03s CPU 1.01s WALL ( 1465 calls) cdiaghg:chol : 1.12s CPU 1.19s WALL ( 7736 calls) cdiaghg:inve : 0.31s CPU 0.38s WALL ( 7736 calls) cdiaghg:para : 1.59s CPU 1.48s WALL ( 15472 calls) Called by h_psi: h_psi:vloc : 41.13s CPU 41.88s WALL ( 8237 calls) h_psi:vnl : 2.93s CPU 2.99s WALL ( 8237 calls) add_vuspsi : 1.42s CPU 1.45s WALL ( 8237 calls) General routines calbec : 1.49s CPU 1.52s WALL ( 8237 calls) fft : 0.01s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 39.09s CPU 39.88s WALL ( 482012 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.14s CPU 0.20s WALL ( 862 calls) Parallel routines fft_scatter : 14.41s CPU 14.77s WALL ( 482035 calls) PWSCF : 1m26.57s CPU 1m38.96s WALL This run was terminated on: 20:17:53 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=