Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:15: 0 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: ./Si.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 7 7 2 95 95 16 Max 8 8 3 100 100 21 Sum 283 283 91 3481 3481 689 Message from routine sym_rho_init: likely internal error: no G-vectors found Message from routine sym_rho_init: likely internal error: no G-vectors found Message from routine sym_rho_init: likely internal error: no G-vectors found Message from routine sym_rho_init: likely internal error: no G-vectors found Message from routine sym_rho_init: likely internal error: no G-vectors found Message from routine sym_rho_init: likely internal error: no G-vectors found Message from routine sym_rho_init: likely internal error: no G-vectors found Message from routine sym_rho_init: likely internal error: no G-vectors found bravais-lattice index = 14 lattice parameter (alat) = 4.7753 a.u. unit-cell volume = 88.5595 (a.u.)^3 number of atoms/cell = 1 number of atomic types = 1 number of electrons = 4.00 number of Kohn-Sham states= 12 kinetic-energy cutoff = 44.0000 Ry charge density cutoff = 176.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 4.775338 celldm(2)= 1.000000 celldm(3)= 0.939058 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 0.939058 ) 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 1.064897 ) PseudoPot. # 1 for Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 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 Si 4.00 28.08550 Si( 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= 604 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0016556 k( 2) = ( 0.0069444 0.0040094 -0.0000000), wk = 0.0016556 k( 3) = ( 0.0138889 0.0080188 -0.0000000), wk = 0.0016556 k( 4) = ( 0.0208333 0.0120281 -0.0000000), wk = 0.0016556 k( 5) = ( 0.0277778 0.0160375 -0.0000000), wk = 0.0016556 k( 6) = ( 0.0347222 0.0200469 -0.0000000), wk = 0.0016556 k( 7) = ( 0.0416667 0.0240563 -0.0000000), wk = 0.0016556 k( 8) = ( 0.0486111 0.0280656 -0.0000000), wk = 0.0016556 k( 9) = ( 0.0555556 0.0320750 -0.0000000), wk = 0.0016556 k( 10) = ( 0.0625000 0.0360844 -0.0000000), wk = 0.0016556 k( 11) = ( 0.0694444 0.0400938 -0.0000000), wk = 0.0016556 k( 12) = ( 0.0763889 0.0441031 -0.0000000), wk = 0.0016556 k( 13) = ( 0.0833333 0.0481125 -0.0000000), wk = 0.0016556 k( 14) = ( 0.0902778 0.0521219 -0.0000000), wk = 0.0016556 k( 15) = ( 0.0972222 0.0561313 -0.0000000), wk = 0.0016556 k( 16) = ( 0.1041667 0.0601407 -0.0000000), wk = 0.0016556 k( 17) = ( 0.1111111 0.0641500 -0.0000000), wk = 0.0016556 k( 18) = ( 0.1180556 0.0681594 -0.0000000), wk = 0.0016556 k( 19) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0016556 k( 20) = ( 0.1319444 0.0761782 -0.0000000), wk = 0.0016556 k( 21) = ( 0.1388889 0.0801875 -0.0000000), wk = 0.0016556 k( 22) = ( 0.1458333 0.0841969 -0.0000000), wk = 0.0016556 k( 23) = ( 0.1527778 0.0882063 -0.0000000), wk = 0.0016556 k( 24) = ( 0.1597222 0.0922157 -0.0000000), wk = 0.0016556 k( 25) = ( 0.1666667 0.0962250 -0.0000000), wk = 0.0016556 k( 26) = ( 0.1736111 0.1002344 -0.0000000), wk = 0.0016556 k( 27) = ( 0.1805556 0.1042438 -0.0000000), wk = 0.0016556 k( 28) = ( 0.1875000 0.1082532 -0.0000000), wk = 0.0016556 k( 29) = ( 0.1944444 0.1122625 -0.0000000), wk = 0.0016556 k( 30) = ( 0.2013889 0.1162719 -0.0000000), wk = 0.0016556 k( 31) = ( 0.2083333 0.1202813 -0.0000000), wk = 0.0016556 k( 32) = ( 0.2152778 0.1242907 -0.0000000), wk = 0.0016556 k( 33) = ( 0.2222222 0.1283001 -0.0000000), wk = 0.0016556 k( 34) = ( 0.2291667 0.1323094 -0.0000000), wk = 0.0016556 k( 35) = ( 0.2361111 0.1363188 -0.0000000), wk = 0.0016556 k( 36) = ( 0.2430556 0.1403282 -0.0000000), wk = 0.0016556 k( 37) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0016556 k( 38) = ( 0.2569444 0.1483469 -0.0000000), wk = 0.0016556 k( 39) = ( 0.2638889 0.1523563 -0.0000000), wk = 0.0016556 k( 40) = ( 0.2708333 0.1563657 -0.0000000), wk = 0.0016556 k( 41) = ( 0.2777778 0.1603751 -0.0000000), wk = 0.0016556 k( 42) = ( 0.2847222 0.1643845 -0.0000000), wk = 0.0016556 k( 43) = ( 0.2916667 0.1683938 -0.0000000), wk = 0.0016556 k( 44) = ( 0.2986111 0.1724032 -0.0000000), wk = 0.0016556 k( 45) = ( 0.3055556 0.1764126 -0.0000000), wk = 0.0016556 k( 46) = ( 0.3125000 0.1804220 -0.0000000), wk = 0.0016556 k( 47) = ( 0.3194444 0.1844313 -0.0000000), wk = 0.0016556 k( 48) = ( 0.3263889 0.1884407 -0.0000000), wk = 0.0016556 k( 49) = ( 0.3333333 0.1924501 -0.0000000), wk = 0.0016556 k( 50) = ( 0.3402778 0.1964595 -0.0000000), wk = 0.0016556 k( 51) = ( 0.3472222 0.2004688 -0.0000000), wk = 0.0016556 k( 52) = ( 0.3541667 0.2044782 -0.0000000), wk = 0.0016556 k( 53) = ( 0.3611111 0.2084876 -0.0000000), wk = 0.0016556 k( 54) = ( 0.3680556 0.2124970 -0.0000000), wk = 0.0016556 k( 55) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0016556 k( 56) = ( 0.3819444 0.2205157 -0.0000000), wk = 0.0016556 k( 57) = ( 0.3888889 0.2245251 -0.0000000), wk = 0.0016556 k( 58) = ( 0.3958333 0.2285345 -0.0000000), wk = 0.0016556 k( 59) = ( 0.4027778 0.2325439 -0.0000000), wk = 0.0016556 k( 60) = ( 0.4097222 0.2365532 -0.0000000), wk = 0.0016556 k( 61) = ( 0.4166667 0.2405626 -0.0000000), wk = 0.0016556 k( 62) = ( 0.4236111 0.2445720 -0.0000000), wk = 0.0016556 k( 63) = ( 0.4305556 0.2485814 -0.0000000), wk = 0.0016556 k( 64) = ( 0.4375000 0.2525907 -0.0000000), wk = 0.0016556 k( 65) = ( 0.4444444 0.2566001 -0.0000000), wk = 0.0016556 k( 66) = ( 0.4513889 0.2606095 -0.0000000), wk = 0.0016556 k( 67) = ( 0.4583333 0.2646189 -0.0000000), wk = 0.0016556 k( 68) = ( 0.4652778 0.2686283 -0.0000000), wk = 0.0016556 k( 69) = ( 0.4722222 0.2726376 -0.0000000), wk = 0.0016556 k( 70) = ( 0.4791667 0.2766470 -0.0000000), wk = 0.0016556 k( 71) = ( 0.4861111 0.2806564 -0.0000000), wk = 0.0016556 k( 72) = ( 0.4930556 0.2846658 -0.0000000), wk = 0.0016556 k( 73) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0016556 k( 74) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0016556 k( 75) = ( 0.4960317 0.2955484 -0.0000000), wk = 0.0016556 k( 76) = ( 0.4920635 0.3024216 -0.0000000), wk = 0.0016556 k( 77) = ( 0.4880952 0.3092948 -0.0000000), wk = 0.0016556 k( 78) = ( 0.4841270 0.3161680 -0.0000000), wk = 0.0016556 k( 79) = ( 0.4801587 0.3230412 -0.0000000), wk = 0.0016556 k( 80) = ( 0.4761905 0.3299144 -0.0000000), wk = 0.0016556 k( 81) = ( 0.4722222 0.3367877 -0.0000000), wk = 0.0016556 k( 82) = ( 0.4682540 0.3436609 -0.0000000), wk = 0.0016556 k( 83) = ( 0.4642857 0.3505341 -0.0000000), wk = 0.0016556 k( 84) = ( 0.4603175 0.3574073 -0.0000000), wk = 0.0016556 k( 85) = ( 0.4563492 0.3642805 -0.0000000), wk = 0.0016556 k( 86) = ( 0.4523810 0.3711537 -0.0000000), wk = 0.0016556 k( 87) = ( 0.4484127 0.3780270 -0.0000000), wk = 0.0016556 k( 88) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0016556 k( 89) = ( 0.4404762 0.3917734 -0.0000000), wk = 0.0016556 k( 90) = ( 0.4365079 0.3986466 -0.0000000), wk = 0.0016556 k( 91) = ( 0.4325397 0.4055198 -0.0000000), wk = 0.0016556 k( 92) = ( 0.4285714 0.4123930 -0.0000000), wk = 0.0016556 k( 93) = ( 0.4246032 0.4192663 -0.0000000), wk = 0.0016556 k( 94) = ( 0.4206349 0.4261395 -0.0000000), wk = 0.0016556 k( 95) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0016556 k( 96) = ( 0.4126984 0.4398859 -0.0000000), wk = 0.0016556 k( 97) = ( 0.4087302 0.4467591 -0.0000000), wk = 0.0016556 k( 98) = ( 0.4047619 0.4536324 -0.0000000), wk = 0.0016556 k( 99) = ( 0.4007937 0.4605056 -0.0000000), wk = 0.0016556 k( 100) = ( 0.3968254 0.4673788 -0.0000000), wk = 0.0016556 k( 101) = ( 0.3928571 0.4742520 -0.0000000), wk = 0.0016556 k( 102) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0016556 k( 103) = ( 0.3849206 0.4879984 -0.0000000), wk = 0.0016556 k( 104) = ( 0.3809524 0.4948717 -0.0000000), wk = 0.0016556 k( 105) = ( 0.3769841 0.5017449 -0.0000000), wk = 0.0016556 k( 106) = ( 0.3730159 0.5086181 -0.0000000), wk = 0.0016556 k( 107) = ( 0.3690476 0.5154913 -0.0000000), wk = 0.0016556 k( 108) = ( 0.3650794 0.5223645 -0.0000000), wk = 0.0016556 k( 109) = ( 0.3611111 0.5292377 -0.0000000), wk = 0.0016556 k( 110) = ( 0.3571429 0.5361110 -0.0000000), wk = 0.0016556 k( 111) = ( 0.3531746 0.5429842 -0.0000000), wk = 0.0016556 k( 112) = ( 0.3492063 0.5498574 -0.0000000), wk = 0.0016556 k( 113) = ( 0.3452381 0.5567306 -0.0000000), wk = 0.0016556 k( 114) = ( 0.3412698 0.5636038 -0.0000000), wk = 0.0016556 k( 115) = ( 0.3373016 0.5704771 -0.0000000), wk = 0.0016556 k( 116) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0016556 k( 117) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0016556 k( 118) = ( 0.3293173 0.5703942 -0.0000000), wk = 0.0016556 k( 119) = ( 0.3253012 0.5634382 -0.0000000), wk = 0.0016556 k( 120) = ( 0.3212851 0.5564822 -0.0000000), wk = 0.0016556 k( 121) = ( 0.3172691 0.5495262 -0.0000000), wk = 0.0016556 k( 122) = ( 0.3132530 0.5425701 -0.0000000), wk = 0.0016556 k( 123) = ( 0.3092370 0.5356141 -0.0000000), wk = 0.0016556 k( 124) = ( 0.3052209 0.5286581 -0.0000000), wk = 0.0016556 k( 125) = ( 0.3012048 0.5217021 -0.0000000), wk = 0.0016556 k( 126) = ( 0.2971888 0.5147460 -0.0000000), wk = 0.0016556 k( 127) = ( 0.2931727 0.5077900 -0.0000000), wk = 0.0016556 k( 128) = ( 0.2891566 0.5008340 -0.0000000), wk = 0.0016556 k( 129) = ( 0.2851406 0.4938779 -0.0000000), wk = 0.0016556 k( 130) = ( 0.2811245 0.4869219 -0.0000000), wk = 0.0016556 k( 131) = ( 0.2771084 0.4799659 -0.0000000), wk = 0.0016556 k( 132) = ( 0.2730924 0.4730099 -0.0000000), wk = 0.0016556 k( 133) = ( 0.2690763 0.4660538 -0.0000000), wk = 0.0016556 k( 134) = ( 0.2650602 0.4590978 -0.0000000), wk = 0.0016556 k( 135) = ( 0.2610442 0.4521418 -0.0000000), wk = 0.0016556 k( 136) = ( 0.2570281 0.4451857 -0.0000000), wk = 0.0016556 k( 137) = ( 0.2530120 0.4382297 -0.0000000), wk = 0.0016556 k( 138) = ( 0.2489960 0.4312737 -0.0000000), wk = 0.0016556 k( 139) = ( 0.2449799 0.4243177 -0.0000000), wk = 0.0016556 k( 140) = ( 0.2409639 0.4173616 -0.0000000), wk = 0.0016556 k( 141) = ( 0.2369478 0.4104056 -0.0000000), wk = 0.0016556 k( 142) = ( 0.2329317 0.4034496 -0.0000000), wk = 0.0016556 k( 143) = ( 0.2289157 0.3964936 -0.0000000), wk = 0.0016556 k( 144) = ( 0.2248996 0.3895375 -0.0000000), wk = 0.0016556 k( 145) = ( 0.2208835 0.3825815 -0.0000000), wk = 0.0016556 k( 146) = ( 0.2168675 0.3756255 -0.0000000), wk = 0.0016556 k( 147) = ( 0.2128514 0.3686695 -0.0000000), wk = 0.0016556 k( 148) = ( 0.2088353 0.3617134 -0.0000000), wk = 0.0016556 k( 149) = ( 0.2048193 0.3547574 -0.0000000), wk = 0.0016556 k( 150) = ( 0.2008032 0.3478014 -0.0000000), wk = 0.0016556 k( 151) = ( 0.1967871 0.3408453 -0.0000000), wk = 0.0016556 k( 152) = ( 0.1927711 0.3338893 -0.0000000), wk = 0.0016556 k( 153) = ( 0.1887550 0.3269333 -0.0000000), wk = 0.0016556 k( 154) = ( 0.1847390 0.3199773 -0.0000000), wk = 0.0016556 k( 155) = ( 0.1807229 0.3130212 -0.0000000), wk = 0.0016556 k( 156) = ( 0.1767068 0.3060652 -0.0000000), wk = 0.0016556 k( 157) = ( 0.1726908 0.2991092 -0.0000000), wk = 0.0016556 k( 158) = ( 0.1686747 0.2921532 -0.0000000), wk = 0.0016556 k( 159) = ( 0.1646586 0.2851971 -0.0000000), wk = 0.0016556 k( 160) = ( 0.1606426 0.2782411 -0.0000000), wk = 0.0016556 k( 161) = ( 0.1566265 0.2712851 -0.0000000), wk = 0.0016556 k( 162) = ( 0.1526104 0.2643290 -0.0000000), wk = 0.0016556 k( 163) = ( 0.1485944 0.2573730 -0.0000000), wk = 0.0016556 k( 164) = ( 0.1445783 0.2504170 -0.0000000), wk = 0.0016556 k( 165) = ( 0.1405622 0.2434610 -0.0000000), wk = 0.0016556 k( 166) = ( 0.1365462 0.2365049 -0.0000000), wk = 0.0016556 k( 167) = ( 0.1325301 0.2295489 -0.0000000), wk = 0.0016556 k( 168) = ( 0.1285141 0.2225929 -0.0000000), wk = 0.0016556 k( 169) = ( 0.1244980 0.2156368 -0.0000000), wk = 0.0016556 k( 170) = ( 0.1204819 0.2086808 -0.0000000), wk = 0.0016556 k( 171) = ( 0.1164659 0.2017248 -0.0000000), wk = 0.0016556 k( 172) = ( 0.1124498 0.1947688 -0.0000000), wk = 0.0016556 k( 173) = ( 0.1084337 0.1878127 -0.0000000), wk = 0.0016556 k( 174) = ( 0.1044177 0.1808567 -0.0000000), wk = 0.0016556 k( 175) = ( 0.1004016 0.1739007 -0.0000000), wk = 0.0016556 k( 176) = ( 0.0963855 0.1669447 -0.0000000), wk = 0.0016556 k( 177) = ( 0.0923695 0.1599886 -0.0000000), wk = 0.0016556 k( 178) = ( 0.0883534 0.1530326 -0.0000000), wk = 0.0016556 k( 179) = ( 0.0843374 0.1460766 -0.0000000), wk = 0.0016556 k( 180) = ( 0.0803213 0.1391206 -0.0000000), wk = 0.0016556 k( 181) = ( 0.0763052 0.1321645 -0.0000000), wk = 0.0016556 k( 182) = ( 0.0722892 0.1252085 -0.0000000), wk = 0.0016556 k( 183) = ( 0.0682731 0.1182525 -0.0000000), wk = 0.0016556 k( 184) = ( 0.0642570 0.1112964 -0.0000000), wk = 0.0016556 k( 185) = ( 0.0602410 0.1043404 -0.0000000), wk = 0.0016556 k( 186) = ( 0.0562249 0.0973844 -0.0000000), wk = 0.0016556 k( 187) = ( 0.0522088 0.0904284 -0.0000000), wk = 0.0016556 k( 188) = ( 0.0481928 0.0834723 -0.0000000), wk = 0.0016556 k( 189) = ( 0.0441767 0.0765163 -0.0000000), wk = 0.0016556 k( 190) = ( 0.0401606 0.0695603 -0.0000000), wk = 0.0016556 k( 191) = ( 0.0361446 0.0626042 -0.0000000), wk = 0.0016556 k( 192) = ( 0.0321285 0.0556482 -0.0000000), wk = 0.0016556 k( 193) = ( 0.0281125 0.0486922 -0.0000000), wk = 0.0016556 k( 194) = ( 0.0240964 0.0417362 -0.0000000), wk = 0.0016556 k( 195) = ( 0.0200803 0.0347801 -0.0000000), wk = 0.0016556 k( 196) = ( 0.0160643 0.0278241 -0.0000000), wk = 0.0016556 k( 197) = ( 0.0120482 0.0208681 -0.0000000), wk = 0.0016556 k( 198) = ( 0.0080321 0.0139121 -0.0000000), wk = 0.0016556 k( 199) = ( 0.0040161 0.0069560 -0.0000000), wk = 0.0016556 k( 200) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0016556 k( 201) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0016556 k( 202) = ( 0.0000000 0.0000000 0.0079470), wk = 0.0016556 k( 203) = ( 0.0000000 0.0000000 0.0158940), wk = 0.0016556 k( 204) = ( 0.0000000 0.0000000 0.0238410), wk = 0.0016556 k( 205) = ( 0.0000000 0.0000000 0.0317880), wk = 0.0016556 k( 206) = ( 0.0000000 0.0000000 0.0397350), wk = 0.0016556 k( 207) = ( 0.0000000 0.0000000 0.0476819), wk = 0.0016556 k( 208) = ( 0.0000000 0.0000000 0.0556289), wk = 0.0016556 k( 209) = ( 0.0000000 0.0000000 0.0635759), wk = 0.0016556 k( 210) = ( 0.0000000 0.0000000 0.0715229), wk = 0.0016556 k( 211) = ( 0.0000000 0.0000000 0.0794699), wk = 0.0016556 k( 212) = ( 0.0000000 0.0000000 0.0874169), wk = 0.0016556 k( 213) = ( 0.0000000 0.0000000 0.0953639), wk = 0.0016556 k( 214) = ( 0.0000000 0.0000000 0.1033109), wk = 0.0016556 k( 215) = ( 0.0000000 0.0000000 0.1112579), wk = 0.0016556 k( 216) = ( 0.0000000 0.0000000 0.1192049), wk = 0.0016556 k( 217) = ( 0.0000000 0.0000000 0.1271519), wk = 0.0016556 k( 218) = ( 0.0000000 0.0000000 0.1350988), wk = 0.0016556 k( 219) = ( 0.0000000 0.0000000 0.1430458), wk = 0.0016556 k( 220) = ( 0.0000000 0.0000000 0.1509928), wk = 0.0016556 k( 221) = ( 0.0000000 0.0000000 0.1589398), wk = 0.0016556 k( 222) = ( 0.0000000 0.0000000 0.1668868), wk = 0.0016556 k( 223) = ( 0.0000000 0.0000000 0.1748338), wk = 0.0016556 k( 224) = ( 0.0000000 0.0000000 0.1827808), wk = 0.0016556 k( 225) = ( 0.0000000 0.0000000 0.1907278), wk = 0.0016556 k( 226) = ( 0.0000000 0.0000000 0.1986748), wk = 0.0016556 k( 227) = ( 0.0000000 0.0000000 0.2066218), wk = 0.0016556 k( 228) = ( 0.0000000 0.0000000 0.2145688), wk = 0.0016556 k( 229) = ( 0.0000000 0.0000000 0.2225157), wk = 0.0016556 k( 230) = ( 0.0000000 0.0000000 0.2304627), wk = 0.0016556 k( 231) = ( 0.0000000 0.0000000 0.2384097), wk = 0.0016556 k( 232) = ( 0.0000000 0.0000000 0.2463567), wk = 0.0016556 k( 233) = ( 0.0000000 0.0000000 0.2543037), wk = 0.0016556 k( 234) = ( 0.0000000 0.0000000 0.2622507), wk = 0.0016556 k( 235) = ( 0.0000000 0.0000000 0.2701977), wk = 0.0016556 k( 236) = ( 0.0000000 0.0000000 0.2781447), wk = 0.0016556 k( 237) = ( 0.0000000 0.0000000 0.2860917), wk = 0.0016556 k( 238) = ( 0.0000000 0.0000000 0.2940387), wk = 0.0016556 k( 239) = ( 0.0000000 0.0000000 0.3019856), wk = 0.0016556 k( 240) = ( 0.0000000 0.0000000 0.3099326), wk = 0.0016556 k( 241) = ( 0.0000000 0.0000000 0.3178796), wk = 0.0016556 k( 242) = ( 0.0000000 0.0000000 0.3258266), wk = 0.0016556 k( 243) = ( 0.0000000 0.0000000 0.3337736), wk = 0.0016556 k( 244) = ( 0.0000000 0.0000000 0.3417206), wk = 0.0016556 k( 245) = ( 0.0000000 0.0000000 0.3496676), wk = 0.0016556 k( 246) = ( 0.0000000 0.0000000 0.3576146), wk = 0.0016556 k( 247) = ( 0.0000000 0.0000000 0.3655616), wk = 0.0016556 k( 248) = ( 0.0000000 0.0000000 0.3735086), wk = 0.0016556 k( 249) = ( 0.0000000 0.0000000 0.3814556), wk = 0.0016556 k( 250) = ( 0.0000000 0.0000000 0.3894025), wk = 0.0016556 k( 251) = ( 0.0000000 0.0000000 0.3973495), wk = 0.0016556 k( 252) = ( 0.0000000 0.0000000 0.4052965), wk = 0.0016556 k( 253) = ( 0.0000000 0.0000000 0.4132435), wk = 0.0016556 k( 254) = ( 0.0000000 0.0000000 0.4211905), wk = 0.0016556 k( 255) = ( 0.0000000 0.0000000 0.4291375), wk = 0.0016556 k( 256) = ( 0.0000000 0.0000000 0.4370845), wk = 0.0016556 k( 257) = ( 0.0000000 0.0000000 0.4450315), wk = 0.0016556 k( 258) = ( 0.0000000 0.0000000 0.4529785), wk = 0.0016556 k( 259) = ( 0.0000000 0.0000000 0.4609255), wk = 0.0016556 k( 260) = ( 0.0000000 0.0000000 0.4688725), wk = 0.0016556 k( 261) = ( 0.0000000 0.0000000 0.4768194), wk = 0.0016556 k( 262) = ( 0.0000000 0.0000000 0.4847664), wk = 0.0016556 k( 263) = ( 0.0000000 0.0000000 0.4927134), wk = 0.0016556 k( 264) = ( 0.0000000 0.0000000 0.5006604), wk = 0.0016556 k( 265) = ( 0.0000000 0.0000000 0.5086074), wk = 0.0016556 k( 266) = ( 0.0000000 0.0000000 0.5165544), wk = 0.0016556 k( 267) = ( 0.0000000 0.0000000 0.5245014), wk = 0.0016556 k( 268) = ( 0.0000000 0.0000000 0.5324484), wk = 0.0016556 k( 269) = ( 0.0000000 0.0000000 0.5324484), wk = 0.0016556 k( 270) = ( 0.0069444 0.0040094 0.5324484), wk = 0.0016556 k( 271) = ( 0.0138889 0.0080188 0.5324484), wk = 0.0016556 k( 272) = ( 0.0208333 0.0120281 0.5324484), wk = 0.0016556 k( 273) = ( 0.0277778 0.0160375 0.5324484), wk = 0.0016556 k( 274) = ( 0.0347222 0.0200469 0.5324484), wk = 0.0016556 k( 275) = ( 0.0416667 0.0240563 0.5324484), wk = 0.0016556 k( 276) = ( 0.0486111 0.0280656 0.5324484), wk = 0.0016556 k( 277) = ( 0.0555556 0.0320750 0.5324484), wk = 0.0016556 k( 278) = ( 0.0625000 0.0360844 0.5324484), wk = 0.0016556 k( 279) = ( 0.0694444 0.0400938 0.5324484), wk = 0.0016556 k( 280) = ( 0.0763889 0.0441031 0.5324484), wk = 0.0016556 k( 281) = ( 0.0833333 0.0481125 0.5324484), wk = 0.0016556 k( 282) = ( 0.0902778 0.0521219 0.5324484), wk = 0.0016556 k( 283) = ( 0.0972222 0.0561313 0.5324484), wk = 0.0016556 k( 284) = ( 0.1041667 0.0601407 0.5324484), wk = 0.0016556 k( 285) = ( 0.1111111 0.0641500 0.5324484), wk = 0.0016556 k( 286) = ( 0.1180556 0.0681594 0.5324484), wk = 0.0016556 k( 287) = ( 0.1250000 0.0721688 0.5324484), wk = 0.0016556 k( 288) = ( 0.1319444 0.0761782 0.5324484), wk = 0.0016556 k( 289) = ( 0.1388889 0.0801875 0.5324484), wk = 0.0016556 k( 290) = ( 0.1458333 0.0841969 0.5324484), wk = 0.0016556 k( 291) = ( 0.1527778 0.0882063 0.5324484), wk = 0.0016556 k( 292) = ( 0.1597222 0.0922157 0.5324484), wk = 0.0016556 k( 293) = ( 0.1666667 0.0962250 0.5324484), wk = 0.0016556 k( 294) = ( 0.1736111 0.1002344 0.5324484), wk = 0.0016556 k( 295) = ( 0.1805556 0.1042438 0.5324484), wk = 0.0016556 k( 296) = ( 0.1875000 0.1082532 0.5324484), wk = 0.0016556 k( 297) = ( 0.1944444 0.1122625 0.5324484), wk = 0.0016556 k( 298) = ( 0.2013889 0.1162719 0.5324484), wk = 0.0016556 k( 299) = ( 0.2083333 0.1202813 0.5324484), wk = 0.0016556 k( 300) = ( 0.2152778 0.1242907 0.5324484), wk = 0.0016556 k( 301) = ( 0.2222222 0.1283001 0.5324484), wk = 0.0016556 k( 302) = ( 0.2291667 0.1323094 0.5324484), wk = 0.0016556 k( 303) = ( 0.2361111 0.1363188 0.5324484), wk = 0.0016556 k( 304) = ( 0.2430556 0.1403282 0.5324484), wk = 0.0016556 k( 305) = ( 0.2500000 0.1443376 0.5324484), wk = 0.0016556 k( 306) = ( 0.2569444 0.1483469 0.5324484), wk = 0.0016556 k( 307) = ( 0.2638889 0.1523563 0.5324484), wk = 0.0016556 k( 308) = ( 0.2708333 0.1563657 0.5324484), wk = 0.0016556 k( 309) = ( 0.2777778 0.1603751 0.5324484), wk = 0.0016556 k( 310) = ( 0.2847222 0.1643845 0.5324484), wk = 0.0016556 k( 311) = ( 0.2916667 0.1683938 0.5324484), wk = 0.0016556 k( 312) = ( 0.2986111 0.1724032 0.5324484), wk = 0.0016556 k( 313) = ( 0.3055556 0.1764126 0.5324484), wk = 0.0016556 k( 314) = ( 0.3125000 0.1804220 0.5324484), wk = 0.0016556 k( 315) = ( 0.3194444 0.1844313 0.5324484), wk = 0.0016556 k( 316) = ( 0.3263889 0.1884407 0.5324484), wk = 0.0016556 k( 317) = ( 0.3333333 0.1924501 0.5324484), wk = 0.0016556 k( 318) = ( 0.3402778 0.1964595 0.5324484), wk = 0.0016556 k( 319) = ( 0.3472222 0.2004688 0.5324484), wk = 0.0016556 k( 320) = ( 0.3541667 0.2044782 0.5324484), wk = 0.0016556 k( 321) = ( 0.3611111 0.2084876 0.5324484), wk = 0.0016556 k( 322) = ( 0.3680556 0.2124970 0.5324484), wk = 0.0016556 k( 323) = ( 0.3750000 0.2165064 0.5324484), wk = 0.0016556 k( 324) = ( 0.3819444 0.2205157 0.5324484), wk = 0.0016556 k( 325) = ( 0.3888889 0.2245251 0.5324484), wk = 0.0016556 k( 326) = ( 0.3958333 0.2285345 0.5324484), wk = 0.0016556 k( 327) = ( 0.4027778 0.2325439 0.5324484), wk = 0.0016556 k( 328) = ( 0.4097222 0.2365532 0.5324484), wk = 0.0016556 k( 329) = ( 0.4166667 0.2405626 0.5324484), wk = 0.0016556 k( 330) = ( 0.4236111 0.2445720 0.5324484), wk = 0.0016556 k( 331) = ( 0.4305556 0.2485814 0.5324484), wk = 0.0016556 k( 332) = ( 0.4375000 0.2525907 0.5324484), wk = 0.0016556 k( 333) = ( 0.4444444 0.2566001 0.5324484), wk = 0.0016556 k( 334) = ( 0.4513889 0.2606095 0.5324484), wk = 0.0016556 k( 335) = ( 0.4583333 0.2646189 0.5324484), wk = 0.0016556 k( 336) = ( 0.4652778 0.2686283 0.5324484), wk = 0.0016556 k( 337) = ( 0.4722222 0.2726376 0.5324484), wk = 0.0016556 k( 338) = ( 0.4791667 0.2766470 0.5324484), wk = 0.0016556 k( 339) = ( 0.4861111 0.2806564 0.5324484), wk = 0.0016556 k( 340) = ( 0.4930556 0.2846658 0.5324484), wk = 0.0016556 k( 341) = ( 0.5000000 0.2886751 0.5324484), wk = 0.0016556 k( 342) = ( 0.5000000 0.2886751 0.5324484), wk = 0.0016556 k( 343) = ( 0.4960317 0.2955484 0.5324484), wk = 0.0016556 k( 344) = ( 0.4920635 0.3024216 0.5324484), wk = 0.0016556 k( 345) = ( 0.4880952 0.3092948 0.5324484), wk = 0.0016556 k( 346) = ( 0.4841270 0.3161680 0.5324484), wk = 0.0016556 k( 347) = ( 0.4801587 0.3230412 0.5324484), wk = 0.0016556 k( 348) = ( 0.4761905 0.3299144 0.5324484), wk = 0.0016556 k( 349) = ( 0.4722222 0.3367877 0.5324484), wk = 0.0016556 k( 350) = ( 0.4682540 0.3436609 0.5324484), wk = 0.0016556 k( 351) = ( 0.4642857 0.3505341 0.5324484), wk = 0.0016556 k( 352) = ( 0.4603175 0.3574073 0.5324484), wk = 0.0016556 k( 353) = ( 0.4563492 0.3642805 0.5324484), wk = 0.0016556 k( 354) = ( 0.4523810 0.3711537 0.5324484), wk = 0.0016556 k( 355) = ( 0.4484127 0.3780270 0.5324484), wk = 0.0016556 k( 356) = ( 0.4444444 0.3849002 0.5324484), wk = 0.0016556 k( 357) = ( 0.4404762 0.3917734 0.5324484), wk = 0.0016556 k( 358) = ( 0.4365079 0.3986466 0.5324484), wk = 0.0016556 k( 359) = ( 0.4325397 0.4055198 0.5324484), wk = 0.0016556 k( 360) = ( 0.4285714 0.4123930 0.5324484), wk = 0.0016556 k( 361) = ( 0.4246032 0.4192663 0.5324484), wk = 0.0016556 k( 362) = ( 0.4206349 0.4261395 0.5324484), wk = 0.0016556 k( 363) = ( 0.4166667 0.4330127 0.5324484), wk = 0.0016556 k( 364) = ( 0.4126984 0.4398859 0.5324484), wk = 0.0016556 k( 365) = ( 0.4087302 0.4467591 0.5324484), wk = 0.0016556 k( 366) = ( 0.4047619 0.4536324 0.5324484), wk = 0.0016556 k( 367) = ( 0.4007937 0.4605056 0.5324484), wk = 0.0016556 k( 368) = ( 0.3968254 0.4673788 0.5324484), wk = 0.0016556 k( 369) = ( 0.3928571 0.4742520 0.5324484), wk = 0.0016556 k( 370) = ( 0.3888889 0.4811252 0.5324484), wk = 0.0016556 k( 371) = ( 0.3849206 0.4879984 0.5324484), wk = 0.0016556 k( 372) = ( 0.3809524 0.4948717 0.5324484), wk = 0.0016556 k( 373) = ( 0.3769841 0.5017449 0.5324484), wk = 0.0016556 k( 374) = ( 0.3730159 0.5086181 0.5324484), wk = 0.0016556 k( 375) = ( 0.3690476 0.5154913 0.5324484), wk = 0.0016556 k( 376) = ( 0.3650794 0.5223645 0.5324484), wk = 0.0016556 k( 377) = ( 0.3611111 0.5292377 0.5324484), wk = 0.0016556 k( 378) = ( 0.3571429 0.5361110 0.5324484), wk = 0.0016556 k( 379) = ( 0.3531746 0.5429842 0.5324484), wk = 0.0016556 k( 380) = ( 0.3492063 0.5498574 0.5324484), wk = 0.0016556 k( 381) = ( 0.3452381 0.5567306 0.5324484), wk = 0.0016556 k( 382) = ( 0.3412698 0.5636038 0.5324484), wk = 0.0016556 k( 383) = ( 0.3373016 0.5704771 0.5324484), wk = 0.0016556 k( 384) = ( 0.3333333 0.5773503 0.5324484), wk = 0.0016556 k( 385) = ( 0.3333333 0.5773503 0.5324484), wk = 0.0016556 k( 386) = ( 0.3293173 0.5703942 0.5324484), wk = 0.0016556 k( 387) = ( 0.3253012 0.5634382 0.5324484), wk = 0.0016556 k( 388) = ( 0.3212851 0.5564822 0.5324484), wk = 0.0016556 k( 389) = ( 0.3172691 0.5495262 0.5324484), wk = 0.0016556 k( 390) = ( 0.3132530 0.5425701 0.5324484), wk = 0.0016556 k( 391) = ( 0.3092370 0.5356141 0.5324484), wk = 0.0016556 k( 392) = ( 0.3052209 0.5286581 0.5324484), wk = 0.0016556 k( 393) = ( 0.3012048 0.5217021 0.5324484), wk = 0.0016556 k( 394) = ( 0.2971888 0.5147460 0.5324484), wk = 0.0016556 k( 395) = ( 0.2931727 0.5077900 0.5324484), wk = 0.0016556 k( 396) = ( 0.2891566 0.5008340 0.5324484), wk = 0.0016556 k( 397) = ( 0.2851406 0.4938779 0.5324484), wk = 0.0016556 k( 398) = ( 0.2811245 0.4869219 0.5324484), wk = 0.0016556 k( 399) = ( 0.2771084 0.4799659 0.5324484), wk = 0.0016556 k( 400) = ( 0.2730924 0.4730099 0.5324484), wk = 0.0016556 k( 401) = ( 0.2690763 0.4660538 0.5324484), wk = 0.0016556 k( 402) = ( 0.2650602 0.4590978 0.5324484), wk = 0.0016556 k( 403) = ( 0.2610442 0.4521418 0.5324484), wk = 0.0016556 k( 404) = ( 0.2570281 0.4451857 0.5324484), wk = 0.0016556 k( 405) = ( 0.2530120 0.4382297 0.5324484), wk = 0.0016556 k( 406) = ( 0.2489960 0.4312737 0.5324484), wk = 0.0016556 k( 407) = ( 0.2449799 0.4243177 0.5324484), wk = 0.0016556 k( 408) = ( 0.2409639 0.4173616 0.5324484), wk = 0.0016556 k( 409) = ( 0.2369478 0.4104056 0.5324484), wk = 0.0016556 k( 410) = ( 0.2329317 0.4034496 0.5324484), wk = 0.0016556 k( 411) = ( 0.2289157 0.3964936 0.5324484), wk = 0.0016556 k( 412) = ( 0.2248996 0.3895375 0.5324484), wk = 0.0016556 k( 413) = ( 0.2208835 0.3825815 0.5324484), wk = 0.0016556 k( 414) = ( 0.2168675 0.3756255 0.5324484), wk = 0.0016556 k( 415) = ( 0.2128514 0.3686695 0.5324484), wk = 0.0016556 k( 416) = ( 0.2088353 0.3617134 0.5324484), wk = 0.0016556 k( 417) = ( 0.2048193 0.3547574 0.5324484), wk = 0.0016556 k( 418) = ( 0.2008032 0.3478014 0.5324484), wk = 0.0016556 k( 419) = ( 0.1967871 0.3408453 0.5324484), wk = 0.0016556 k( 420) = ( 0.1927711 0.3338893 0.5324484), wk = 0.0016556 k( 421) = ( 0.1887550 0.3269333 0.5324484), wk = 0.0016556 k( 422) = ( 0.1847390 0.3199773 0.5324484), wk = 0.0016556 k( 423) = ( 0.1807229 0.3130212 0.5324484), wk = 0.0016556 k( 424) = ( 0.1767068 0.3060652 0.5324484), wk = 0.0016556 k( 425) = ( 0.1726908 0.2991092 0.5324484), wk = 0.0016556 k( 426) = ( 0.1686747 0.2921532 0.5324484), wk = 0.0016556 k( 427) = ( 0.1646586 0.2851971 0.5324484), wk = 0.0016556 k( 428) = ( 0.1606426 0.2782411 0.5324484), wk = 0.0016556 k( 429) = ( 0.1566265 0.2712851 0.5324484), wk = 0.0016556 k( 430) = ( 0.1526104 0.2643290 0.5324484), wk = 0.0016556 k( 431) = ( 0.1485944 0.2573730 0.5324484), wk = 0.0016556 k( 432) = ( 0.1445783 0.2504170 0.5324484), wk = 0.0016556 k( 433) = ( 0.1405622 0.2434610 0.5324484), wk = 0.0016556 k( 434) = ( 0.1365462 0.2365049 0.5324484), wk = 0.0016556 k( 435) = ( 0.1325301 0.2295489 0.5324484), wk = 0.0016556 k( 436) = ( 0.1285141 0.2225929 0.5324484), wk = 0.0016556 k( 437) = ( 0.1244980 0.2156368 0.5324484), wk = 0.0016556 k( 438) = ( 0.1204819 0.2086808 0.5324484), wk = 0.0016556 k( 439) = ( 0.1164659 0.2017248 0.5324484), wk = 0.0016556 k( 440) = ( 0.1124498 0.1947688 0.5324484), wk = 0.0016556 k( 441) = ( 0.1084337 0.1878127 0.5324484), wk = 0.0016556 k( 442) = ( 0.1044177 0.1808567 0.5324484), wk = 0.0016556 k( 443) = ( 0.1004016 0.1739007 0.5324484), wk = 0.0016556 k( 444) = ( 0.0963855 0.1669447 0.5324484), wk = 0.0016556 k( 445) = ( 0.0923695 0.1599886 0.5324484), wk = 0.0016556 k( 446) = ( 0.0883534 0.1530326 0.5324484), wk = 0.0016556 k( 447) = ( 0.0843374 0.1460766 0.5324484), wk = 0.0016556 k( 448) = ( 0.0803213 0.1391206 0.5324484), wk = 0.0016556 k( 449) = ( 0.0763052 0.1321645 0.5324484), wk = 0.0016556 k( 450) = ( 0.0722892 0.1252085 0.5324484), wk = 0.0016556 k( 451) = ( 0.0682731 0.1182525 0.5324484), wk = 0.0016556 k( 452) = ( 0.0642570 0.1112964 0.5324484), wk = 0.0016556 k( 453) = ( 0.0602410 0.1043404 0.5324484), wk = 0.0016556 k( 454) = ( 0.0562249 0.0973844 0.5324484), wk = 0.0016556 k( 455) = ( 0.0522088 0.0904284 0.5324484), wk = 0.0016556 k( 456) = ( 0.0481928 0.0834723 0.5324484), wk = 0.0016556 k( 457) = ( 0.0441767 0.0765163 0.5324484), wk = 0.0016556 k( 458) = ( 0.0401606 0.0695603 0.5324484), wk = 0.0016556 k( 459) = ( 0.0361446 0.0626042 0.5324484), wk = 0.0016556 k( 460) = ( 0.0321285 0.0556482 0.5324484), wk = 0.0016556 k( 461) = ( 0.0281125 0.0486922 0.5324484), wk = 0.0016556 k( 462) = ( 0.0240964 0.0417362 0.5324484), wk = 0.0016556 k( 463) = ( 0.0200803 0.0347801 0.5324484), wk = 0.0016556 k( 464) = ( 0.0160643 0.0278241 0.5324484), wk = 0.0016556 k( 465) = ( 0.0120482 0.0208681 0.5324484), wk = 0.0016556 k( 466) = ( 0.0080321 0.0139121 0.5324484), wk = 0.0016556 k( 467) = ( 0.0040161 0.0069560 0.5324484), wk = 0.0016556 k( 468) = ( 0.0000000 0.0000000 0.5324484), wk = 0.0016556 k( 469) = ( 0.5000000 0.2886751 0.5324484), wk = 0.0016556 k( 470) = ( 0.5000000 0.2886751 0.5245014), wk = 0.0016556 k( 471) = ( 0.5000000 0.2886751 0.5165544), wk = 0.0016556 k( 472) = ( 0.5000000 0.2886751 0.5086074), wk = 0.0016556 k( 473) = ( 0.5000000 0.2886751 0.5006604), wk = 0.0016556 k( 474) = ( 0.5000000 0.2886751 0.4927134), wk = 0.0016556 k( 475) = ( 0.5000000 0.2886751 0.4847664), wk = 0.0016556 k( 476) = ( 0.5000000 0.2886751 0.4768194), wk = 0.0016556 k( 477) = ( 0.5000000 0.2886751 0.4688725), wk = 0.0016556 k( 478) = ( 0.5000000 0.2886751 0.4609255), wk = 0.0016556 k( 479) = ( 0.5000000 0.2886751 0.4529785), wk = 0.0016556 k( 480) = ( 0.5000000 0.2886751 0.4450315), wk = 0.0016556 k( 481) = ( 0.5000000 0.2886751 0.4370845), wk = 0.0016556 k( 482) = ( 0.5000000 0.2886751 0.4291375), wk = 0.0016556 k( 483) = ( 0.5000000 0.2886751 0.4211905), wk = 0.0016556 k( 484) = ( 0.5000000 0.2886751 0.4132435), wk = 0.0016556 k( 485) = ( 0.5000000 0.2886751 0.4052965), wk = 0.0016556 k( 486) = ( 0.5000000 0.2886751 0.3973495), wk = 0.0016556 k( 487) = ( 0.5000000 0.2886751 0.3894025), wk = 0.0016556 k( 488) = ( 0.5000000 0.2886751 0.3814556), wk = 0.0016556 k( 489) = ( 0.5000000 0.2886751 0.3735086), wk = 0.0016556 k( 490) = ( 0.5000000 0.2886751 0.3655616), wk = 0.0016556 k( 491) = ( 0.5000000 0.2886751 0.3576146), wk = 0.0016556 k( 492) = ( 0.5000000 0.2886751 0.3496676), wk = 0.0016556 k( 493) = ( 0.5000000 0.2886751 0.3417206), wk = 0.0016556 k( 494) = ( 0.5000000 0.2886751 0.3337736), wk = 0.0016556 k( 495) = ( 0.5000000 0.2886751 0.3258266), wk = 0.0016556 k( 496) = ( 0.5000000 0.2886751 0.3178796), wk = 0.0016556 k( 497) = ( 0.5000000 0.2886751 0.3099326), wk = 0.0016556 k( 498) = ( 0.5000000 0.2886751 0.3019856), wk = 0.0016556 k( 499) = ( 0.5000000 0.2886751 0.2940387), wk = 0.0016556 k( 500) = ( 0.5000000 0.2886751 0.2860917), wk = 0.0016556 k( 501) = ( 0.5000000 0.2886751 0.2781447), wk = 0.0016556 k( 502) = ( 0.5000000 0.2886751 0.2701977), wk = 0.0016556 k( 503) = ( 0.5000000 0.2886751 0.2622507), wk = 0.0016556 k( 504) = ( 0.5000000 0.2886751 0.2543037), wk = 0.0016556 k( 505) = ( 0.5000000 0.2886751 0.2463567), wk = 0.0016556 k( 506) = ( 0.5000000 0.2886751 0.2384097), wk = 0.0016556 k( 507) = ( 0.5000000 0.2886751 0.2304627), wk = 0.0016556 k( 508) = ( 0.5000000 0.2886751 0.2225157), wk = 0.0016556 k( 509) = ( 0.5000000 0.2886751 0.2145688), wk = 0.0016556 k( 510) = ( 0.5000000 0.2886751 0.2066218), wk = 0.0016556 k( 511) = ( 0.5000000 0.2886751 0.1986748), wk = 0.0016556 k( 512) = ( 0.5000000 0.2886751 0.1907278), wk = 0.0016556 k( 513) = ( 0.5000000 0.2886751 0.1827808), wk = 0.0016556 k( 514) = ( 0.5000000 0.2886751 0.1748338), wk = 0.0016556 k( 515) = ( 0.5000000 0.2886751 0.1668868), wk = 0.0016556 k( 516) = ( 0.5000000 0.2886751 0.1589398), wk = 0.0016556 k( 517) = ( 0.5000000 0.2886751 0.1509928), wk = 0.0016556 k( 518) = ( 0.5000000 0.2886751 0.1430458), wk = 0.0016556 k( 519) = ( 0.5000000 0.2886751 0.1350988), wk = 0.0016556 k( 520) = ( 0.5000000 0.2886751 0.1271519), wk = 0.0016556 k( 521) = ( 0.5000000 0.2886751 0.1192049), wk = 0.0016556 k( 522) = ( 0.5000000 0.2886751 0.1112579), wk = 0.0016556 k( 523) = ( 0.5000000 0.2886751 0.1033109), wk = 0.0016556 k( 524) = ( 0.5000000 0.2886751 0.0953639), wk = 0.0016556 k( 525) = ( 0.5000000 0.2886751 0.0874169), wk = 0.0016556 k( 526) = ( 0.5000000 0.2886751 0.0794699), wk = 0.0016556 k( 527) = ( 0.5000000 0.2886751 0.0715229), wk = 0.0016556 k( 528) = ( 0.5000000 0.2886751 0.0635759), wk = 0.0016556 k( 529) = ( 0.5000000 0.2886751 0.0556289), wk = 0.0016556 k( 530) = ( 0.5000000 0.2886751 0.0476819), wk = 0.0016556 k( 531) = ( 0.5000000 0.2886751 0.0397350), wk = 0.0016556 k( 532) = ( 0.5000000 0.2886751 0.0317880), wk = 0.0016556 k( 533) = ( 0.5000000 0.2886751 0.0238410), wk = 0.0016556 k( 534) = ( 0.5000000 0.2886751 0.0158940), wk = 0.0016556 k( 535) = ( 0.5000000 0.2886751 0.0079470), wk = 0.0016556 k( 536) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0016556 k( 537) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0016556 k( 538) = ( 0.3333333 0.5773503 0.0079470), wk = 0.0016556 k( 539) = ( 0.3333333 0.5773503 0.0158940), wk = 0.0016556 k( 540) = ( 0.3333333 0.5773503 0.0238410), wk = 0.0016556 k( 541) = ( 0.3333333 0.5773503 0.0317880), wk = 0.0016556 k( 542) = ( 0.3333333 0.5773503 0.0397350), wk = 0.0016556 k( 543) = ( 0.3333333 0.5773503 0.0476819), wk = 0.0016556 k( 544) = ( 0.3333333 0.5773503 0.0556289), wk = 0.0016556 k( 545) = ( 0.3333333 0.5773503 0.0635759), wk = 0.0016556 k( 546) = ( 0.3333333 0.5773503 0.0715229), wk = 0.0016556 k( 547) = ( 0.3333333 0.5773503 0.0794699), wk = 0.0016556 k( 548) = ( 0.3333333 0.5773503 0.0874169), wk = 0.0016556 k( 549) = ( 0.3333333 0.5773503 0.0953639), wk = 0.0016556 k( 550) = ( 0.3333333 0.5773503 0.1033109), wk = 0.0016556 k( 551) = ( 0.3333333 0.5773503 0.1112579), wk = 0.0016556 k( 552) = ( 0.3333333 0.5773503 0.1192049), wk = 0.0016556 k( 553) = ( 0.3333333 0.5773503 0.1271519), wk = 0.0016556 k( 554) = ( 0.3333333 0.5773503 0.1350988), wk = 0.0016556 k( 555) = ( 0.3333333 0.5773503 0.1430458), wk = 0.0016556 k( 556) = ( 0.3333333 0.5773503 0.1509928), wk = 0.0016556 k( 557) = ( 0.3333333 0.5773503 0.1589398), wk = 0.0016556 k( 558) = ( 0.3333333 0.5773503 0.1668868), wk = 0.0016556 k( 559) = ( 0.3333333 0.5773503 0.1748338), wk = 0.0016556 k( 560) = ( 0.3333333 0.5773503 0.1827808), wk = 0.0016556 k( 561) = ( 0.3333333 0.5773503 0.1907278), wk = 0.0016556 k( 562) = ( 0.3333333 0.5773503 0.1986748), wk = 0.0016556 k( 563) = ( 0.3333333 0.5773503 0.2066218), wk = 0.0016556 k( 564) = ( 0.3333333 0.5773503 0.2145688), wk = 0.0016556 k( 565) = ( 0.3333333 0.5773503 0.2225157), wk = 0.0016556 k( 566) = ( 0.3333333 0.5773503 0.2304627), wk = 0.0016556 k( 567) = ( 0.3333333 0.5773503 0.2384097), wk = 0.0016556 k( 568) = ( 0.3333333 0.5773503 0.2463567), wk = 0.0016556 k( 569) = ( 0.3333333 0.5773503 0.2543037), wk = 0.0016556 k( 570) = ( 0.3333333 0.5773503 0.2622507), wk = 0.0016556 k( 571) = ( 0.3333333 0.5773503 0.2701977), wk = 0.0016556 k( 572) = ( 0.3333333 0.5773503 0.2781447), wk = 0.0016556 k( 573) = ( 0.3333333 0.5773503 0.2860917), wk = 0.0016556 k( 574) = ( 0.3333333 0.5773503 0.2940387), wk = 0.0016556 k( 575) = ( 0.3333333 0.5773503 0.3019856), wk = 0.0016556 k( 576) = ( 0.3333333 0.5773503 0.3099326), wk = 0.0016556 k( 577) = ( 0.3333333 0.5773503 0.3178796), wk = 0.0016556 k( 578) = ( 0.3333333 0.5773503 0.3258266), wk = 0.0016556 k( 579) = ( 0.3333333 0.5773503 0.3337736), wk = 0.0016556 k( 580) = ( 0.3333333 0.5773503 0.3417206), wk = 0.0016556 k( 581) = ( 0.3333333 0.5773503 0.3496676), wk = 0.0016556 k( 582) = ( 0.3333333 0.5773503 0.3576146), wk = 0.0016556 k( 583) = ( 0.3333333 0.5773503 0.3655616), wk = 0.0016556 k( 584) = ( 0.3333333 0.5773503 0.3735086), wk = 0.0016556 k( 585) = ( 0.3333333 0.5773503 0.3814556), wk = 0.0016556 k( 586) = ( 0.3333333 0.5773503 0.3894025), wk = 0.0016556 k( 587) = ( 0.3333333 0.5773503 0.3973495), wk = 0.0016556 k( 588) = ( 0.3333333 0.5773503 0.4052965), wk = 0.0016556 k( 589) = ( 0.3333333 0.5773503 0.4132435), wk = 0.0016556 k( 590) = ( 0.3333333 0.5773503 0.4211905), wk = 0.0016556 k( 591) = ( 0.3333333 0.5773503 0.4291375), wk = 0.0016556 k( 592) = ( 0.3333333 0.5773503 0.4370845), wk = 0.0016556 k( 593) = ( 0.3333333 0.5773503 0.4450315), wk = 0.0016556 k( 594) = ( 0.3333333 0.5773503 0.4529785), wk = 0.0016556 k( 595) = ( 0.3333333 0.5773503 0.4609255), wk = 0.0016556 k( 596) = ( 0.3333333 0.5773503 0.4688725), wk = 0.0016556 k( 597) = ( 0.3333333 0.5773503 0.4768194), wk = 0.0016556 k( 598) = ( 0.3333333 0.5773503 0.4847664), wk = 0.0016556 k( 599) = ( 0.3333333 0.5773503 0.4927134), wk = 0.0016556 k( 600) = ( 0.3333333 0.5773503 0.5006604), wk = 0.0016556 k( 601) = ( 0.3333333 0.5773503 0.5086074), wk = 0.0016556 k( 602) = ( 0.3333333 0.5773503 0.5165544), wk = 0.0016556 k( 603) = ( 0.3333333 0.5773503 0.5245014), wk = 0.0016556 k( 604) = ( 0.3333333 0.5773503 0.5324484), wk = 0.0016556 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0016556 k( 2) = ( 0.0069444 -0.0000000 -0.0000000), wk = 0.0016556 k( 3) = ( 0.0138889 -0.0000000 0.0000000), wk = 0.0016556 k( 4) = ( 0.0208333 -0.0000000 -0.0000000), wk = 0.0016556 k( 5) = ( 0.0277778 -0.0000000 0.0000000), wk = 0.0016556 k( 6) = ( 0.0347222 -0.0000000 0.0000000), wk = 0.0016556 k( 7) = ( 0.0416667 -0.0000000 -0.0000000), wk = 0.0016556 k( 8) = ( 0.0486111 -0.0000000 0.0000000), wk = 0.0016556 k( 9) = ( 0.0555556 -0.0000000 0.0000000), wk = 0.0016556 k( 10) = ( 0.0625000 -0.0000000 -0.0000000), wk = 0.0016556 k( 11) = ( 0.0694444 -0.0000000 0.0000000), wk = 0.0016556 k( 12) = ( 0.0763889 -0.0000000 -0.0000000), wk = 0.0016556 k( 13) = ( 0.0833333 -0.0000000 -0.0000000), wk = 0.0016556 k( 14) = ( 0.0902778 -0.0000000 -0.0000000), wk = 0.0016556 k( 15) = ( 0.0972222 -0.0000000 0.0000000), wk = 0.0016556 k( 16) = ( 0.1041667 -0.0000000 -0.0000000), wk = 0.0016556 k( 17) = ( 0.1111111 -0.0000000 -0.0000000), wk = 0.0016556 k( 18) = ( 0.1180556 -0.0000000 -0.0000000), wk = 0.0016556 k( 19) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0016556 k( 20) = ( 0.1319444 -0.0000000 0.0000000), wk = 0.0016556 k( 21) = ( 0.1388889 -0.0000000 -0.0000000), wk = 0.0016556 k( 22) = ( 0.1458333 -0.0000000 -0.0000000), wk = 0.0016556 k( 23) = ( 0.1527778 -0.0000000 -0.0000000), wk = 0.0016556 k( 24) = ( 0.1597222 -0.0000000 0.0000000), wk = 0.0016556 k( 25) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0016556 k( 26) = ( 0.1736111 -0.0000000 0.0000000), wk = 0.0016556 k( 27) = ( 0.1805556 -0.0000000 -0.0000000), wk = 0.0016556 k( 28) = ( 0.1875000 -0.0000000 -0.0000000), wk = 0.0016556 k( 29) = ( 0.1944444 -0.0000000 0.0000000), wk = 0.0016556 k( 30) = ( 0.2013889 -0.0000000 -0.0000000), wk = 0.0016556 k( 31) = ( 0.2083333 -0.0000000 -0.0000000), wk = 0.0016556 k( 32) = ( 0.2152778 -0.0000000 -0.0000000), wk = 0.0016556 k( 33) = ( 0.2222222 -0.0000000 -0.0000000), wk = 0.0016556 k( 34) = ( 0.2291667 -0.0000000 -0.0000000), wk = 0.0016556 k( 35) = ( 0.2361111 -0.0000000 -0.0000000), wk = 0.0016556 k( 36) = ( 0.2430556 -0.0000000 -0.0000000), wk = 0.0016556 k( 37) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0016556 k( 38) = ( 0.2569444 -0.0000000 -0.0000000), wk = 0.0016556 k( 39) = ( 0.2638889 -0.0000000 0.0000000), wk = 0.0016556 k( 40) = ( 0.2708333 -0.0000000 0.0000000), wk = 0.0016556 k( 41) = ( 0.2777778 -0.0000000 -0.0000000), wk = 0.0016556 k( 42) = ( 0.2847222 -0.0000000 -0.0000000), wk = 0.0016556 k( 43) = ( 0.2916667 -0.0000000 -0.0000000), wk = 0.0016556 k( 44) = ( 0.2986111 -0.0000000 -0.0000000), wk = 0.0016556 k( 45) = ( 0.3055556 -0.0000000 -0.0000000), wk = 0.0016556 k( 46) = ( 0.3125000 -0.0000000 -0.0000000), wk = 0.0016556 k( 47) = ( 0.3194444 -0.0000000 0.0000000), wk = 0.0016556 k( 48) = ( 0.3263889 -0.0000000 -0.0000000), wk = 0.0016556 k( 49) = ( 0.3333333 -0.0000000 -0.0000000), wk = 0.0016556 k( 50) = ( 0.3402778 -0.0000000 -0.0000000), wk = 0.0016556 k( 51) = ( 0.3472222 -0.0000000 0.0000000), wk = 0.0016556 k( 52) = ( 0.3541667 -0.0000000 0.0000000), wk = 0.0016556 k( 53) = ( 0.3611111 -0.0000000 -0.0000000), wk = 0.0016556 k( 54) = ( 0.3680556 -0.0000000 -0.0000000), wk = 0.0016556 k( 55) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0016556 k( 56) = ( 0.3819444 -0.0000000 -0.0000000), wk = 0.0016556 k( 57) = ( 0.3888889 -0.0000000 0.0000000), wk = 0.0016556 k( 58) = ( 0.3958333 -0.0000000 -0.0000000), wk = 0.0016556 k( 59) = ( 0.4027778 -0.0000000 -0.0000000), wk = 0.0016556 k( 60) = ( 0.4097222 -0.0000000 -0.0000000), wk = 0.0016556 k( 61) = ( 0.4166667 -0.0000000 -0.0000000), wk = 0.0016556 k( 62) = ( 0.4236111 -0.0000000 -0.0000000), wk = 0.0016556 k( 63) = ( 0.4305556 -0.0000000 -0.0000000), wk = 0.0016556 k( 64) = ( 0.4375000 -0.0000000 0.0000000), wk = 0.0016556 k( 65) = ( 0.4444444 -0.0000000 -0.0000000), wk = 0.0016556 k( 66) = ( 0.4513889 -0.0000000 -0.0000000), wk = 0.0016556 k( 67) = ( 0.4583333 -0.0000000 -0.0000000), wk = 0.0016556 k( 68) = ( 0.4652778 -0.0000000 -0.0000000), wk = 0.0016556 k( 69) = ( 0.4722222 -0.0000000 -0.0000000), wk = 0.0016556 k( 70) = ( 0.4791667 -0.0000000 -0.0000000), wk = 0.0016556 k( 71) = ( 0.4861111 -0.0000000 0.0000000), wk = 0.0016556 k( 72) = ( 0.4930556 -0.0000000 -0.0000000), wk = 0.0016556 k( 73) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0016556 k( 74) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0016556 k( 75) = ( 0.4960317 0.0079365 0.0000000), wk = 0.0016556 k( 76) = ( 0.4920635 0.0158730 -0.0000000), wk = 0.0016556 k( 77) = ( 0.4880952 0.0238095 -0.0000000), wk = 0.0016556 k( 78) = ( 0.4841270 0.0317460 -0.0000000), wk = 0.0016556 k( 79) = ( 0.4801587 0.0396825 0.0000000), wk = 0.0016556 k( 80) = ( 0.4761905 0.0476190 0.0000000), wk = 0.0016556 k( 81) = ( 0.4722222 0.0555556 -0.0000000), wk = 0.0016556 k( 82) = ( 0.4682540 0.0634921 -0.0000000), wk = 0.0016556 k( 83) = ( 0.4642857 0.0714286 0.0000000), wk = 0.0016556 k( 84) = ( 0.4603175 0.0793651 -0.0000000), wk = 0.0016556 k( 85) = ( 0.4563492 0.0873016 -0.0000000), wk = 0.0016556 k( 86) = ( 0.4523810 0.0952381 -0.0000000), wk = 0.0016556 k( 87) = ( 0.4484127 0.1031746 -0.0000000), wk = 0.0016556 k( 88) = ( 0.4444444 0.1111111 -0.0000000), wk = 0.0016556 k( 89) = ( 0.4404762 0.1190476 0.0000000), wk = 0.0016556 k( 90) = ( 0.4365079 0.1269841 -0.0000000), wk = 0.0016556 k( 91) = ( 0.4325397 0.1349206 0.0000000), wk = 0.0016556 k( 92) = ( 0.4285714 0.1428571 0.0000000), wk = 0.0016556 k( 93) = ( 0.4246032 0.1507937 -0.0000000), wk = 0.0016556 k( 94) = ( 0.4206349 0.1587302 -0.0000000), wk = 0.0016556 k( 95) = ( 0.4166667 0.1666667 0.0000000), wk = 0.0016556 k( 96) = ( 0.4126984 0.1746032 -0.0000000), wk = 0.0016556 k( 97) = ( 0.4087302 0.1825397 -0.0000000), wk = 0.0016556 k( 98) = ( 0.4047619 0.1904762 -0.0000000), wk = 0.0016556 k( 99) = ( 0.4007937 0.1984127 -0.0000000), wk = 0.0016556 k( 100) = ( 0.3968254 0.2063492 -0.0000000), wk = 0.0016556 k( 101) = ( 0.3928571 0.2142857 0.0000000), wk = 0.0016556 k( 102) = ( 0.3888889 0.2222222 -0.0000000), wk = 0.0016556 k( 103) = ( 0.3849206 0.2301587 0.0000000), wk = 0.0016556 k( 104) = ( 0.3809524 0.2380952 0.0000000), wk = 0.0016556 k( 105) = ( 0.3769841 0.2460317 0.0000000), wk = 0.0016556 k( 106) = ( 0.3730159 0.2539682 -0.0000000), wk = 0.0016556 k( 107) = ( 0.3690476 0.2619048 0.0000000), wk = 0.0016556 k( 108) = ( 0.3650794 0.2698413 -0.0000000), wk = 0.0016556 k( 109) = ( 0.3611111 0.2777778 -0.0000000), wk = 0.0016556 k( 110) = ( 0.3571429 0.2857143 -0.0000000), wk = 0.0016556 k( 111) = ( 0.3531746 0.2936508 -0.0000000), wk = 0.0016556 k( 112) = ( 0.3492063 0.3015873 0.0000000), wk = 0.0016556 k( 113) = ( 0.3452381 0.3095238 0.0000000), wk = 0.0016556 k( 114) = ( 0.3412698 0.3174603 0.0000000), wk = 0.0016556 k( 115) = ( 0.3373016 0.3253968 -0.0000000), wk = 0.0016556 k( 116) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0016556 k( 117) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0016556 k( 118) = ( 0.3293173 0.3293173 -0.0000000), wk = 0.0016556 k( 119) = ( 0.3253012 0.3253012 -0.0000000), wk = 0.0016556 k( 120) = ( 0.3212851 0.3212851 -0.0000000), wk = 0.0016556 k( 121) = ( 0.3172691 0.3172691 0.0000000), wk = 0.0016556 k( 122) = ( 0.3132530 0.3132530 0.0000000), wk = 0.0016556 k( 123) = ( 0.3092370 0.3092370 0.0000000), wk = 0.0016556 k( 124) = ( 0.3052209 0.3052209 -0.0000000), wk = 0.0016556 k( 125) = ( 0.3012048 0.3012048 -0.0000000), wk = 0.0016556 k( 126) = ( 0.2971888 0.2971888 0.0000000), wk = 0.0016556 k( 127) = ( 0.2931727 0.2931727 -0.0000000), wk = 0.0016556 k( 128) = ( 0.2891566 0.2891566 -0.0000000), wk = 0.0016556 k( 129) = ( 0.2851406 0.2851406 0.0000000), wk = 0.0016556 k( 130) = ( 0.2811245 0.2811245 -0.0000000), wk = 0.0016556 k( 131) = ( 0.2771084 0.2771084 -0.0000000), wk = 0.0016556 k( 132) = ( 0.2730924 0.2730924 0.0000000), wk = 0.0016556 k( 133) = ( 0.2690763 0.2690763 0.0000000), wk = 0.0016556 k( 134) = ( 0.2650602 0.2650602 0.0000000), wk = 0.0016556 k( 135) = ( 0.2610442 0.2610442 -0.0000000), wk = 0.0016556 k( 136) = ( 0.2570281 0.2570281 -0.0000000), wk = 0.0016556 k( 137) = ( 0.2530120 0.2530120 0.0000000), wk = 0.0016556 k( 138) = ( 0.2489960 0.2489960 -0.0000000), wk = 0.0016556 k( 139) = ( 0.2449799 0.2449799 0.0000000), wk = 0.0016556 k( 140) = ( 0.2409639 0.2409639 -0.0000000), wk = 0.0016556 k( 141) = ( 0.2369478 0.2369478 -0.0000000), wk = 0.0016556 k( 142) = ( 0.2329317 0.2329317 -0.0000000), wk = 0.0016556 k( 143) = ( 0.2289157 0.2289157 0.0000000), wk = 0.0016556 k( 144) = ( 0.2248996 0.2248996 0.0000000), wk = 0.0016556 k( 145) = ( 0.2208835 0.2208835 0.0000000), wk = 0.0016556 k( 146) = ( 0.2168675 0.2168675 -0.0000000), wk = 0.0016556 k( 147) = ( 0.2128514 0.2128514 0.0000000), wk = 0.0016556 k( 148) = ( 0.2088353 0.2088353 -0.0000000), wk = 0.0016556 k( 149) = ( 0.2048193 0.2048193 0.0000000), wk = 0.0016556 k( 150) = ( 0.2008032 0.2008032 -0.0000000), wk = 0.0016556 k( 151) = ( 0.1967871 0.1967871 -0.0000000), wk = 0.0016556 k( 152) = ( 0.1927711 0.1927711 -0.0000000), wk = 0.0016556 k( 153) = ( 0.1887550 0.1887550 0.0000000), wk = 0.0016556 k( 154) = ( 0.1847390 0.1847390 -0.0000000), wk = 0.0016556 k( 155) = ( 0.1807229 0.1807229 -0.0000000), wk = 0.0016556 k( 156) = ( 0.1767068 0.1767068 -0.0000000), wk = 0.0016556 k( 157) = ( 0.1726908 0.1726908 -0.0000000), wk = 0.0016556 k( 158) = ( 0.1686747 0.1686747 0.0000000), wk = 0.0016556 k( 159) = ( 0.1646586 0.1646586 0.0000000), wk = 0.0016556 k( 160) = ( 0.1606426 0.1606426 -0.0000000), wk = 0.0016556 k( 161) = ( 0.1566265 0.1566265 -0.0000000), wk = 0.0016556 k( 162) = ( 0.1526104 0.1526104 -0.0000000), wk = 0.0016556 k( 163) = ( 0.1485944 0.1485944 0.0000000), wk = 0.0016556 k( 164) = ( 0.1445783 0.1445783 0.0000000), wk = 0.0016556 k( 165) = ( 0.1405622 0.1405622 -0.0000000), wk = 0.0016556 k( 166) = ( 0.1365462 0.1365462 0.0000000), wk = 0.0016556 k( 167) = ( 0.1325301 0.1325301 0.0000000), wk = 0.0016556 k( 168) = ( 0.1285141 0.1285141 -0.0000000), wk = 0.0016556 k( 169) = ( 0.1244980 0.1244980 -0.0000000), wk = 0.0016556 k( 170) = ( 0.1204819 0.1204819 -0.0000000), wk = 0.0016556 k( 171) = ( 0.1164659 0.1164659 -0.0000000), wk = 0.0016556 k( 172) = ( 0.1124498 0.1124498 0.0000000), wk = 0.0016556 k( 173) = ( 0.1084337 0.1084337 0.0000000), wk = 0.0016556 k( 174) = ( 0.1044177 0.1044177 -0.0000000), wk = 0.0016556 k( 175) = ( 0.1004016 0.1004016 -0.0000000), wk = 0.0016556 k( 176) = ( 0.0963855 0.0963855 -0.0000000), wk = 0.0016556 k( 177) = ( 0.0923695 0.0923695 -0.0000000), wk = 0.0016556 k( 178) = ( 0.0883534 0.0883534 -0.0000000), wk = 0.0016556 k( 179) = ( 0.0843374 0.0843374 0.0000000), wk = 0.0016556 k( 180) = ( 0.0803213 0.0803213 -0.0000000), wk = 0.0016556 k( 181) = ( 0.0763052 0.0763052 -0.0000000), wk = 0.0016556 k( 182) = ( 0.0722892 0.0722892 0.0000000), wk = 0.0016556 k( 183) = ( 0.0682731 0.0682731 0.0000000), wk = 0.0016556 k( 184) = ( 0.0642570 0.0642570 -0.0000000), wk = 0.0016556 k( 185) = ( 0.0602410 0.0602410 0.0000000), wk = 0.0016556 k( 186) = ( 0.0562249 0.0562249 0.0000000), wk = 0.0016556 k( 187) = ( 0.0522088 0.0522088 -0.0000000), wk = 0.0016556 k( 188) = ( 0.0481928 0.0481928 -0.0000000), wk = 0.0016556 k( 189) = ( 0.0441767 0.0441767 -0.0000000), wk = 0.0016556 k( 190) = ( 0.0401606 0.0401606 -0.0000000), wk = 0.0016556 k( 191) = ( 0.0361446 0.0361446 0.0000000), wk = 0.0016556 k( 192) = ( 0.0321285 0.0321285 0.0000000), wk = 0.0016556 k( 193) = ( 0.0281125 0.0281125 0.0000000), wk = 0.0016556 k( 194) = ( 0.0240964 0.0240964 -0.0000000), wk = 0.0016556 k( 195) = ( 0.0200803 0.0200803 -0.0000000), wk = 0.0016556 k( 196) = ( 0.0160643 0.0160643 -0.0000000), wk = 0.0016556 k( 197) = ( 0.0120482 0.0120482 -0.0000000), wk = 0.0016556 k( 198) = ( 0.0080321 0.0080321 -0.0000000), wk = 0.0016556 k( 199) = ( 0.0040161 0.0040161 -0.0000000), wk = 0.0016556 k( 200) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0016556 k( 201) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0016556 k( 202) = ( 0.0000000 0.0000000 0.0074627), wk = 0.0016556 k( 203) = ( 0.0000000 0.0000000 0.0149254), wk = 0.0016556 k( 204) = ( 0.0000000 0.0000000 0.0223881), wk = 0.0016556 k( 205) = ( 0.0000000 0.0000000 0.0298507), wk = 0.0016556 k( 206) = ( 0.0000000 0.0000000 0.0373134), wk = 0.0016556 k( 207) = ( 0.0000000 0.0000000 0.0447761), wk = 0.0016556 k( 208) = ( 0.0000000 0.0000000 0.0522388), wk = 0.0016556 k( 209) = ( 0.0000000 0.0000000 0.0597015), wk = 0.0016556 k( 210) = ( 0.0000000 0.0000000 0.0671642), wk = 0.0016556 k( 211) = ( 0.0000000 0.0000000 0.0746269), wk = 0.0016556 k( 212) = ( 0.0000000 0.0000000 0.0820895), wk = 0.0016556 k( 213) = ( 0.0000000 0.0000000 0.0895522), wk = 0.0016556 k( 214) = ( 0.0000000 0.0000000 0.0970149), wk = 0.0016556 k( 215) = ( 0.0000000 0.0000000 0.1044776), wk = 0.0016556 k( 216) = ( 0.0000000 0.0000000 0.1119403), wk = 0.0016556 k( 217) = ( 0.0000000 0.0000000 0.1194030), wk = 0.0016556 k( 218) = ( 0.0000000 0.0000000 0.1268657), wk = 0.0016556 k( 219) = ( 0.0000000 0.0000000 0.1343284), wk = 0.0016556 k( 220) = ( 0.0000000 0.0000000 0.1417910), wk = 0.0016556 k( 221) = ( 0.0000000 0.0000000 0.1492537), wk = 0.0016556 k( 222) = ( 0.0000000 0.0000000 0.1567164), wk = 0.0016556 k( 223) = ( 0.0000000 0.0000000 0.1641791), wk = 0.0016556 k( 224) = ( 0.0000000 0.0000000 0.1716418), wk = 0.0016556 k( 225) = ( 0.0000000 0.0000000 0.1791045), wk = 0.0016556 k( 226) = ( 0.0000000 0.0000000 0.1865672), wk = 0.0016556 k( 227) = ( 0.0000000 0.0000000 0.1940299), wk = 0.0016556 k( 228) = ( 0.0000000 0.0000000 0.2014925), wk = 0.0016556 k( 229) = ( 0.0000000 0.0000000 0.2089552), wk = 0.0016556 k( 230) = ( 0.0000000 0.0000000 0.2164179), wk = 0.0016556 k( 231) = ( 0.0000000 0.0000000 0.2238806), wk = 0.0016556 k( 232) = ( 0.0000000 0.0000000 0.2313433), wk = 0.0016556 k( 233) = ( 0.0000000 0.0000000 0.2388060), wk = 0.0016556 k( 234) = ( 0.0000000 0.0000000 0.2462687), wk = 0.0016556 k( 235) = ( 0.0000000 0.0000000 0.2537313), wk = 0.0016556 k( 236) = ( 0.0000000 0.0000000 0.2611940), wk = 0.0016556 k( 237) = ( 0.0000000 0.0000000 0.2686567), wk = 0.0016556 k( 238) = ( 0.0000000 0.0000000 0.2761194), wk = 0.0016556 k( 239) = ( 0.0000000 0.0000000 0.2835821), wk = 0.0016556 k( 240) = ( 0.0000000 0.0000000 0.2910448), wk = 0.0016556 k( 241) = ( 0.0000000 0.0000000 0.2985075), wk = 0.0016556 k( 242) = ( 0.0000000 0.0000000 0.3059701), wk = 0.0016556 k( 243) = ( 0.0000000 0.0000000 0.3134328), wk = 0.0016556 k( 244) = ( 0.0000000 0.0000000 0.3208955), wk = 0.0016556 k( 245) = ( 0.0000000 0.0000000 0.3283582), wk = 0.0016556 k( 246) = ( 0.0000000 0.0000000 0.3358209), wk = 0.0016556 k( 247) = ( 0.0000000 0.0000000 0.3432836), wk = 0.0016556 k( 248) = ( 0.0000000 0.0000000 0.3507463), wk = 0.0016556 k( 249) = ( 0.0000000 0.0000000 0.3582090), wk = 0.0016556 k( 250) = ( 0.0000000 0.0000000 0.3656716), wk = 0.0016556 k( 251) = ( 0.0000000 0.0000000 0.3731343), wk = 0.0016556 k( 252) = ( 0.0000000 0.0000000 0.3805970), wk = 0.0016556 k( 253) = ( 0.0000000 0.0000000 0.3880597), wk = 0.0016556 k( 254) = ( 0.0000000 0.0000000 0.3955224), wk = 0.0016556 k( 255) = ( 0.0000000 0.0000000 0.4029851), wk = 0.0016556 k( 256) = ( 0.0000000 0.0000000 0.4104478), wk = 0.0016556 k( 257) = ( 0.0000000 0.0000000 0.4179104), wk = 0.0016556 k( 258) = ( 0.0000000 0.0000000 0.4253731), wk = 0.0016556 k( 259) = ( 0.0000000 0.0000000 0.4328358), wk = 0.0016556 k( 260) = ( 0.0000000 0.0000000 0.4402985), wk = 0.0016556 k( 261) = ( 0.0000000 0.0000000 0.4477612), wk = 0.0016556 k( 262) = ( 0.0000000 0.0000000 0.4552239), wk = 0.0016556 k( 263) = ( 0.0000000 0.0000000 0.4626866), wk = 0.0016556 k( 264) = ( 0.0000000 0.0000000 0.4701492), wk = 0.0016556 k( 265) = ( 0.0000000 0.0000000 0.4776119), wk = 0.0016556 k( 266) = ( 0.0000000 0.0000000 0.4850746), wk = 0.0016556 k( 267) = ( 0.0000000 0.0000000 0.4925373), wk = 0.0016556 k( 268) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0016556 k( 269) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0016556 k( 270) = ( 0.0069444 -0.0000000 0.5000000), wk = 0.0016556 k( 271) = ( 0.0138889 -0.0000000 0.5000000), wk = 0.0016556 k( 272) = ( 0.0208333 -0.0000000 0.5000000), wk = 0.0016556 k( 273) = ( 0.0277778 -0.0000000 0.5000000), wk = 0.0016556 k( 274) = ( 0.0347222 -0.0000000 0.5000000), wk = 0.0016556 k( 275) = ( 0.0416667 -0.0000000 0.5000000), wk = 0.0016556 k( 276) = ( 0.0486111 -0.0000000 0.5000000), wk = 0.0016556 k( 277) = ( 0.0555556 -0.0000000 0.5000000), wk = 0.0016556 k( 278) = ( 0.0625000 -0.0000000 0.5000000), wk = 0.0016556 k( 279) = ( 0.0694444 -0.0000000 0.5000000), wk = 0.0016556 k( 280) = ( 0.0763889 -0.0000000 0.5000000), wk = 0.0016556 k( 281) = ( 0.0833333 -0.0000000 0.5000000), wk = 0.0016556 k( 282) = ( 0.0902778 -0.0000000 0.5000000), wk = 0.0016556 k( 283) = ( 0.0972222 -0.0000000 0.5000000), wk = 0.0016556 k( 284) = ( 0.1041667 -0.0000000 0.5000000), wk = 0.0016556 k( 285) = ( 0.1111111 -0.0000000 0.5000000), wk = 0.0016556 k( 286) = ( 0.1180556 -0.0000000 0.5000000), wk = 0.0016556 k( 287) = ( 0.1250000 -0.0000000 0.5000000), wk = 0.0016556 k( 288) = ( 0.1319444 -0.0000000 0.5000000), wk = 0.0016556 k( 289) = ( 0.1388889 -0.0000000 0.5000000), wk = 0.0016556 k( 290) = ( 0.1458333 -0.0000000 0.5000000), wk = 0.0016556 k( 291) = ( 0.1527778 -0.0000000 0.5000000), wk = 0.0016556 k( 292) = ( 0.1597222 -0.0000000 0.5000000), wk = 0.0016556 k( 293) = ( 0.1666667 -0.0000000 0.5000000), wk = 0.0016556 k( 294) = ( 0.1736111 -0.0000000 0.5000000), wk = 0.0016556 k( 295) = ( 0.1805556 -0.0000000 0.5000000), wk = 0.0016556 k( 296) = ( 0.1875000 -0.0000000 0.5000000), wk = 0.0016556 k( 297) = ( 0.1944444 -0.0000000 0.5000000), wk = 0.0016556 k( 298) = ( 0.2013889 -0.0000000 0.5000000), wk = 0.0016556 k( 299) = ( 0.2083333 -0.0000000 0.5000000), wk = 0.0016556 k( 300) = ( 0.2152778 -0.0000000 0.5000000), wk = 0.0016556 k( 301) = ( 0.2222222 -0.0000000 0.5000000), wk = 0.0016556 k( 302) = ( 0.2291667 -0.0000000 0.5000000), wk = 0.0016556 k( 303) = ( 0.2361111 -0.0000000 0.5000000), wk = 0.0016556 k( 304) = ( 0.2430556 -0.0000000 0.5000000), wk = 0.0016556 k( 305) = ( 0.2500000 -0.0000000 0.5000000), wk = 0.0016556 k( 306) = ( 0.2569444 -0.0000000 0.5000000), wk = 0.0016556 k( 307) = ( 0.2638889 -0.0000000 0.5000000), wk = 0.0016556 k( 308) = ( 0.2708333 -0.0000000 0.5000000), wk = 0.0016556 k( 309) = ( 0.2777778 -0.0000000 0.5000000), wk = 0.0016556 k( 310) = ( 0.2847222 -0.0000000 0.5000000), wk = 0.0016556 k( 311) = ( 0.2916667 -0.0000000 0.5000000), wk = 0.0016556 k( 312) = ( 0.2986111 -0.0000000 0.5000000), wk = 0.0016556 k( 313) = ( 0.3055556 -0.0000000 0.5000000), wk = 0.0016556 k( 314) = ( 0.3125000 -0.0000000 0.5000000), wk = 0.0016556 k( 315) = ( 0.3194444 -0.0000000 0.5000000), wk = 0.0016556 k( 316) = ( 0.3263889 -0.0000000 0.5000000), wk = 0.0016556 k( 317) = ( 0.3333333 -0.0000000 0.5000000), wk = 0.0016556 k( 318) = ( 0.3402778 -0.0000000 0.5000000), wk = 0.0016556 k( 319) = ( 0.3472222 -0.0000000 0.5000000), wk = 0.0016556 k( 320) = ( 0.3541667 -0.0000000 0.5000000), wk = 0.0016556 k( 321) = ( 0.3611111 -0.0000000 0.5000000), wk = 0.0016556 k( 322) = ( 0.3680556 -0.0000000 0.5000000), wk = 0.0016556 k( 323) = ( 0.3750000 -0.0000000 0.5000000), wk = 0.0016556 k( 324) = ( 0.3819444 -0.0000000 0.5000000), wk = 0.0016556 k( 325) = ( 0.3888889 -0.0000000 0.5000000), wk = 0.0016556 k( 326) = ( 0.3958333 -0.0000000 0.5000000), wk = 0.0016556 k( 327) = ( 0.4027778 -0.0000000 0.5000000), wk = 0.0016556 k( 328) = ( 0.4097222 -0.0000000 0.5000000), wk = 0.0016556 k( 329) = ( 0.4166667 -0.0000000 0.5000000), wk = 0.0016556 k( 330) = ( 0.4236111 -0.0000000 0.5000000), wk = 0.0016556 k( 331) = ( 0.4305556 -0.0000000 0.5000000), wk = 0.0016556 k( 332) = ( 0.4375000 -0.0000000 0.5000000), wk = 0.0016556 k( 333) = ( 0.4444444 -0.0000000 0.5000000), wk = 0.0016556 k( 334) = ( 0.4513889 -0.0000000 0.5000000), wk = 0.0016556 k( 335) = ( 0.4583333 -0.0000000 0.5000000), wk = 0.0016556 k( 336) = ( 0.4652778 -0.0000000 0.5000000), wk = 0.0016556 k( 337) = ( 0.4722222 -0.0000000 0.5000000), wk = 0.0016556 k( 338) = ( 0.4791667 -0.0000000 0.5000000), wk = 0.0016556 k( 339) = ( 0.4861111 -0.0000000 0.5000000), wk = 0.0016556 k( 340) = ( 0.4930556 -0.0000000 0.5000000), wk = 0.0016556 k( 341) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0016556 k( 342) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0016556 k( 343) = ( 0.4960317 0.0079365 0.5000000), wk = 0.0016556 k( 344) = ( 0.4920635 0.0158730 0.5000000), wk = 0.0016556 k( 345) = ( 0.4880952 0.0238095 0.5000000), wk = 0.0016556 k( 346) = ( 0.4841270 0.0317460 0.5000000), wk = 0.0016556 k( 347) = ( 0.4801587 0.0396825 0.5000000), wk = 0.0016556 k( 348) = ( 0.4761905 0.0476190 0.5000000), wk = 0.0016556 k( 349) = ( 0.4722222 0.0555556 0.5000000), wk = 0.0016556 k( 350) = ( 0.4682540 0.0634921 0.5000000), wk = 0.0016556 k( 351) = ( 0.4642857 0.0714286 0.5000000), wk = 0.0016556 k( 352) = ( 0.4603175 0.0793651 0.5000000), wk = 0.0016556 k( 353) = ( 0.4563492 0.0873016 0.5000000), wk = 0.0016556 k( 354) = ( 0.4523810 0.0952381 0.5000000), wk = 0.0016556 k( 355) = ( 0.4484127 0.1031746 0.5000000), wk = 0.0016556 k( 356) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0016556 k( 357) = ( 0.4404762 0.1190476 0.5000000), wk = 0.0016556 k( 358) = ( 0.4365079 0.1269841 0.5000000), wk = 0.0016556 k( 359) = ( 0.4325397 0.1349206 0.5000000), wk = 0.0016556 k( 360) = ( 0.4285714 0.1428571 0.5000000), wk = 0.0016556 k( 361) = ( 0.4246032 0.1507937 0.5000000), wk = 0.0016556 k( 362) = ( 0.4206349 0.1587302 0.5000000), wk = 0.0016556 k( 363) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0016556 k( 364) = ( 0.4126984 0.1746032 0.5000000), wk = 0.0016556 k( 365) = ( 0.4087302 0.1825397 0.5000000), wk = 0.0016556 k( 366) = ( 0.4047619 0.1904762 0.5000000), wk = 0.0016556 k( 367) = ( 0.4007937 0.1984127 0.5000000), wk = 0.0016556 k( 368) = ( 0.3968254 0.2063492 0.5000000), wk = 0.0016556 k( 369) = ( 0.3928571 0.2142857 0.5000000), wk = 0.0016556 k( 370) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0016556 k( 371) = ( 0.3849206 0.2301587 0.5000000), wk = 0.0016556 k( 372) = ( 0.3809524 0.2380952 0.5000000), wk = 0.0016556 k( 373) = ( 0.3769841 0.2460317 0.5000000), wk = 0.0016556 k( 374) = ( 0.3730159 0.2539682 0.5000000), wk = 0.0016556 k( 375) = ( 0.3690476 0.2619048 0.5000000), wk = 0.0016556 k( 376) = ( 0.3650794 0.2698413 0.5000000), wk = 0.0016556 k( 377) = ( 0.3611111 0.2777778 0.5000000), wk = 0.0016556 k( 378) = ( 0.3571429 0.2857143 0.5000000), wk = 0.0016556 k( 379) = ( 0.3531746 0.2936508 0.5000000), wk = 0.0016556 k( 380) = ( 0.3492063 0.3015873 0.5000000), wk = 0.0016556 k( 381) = ( 0.3452381 0.3095238 0.5000000), wk = 0.0016556 k( 382) = ( 0.3412698 0.3174603 0.5000000), wk = 0.0016556 k( 383) = ( 0.3373016 0.3253968 0.5000000), wk = 0.0016556 k( 384) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0016556 k( 385) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0016556 k( 386) = ( 0.3293173 0.3293173 0.5000000), wk = 0.0016556 k( 387) = ( 0.3253012 0.3253012 0.5000000), wk = 0.0016556 k( 388) = ( 0.3212851 0.3212851 0.5000000), wk = 0.0016556 k( 389) = ( 0.3172691 0.3172691 0.5000000), wk = 0.0016556 k( 390) = ( 0.3132530 0.3132530 0.5000000), wk = 0.0016556 k( 391) = ( 0.3092370 0.3092370 0.5000000), wk = 0.0016556 k( 392) = ( 0.3052209 0.3052209 0.5000000), wk = 0.0016556 k( 393) = ( 0.3012048 0.3012048 0.5000000), wk = 0.0016556 k( 394) = ( 0.2971888 0.2971888 0.5000000), wk = 0.0016556 k( 395) = ( 0.2931727 0.2931727 0.5000000), wk = 0.0016556 k( 396) = ( 0.2891566 0.2891566 0.5000000), wk = 0.0016556 k( 397) = ( 0.2851406 0.2851406 0.5000000), wk = 0.0016556 k( 398) = ( 0.2811245 0.2811245 0.5000000), wk = 0.0016556 k( 399) = ( 0.2771084 0.2771084 0.5000000), wk = 0.0016556 k( 400) = ( 0.2730924 0.2730924 0.5000000), wk = 0.0016556 k( 401) = ( 0.2690763 0.2690763 0.5000000), wk = 0.0016556 k( 402) = ( 0.2650602 0.2650602 0.5000000), wk = 0.0016556 k( 403) = ( 0.2610442 0.2610442 0.5000000), wk = 0.0016556 k( 404) = ( 0.2570281 0.2570281 0.5000000), wk = 0.0016556 k( 405) = ( 0.2530120 0.2530120 0.5000000), wk = 0.0016556 k( 406) = ( 0.2489960 0.2489960 0.5000000), wk = 0.0016556 k( 407) = ( 0.2449799 0.2449799 0.5000000), wk = 0.0016556 k( 408) = ( 0.2409639 0.2409639 0.5000000), wk = 0.0016556 k( 409) = ( 0.2369478 0.2369478 0.5000000), wk = 0.0016556 k( 410) = ( 0.2329317 0.2329317 0.5000000), wk = 0.0016556 k( 411) = ( 0.2289157 0.2289157 0.5000000), wk = 0.0016556 k( 412) = ( 0.2248996 0.2248996 0.5000000), wk = 0.0016556 k( 413) = ( 0.2208835 0.2208835 0.5000000), wk = 0.0016556 k( 414) = ( 0.2168675 0.2168675 0.5000000), wk = 0.0016556 k( 415) = ( 0.2128514 0.2128514 0.5000000), wk = 0.0016556 k( 416) = ( 0.2088353 0.2088353 0.5000000), wk = 0.0016556 k( 417) = ( 0.2048193 0.2048193 0.5000000), wk = 0.0016556 k( 418) = ( 0.2008032 0.2008032 0.5000000), wk = 0.0016556 k( 419) = ( 0.1967871 0.1967871 0.5000000), wk = 0.0016556 k( 420) = ( 0.1927711 0.1927711 0.5000000), wk = 0.0016556 k( 421) = ( 0.1887550 0.1887550 0.5000000), wk = 0.0016556 k( 422) = ( 0.1847390 0.1847390 0.5000000), wk = 0.0016556 k( 423) = ( 0.1807229 0.1807229 0.5000000), wk = 0.0016556 k( 424) = ( 0.1767068 0.1767068 0.5000000), wk = 0.0016556 k( 425) = ( 0.1726908 0.1726908 0.5000000), wk = 0.0016556 k( 426) = ( 0.1686747 0.1686747 0.5000000), wk = 0.0016556 k( 427) = ( 0.1646586 0.1646586 0.5000000), wk = 0.0016556 k( 428) = ( 0.1606426 0.1606426 0.5000000), wk = 0.0016556 k( 429) = ( 0.1566265 0.1566265 0.5000000), wk = 0.0016556 k( 430) = ( 0.1526104 0.1526104 0.5000000), wk = 0.0016556 k( 431) = ( 0.1485944 0.1485944 0.5000000), wk = 0.0016556 k( 432) = ( 0.1445783 0.1445783 0.5000000), wk = 0.0016556 k( 433) = ( 0.1405622 0.1405622 0.5000000), wk = 0.0016556 k( 434) = ( 0.1365462 0.1365462 0.5000000), wk = 0.0016556 k( 435) = ( 0.1325301 0.1325301 0.5000000), wk = 0.0016556 k( 436) = ( 0.1285141 0.1285141 0.5000000), wk = 0.0016556 k( 437) = ( 0.1244980 0.1244980 0.5000000), wk = 0.0016556 k( 438) = ( 0.1204819 0.1204819 0.5000000), wk = 0.0016556 k( 439) = ( 0.1164659 0.1164659 0.5000000), wk = 0.0016556 k( 440) = ( 0.1124498 0.1124498 0.5000000), wk = 0.0016556 k( 441) = ( 0.1084337 0.1084337 0.5000000), wk = 0.0016556 k( 442) = ( 0.1044177 0.1044177 0.5000000), wk = 0.0016556 k( 443) = ( 0.1004016 0.1004016 0.5000000), wk = 0.0016556 k( 444) = ( 0.0963855 0.0963855 0.5000000), wk = 0.0016556 k( 445) = ( 0.0923695 0.0923695 0.5000000), wk = 0.0016556 k( 446) = ( 0.0883534 0.0883534 0.5000000), wk = 0.0016556 k( 447) = ( 0.0843374 0.0843374 0.5000000), wk = 0.0016556 k( 448) = ( 0.0803213 0.0803213 0.5000000), wk = 0.0016556 k( 449) = ( 0.0763052 0.0763052 0.5000000), wk = 0.0016556 k( 450) = ( 0.0722892 0.0722892 0.5000000), wk = 0.0016556 k( 451) = ( 0.0682731 0.0682731 0.5000000), wk = 0.0016556 k( 452) = ( 0.0642570 0.0642570 0.5000000), wk = 0.0016556 k( 453) = ( 0.0602410 0.0602410 0.5000000), wk = 0.0016556 k( 454) = ( 0.0562249 0.0562249 0.5000000), wk = 0.0016556 k( 455) = ( 0.0522088 0.0522088 0.5000000), wk = 0.0016556 k( 456) = ( 0.0481928 0.0481928 0.5000000), wk = 0.0016556 k( 457) = ( 0.0441767 0.0441767 0.5000000), wk = 0.0016556 k( 458) = ( 0.0401606 0.0401606 0.5000000), wk = 0.0016556 k( 459) = ( 0.0361446 0.0361446 0.5000000), wk = 0.0016556 k( 460) = ( 0.0321285 0.0321285 0.5000000), wk = 0.0016556 k( 461) = ( 0.0281125 0.0281125 0.5000000), wk = 0.0016556 k( 462) = ( 0.0240964 0.0240964 0.5000000), wk = 0.0016556 k( 463) = ( 0.0200803 0.0200803 0.5000000), wk = 0.0016556 k( 464) = ( 0.0160643 0.0160643 0.5000000), wk = 0.0016556 k( 465) = ( 0.0120482 0.0120482 0.5000000), wk = 0.0016556 k( 466) = ( 0.0080321 0.0080321 0.5000000), wk = 0.0016556 k( 467) = ( 0.0040161 0.0040161 0.5000000), wk = 0.0016556 k( 468) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0016556 k( 469) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0016556 k( 470) = ( 0.5000000 -0.0000000 0.4925373), wk = 0.0016556 k( 471) = ( 0.5000000 -0.0000000 0.4850746), wk = 0.0016556 k( 472) = ( 0.5000000 -0.0000000 0.4776119), wk = 0.0016556 k( 473) = ( 0.5000000 -0.0000000 0.4701492), wk = 0.0016556 k( 474) = ( 0.5000000 -0.0000000 0.4626866), wk = 0.0016556 k( 475) = ( 0.5000000 -0.0000000 0.4552239), wk = 0.0016556 k( 476) = ( 0.5000000 -0.0000000 0.4477612), wk = 0.0016556 k( 477) = ( 0.5000000 -0.0000000 0.4402985), wk = 0.0016556 k( 478) = ( 0.5000000 -0.0000000 0.4328358), wk = 0.0016556 k( 479) = ( 0.5000000 -0.0000000 0.4253731), wk = 0.0016556 k( 480) = ( 0.5000000 -0.0000000 0.4179104), wk = 0.0016556 k( 481) = ( 0.5000000 -0.0000000 0.4104478), wk = 0.0016556 k( 482) = ( 0.5000000 -0.0000000 0.4029851), wk = 0.0016556 k( 483) = ( 0.5000000 -0.0000000 0.3955224), wk = 0.0016556 k( 484) = ( 0.5000000 -0.0000000 0.3880597), wk = 0.0016556 k( 485) = ( 0.5000000 -0.0000000 0.3805970), wk = 0.0016556 k( 486) = ( 0.5000000 -0.0000000 0.3731343), wk = 0.0016556 k( 487) = ( 0.5000000 -0.0000000 0.3656716), wk = 0.0016556 k( 488) = ( 0.5000000 -0.0000000 0.3582090), wk = 0.0016556 k( 489) = ( 0.5000000 -0.0000000 0.3507463), wk = 0.0016556 k( 490) = ( 0.5000000 -0.0000000 0.3432836), wk = 0.0016556 k( 491) = ( 0.5000000 -0.0000000 0.3358209), wk = 0.0016556 k( 492) = ( 0.5000000 -0.0000000 0.3283582), wk = 0.0016556 k( 493) = ( 0.5000000 -0.0000000 0.3208955), wk = 0.0016556 k( 494) = ( 0.5000000 -0.0000000 0.3134328), wk = 0.0016556 k( 495) = ( 0.5000000 -0.0000000 0.3059701), wk = 0.0016556 k( 496) = ( 0.5000000 -0.0000000 0.2985075), wk = 0.0016556 k( 497) = ( 0.5000000 -0.0000000 0.2910448), wk = 0.0016556 k( 498) = ( 0.5000000 -0.0000000 0.2835821), wk = 0.0016556 k( 499) = ( 0.5000000 -0.0000000 0.2761194), wk = 0.0016556 k( 500) = ( 0.5000000 -0.0000000 0.2686567), wk = 0.0016556 k( 501) = ( 0.5000000 -0.0000000 0.2611940), wk = 0.0016556 k( 502) = ( 0.5000000 -0.0000000 0.2537313), wk = 0.0016556 k( 503) = ( 0.5000000 -0.0000000 0.2462687), wk = 0.0016556 k( 504) = ( 0.5000000 -0.0000000 0.2388060), wk = 0.0016556 k( 505) = ( 0.5000000 -0.0000000 0.2313433), wk = 0.0016556 k( 506) = ( 0.5000000 -0.0000000 0.2238806), wk = 0.0016556 k( 507) = ( 0.5000000 -0.0000000 0.2164179), wk = 0.0016556 k( 508) = ( 0.5000000 -0.0000000 0.2089552), wk = 0.0016556 k( 509) = ( 0.5000000 -0.0000000 0.2014925), wk = 0.0016556 k( 510) = ( 0.5000000 -0.0000000 0.1940299), wk = 0.0016556 k( 511) = ( 0.5000000 -0.0000000 0.1865672), wk = 0.0016556 k( 512) = ( 0.5000000 -0.0000000 0.1791045), wk = 0.0016556 k( 513) = ( 0.5000000 -0.0000000 0.1716418), wk = 0.0016556 k( 514) = ( 0.5000000 -0.0000000 0.1641791), wk = 0.0016556 k( 515) = ( 0.5000000 -0.0000000 0.1567164), wk = 0.0016556 k( 516) = ( 0.5000000 -0.0000000 0.1492537), wk = 0.0016556 k( 517) = ( 0.5000000 -0.0000000 0.1417910), wk = 0.0016556 k( 518) = ( 0.5000000 -0.0000000 0.1343284), wk = 0.0016556 k( 519) = ( 0.5000000 -0.0000000 0.1268657), wk = 0.0016556 k( 520) = ( 0.5000000 -0.0000000 0.1194030), wk = 0.0016556 k( 521) = ( 0.5000000 -0.0000000 0.1119403), wk = 0.0016556 k( 522) = ( 0.5000000 -0.0000000 0.1044776), wk = 0.0016556 k( 523) = ( 0.5000000 -0.0000000 0.0970149), wk = 0.0016556 k( 524) = ( 0.5000000 -0.0000000 0.0895522), wk = 0.0016556 k( 525) = ( 0.5000000 -0.0000000 0.0820895), wk = 0.0016556 k( 526) = ( 0.5000000 -0.0000000 0.0746269), wk = 0.0016556 k( 527) = ( 0.5000000 -0.0000000 0.0671642), wk = 0.0016556 k( 528) = ( 0.5000000 -0.0000000 0.0597015), wk = 0.0016556 k( 529) = ( 0.5000000 -0.0000000 0.0522388), wk = 0.0016556 k( 530) = ( 0.5000000 -0.0000000 0.0447761), wk = 0.0016556 k( 531) = ( 0.5000000 -0.0000000 0.0373134), wk = 0.0016556 k( 532) = ( 0.5000000 -0.0000000 0.0298507), wk = 0.0016556 k( 533) = ( 0.5000000 -0.0000000 0.0223881), wk = 0.0016556 k( 534) = ( 0.5000000 -0.0000000 0.0149254), wk = 0.0016556 k( 535) = ( 0.5000000 -0.0000000 0.0074627), wk = 0.0016556 k( 536) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0016556 k( 537) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0016556 k( 538) = ( 0.3333333 0.3333333 0.0074627), wk = 0.0016556 k( 539) = ( 0.3333333 0.3333333 0.0149254), wk = 0.0016556 k( 540) = ( 0.3333333 0.3333333 0.0223881), wk = 0.0016556 k( 541) = ( 0.3333333 0.3333333 0.0298507), wk = 0.0016556 k( 542) = ( 0.3333333 0.3333333 0.0373134), wk = 0.0016556 k( 543) = ( 0.3333333 0.3333333 0.0447761), wk = 0.0016556 k( 544) = ( 0.3333333 0.3333333 0.0522388), wk = 0.0016556 k( 545) = ( 0.3333333 0.3333333 0.0597015), wk = 0.0016556 k( 546) = ( 0.3333333 0.3333333 0.0671642), wk = 0.0016556 k( 547) = ( 0.3333333 0.3333333 0.0746269), wk = 0.0016556 k( 548) = ( 0.3333333 0.3333333 0.0820895), wk = 0.0016556 k( 549) = ( 0.3333333 0.3333333 0.0895522), wk = 0.0016556 k( 550) = ( 0.3333333 0.3333333 0.0970149), wk = 0.0016556 k( 551) = ( 0.3333333 0.3333333 0.1044776), wk = 0.0016556 k( 552) = ( 0.3333333 0.3333333 0.1119403), wk = 0.0016556 k( 553) = ( 0.3333333 0.3333333 0.1194030), wk = 0.0016556 k( 554) = ( 0.3333333 0.3333333 0.1268657), wk = 0.0016556 k( 555) = ( 0.3333333 0.3333333 0.1343284), wk = 0.0016556 k( 556) = ( 0.3333333 0.3333333 0.1417910), wk = 0.0016556 k( 557) = ( 0.3333333 0.3333333 0.1492537), wk = 0.0016556 k( 558) = ( 0.3333333 0.3333333 0.1567164), wk = 0.0016556 k( 559) = ( 0.3333333 0.3333333 0.1641791), wk = 0.0016556 k( 560) = ( 0.3333333 0.3333333 0.1716418), wk = 0.0016556 k( 561) = ( 0.3333333 0.3333333 0.1791045), wk = 0.0016556 k( 562) = ( 0.3333333 0.3333333 0.1865672), wk = 0.0016556 k( 563) = ( 0.3333333 0.3333333 0.1940299), wk = 0.0016556 k( 564) = ( 0.3333333 0.3333333 0.2014925), wk = 0.0016556 k( 565) = ( 0.3333333 0.3333333 0.2089552), wk = 0.0016556 k( 566) = ( 0.3333333 0.3333333 0.2164179), wk = 0.0016556 k( 567) = ( 0.3333333 0.3333333 0.2238806), wk = 0.0016556 k( 568) = ( 0.3333333 0.3333333 0.2313433), wk = 0.0016556 k( 569) = ( 0.3333333 0.3333333 0.2388060), wk = 0.0016556 k( 570) = ( 0.3333333 0.3333333 0.2462687), wk = 0.0016556 k( 571) = ( 0.3333333 0.3333333 0.2537313), wk = 0.0016556 k( 572) = ( 0.3333333 0.3333333 0.2611940), wk = 0.0016556 k( 573) = ( 0.3333333 0.3333333 0.2686567), wk = 0.0016556 k( 574) = ( 0.3333333 0.3333333 0.2761194), wk = 0.0016556 k( 575) = ( 0.3333333 0.3333333 0.2835821), wk = 0.0016556 k( 576) = ( 0.3333333 0.3333333 0.2910448), wk = 0.0016556 k( 577) = ( 0.3333333 0.3333333 0.2985075), wk = 0.0016556 k( 578) = ( 0.3333333 0.3333333 0.3059701), wk = 0.0016556 k( 579) = ( 0.3333333 0.3333333 0.3134328), wk = 0.0016556 k( 580) = ( 0.3333333 0.3333333 0.3208955), wk = 0.0016556 k( 581) = ( 0.3333333 0.3333333 0.3283582), wk = 0.0016556 k( 582) = ( 0.3333333 0.3333333 0.3358209), wk = 0.0016556 k( 583) = ( 0.3333333 0.3333333 0.3432836), wk = 0.0016556 k( 584) = ( 0.3333333 0.3333333 0.3507463), wk = 0.0016556 k( 585) = ( 0.3333333 0.3333333 0.3582090), wk = 0.0016556 k( 586) = ( 0.3333333 0.3333333 0.3656716), wk = 0.0016556 k( 587) = ( 0.3333333 0.3333333 0.3731343), wk = 0.0016556 k( 588) = ( 0.3333333 0.3333333 0.3805970), wk = 0.0016556 k( 589) = ( 0.3333333 0.3333333 0.3880597), wk = 0.0016556 k( 590) = ( 0.3333333 0.3333333 0.3955224), wk = 0.0016556 k( 591) = ( 0.3333333 0.3333333 0.4029851), wk = 0.0016556 k( 592) = ( 0.3333333 0.3333333 0.4104478), wk = 0.0016556 k( 593) = ( 0.3333333 0.3333333 0.4179104), wk = 0.0016556 k( 594) = ( 0.3333333 0.3333333 0.4253731), wk = 0.0016556 k( 595) = ( 0.3333333 0.3333333 0.4328358), wk = 0.0016556 k( 596) = ( 0.3333333 0.3333333 0.4402985), wk = 0.0016556 k( 597) = ( 0.3333333 0.3333333 0.4477612), wk = 0.0016556 k( 598) = ( 0.3333333 0.3333333 0.4552239), wk = 0.0016556 k( 599) = ( 0.3333333 0.3333333 0.4626866), wk = 0.0016556 k( 600) = ( 0.3333333 0.3333333 0.4701493), wk = 0.0016556 k( 601) = ( 0.3333333 0.3333333 0.4776119), wk = 0.0016556 k( 602) = ( 0.3333333 0.3333333 0.4850746), wk = 0.0016556 k( 603) = ( 0.3333333 0.3333333 0.4925373), wk = 0.0016556 k( 604) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0016556 Dense grid: 3481 G-vectors FFT dimensions: ( 24, 24, 20) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.01 Mb ( 32, 12) NL pseudopotentials 0.01 Mb ( 16, 34) Each V/rho on FFT grid 0.01 Mb ( 576) Each G-vector array 0.00 Mb ( 98) G-vector shells 0.00 Mb ( 45) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.02 Mb ( 32, 48) Each subspace H/S matrix 0.00 Mb ( 12, 12) Each matrix 0.01 Mb ( 34, 2, 12) The potential is recalculated from file : ./Si.save/charge-density.dat Starting wfc are 8 randomized atomic wfcs + 4 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.5 secs Computing kpt #: 2 total cpu time spent up to now is 1.6 secs Computing kpt #: 3 total cpu time spent up to now is 1.7 secs Computing kpt #: 4 total cpu time spent up to now is 1.7 secs Computing kpt #: 5 total cpu time spent up to now is 1.8 secs Computing kpt #: 6 total cpu time spent up to now is 1.8 secs Computing kpt #: 7 total cpu time spent up to now is 1.9 secs Computing kpt #: 8 total cpu time spent up to now is 1.9 secs Computing kpt #: 9 total cpu time spent up to now is 2.0 secs Computing kpt #: 10 total cpu time spent up to now is 2.0 secs Computing kpt #: 11 total cpu time spent up to now is 2.0 secs Computing kpt #: 12 total cpu time spent up to now is 2.1 secs Computing kpt #: 13 total cpu time spent up to now is 2.1 secs Computing kpt #: 14 total cpu time spent up to now is 2.2 secs Computing kpt #: 15 total cpu time spent up to now is 2.2 secs Computing kpt #: 16 total cpu time spent up to now is 2.2 secs Computing kpt #: 17 total cpu time spent up to now is 2.3 secs Computing kpt #: 18 total cpu time spent up to now is 2.3 secs Computing kpt #: 19 total cpu time spent up to now is 2.3 secs Computing kpt #: 20 total cpu time spent up to now is 2.4 secs Computing kpt #: 21 total cpu time spent up to now is 2.4 secs Computing kpt #: 22 total cpu time spent up to now is 2.5 secs Computing kpt #: 23 total cpu time spent up to now is 2.5 secs Computing kpt #: 24 total cpu time spent up to now is 2.5 secs Computing kpt #: 25 total cpu time spent up to now is 2.6 secs Computing kpt #: 26 total cpu time spent up to now is 2.6 secs Computing kpt #: 27 total cpu time spent up to now is 2.6 secs Computing kpt #: 28 total cpu time spent up to now is 2.7 secs Computing kpt #: 29 total cpu time spent up to now is 2.7 secs Computing kpt #: 30 total cpu time spent up to now is 2.7 secs Computing kpt #: 31 total cpu time spent up to now is 2.7 secs Computing kpt #: 32 total cpu time spent up to now is 2.8 secs Computing kpt #: 33 total cpu time spent up to now is 2.8 secs Computing kpt #: 34 total cpu time spent up to now is 2.8 secs Computing kpt #: 35 total cpu time spent up to now is 2.9 secs Computing kpt #: 36 total cpu time spent up to now is 2.9 secs Computing kpt #: 37 total cpu time spent up to now is 2.9 secs Computing kpt #: 38 total cpu time spent up to now is 3.0 secs Computing kpt #: 39 total cpu time spent up to now is 3.0 secs Computing kpt #: 40 total cpu time spent up to now is 3.0 secs Computing kpt #: 41 total cpu time spent up to now is 3.0 secs Computing kpt #: 42 total cpu time spent up to now is 3.1 secs Computing kpt #: 43 total cpu time spent up to now is 3.1 secs Computing kpt #: 44 total cpu time spent up to now is 3.1 secs Computing kpt #: 45 total cpu time spent up to now is 3.2 secs Computing kpt #: 46 total cpu time spent up to now is 3.2 secs Computing kpt #: 47 total cpu time spent up to now is 3.2 secs Computing kpt #: 48 total cpu time spent up to now is 3.3 secs Computing kpt #: 49 total cpu time spent up to now is 3.3 secs Computing kpt #: 50 total cpu time spent up to now is 3.3 secs Computing kpt #: 51 total cpu time spent up to now is 3.4 secs Computing kpt #: 52 total cpu time spent up to now is 3.4 secs Computing kpt #: 53 total cpu time spent up to now is 3.4 secs Computing kpt #: 54 total cpu time spent up to now is 3.5 secs Computing kpt #: 55 total cpu time spent up to now is 3.5 secs Computing kpt #: 56 total cpu time spent up to now is 3.5 secs Computing kpt #: 57 total cpu time spent up to now is 3.6 secs Computing kpt #: 58 total cpu time spent up to now is 3.6 secs Computing kpt #: 59 total cpu time spent up to now is 3.7 secs Computing kpt #: 60 total cpu time spent up to now is 3.7 secs Computing kpt #: 61 total cpu time spent up to now is 3.7 secs Computing kpt #: 62 total cpu time spent up to now is 3.8 secs Computing kpt #: 63 total cpu time spent up to now is 3.8 secs Computing kpt #: 64 total cpu time spent up to now is 3.9 secs Computing kpt #: 65 total cpu time spent up to now is 3.9 secs Computing kpt #: 66 total cpu time spent up to now is 3.9 secs Computing kpt #: 67 total cpu time spent up to now is 4.0 secs Computing kpt #: 68 total cpu time spent up to now is 4.0 secs Computing kpt #: 69 total cpu time spent up to now is 4.1 secs Computing kpt #: 70 total cpu time spent up to now is 4.1 secs Computing kpt #: 71 total cpu time spent up to now is 4.1 secs Computing kpt #: 72 total cpu time spent up to now is 4.2 secs Computing kpt #: 73 total cpu time spent up to now is 4.2 secs Computing kpt #: 74 total cpu time spent up to now is 4.3 secs Computing kpt #: 75 total cpu time spent up to now is 4.3 secs Computing kpt #: 76 total cpu time spent up to now is 4.3 secs Computing kpt #: 77 total cpu time spent up to now is 4.4 secs Computing kpt #: 78 total cpu time spent up to now is 4.4 secs Computing kpt #: 79 total cpu time spent up to now is 4.5 secs Computing kpt #: 80 total cpu time spent up to now is 4.5 secs Computing kpt #: 81 total cpu time spent up to now is 4.5 secs Computing kpt #: 82 total cpu time spent up to now is 4.6 secs Computing kpt #: 83 total cpu time spent up to now is 4.6 secs Computing kpt #: 84 total cpu time spent up to now is 4.7 secs Computing kpt #: 85 total cpu time spent up to now is 5.2 secs Computing kpt #: 86 total cpu time spent up to now is 5.3 secs Computing kpt #: 87 total cpu time spent up to now is 5.3 secs Computing kpt #: 88 total cpu time spent up to now is 5.3 secs Computing kpt #: 89 total cpu time spent up to now is 5.4 secs Computing kpt #: 90 total cpu time spent up to now is 5.4 secs Computing kpt #: 91 total cpu time spent up to now is 5.5 secs Computing kpt #: 92 total cpu time spent up to now is 5.5 secs Computing kpt #: 93 total cpu time spent up to now is 5.5 secs Computing kpt #: 94 total cpu time spent up to now is 5.6 secs Computing kpt #: 95 total cpu time spent up to now is 5.6 secs Computing kpt #: 96 total cpu time spent up to now is 5.7 secs Computing kpt #: 97 total cpu time spent up to now is 5.7 secs Computing kpt #: 98 total cpu time spent up to now is 5.7 secs Computing kpt #: 99 total cpu time spent up to now is 5.8 secs Computing kpt #: 100 total cpu time spent up to now is 5.8 secs Computing kpt #: 101 total cpu time spent up to now is 5.9 secs Computing kpt #: 102 total cpu time spent up to now is 5.9 secs Computing kpt #: 103 total cpu time spent up to now is 5.9 secs Computing kpt #: 104 total cpu time spent up to now is 6.0 secs Computing kpt #: 105 total cpu time spent up to now is 6.0 secs Computing kpt #: 106 total cpu time spent up to now is 6.1 secs Computing kpt #: 107 total cpu time spent up to now is 6.1 secs Computing kpt #: 108 total cpu time spent up to now is 6.2 secs Computing kpt #: 109 total cpu time spent up to now is 6.2 secs Computing kpt #: 110 total cpu time spent up to now is 6.2 secs Computing kpt #: 111 total cpu time spent up to now is 6.3 secs Computing kpt #: 112 total cpu time spent up to now is 6.3 secs Computing kpt #: 113 total cpu time spent up to now is 6.4 secs Computing kpt #: 114 total cpu time spent up to now is 6.4 secs Computing kpt #: 115 total cpu time spent up to now is 6.5 secs Computing kpt #: 116 total cpu time spent up to now is 6.5 secs Computing kpt #: 117 total cpu time spent up to now is 6.6 secs Computing kpt #: 118 total cpu time spent up to now is 6.6 secs Computing kpt #: 119 total cpu time spent up to now is 6.7 secs Computing kpt #: 120 total cpu time spent up to now is 6.7 secs Computing kpt #: 121 total cpu time spent up to now is 6.7 secs Computing kpt #: 122 total cpu time spent up to now is 6.8 secs Computing kpt #: 123 total cpu time spent up to now is 6.8 secs Computing kpt #: 124 total cpu time spent up to now is 6.8 secs Computing kpt #: 125 total cpu time spent up to now is 6.9 secs Computing kpt #: 126 total cpu time spent up to now is 6.9 secs Computing kpt #: 127 total cpu time spent up to now is 6.9 secs Computing kpt #: 128 total cpu time spent up to now is 7.0 secs Computing kpt #: 129 total cpu time spent up to now is 7.0 secs Computing kpt #: 130 total cpu time spent up to now is 7.1 secs Computing kpt #: 131 total cpu time spent up to now is 7.1 secs Computing kpt #: 132 total cpu time spent up to now is 7.1 secs Computing kpt #: 133 total cpu time spent up to now is 7.2 secs Computing kpt #: 134 total cpu time spent up to now is 7.2 secs Computing kpt #: 135 total cpu time spent up to now is 7.3 secs Computing kpt #: 136 total cpu time spent up to now is 7.3 secs Computing kpt #: 137 total cpu time spent up to now is 7.3 secs Computing kpt #: 138 total cpu time spent up to now is 7.4 secs Computing kpt #: 139 total cpu time spent up to now is 7.4 secs Computing kpt #: 140 total cpu time spent up to now is 7.4 secs Computing kpt #: 141 total cpu time spent up to now is 7.5 secs Computing kpt #: 142 total cpu time spent up to now is 7.5 secs Computing kpt #: 143 total cpu time spent up to now is 7.5 secs Computing kpt #: 144 total cpu time spent up to now is 7.6 secs Computing kpt #: 145 total cpu time spent up to now is 7.6 secs Computing kpt #: 146 total cpu time spent up to now is 7.6 secs Computing kpt #: 147 total cpu time spent up to now is 7.7 secs Computing kpt #: 148 total cpu time spent up to now is 7.7 secs Computing kpt #: 149 total cpu time spent up to now is 7.7 secs Computing kpt #: 150 total cpu time spent up to now is 7.8 secs Computing kpt #: 151 total cpu time spent up to now is 7.8 secs Computing kpt #: 152 total cpu time spent up to now is 7.9 secs Computing kpt #: 153 total cpu time spent up to now is 7.9 secs Computing kpt #: 154 total cpu time spent up to now is 7.9 secs Computing kpt #: 155 total cpu time spent up to now is 8.0 secs Computing kpt #: 156 total cpu time spent up to now is 8.0 secs Computing kpt #: 157 total cpu time spent up to now is 8.0 secs Computing kpt #: 158 total cpu time spent up to now is 8.1 secs Computing kpt #: 159 total cpu time spent up to now is 8.1 secs Computing kpt #: 160 total cpu time spent up to now is 8.1 secs Computing kpt #: 161 total cpu time spent up to now is 8.2 secs Computing kpt #: 162 total cpu time spent up to now is 8.2 secs Computing kpt #: 163 total cpu time spent up to now is 8.2 secs Computing kpt #: 164 total cpu time spent up to now is 8.3 secs Computing kpt #: 165 total cpu time spent up to now is 8.3 secs Computing kpt #: 166 total cpu time spent up to now is 8.3 secs Computing kpt #: 167 total cpu time spent up to now is 8.4 secs Computing kpt #: 168 total cpu time spent up to now is 8.4 secs Computing kpt #: 169 total cpu time spent up to now is 8.4 secs Computing kpt #: 170 total cpu time spent up to now is 8.5 secs Computing kpt #: 171 total cpu time spent up to now is 8.5 secs Computing kpt #: 172 total cpu time spent up to now is 8.6 secs Computing kpt #: 173 total cpu time spent up to now is 8.6 secs Computing kpt #: 174 total cpu time spent up to now is 8.6 secs Computing kpt #: 175 total cpu time spent up to now is 8.7 secs Computing kpt #: 176 total cpu time spent up to now is 8.7 secs Computing kpt #: 177 total cpu time spent up to now is 8.7 secs Computing kpt #: 178 total cpu time spent up to now is 8.8 secs Computing kpt #: 179 total cpu time spent up to now is 8.8 secs Computing kpt #: 180 total cpu time spent up to now is 8.8 secs Computing kpt #: 181 total cpu time spent up to now is 8.9 secs Computing kpt #: 182 total cpu time spent up to now is 8.9 secs Computing kpt #: 183 total cpu time spent up to now is 9.0 secs Computing kpt #: 184 total cpu time spent up to now is 9.0 secs Computing kpt #: 185 total cpu time spent up to now is 9.0 secs Computing kpt #: 186 total cpu time spent up to now is 9.1 secs Computing kpt #: 187 total cpu time spent up to now is 9.1 secs Computing kpt #: 188 total cpu time spent up to now is 9.2 secs Computing kpt #: 189 total cpu time spent up to now is 9.2 secs Computing kpt #: 190 total cpu time spent up to now is 9.2 secs Computing kpt #: 191 total cpu time spent up to now is 9.3 secs Computing kpt #: 192 total cpu time spent up to now is 9.3 secs Computing kpt #: 193 total cpu time spent up to now is 9.4 secs Computing kpt #: 194 total cpu time spent up to now is 9.4 secs Computing kpt #: 195 total cpu time spent up to now is 9.5 secs Computing kpt #: 196 total cpu time spent up to now is 9.5 secs Computing kpt #: 197 total cpu time spent up to now is 9.6 secs Computing kpt #: 198 total cpu time spent up to now is 9.6 secs Computing kpt #: 199 total cpu time spent up to now is 9.7 secs Computing kpt #: 200 total cpu time spent up to now is 9.7 secs Computing kpt #: 201 total cpu time spent up to now is 9.8 secs Computing kpt #: 202 total cpu time spent up to now is 9.8 secs Computing kpt #: 203 total cpu time spent up to now is 9.8 secs Computing kpt #: 204 total cpu time spent up to now is 9.9 secs Computing kpt #: 205 total cpu time spent up to now is 9.9 secs Computing kpt #: 206 total cpu time spent up to now is 9.9 secs Computing kpt #: 207 total cpu time spent up to now is 10.0 secs Computing kpt #: 208 total cpu time spent up to now is 10.0 secs Computing kpt #: 209 total cpu time spent up to now is 10.1 secs Computing kpt #: 210 total cpu time spent up to now is 10.1 secs Computing kpt #: 211 total cpu time spent up to now is 10.2 secs Computing kpt #: 212 total cpu time spent up to now is 10.2 secs Computing kpt #: 213 total cpu time spent up to now is 10.2 secs Computing kpt #: 214 total cpu time spent up to now is 10.3 secs Computing kpt #: 215 total cpu time spent up to now is 10.3 secs Computing kpt #: 216 total cpu time spent up to now is 10.4 secs Computing kpt #: 217 total cpu time spent up to now is 10.4 secs Computing kpt #: 218 total cpu time spent up to now is 10.5 secs Computing kpt #: 219 total cpu time spent up to now is 10.5 secs Computing kpt #: 220 total cpu time spent up to now is 10.6 secs Computing kpt #: 221 total cpu time spent up to now is 10.6 secs Computing kpt #: 222 total cpu time spent up to now is 10.7 secs Computing kpt #: 223 total cpu time spent up to now is 10.7 secs Computing kpt #: 224 total cpu time spent up to now is 10.8 secs Computing kpt #: 225 total cpu time spent up to now is 10.8 secs Computing kpt #: 226 total cpu time spent up to now is 10.8 secs Computing kpt #: 227 total cpu time spent up to now is 10.9 secs Computing kpt #: 228 total cpu time spent up to now is 10.9 secs Computing kpt #: 229 total cpu time spent up to now is 11.0 secs Computing kpt #: 230 total cpu time spent up to now is 11.0 secs Computing kpt #: 231 total cpu time spent up to now is 11.1 secs Computing kpt #: 232 total cpu time spent up to now is 11.1 secs Computing kpt #: 233 total cpu time spent up to now is 11.1 secs Computing kpt #: 234 total cpu time spent up to now is 11.2 secs Computing kpt #: 235 total cpu time spent up to now is 11.2 secs Computing kpt #: 236 total cpu time spent up to now is 11.3 secs Computing kpt #: 237 total cpu time spent up to now is 11.3 secs Computing kpt #: 238 total cpu time spent up to now is 11.3 secs Computing kpt #: 239 total cpu time spent up to now is 11.4 secs Computing kpt #: 240 total cpu time spent up to now is 11.4 secs Computing kpt #: 241 total cpu time spent up to now is 11.5 secs Computing kpt #: 242 total cpu time spent up to now is 11.5 secs Computing kpt #: 243 total cpu time spent up to now is 11.6 secs Computing kpt #: 244 total cpu time spent up to now is 11.6 secs Computing kpt #: 245 total cpu time spent up to now is 11.6 secs Computing kpt #: 246 total cpu time spent up to now is 11.7 secs Computing kpt #: 247 total cpu time spent up to now is 11.7 secs Computing kpt #: 248 total cpu time spent up to now is 11.8 secs Computing kpt #: 249 total cpu time spent up to now is 11.8 secs Computing kpt #: 250 total cpu time spent up to now is 11.9 secs Computing kpt #: 251 total cpu time spent up to now is 11.9 secs Computing kpt #: 252 total cpu time spent up to now is 11.9 secs Computing kpt #: 253 total cpu time spent up to now is 12.0 secs Computing kpt #: 254 total cpu time spent up to now is 12.0 secs Computing kpt #: 255 total cpu time spent up to now is 12.1 secs Computing kpt #: 256 total cpu time spent up to now is 12.1 secs Computing kpt #: 257 total cpu time spent up to now is 12.1 secs Computing kpt #: 258 total cpu time spent up to now is 12.2 secs Computing kpt #: 259 total cpu time spent up to now is 12.2 secs Computing kpt #: 260 total cpu time spent up to now is 12.3 secs Computing kpt #: 261 total cpu time spent up to now is 12.3 secs Computing kpt #: 262 total cpu time spent up to now is 12.4 secs Computing kpt #: 263 total cpu time spent up to now is 12.4 secs Computing kpt #: 264 total cpu time spent up to now is 12.5 secs Computing kpt #: 265 total cpu time spent up to now is 12.5 secs Computing kpt #: 266 total cpu time spent up to now is 12.5 secs Computing kpt #: 267 total cpu time spent up to now is 12.6 secs Computing kpt #: 268 total cpu time spent up to now is 12.6 secs Computing kpt #: 269 total cpu time spent up to now is 12.7 secs Computing kpt #: 270 total cpu time spent up to now is 12.7 secs Computing kpt #: 271 total cpu time spent up to now is 12.8 secs Computing kpt #: 272 total cpu time spent up to now is 12.8 secs Computing kpt #: 273 total cpu time spent up to now is 12.9 secs Computing kpt #: 274 total cpu time spent up to now is 12.9 secs Computing kpt #: 275 total cpu time spent up to now is 13.0 secs Computing kpt #: 276 total cpu time spent up to now is 13.0 secs Computing kpt #: 277 total cpu time spent up to now is 13.1 secs Computing kpt #: 278 total cpu time spent up to now is 13.1 secs Computing kpt #: 279 total cpu time spent up to now is 13.2 secs Computing kpt #: 280 total cpu time spent up to now is 13.2 secs Computing kpt #: 281 total cpu time spent up to now is 13.2 secs Computing kpt #: 282 total cpu time spent up to now is 13.3 secs Computing kpt #: 283 total cpu time spent up to now is 13.3 secs Computing kpt #: 284 total cpu time spent up to now is 13.4 secs Computing kpt #: 285 total cpu time spent up to now is 13.4 secs Computing kpt #: 286 total cpu time spent up to now is 13.5 secs Computing kpt #: 287 total cpu time spent up to now is 13.5 secs Computing kpt #: 288 total cpu time spent up to now is 13.6 secs Computing kpt #: 289 total cpu time spent up to now is 13.6 secs Computing kpt #: 290 total cpu time spent up to now is 13.7 secs Computing kpt #: 291 total cpu time spent up to now is 13.8 secs Computing kpt #: 292 total cpu time spent up to now is 13.8 secs Computing kpt #: 293 total cpu time spent up to now is 13.9 secs Computing kpt #: 294 total cpu time spent up to now is 13.9 secs Computing kpt #: 295 total cpu time spent up to now is 14.0 secs Computing kpt #: 296 total cpu time spent up to now is 14.0 secs Computing kpt #: 297 total cpu time spent up to now is 14.0 secs Computing kpt #: 298 total cpu time spent up to now is 14.1 secs Computing kpt #: 299 total cpu time spent up to now is 14.1 secs Computing kpt #: 300 total cpu time spent up to now is 14.2 secs Computing kpt #: 301 total cpu time spent up to now is 14.2 secs Computing kpt #: 302 total cpu time spent up to now is 14.3 secs Computing kpt #: 303 total cpu time spent up to now is 14.3 secs Computing kpt #: 304 total cpu time spent up to now is 14.4 secs Computing kpt #: 305 total cpu time spent up to now is 14.4 secs Computing kpt #: 306 total cpu time spent up to now is 14.4 secs Computing kpt #: 307 total cpu time spent up to now is 14.5 secs Computing kpt #: 308 total cpu time spent up to now is 14.5 secs Computing kpt #: 309 total cpu time spent up to now is 14.6 secs Computing kpt #: 310 total cpu time spent up to now is 14.6 secs Computing kpt #: 311 total cpu time spent up to now is 14.6 secs Computing kpt #: 312 total cpu time spent up to now is 14.7 secs Computing kpt #: 313 total cpu time spent up to now is 14.8 secs Computing kpt #: 314 total cpu time spent up to now is 14.9 secs Computing kpt #: 315 total cpu time spent up to now is 14.9 secs Computing kpt #: 316 total cpu time spent up to now is 15.0 secs Computing kpt #: 317 total cpu time spent up to now is 15.0 secs Computing kpt #: 318 total cpu time spent up to now is 15.1 secs Computing kpt #: 319 total cpu time spent up to now is 15.1 secs Computing kpt #: 320 total cpu time spent up to now is 15.1 secs Computing kpt #: 321 total cpu time spent up to now is 15.2 secs Computing kpt #: 322 total cpu time spent up to now is 15.2 secs Computing kpt #: 323 total cpu time spent up to now is 15.2 secs Computing kpt #: 324 total cpu time spent up to now is 15.3 secs Computing kpt #: 325 total cpu time spent up to now is 15.3 secs Computing kpt #: 326 total cpu time spent up to now is 15.4 secs Computing kpt #: 327 total cpu time spent up to now is 15.4 secs Computing kpt #: 328 total cpu time spent up to now is 15.4 secs Computing kpt #: 329 total cpu time spent up to now is 15.5 secs Computing kpt #: 330 total cpu time spent up to now is 15.5 secs Computing kpt #: 331 total cpu time spent up to now is 15.6 secs Computing kpt #: 332 total cpu time spent up to now is 15.6 secs Computing kpt #: 333 total cpu time spent up to now is 15.6 secs Computing kpt #: 334 total cpu time spent up to now is 15.7 secs Computing kpt #: 335 total cpu time spent up to now is 15.7 secs Computing kpt #: 336 total cpu time spent up to now is 15.8 secs Computing kpt #: 337 total cpu time spent up to now is 15.8 secs Computing kpt #: 338 total cpu time spent up to now is 15.8 secs Computing kpt #: 339 total cpu time spent up to now is 15.9 secs Computing kpt #: 340 total cpu time spent up to now is 15.9 secs Computing kpt #: 341 total cpu time spent up to now is 16.0 secs Computing kpt #: 342 total cpu time spent up to now is 16.0 secs Computing kpt #: 343 total cpu time spent up to now is 16.0 secs Computing kpt #: 344 total cpu time spent up to now is 16.1 secs Computing kpt #: 345 total cpu time spent up to now is 16.1 secs Computing kpt #: 346 total cpu time spent up to now is 16.1 secs Computing kpt #: 347 total cpu time spent up to now is 16.2 secs Computing kpt #: 348 total cpu time spent up to now is 16.2 secs Computing kpt #: 349 total cpu time spent up to now is 16.2 secs Computing kpt #: 350 total cpu time spent up to now is 16.3 secs Computing kpt #: 351 total cpu time spent up to now is 16.3 secs Computing kpt #: 352 total cpu time spent up to now is 16.3 secs Computing kpt #: 353 total cpu time spent up to now is 16.4 secs Computing kpt #: 354 total cpu time spent up to now is 16.4 secs Computing kpt #: 355 total cpu time spent up to now is 16.4 secs Computing kpt #: 356 total cpu time spent up to now is 16.4 secs Computing kpt #: 357 total cpu time spent up to now is 16.5 secs Computing kpt #: 358 total cpu time spent up to now is 16.5 secs Computing kpt #: 359 total cpu time spent up to now is 16.5 secs Computing kpt #: 360 total cpu time spent up to now is 16.6 secs Computing kpt #: 361 total cpu time spent up to now is 16.6 secs Computing kpt #: 362 total cpu time spent up to now is 16.6 secs Computing kpt #: 363 total cpu time spent up to now is 16.6 secs Computing kpt #: 364 total cpu time spent up to now is 16.7 secs Computing kpt #: 365 total cpu time spent up to now is 16.7 secs Computing kpt #: 366 total cpu time spent up to now is 16.7 secs Computing kpt #: 367 total cpu time spent up to now is 16.8 secs Computing kpt #: 368 total cpu time spent up to now is 16.8 secs Computing kpt #: 369 total cpu time spent up to now is 16.8 secs Computing kpt #: 370 total cpu time spent up to now is 16.8 secs Computing kpt #: 371 total cpu time spent up to now is 16.9 secs Computing kpt #: 372 total cpu time spent up to now is 16.9 secs Computing kpt #: 373 total cpu time spent up to now is 16.9 secs Computing kpt #: 374 total cpu time spent up to now is 17.0 secs Computing kpt #: 375 total cpu time spent up to now is 17.0 secs Computing kpt #: 376 total cpu time spent up to now is 17.0 secs Computing kpt #: 377 total cpu time spent up to now is 17.0 secs Computing kpt #: 378 total cpu time spent up to now is 17.1 secs Computing kpt #: 379 total cpu time spent up to now is 17.1 secs Computing kpt #: 380 total cpu time spent up to now is 17.1 secs Computing kpt #: 381 total cpu time spent up to now is 17.2 secs Computing kpt #: 382 total cpu time spent up to now is 17.2 secs Computing kpt #: 383 total cpu time spent up to now is 17.2 secs Computing kpt #: 384 total cpu time spent up to now is 17.2 secs Computing kpt #: 385 total cpu time spent up to now is 17.3 secs Computing kpt #: 386 total cpu time spent up to now is 17.3 secs Computing kpt #: 387 total cpu time spent up to now is 17.3 secs Computing kpt #: 388 total cpu time spent up to now is 17.4 secs Computing kpt #: 389 total cpu time spent up to now is 17.4 secs Computing kpt #: 390 total cpu time spent up to now is 17.4 secs Computing kpt #: 391 total cpu time spent up to now is 17.4 secs Computing kpt #: 392 total cpu time spent up to now is 17.5 secs Computing kpt #: 393 total cpu time spent up to now is 17.5 secs Computing kpt #: 394 total cpu time spent up to now is 17.5 secs Computing kpt #: 395 total cpu time spent up to now is 17.6 secs Computing kpt #: 396 total cpu time spent up to now is 17.6 secs Computing kpt #: 397 total cpu time spent up to now is 17.6 secs Computing kpt #: 398 total cpu time spent up to now is 17.6 secs Computing kpt #: 399 total cpu time spent up to now is 17.7 secs Computing kpt #: 400 total cpu time spent up to now is 17.7 secs Computing kpt #: 401 total cpu time spent up to now is 17.7 secs Computing kpt #: 402 total cpu time spent up to now is 17.8 secs Computing kpt #: 403 total cpu time spent up to now is 17.8 secs Computing kpt #: 404 total cpu time spent up to now is 17.8 secs Computing kpt #: 405 total cpu time spent up to now is 17.9 secs Computing kpt #: 406 total cpu time spent up to now is 17.9 secs Computing kpt #: 407 total cpu time spent up to now is 17.9 secs Computing kpt #: 408 total cpu time spent up to now is 18.0 secs Computing kpt #: 409 total cpu time spent up to now is 18.0 secs Computing kpt #: 410 total cpu time spent up to now is 18.0 secs Computing kpt #: 411 total cpu time spent up to now is 18.1 secs Computing kpt #: 412 total cpu time spent up to now is 18.1 secs Computing kpt #: 413 total cpu time spent up to now is 18.1 secs Computing kpt #: 414 total cpu time spent up to now is 18.1 secs Computing kpt #: 415 total cpu time spent up to now is 18.2 secs Computing kpt #: 416 total cpu time spent up to now is 18.2 secs Computing kpt #: 417 total cpu time spent up to now is 18.2 secs Computing kpt #: 418 total cpu time spent up to now is 18.3 secs Computing kpt #: 419 total cpu time spent up to now is 18.3 secs Computing kpt #: 420 total cpu time spent up to now is 18.3 secs Computing kpt #: 421 total cpu time spent up to now is 18.4 secs Computing kpt #: 422 total cpu time spent up to now is 18.4 secs Computing kpt #: 423 total cpu time spent up to now is 18.4 secs Computing kpt #: 424 total cpu time spent up to now is 18.5 secs Computing kpt #: 425 total cpu time spent up to now is 18.5 secs Computing kpt #: 426 total cpu time spent up to now is 18.5 secs Computing kpt #: 427 total cpu time spent up to now is 18.6 secs Computing kpt #: 428 total cpu time spent up to now is 18.6 secs Computing kpt #: 429 total cpu time spent up to now is 18.6 secs Computing kpt #: 430 total cpu time spent up to now is 18.7 secs Computing kpt #: 431 total cpu time spent up to now is 18.7 secs Computing kpt #: 432 total cpu time spent up to now is 18.7 secs Computing kpt #: 433 total cpu time spent up to now is 18.8 secs Computing kpt #: 434 total cpu time spent up to now is 18.8 secs Computing kpt #: 435 total cpu time spent up to now is 18.8 secs Computing kpt #: 436 total cpu time spent up to now is 18.9 secs Computing kpt #: 437 total cpu time spent up to now is 18.9 secs Computing kpt #: 438 total cpu time spent up to now is 18.9 secs Computing kpt #: 439 total cpu time spent up to now is 19.0 secs Computing kpt #: 440 total cpu time spent up to now is 19.0 secs Computing kpt #: 441 total cpu time spent up to now is 19.1 secs Computing kpt #: 442 total cpu time spent up to now is 19.1 secs Computing kpt #: 443 total cpu time spent up to now is 19.1 secs Computing kpt #: 444 total cpu time spent up to now is 19.2 secs Computing kpt #: 445 total cpu time spent up to now is 19.2 secs Computing kpt #: 446 total cpu time spent up to now is 19.3 secs Computing kpt #: 447 total cpu time spent up to now is 19.3 secs Computing kpt #: 448 total cpu time spent up to now is 19.3 secs Computing kpt #: 449 total cpu time spent up to now is 19.4 secs Computing kpt #: 450 total cpu time spent up to now is 19.4 secs Computing kpt #: 451 total cpu time spent up to now is 19.5 secs Computing kpt #: 452 total cpu time spent up to now is 19.5 secs Computing kpt #: 453 total cpu time spent up to now is 19.5 secs Computing kpt #: 454 total cpu time spent up to now is 19.6 secs Computing kpt #: 455 total cpu time spent up to now is 19.7 secs Computing kpt #: 456 total cpu time spent up to now is 19.7 secs Computing kpt #: 457 total cpu time spent up to now is 19.8 secs Computing kpt #: 458 total cpu time spent up to now is 19.8 secs Computing kpt #: 459 total cpu time spent up to now is 19.9 secs Computing kpt #: 460 total cpu time spent up to now is 19.9 secs Computing kpt #: 461 total cpu time spent up to now is 20.0 secs Computing kpt #: 462 total cpu time spent up to now is 20.1 secs Computing kpt #: 463 total cpu time spent up to now is 20.1 secs Computing kpt #: 464 total cpu time spent up to now is 20.2 secs Computing kpt #: 465 total cpu time spent up to now is 20.2 secs Computing kpt #: 466 total cpu time spent up to now is 20.2 secs Computing kpt #: 467 total cpu time spent up to now is 20.3 secs Computing kpt #: 468 total cpu time spent up to now is 20.3 secs Computing kpt #: 469 total cpu time spent up to now is 20.4 secs Computing kpt #: 470 total cpu time spent up to now is 20.4 secs Computing kpt #: 471 total cpu time spent up to now is 20.5 secs Computing kpt #: 472 total cpu time spent up to now is 20.5 secs Computing kpt #: 473 total cpu time spent up to now is 20.5 secs Computing kpt #: 474 total cpu time spent up to now is 20.6 secs Computing kpt #: 475 total cpu time spent up to now is 20.6 secs Computing kpt #: 476 total cpu time spent up to now is 20.7 secs Computing kpt #: 477 total cpu time spent up to now is 20.7 secs Computing kpt #: 478 total cpu time spent up to now is 20.7 secs Computing kpt #: 479 total cpu time spent up to now is 20.8 secs Computing kpt #: 480 total cpu time spent up to now is 20.8 secs Computing kpt #: 481 total cpu time spent up to now is 20.8 secs Computing kpt #: 482 total cpu time spent up to now is 20.9 secs Computing kpt #: 483 total cpu time spent up to now is 20.9 secs Computing kpt #: 484 total cpu time spent up to now is 20.9 secs Computing kpt #: 485 total cpu time spent up to now is 21.0 secs Computing kpt #: 486 total cpu time spent up to now is 21.0 secs Computing kpt #: 487 total cpu time spent up to now is 21.0 secs Computing kpt #: 488 total cpu time spent up to now is 21.1 secs Computing kpt #: 489 total cpu time spent up to now is 21.1 secs Computing kpt #: 490 total cpu time spent up to now is 21.1 secs Computing kpt #: 491 total cpu time spent up to now is 21.1 secs Computing kpt #: 492 total cpu time spent up to now is 21.2 secs Computing kpt #: 493 total cpu time spent up to now is 21.2 secs Computing kpt #: 494 total cpu time spent up to now is 21.2 secs Computing kpt #: 495 total cpu time spent up to now is 21.3 secs Computing kpt #: 496 total cpu time spent up to now is 21.3 secs Computing kpt #: 497 total cpu time spent up to now is 21.3 secs Computing kpt #: 498 total cpu time spent up to now is 21.3 secs Computing kpt #: 499 total cpu time spent up to now is 21.4 secs Computing kpt #: 500 total cpu time spent up to now is 21.4 secs Computing kpt #: 501 total cpu time spent up to now is 21.4 secs Computing kpt #: 502 total cpu time spent up to now is 21.5 secs Computing kpt #: 503 total cpu time spent up to now is 21.5 secs Computing kpt #: 504 total cpu time spent up to now is 21.5 secs Computing kpt #: 505 total cpu time spent up to now is 21.5 secs Computing kpt #: 506 total cpu time spent up to now is 21.6 secs Computing kpt #: 507 total cpu time spent up to now is 21.6 secs Computing kpt #: 508 total cpu time spent up to now is 21.6 secs Computing kpt #: 509 total cpu time spent up to now is 21.7 secs Computing kpt #: 510 total cpu time spent up to now is 21.7 secs Computing kpt #: 511 total cpu time spent up to now is 21.7 secs Computing kpt #: 512 total cpu time spent up to now is 21.7 secs Computing kpt #: 513 total cpu time spent up to now is 21.8 secs Computing kpt #: 514 total cpu time spent up to now is 21.8 secs Computing kpt #: 515 total cpu time spent up to now is 21.8 secs Computing kpt #: 516 total cpu time spent up to now is 21.9 secs Computing kpt #: 517 total cpu time spent up to now is 21.9 secs Computing kpt #: 518 total cpu time spent up to now is 21.9 secs Computing kpt #: 519 total cpu time spent up to now is 21.9 secs Computing kpt #: 520 total cpu time spent up to now is 22.0 secs Computing kpt #: 521 total cpu time spent up to now is 22.0 secs Computing kpt #: 522 total cpu time spent up to now is 22.0 secs Computing kpt #: 523 total cpu time spent up to now is 22.1 secs Computing kpt #: 524 total cpu time spent up to now is 22.1 secs Computing kpt #: 525 total cpu time spent up to now is 22.1 secs Computing kpt #: 526 total cpu time spent up to now is 22.2 secs Computing kpt #: 527 total cpu time spent up to now is 22.2 secs Computing kpt #: 528 total cpu time spent up to now is 22.3 secs Computing kpt #: 529 total cpu time spent up to now is 22.3 secs Computing kpt #: 530 total cpu time spent up to now is 22.3 secs Computing kpt #: 531 total cpu time spent up to now is 22.4 secs Computing kpt #: 532 total cpu time spent up to now is 22.4 secs Computing kpt #: 533 total cpu time spent up to now is 22.4 secs Computing kpt #: 534 total cpu time spent up to now is 22.5 secs Computing kpt #: 535 total cpu time spent up to now is 22.5 secs Computing kpt #: 536 total cpu time spent up to now is 22.6 secs Computing kpt #: 537 total cpu time spent up to now is 22.6 secs Computing kpt #: 538 total cpu time spent up to now is 22.6 secs Computing kpt #: 539 total cpu time spent up to now is 22.7 secs Computing kpt #: 540 total cpu time spent up to now is 22.7 secs Computing kpt #: 541 total cpu time spent up to now is 22.8 secs Computing kpt #: 542 total cpu time spent up to now is 22.9 secs Computing kpt #: 543 total cpu time spent up to now is 22.9 secs Computing kpt #: 544 total cpu time spent up to now is 23.0 secs Computing kpt #: 545 total cpu time spent up to now is 23.0 secs Computing kpt #: 546 total cpu time spent up to now is 23.1 secs Computing kpt #: 547 total cpu time spent up to now is 23.1 secs Computing kpt #: 548 total cpu time spent up to now is 23.1 secs Computing kpt #: 549 total cpu time spent up to now is 23.2 secs Computing kpt #: 550 total cpu time spent up to now is 23.2 secs Computing kpt #: 551 total cpu time spent up to now is 23.2 secs Computing kpt #: 552 total cpu time spent up to now is 23.3 secs Computing kpt #: 553 total cpu time spent up to now is 23.3 secs Computing kpt #: 554 total cpu time spent up to now is 23.4 secs Computing kpt #: 555 total cpu time spent up to now is 23.4 secs Computing kpt #: 556 total cpu time spent up to now is 23.4 secs Computing kpt #: 557 total cpu time spent up to now is 23.5 secs Computing kpt #: 558 total cpu time spent up to now is 23.5 secs Computing kpt #: 559 total cpu time spent up to now is 23.5 secs Computing kpt #: 560 total cpu time spent up to now is 23.5 secs Computing kpt #: 561 total cpu time spent up to now is 23.6 secs Computing kpt #: 562 total cpu time spent up to now is 23.6 secs Computing kpt #: 563 total cpu time spent up to now is 23.6 secs Computing kpt #: 564 total cpu time spent up to now is 23.7 secs Computing kpt #: 565 total cpu time spent up to now is 23.7 secs Computing kpt #: 566 total cpu time spent up to now is 23.7 secs Computing kpt #: 567 total cpu time spent up to now is 23.8 secs Computing kpt #: 568 total cpu time spent up to now is 23.8 secs Computing kpt #: 569 total cpu time spent up to now is 23.8 secs Computing kpt #: 570 total cpu time spent up to now is 23.9 secs Computing kpt #: 571 total cpu time spent up to now is 23.9 secs Computing kpt #: 572 total cpu time spent up to now is 23.9 secs Computing kpt #: 573 total cpu time spent up to now is 24.0 secs Computing kpt #: 574 total cpu time spent up to now is 24.0 secs Computing kpt #: 575 total cpu time spent up to now is 24.0 secs Computing kpt #: 576 total cpu time spent up to now is 24.0 secs Computing kpt #: 577 total cpu time spent up to now is 24.1 secs Computing kpt #: 578 total cpu time spent up to now is 24.1 secs Computing kpt #: 579 total cpu time spent up to now is 24.1 secs Computing kpt #: 580 total cpu time spent up to now is 24.2 secs Computing kpt #: 581 total cpu time spent up to now is 24.2 secs Computing kpt #: 582 total cpu time spent up to now is 24.2 secs Computing kpt #: 583 total cpu time spent up to now is 24.2 secs Computing kpt #: 584 total cpu time spent up to now is 24.3 secs Computing kpt #: 585 total cpu time spent up to now is 24.3 secs Computing kpt #: 586 total cpu time spent up to now is 24.3 secs Computing kpt #: 587 total cpu time spent up to now is 24.4 secs Computing kpt #: 588 total cpu time spent up to now is 24.4 secs Computing kpt #: 589 total cpu time spent up to now is 24.4 secs Computing kpt #: 590 total cpu time spent up to now is 24.4 secs Computing kpt #: 591 total cpu time spent up to now is 24.5 secs Computing kpt #: 592 total cpu time spent up to now is 24.5 secs Computing kpt #: 593 total cpu time spent up to now is 24.5 secs Computing kpt #: 594 total cpu time spent up to now is 24.6 secs Computing kpt #: 595 total cpu time spent up to now is 24.6 secs Computing kpt #: 596 total cpu time spent up to now is 24.6 secs Computing kpt #: 597 total cpu time spent up to now is 24.6 secs Computing kpt #: 598 total cpu time spent up to now is 24.7 secs Computing kpt #: 599 total cpu time spent up to now is 24.7 secs Computing kpt #: 600 total cpu time spent up to now is 24.7 secs Computing kpt #: 601 total cpu time spent up to now is 24.7 secs Computing kpt #: 602 total cpu time spent up to now is 24.8 secs Computing kpt #: 603 total cpu time spent up to now is 24.8 secs Computing kpt #: 604 total cpu time spent up to now is 24.8 secs ethr = 2.50E-07, avg # of iterations = 13.1 total cpu time spent up to now is 24.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 417 PWs) bands (ev): -3.3918 -3.3918 19.4016 19.4016 20.6870 20.6870 23.3505 23.3505 23.4102 23.4102 24.4837 24.4844 k = 0.0069 0.0040-0.0000 ( 417 PWs) bands (ev): -3.3904 -3.3904 19.3980 19.3980 20.6882 20.6882 23.3238 23.3238 23.3821 23.3821 24.4977 24.4977 k = 0.0139 0.0080-0.0000 ( 413 PWs) bands (ev): -3.3860 -3.3860 19.3871 19.3871 20.6919 20.6919 23.2495 23.2495 23.3045 23.3045 24.5346 24.5346 k = 0.0208 0.0120-0.0000 ( 413 PWs) bands (ev): -3.3787 -3.3787 19.3687 19.3687 20.6979 20.6979 23.1385 23.1385 23.1915 23.1915 24.5855 24.5855 k = 0.0278 0.0160-0.0000 ( 413 PWs) bands (ev): -3.3685 -3.3685 19.3423 19.3423 20.7064 20.7064 22.9996 22.9996 23.0584 23.0584 24.6418 24.6418 k = 0.0347 0.0200-0.0000 ( 413 PWs) bands (ev): -3.3553 -3.3553 19.3073 19.3073 20.7173 20.7173 22.8385 22.8385 22.9165 22.9165 24.6975 24.6975 k = 0.0417 0.0241-0.0000 ( 413 PWs) bands (ev): -3.3393 -3.3393 19.2631 19.2631 20.7307 20.7307 22.6618 22.6618 22.7710 22.7710 24.7494 24.7494 k = 0.0486 0.0281-0.0000 ( 415 PWs) bands (ev): -3.3203 -3.3203 19.2086 19.2086 20.7464 20.7464 22.4757 22.4757 22.6236 22.6236 24.7958 24.7958 k = 0.0556 0.0321-0.0000 ( 415 PWs) bands (ev): -3.2984 -3.2984 19.1427 19.1427 20.7646 20.7646 22.2852 22.2852 22.4756 22.4756 24.8365 24.8365 k = 0.0625 0.0361-0.0000 ( 413 PWs) bands (ev): -3.2736 -3.2736 19.0642 19.0642 20.7852 20.7852 22.0943 22.0943 22.3276 22.3276 24.8717 24.8717 k = 0.0694 0.0401-0.0000 ( 413 PWs) bands (ev): -3.2459 -3.2459 18.9719 18.9719 20.8082 20.8082 21.9065 21.9065 22.1804 22.1804 24.9020 24.9020 k = 0.0764 0.0441-0.0000 ( 413 PWs) bands (ev): -3.2152 -3.2152 18.8644 18.8644 20.8337 20.8337 21.7246 21.7246 22.0342 22.0342 24.9281 24.9281 k = 0.0833 0.0481-0.0000 ( 413 PWs) bands (ev): -3.1817 -3.1817 18.7408 18.7408 20.8615 20.8615 21.5511 21.5511 21.8895 21.8895 24.9509 24.9509 k = 0.0903 0.0521-0.0000 ( 417 PWs) bands (ev): -3.1452 -3.1452 18.6002 18.6002 20.8917 20.8917 21.3877 21.3877 21.7464 21.7464 24.9712 24.9712 k = 0.0972 0.0561-0.0000 ( 417 PWs) bands (ev): -3.1058 -3.1058 18.4425 18.4425 20.9242 20.9242 21.2357 21.2357 21.6053 21.6053 24.9898 24.9898 k = 0.1042 0.0601-0.0000 ( 425 PWs) bands (ev): -3.0636 -3.0636 18.2678 18.2678 20.9588 20.9588 21.0959 21.0959 21.4661 21.4661 25.0074 25.0074 k = 0.1111 0.0642-0.0000 ( 425 PWs) bands (ev): -3.0184 -3.0184 18.0770 18.0770 20.9642 20.9642 20.9993 20.9993 21.3293 21.3293 25.0247 25.0247 k = 0.1181 0.0682-0.0000 ( 429 PWs) bands (ev): -2.9703 -2.9703 17.8712 17.8712 20.8491 20.8491 21.0356 21.0356 21.1955 21.1955 25.0424 25.0424 k = 0.1250 0.0722-0.0000 ( 429 PWs) bands (ev): -2.9193 -2.9193 17.6521 17.6521 20.7423 20.7423 21.0468 21.0468 21.0935 21.0935 25.0609 25.0609 k = 0.1319 0.0762-0.0000 ( 429 PWs) bands (ev): -2.8655 -2.8655 17.4211 17.4211 20.6442 20.6442 20.9267 20.9267 21.1276 21.1276 25.0808 25.0808 k = 0.1389 0.0802-0.0000 ( 429 PWs) bands (ev): -2.8087 -2.8087 17.1800 17.1800 20.5538 20.5538 20.7993 20.7993 21.1738 21.1738 25.1026 25.1026 k = 0.1458 0.0842-0.0000 ( 429 PWs) bands (ev): -2.7490 -2.7490 16.9304 16.9304 20.4698 20.4698 20.6735 20.6735 21.2231 21.2231 25.1265 25.1265 k = 0.1528 0.0882-0.0000 ( 429 PWs) bands (ev): -2.6865 -2.6865 16.6736 16.6736 20.3913 20.3913 20.5498 20.5498 21.2750 21.2750 25.1530 25.1530 k = 0.1597 0.0922-0.0000 ( 429 PWs) bands (ev): -2.6210 -2.6210 16.4109 16.4109 20.3171 20.3171 20.4284 20.4284 21.3294 21.3294 25.1823 25.1823 k = 0.1667 0.0962-0.0000 ( 429 PWs) bands (ev): -2.5527 -2.5527 16.1435 16.1435 20.2466 20.2466 20.3093 20.3093 21.3862 21.3862 25.2146 25.2146 k = 0.1736 0.1002-0.0000 ( 429 PWs) bands (ev): -2.4815 -2.4815 15.8722 15.8722 20.1789 20.1789 20.1927 20.1927 21.4455 21.4455 25.2503 25.2503 k = 0.1806 0.1042-0.0000 ( 429 PWs) bands (ev): -2.4074 -2.4074 15.5980 15.5980 20.0783 20.0783 20.1136 20.1136 21.5072 21.5072 25.2894 25.2894 k = 0.1875 0.1083-0.0000 ( 429 PWs) bands (ev): -2.3305 -2.3305 15.3216 15.3216 19.9664 19.9664 20.0502 20.0502 21.5713 21.5713 25.3321 25.3321 k = 0.1944 0.1123-0.0000 ( 429 PWs) bands (ev): -2.2507 -2.2507 15.0434 15.0434 19.8569 19.8569 19.9883 19.9883 21.6378 21.6378 25.3785 25.3785 k = 0.2014 0.1163-0.0000 ( 429 PWs) bands (ev): -2.1680 -2.1680 14.7641 14.7641 19.7498 19.7498 19.9276 19.9276 21.7068 21.7068 25.4288 25.4288 k = 0.2083 0.1203-0.0000 ( 429 PWs) bands (ev): -2.0824 -2.0824 14.4840 14.4840 19.6452 19.6452 19.8680 19.8680 21.7781 21.7781 25.4829 25.4829 k = 0.2153 0.1243-0.0000 ( 429 PWs) bands (ev): -1.9940 -1.9940 14.2036 14.2036 19.5430 19.5430 19.8093 19.8093 21.8518 21.8518 25.5409 25.5409 k = 0.2222 0.1283-0.0000 ( 431 PWs) bands (ev): -1.9028 -1.9028 13.9231 13.9231 19.4432 19.4432 19.7514 19.7514 21.9279 21.9279 25.6029 25.6029 k = 0.2292 0.1323-0.0000 ( 431 PWs) bands (ev): -1.8087 -1.8087 13.6429 13.6429 19.3459 19.3459 19.6941 19.6941 22.0064 22.0064 25.6689 25.6689 k = 0.2361 0.1363-0.0000 ( 435 PWs) bands (ev): -1.7117 -1.7117 13.3631 13.3631 19.2510 19.2510 19.6376 19.6376 22.0873 22.0873 25.7388 25.7388 k = 0.2431 0.1403-0.0000 ( 435 PWs) bands (ev): -1.6119 -1.6119 13.0840 13.0840 19.1586 19.1586 19.5817 19.5817 22.1705 22.1705 25.8126 25.8126 k = 0.2500 0.1443-0.0000 ( 435 PWs) bands (ev): -1.5093 -1.5093 12.8058 12.8058 19.0686 19.0686 19.5265 19.5265 22.2561 22.2561 25.8904 25.8904 k = 0.2569 0.1483-0.0000 ( 435 PWs) bands (ev): -1.4038 -1.4038 12.5286 12.5286 18.9811 18.9811 19.4719 19.4719 22.3441 22.3441 25.9721 25.9721 k = 0.2639 0.1524-0.0000 ( 435 PWs) bands (ev): -1.2956 -1.2956 12.2526 12.2526 18.8961 18.8961 19.4181 19.4181 22.4345 22.4345 26.0576 26.0576 k = 0.2708 0.1564-0.0000 ( 433 PWs) bands (ev): -1.1845 -1.1845 11.9779 11.9779 18.8135 18.8135 19.3651 19.3651 22.5272 22.5272 26.1470 26.1470 k = 0.2778 0.1604-0.0000 ( 433 PWs) bands (ev): -1.0706 -1.0706 11.7046 11.7046 18.7333 18.7333 19.3128 19.3128 22.6222 22.6222 26.2401 26.2401 k = 0.2847 0.1644-0.0000 ( 433 PWs) bands (ev): -0.9539 -0.9539 11.4329 11.4329 18.6557 18.6557 19.2614 19.2614 22.7195 22.7195 26.3370 26.3370 k = 0.2917 0.1684-0.0000 ( 433 PWs) bands (ev): -0.8344 -0.8344 11.1627 11.1627 18.5805 18.5805 19.2109 19.2109 22.8192 22.8192 26.4375 26.4375 k = 0.2986 0.1724-0.0000 ( 433 PWs) bands (ev): -0.7121 -0.7121 10.8942 10.8942 18.5077 18.5077 19.1614 19.1614 22.9212 22.9212 26.5416 26.5416 k = 0.3056 0.1764-0.0000 ( 433 PWs) bands (ev): -0.5870 -0.5870 10.6274 10.6274 18.4375 18.4375 19.1130 19.1130 23.0255 23.0255 26.6492 26.6492 k = 0.3125 0.1804-0.0000 ( 433 PWs) bands (ev): -0.4591 -0.4591 10.3625 10.3625 18.3697 18.3697 19.0656 19.0656 23.1320 23.1320 26.7603 26.7603 k = 0.3194 0.1844-0.0000 ( 433 PWs) bands (ev): -0.3284 -0.3284 10.0995 10.0995 18.3043 18.3043 19.0195 19.0195 23.2408 23.2408 26.8748 26.8748 k = 0.3264 0.1884-0.0000 ( 437 PWs) bands (ev): -0.1950 -0.1950 9.8384 9.8384 18.2415 18.2415 18.9745 18.9745 23.3519 23.3519 26.9926 26.9926 k = 0.3333 0.1925-0.0000 ( 441 PWs) bands (ev): -0.0589 -0.0589 9.5792 9.5792 18.1811 18.1811 18.9308 18.9308 23.4652 23.4652 27.1137 27.1137 k = 0.3403 0.1965-0.0000 ( 439 PWs) bands (ev): 0.0801 0.0801 9.3222 9.3222 18.1231 18.1231 18.8885 18.8885 23.5806 23.5806 27.2379 27.2379 k = 0.3472 0.2005-0.0000 ( 445 PWs) bands (ev): 0.2217 0.2217 9.0672 9.0672 18.0676 18.0676 18.8475 18.8475 23.6983 23.6983 27.3652 27.3652 k = 0.3542 0.2045-0.0000 ( 445 PWs) bands (ev): 0.3662 0.3662 8.8143 8.8143 18.0146 18.0146 18.8081 18.8081 23.8180 23.8180 27.4955 27.4955 k = 0.3611 0.2085-0.0000 ( 445 PWs) bands (ev): 0.5133 0.5133 8.5636 8.5636 17.9641 17.9641 18.7701 18.7701 23.9399 23.9399 27.6287 27.6287 k = 0.3681 0.2125-0.0000 ( 440 PWs) bands (ev): 0.6631 0.6631 8.3152 8.3152 17.9160 17.9160 18.7337 18.7337 24.0637 24.0637 27.7647 27.7647 k = 0.3750 0.2165-0.0000 ( 440 PWs) bands (ev): 0.8157 0.8157 8.0689 8.0689 17.8704 17.8704 18.6988 18.6988 24.1896 24.1896 27.9033 27.9033 k = 0.3819 0.2205-0.0000 ( 438 PWs) bands (ev): 0.9709 0.9709 7.8249 7.8249 17.8273 17.8273 18.6656 18.6656 24.3174 24.3174 28.0445 28.0445 k = 0.3889 0.2245-0.0000 ( 438 PWs) bands (ev): 1.1289 1.1289 7.5832 7.5832 17.7866 17.7866 18.6341 18.6341 24.4470 24.4470 28.1880 28.1880 k = 0.3958 0.2285-0.0000 ( 438 PWs) bands (ev): 1.2894 1.2894 7.3439 7.3439 17.7484 17.7484 18.6044 18.6044 24.5783 24.5783 28.3337 28.3337 k = 0.4028 0.2325-0.0000 ( 438 PWs) bands (ev): 1.4527 1.4527 7.1069 7.1069 17.7127 17.7127 18.5763 18.5763 24.7112 24.7112 28.4814 28.4814 k = 0.4097 0.2366-0.0000 ( 438 PWs) bands (ev): 1.6185 1.6185 6.8723 6.8723 17.6794 17.6794 18.5501 18.5501 24.8455 24.8455 28.6308 28.6308 k = 0.4167 0.2406-0.0000 ( 438 PWs) bands (ev): 1.7870 1.7870 6.6402 6.6402 17.6486 17.6486 18.5257 18.5257 24.9810 24.9810 28.7816 28.7816 k = 0.4236 0.2446-0.0000 ( 438 PWs) bands (ev): 1.9580 1.9580 6.4105 6.4105 17.6203 17.6203 18.5031 18.5031 25.1175 25.1175 28.9335 28.9335 k = 0.4306 0.2486-0.0000 ( 438 PWs) bands (ev): 2.1315 2.1315 6.1834 6.1834 17.5944 17.5944 18.4824 18.4824 25.2545 25.2545 28.9398 28.9398 k = 0.4375 0.2526-0.0000 ( 442 PWs) bands (ev): 2.3075 2.3075 5.9589 5.9589 17.5710 17.5710 18.4636 18.4636 25.3916 25.3916 28.7627 28.7627 k = 0.4444 0.2566-0.0000 ( 446 PWs) bands (ev): 2.4859 2.4859 5.7371 5.7371 17.5500 17.5500 18.4468 18.4468 25.5281 25.5281 28.5904 28.5904 k = 0.4514 0.2606-0.0000 ( 446 PWs) bands (ev): 2.6666 2.6666 5.5181 5.5181 17.5316 17.5316 18.4318 18.4318 25.6630 25.6630 28.4239 28.4239 k = 0.4583 0.2646-0.0000 ( 446 PWs) bands (ev): 2.8494 2.8494 5.3021 5.3021 17.5155 17.5155 18.4189 18.4189 25.7948 25.7948 28.2646 28.2646 k = 0.4653 0.2686-0.0000 ( 446 PWs) bands (ev): 3.0339 3.0339 5.0894 5.0894 17.5020 17.5020 18.4079 18.4079 25.9215 25.9215 28.1147 28.1147 k = 0.4722 0.2726-0.0000 ( 446 PWs) bands (ev): 3.2195 3.2195 4.8808 4.8808 17.4909 17.4909 18.3988 18.3988 26.0398 26.0398 27.9773 27.9773 k = 0.4792 0.2766-0.0000 ( 446 PWs) bands (ev): 3.4049 3.4049 4.6775 4.6775 17.4823 17.4823 18.3918 18.3918 26.1450 26.1450 27.8573 27.8573 k = 0.4861 0.2807-0.0000 ( 442 PWs) bands (ev): 3.5863 3.5863 4.4834 4.4834 17.4761 17.4761 18.3868 18.3868 26.2302 26.2302 27.7615 27.7615 k = 0.4931 0.2847-0.0000 ( 438 PWs) bands (ev): 3.7499 3.7499 4.3121 4.3121 17.4724 17.4724 18.3838 18.3838 26.2869 26.2869 27.6984 27.6984 k = 0.5000 0.2887-0.0000 ( 438 PWs) bands (ev): 3.8341 3.8341 4.2253 4.2253 17.4712 17.4712 18.3828 18.3828 26.3070 26.3070 27.6763 27.6763 k = 0.5000 0.2887-0.0000 ( 438 PWs) bands (ev): 3.8341 3.8341 4.2253 4.2253 17.4712 17.4712 18.3828 18.3828 26.3070 26.3070 27.6763 27.6763 k = 0.4960 0.2955-0.0000 ( 442 PWs) bands (ev): 3.8355 3.8355 4.2267 4.2267 17.3764 17.3764 18.4786 18.4786 26.3080 26.3080 27.6776 27.6776 k = 0.4921 0.3024-0.0000 ( 442 PWs) bands (ev): 3.8397 3.8397 4.2307 4.2307 17.1601 17.1601 18.6981 18.6981 26.3108 26.3108 27.6816 27.6816 k = 0.4881 0.3093-0.0000 ( 446 PWs) bands (ev): 3.8466 3.8466 4.2375 4.2375 16.8971 16.8971 18.9664 18.9664 26.3156 26.3156 27.6883 27.6883 k = 0.4841 0.3162-0.0000 ( 446 PWs) bands (ev): 3.8564 3.8564 4.2470 4.2470 16.6162 16.6162 19.2547 19.2547 26.3222 26.3222 27.6977 27.6977 k = 0.4802 0.3230-0.0000 ( 446 PWs) bands (ev): 3.8689 3.8689 4.2592 4.2592 16.3275 16.3275 19.5528 19.5528 26.3308 26.3308 27.7097 27.7097 k = 0.4762 0.3299-0.0000 ( 445 PWs) bands (ev): 3.8842 3.8842 4.2741 4.2741 16.0354 16.0354 19.8563 19.8563 26.3413 26.3413 27.7245 27.7245 k = 0.4722 0.3368-0.0000 ( 445 PWs) bands (ev): 3.9023 3.9023 4.2917 4.2917 15.7418 15.7418 20.1632 20.1632 26.3536 26.3536 27.7419 27.7419 k = 0.4683 0.3437-0.0000 ( 445 PWs) bands (ev): 3.9231 3.9231 4.3120 4.3120 15.4479 15.4479 20.4722 20.4722 26.3678 26.3678 27.7620 27.7620 k = 0.4643 0.3505-0.0000 ( 441 PWs) bands (ev): 3.9467 3.9467 4.3350 4.3350 15.1543 15.1543 20.7826 20.7826 26.3839 26.3839 27.7847 27.7847 k = 0.4603 0.3574-0.0000 ( 443 PWs) bands (ev): 3.9731 3.9731 4.3608 4.3608 14.8615 14.8615 21.0938 21.0938 26.4019 26.4019 27.8101 27.8101 k = 0.4563 0.3643-0.0000 ( 443 PWs) bands (ev): 4.0023 4.0023 4.3892 4.3892 14.5697 14.5697 21.4054 21.4054 26.4217 26.4217 27.8382 27.8382 k = 0.4524 0.3712-0.0000 ( 445 PWs) bands (ev): 4.0342 4.0342 4.4204 4.4204 14.2791 14.2791 21.7171 21.7171 26.4434 26.4434 27.8690 27.8690 k = 0.4484 0.3780-0.0000 ( 445 PWs) bands (ev): 4.0689 4.0689 4.4542 4.4542 13.9900 13.9900 22.0285 22.0285 26.4669 26.4669 27.9024 27.9024 k = 0.4444 0.3849-0.0000 ( 445 PWs) bands (ev): 4.1064 4.1064 4.4908 4.4908 13.7023 13.7023 22.3393 22.3393 26.4921 26.4921 27.9385 27.9385 k = 0.4405 0.3918-0.0000 ( 445 PWs) bands (ev): 4.1465 4.1465 4.5301 4.5301 13.4163 13.4163 22.6491 22.6491 26.5192 26.5192 27.9772 27.9772 k = 0.4365 0.3986-0.0000 ( 445 PWs) bands (ev): 4.1895 4.1895 4.5721 4.5721 13.1319 13.1319 22.9576 22.9576 26.5480 26.5480 28.0186 28.0186 k = 0.4325 0.4055-0.0000 ( 439 PWs) bands (ev): 4.2352 4.2352 4.6168 4.6168 12.8493 12.8493 23.2645 23.2645 26.5786 26.5786 28.0626 28.0626 k = 0.4286 0.4124-0.0000 ( 435 PWs) bands (ev): 4.2836 4.2836 4.6642 4.6642 12.5685 12.5685 23.5693 23.5693 26.6109 26.6109 28.1093 28.1093 k = 0.4246 0.4193-0.0000 ( 439 PWs) bands (ev): 4.3347 4.3347 4.7143 4.7143 12.2896 12.2896 23.8716 23.8716 26.6449 26.6449 28.1585 28.1585 k = 0.4206 0.4261-0.0000 ( 439 PWs) bands (ev): 4.3885 4.3885 4.7672 4.7672 12.0126 12.0126 24.1708 24.1708 26.6805 26.6805 28.2104 28.2104 k = 0.4167 0.4330-0.0000 ( 439 PWs) bands (ev): 4.4451 4.4451 4.8227 4.8227 11.7376 11.7376 24.4665 24.4665 26.7177 26.7177 28.2650 28.2650 k = 0.4127 0.4399-0.0000 ( 439 PWs) bands (ev): 4.5043 4.5043 4.8810 4.8810 11.4646 11.4646 24.7581 24.7581 26.7564 26.7564 28.3221 28.3221 k = 0.4087 0.4468-0.0000 ( 439 PWs) bands (ev): 4.5663 4.5663 4.9419 4.9419 11.1936 11.1936 25.0449 25.0449 26.7965 26.7965 28.3819 28.3819 k = 0.4048 0.4536-0.0000 ( 439 PWs) bands (ev): 4.6309 4.6309 5.0056 5.0056 10.9248 10.9248 25.3262 25.3262 26.8381 26.8381 28.4442 28.4442 k = 0.4008 0.4605-0.0000 ( 439 PWs) bands (ev): 4.6981 4.6981 5.0720 5.0720 10.6580 10.6580 25.6011 25.6011 26.8810 26.8810 28.5092 28.5092 k = 0.3968 0.4674-0.0000 ( 439 PWs) bands (ev): 4.7680 4.7680 5.1411 5.1411 10.3934 10.3934 25.8687 25.8687 26.9251 26.9251 28.5767 28.5767 k = 0.3929 0.4743-0.0000 ( 443 PWs) bands (ev): 4.8406 4.8406 5.2129 5.2129 10.1310 10.1310 26.1280 26.1280 26.9703 26.9703 28.6468 28.6468 k = 0.3889 0.4811-0.0000 ( 443 PWs) bands (ev): 4.9157 4.9157 5.2874 5.2874 9.8708 9.8708 26.3780 26.3780 27.0165 27.0165 28.7195 28.7195 k = 0.3849 0.4880-0.0000 ( 439 PWs) bands (ev): 4.9934 4.9934 5.3646 5.3646 9.6129 9.6129 26.6175 26.6175 27.0634 27.0634 28.7947 28.7947 k = 0.3810 0.4949-0.0000 ( 439 PWs) bands (ev): 5.0736 5.0736 5.4445 5.4445 9.3574 9.3574 26.8450 26.8450 27.1110 27.1110 28.8724 28.8724 k = 0.3770 0.5017-0.0000 ( 439 PWs) bands (ev): 5.1563 5.1563 5.5272 5.5272 9.1042 9.1042 27.0589 27.0589 27.1593 27.1593 28.9527 28.9527 k = 0.3730 0.5086-0.0000 ( 439 PWs) bands (ev): 5.2415 5.2415 5.6125 5.6125 8.8535 8.8535 27.2046 27.2046 27.2614 27.2614 29.0356 29.0356 k = 0.3690 0.5155-0.0000 ( 439 PWs) bands (ev): 5.3290 5.3290 5.7006 5.7006 8.6053 8.6053 27.2532 27.2532 27.4443 27.4443 29.1209 29.1209 k = 0.3651 0.5224-0.0000 ( 439 PWs) bands (ev): 5.4188 5.4188 5.7914 5.7914 8.3598 8.3598 27.3000 27.3000 27.6110 27.6110 29.2087 29.2087 k = 0.3611 0.5292-0.0000 ( 439 PWs) bands (ev): 5.5106 5.5106 5.8848 5.8848 8.1172 8.1172 27.3453 27.3453 27.7595 27.7595 29.2990 29.2990 k = 0.3571 0.5361-0.0000 ( 439 PWs) bands (ev): 5.6043 5.6043 5.9810 5.9810 7.8776 7.8776 27.3886 27.3886 27.8887 27.8887 29.3918 29.3918 k = 0.3532 0.5430-0.0000 ( 439 PWs) bands (ev): 5.6993 5.6993 6.0799 6.0799 7.6416 7.6416 27.4289 27.4289 27.9979 27.9979 29.4871 29.4871 k = 0.3492 0.5499-0.0000 ( 439 PWs) bands (ev): 5.7950 5.7950 6.1815 6.1815 7.4099 7.4099 27.4653 27.4653 28.0867 28.0867 29.5847 29.5847 k = 0.3452 0.5567-0.0000 ( 441 PWs) bands (ev): 5.8899 5.8899 6.2858 6.2858 7.1840 7.1840 27.4965 27.4965 28.1550 28.1550 29.6848 29.6848 k = 0.3413 0.5636-0.0000 ( 441 PWs) bands (ev): 5.9805 5.9805 6.3927 6.3927 6.9673 6.9673 27.5210 27.5210 28.2029 28.2029 29.7873 29.7873 k = 0.3373 0.5705-0.0000 ( 441 PWs) bands (ev): 6.0578 6.0578 6.5022 6.5022 6.7691 6.7691 27.5371 27.5371 28.2310 28.2310 29.8922 29.8922 k = 0.3333 0.5774-0.0000 ( 441 PWs) bands (ev): 6.0951 6.0951 6.6039 6.6039 6.6262 6.6262 27.5429 27.5429 28.2402 28.2402 29.9992 29.9995 k = 0.3333 0.5774-0.0000 ( 441 PWs) bands (ev): 6.0951 6.0951 6.6039 6.6039 6.6262 6.6262 27.5429 27.5429 28.2402 28.2402 29.9993 29.9996 k = 0.3293 0.5704-0.0000 ( 441 PWs) bands (ev): 6.0388 6.0388 6.5580 6.5580 6.7323 6.7323 27.5363 27.5363 28.2312 28.2312 29.8984 29.8984 k = 0.3253 0.5634-0.0000 ( 441 PWs) bands (ev): 5.8881 5.8881 6.6015 6.6015 6.8513 6.8513 27.5153 27.5153 28.2050 28.2050 29.8158 29.8158 k = 0.3213 0.5565-0.0000 ( 441 PWs) bands (ev): 5.6966 5.6966 6.6905 6.6905 6.9733 6.9733 27.4787 27.4787 28.1630 28.1630 29.7531 29.7531 k = 0.3173 0.5495-0.0000 ( 441 PWs) bands (ev): 5.4917 5.4917 6.7980 6.7980 7.0981 7.0981 27.4257 27.4257 28.1064 28.1064 29.7109 29.7109 k = 0.3133 0.5426-0.0000 ( 441 PWs) bands (ev): 5.2825 5.2825 6.9149 6.9149 7.2257 7.2257 27.3567 27.3567 28.0369 28.0369 29.6890 29.6890 k = 0.3092 0.5356-0.0000 ( 441 PWs) bands (ev): 5.0724 5.0724 7.0378 7.0378 7.3561 7.3561 27.2727 27.2727 27.9557 27.9557 29.6864 29.6864 k = 0.3052 0.5287-0.0000 ( 441 PWs) bands (ev): 4.8628 4.8628 7.1651 7.1651 7.4893 7.4893 27.1753 27.1753 27.8641 27.8641 29.7014 29.7014 k = 0.3012 0.5217-0.0000 ( 437 PWs) bands (ev): 4.6545 4.6545 7.2962 7.2962 7.6252 7.6252 27.0667 27.0667 27.7635 27.7635 29.7322 29.7322 k = 0.2972 0.5147-0.0000 ( 437 PWs) bands (ev): 4.4480 4.4480 7.4305 7.4305 7.7639 7.7639 26.9487 26.9487 27.6549 27.6549 29.7765 29.7765 k = 0.2932 0.5078-0.0000 ( 437 PWs) bands (ev): 4.2436 4.2436 7.5679 7.5679 7.9054 7.9054 26.8232 26.8232 27.5395 27.5395 29.8327 29.8327 k = 0.2892 0.5008-0.0000 ( 437 PWs) bands (ev): 4.0413 4.0413 7.7081 7.7081 8.0496 8.0496 26.6920 26.6920 27.4182 27.4182 29.8990 29.8990 k = 0.2851 0.4939-0.0000 ( 437 PWs) bands (ev): 3.8413 3.8413 7.8511 7.8511 8.1965 8.1965 26.5564 26.5564 27.2920 27.2920 29.9741 29.9741 k = 0.2811 0.4869-0.0000 ( 439 PWs) bands (ev): 3.6436 3.6436 7.9967 7.9967 8.3463 8.3463 26.4177 26.4177 27.1617 27.1617 30.0568 30.0568 k = 0.2771 0.4800-0.0000 ( 439 PWs) bands (ev): 3.4484 3.4484 8.1449 8.1449 8.4988 8.4988 26.2767 26.2767 27.0280 27.0280 30.1461 30.1461 k = 0.2731 0.4730-0.0000 ( 439 PWs) bands (ev): 3.2557 3.2557 8.2956 8.2956 8.6540 8.6540 26.1342 26.1342 26.8914 26.8914 30.2410 30.2410 k = 0.2691 0.4661-0.0000 ( 443 PWs) bands (ev): 3.0655 3.0655 8.4488 8.4488 8.8120 8.8120 25.9909 25.9909 26.7527 26.7527 30.3222 30.3222 k = 0.2651 0.4591-0.0000 ( 443 PWs) bands (ev): 2.8778 2.8778 8.6044 8.6044 8.9727 8.9727 25.8474 25.8474 26.6123 26.6123 30.1780 30.1780 k = 0.2610 0.4521-0.0000 ( 443 PWs) bands (ev): 2.6927 2.6927 8.7625 8.7625 9.1362 9.1362 25.7039 25.7039 26.4706 26.4706 30.0286 30.0286 k = 0.2570 0.4452-0.0000 ( 443 PWs) bands (ev): 2.5102 2.5102 8.9229 8.9229 9.3024 9.3024 25.5609 25.5609 26.3282 26.3282 29.8810 29.8810 k = 0.2530 0.4382-0.0000 ( 443 PWs) bands (ev): 2.3303 2.3303 9.0856 9.0856 9.4713 9.4713 25.4187 25.4187 26.1853 26.1853 29.7353 29.7353 k = 0.2490 0.4313-0.0000 ( 443 PWs) bands (ev): 2.1530 2.1530 9.2507 9.2507 9.6430 9.6430 25.2774 25.2774 26.0423 26.0423 29.5916 29.5916 k = 0.2450 0.4243-0.0000 ( 443 PWs) bands (ev): 1.9783 1.9783 9.4180 9.4180 9.8174 9.8174 25.1373 25.1373 25.8994 25.8994 29.4500 29.4500 k = 0.2410 0.4174-0.0000 ( 443 PWs) bands (ev): 1.8063 1.8063 9.5875 9.5875 9.9946 9.9946 24.9986 24.9986 25.7570 25.7570 29.3105 29.3105 k = 0.2369 0.4104-0.0000 ( 445 PWs) bands (ev): 1.6369 1.6369 9.7593 9.7593 10.1744 10.1744 24.8613 24.8613 25.6152 25.6152 29.1730 29.1730 k = 0.2329 0.4034-0.0000 ( 441 PWs) bands (ev): 1.4702 1.4702 9.9332 9.9332 10.3569 10.3569 24.7257 24.7257 25.4744 25.4744 29.0377 29.0377 k = 0.2289 0.3965-0.0000 ( 441 PWs) bands (ev): 1.3062 1.3062 10.1093 10.1093 10.5422 10.5422 24.5917 24.5917 25.3346 25.3346 28.9045 28.9045 k = 0.2249 0.3895-0.0000 ( 441 PWs) bands (ev): 1.1449 1.1449 10.2875 10.2875 10.7301 10.7301 24.4596 24.4596 25.1960 25.1960 28.7735 28.7735 k = 0.2209 0.3826-0.0000 ( 441 PWs) bands (ev): 0.9863 0.9863 10.4677 10.4677 10.9208 10.9208 24.3293 24.3293 25.0588 25.0588 28.6446 28.6446 k = 0.2169 0.3756-0.0000 ( 445 PWs) bands (ev): 0.8304 0.8304 10.6500 10.6500 11.1141 11.1141 24.2009 24.2009 24.9232 24.9232 28.5179 28.5179 k = 0.2129 0.3687-0.0000 ( 445 PWs) bands (ev): 0.6773 0.6773 10.8343 10.8343 11.3101 11.3101 24.0745 24.0745 24.7892 24.7892 28.3934 28.3934 k = 0.2088 0.3617-0.0000 ( 449 PWs) bands (ev): 0.5268 0.5268 11.0205 11.0205 11.5088 11.5088 23.9501 23.9501 24.6570 24.6570 28.2711 28.2711 k = 0.2048 0.3548-0.0000 ( 449 PWs) bands (ev): 0.3791 0.3791 11.2086 11.2086 11.7101 11.7101 23.8279 23.8279 24.5268 24.5268 28.1510 28.1510 k = 0.2008 0.3478-0.0000 ( 449 PWs) bands (ev): 0.2342 0.2342 11.3986 11.3986 11.9140 11.9140 23.7077 23.7077 24.3985 24.3985 28.0331 28.0331 k = 0.1968 0.3408-0.0000 ( 449 PWs) bands (ev): 0.0920 0.0920 11.5905 11.5905 12.1206 12.1206 23.5897 23.5897 24.2723 24.2723 27.9174 27.9174 k = 0.1928 0.3339-0.0000 ( 445 PWs) bands (ev): -0.0475 -0.0475 11.7841 11.7841 12.3298 12.3298 23.4739 23.4739 24.1484 24.1484 27.8039 27.8039 k = 0.1888 0.3269-0.0000 ( 441 PWs) bands (ev): -0.1841 -0.1841 11.9795 11.9795 12.5416 12.5416 23.3603 23.3603 24.0267 24.0267 27.6927 27.6927 k = 0.1847 0.3200-0.0000 ( 441 PWs) bands (ev): -0.3180 -0.3180 12.1765 12.1765 12.7560 12.7560 23.2489 23.2489 23.9074 23.9074 27.5837 27.5837 k = 0.1807 0.3130-0.0000 ( 437 PWs) bands (ev): -0.4491 -0.4491 12.3751 12.3751 12.9730 12.9730 23.1397 23.1397 23.7905 23.7905 27.4769 27.4769 k = 0.1767 0.3061-0.0000 ( 437 PWs) bands (ev): -0.5775 -0.5775 12.5753 12.5753 13.1925 13.1925 23.0329 23.0329 23.6762 23.6762 27.3724 27.3724 k = 0.1727 0.2991-0.0000 ( 441 PWs) bands (ev): -0.7030 -0.7030 12.7769 12.7769 13.4146 13.4146 22.9283 22.9283 23.5644 23.5644 27.2701 27.2701 k = 0.1687 0.2922-0.0000 ( 441 PWs) bands (ev): -0.8257 -0.8257 12.9800 12.9800 13.6391 13.6391 22.8260 22.8260 23.4553 23.4553 27.1700 27.1700 k = 0.1647 0.2852-0.0000 ( 439 PWs) bands (ev): -0.9457 -0.9457 13.1844 13.1844 13.8662 13.8662 22.7260 22.7260 23.3489 23.3489 27.0721 27.0721 k = 0.1606 0.2782-0.0000 ( 439 PWs) bands (ev): -1.0628 -1.0628 13.3901 13.3901 14.0957 14.0957 22.6283 22.6283 23.2454 23.2454 26.9765 26.9765 k = 0.1566 0.2713-0.0000 ( 439 PWs) bands (ev): -1.1771 -1.1771 13.5969 13.5969 14.3276 14.3276 22.5330 22.5330 23.1448 23.1448 26.8830 26.8830 k = 0.1526 0.2643-0.0000 ( 439 PWs) bands (ev): -1.2885 -1.2885 13.8047 13.8047 14.5619 14.5619 22.4400 22.4400 23.0472 23.0472 26.7918 26.7918 k = 0.1486 0.2574-0.0000 ( 439 PWs) bands (ev): -1.3972 -1.3972 14.0136 14.0136 14.7986 14.7986 22.3494 22.3494 22.9526 22.9526 26.7028 26.7028 k = 0.1446 0.2504-0.0000 ( 439 PWs) bands (ev): -1.5030 -1.5030 14.2232 14.2232 15.0377 15.0377 22.2611 22.2611 22.8612 22.8612 26.6160 26.6160 k = 0.1406 0.2435-0.0000 ( 435 PWs) bands (ev): -1.6060 -1.6060 14.4336 14.4336 15.2790 15.2790 22.1752 22.1752 22.7731 22.7731 26.5314 26.5314 k = 0.1365 0.2365-0.0000 ( 431 PWs) bands (ev): -1.7061 -1.7061 14.6445 14.6445 15.5225 15.5225 22.0917 22.0917 22.6883 22.6883 26.4490 26.4490 k = 0.1325 0.2295-0.0000 ( 429 PWs) bands (ev): -1.8034 -1.8034 14.8559 14.8559 15.7683 15.7683 22.0105 22.0105 22.6070 22.6070 26.3687 26.3687 k = 0.1285 0.2226-0.0000 ( 429 PWs) bands (ev): -1.8978 -1.8978 15.0674 15.0674 16.0161 16.0161 21.9317 21.9317 22.5293 22.5293 26.2905 26.2905 k = 0.1245 0.2156-0.0000 ( 429 PWs) bands (ev): -1.9893 -1.9893 15.2790 15.2790 16.2661 16.2661 21.8554 21.8554 22.4554 22.4554 26.2145 26.2145 k = 0.1205 0.2087-0.0000 ( 429 PWs) bands (ev): -2.0780 -2.0780 15.4904 15.4904 16.5180 16.5180 21.7814 21.7814 22.3854 22.3854 26.1406 26.1406 k = 0.1165 0.2017-0.0000 ( 429 PWs) bands (ev): -2.1639 -2.1639 15.7015 15.7015 16.7718 16.7718 21.7098 21.7098 22.3194 22.3194 26.0687 26.0687 k = 0.1124 0.1948-0.0000 ( 429 PWs) bands (ev): -2.2468 -2.2468 15.9118 15.9118 17.0275 17.0275 21.6406 21.6406 22.2578 22.2578 25.9990 25.9990 k = 0.1084 0.1878-0.0000 ( 429 PWs) bands (ev): -2.3269 -2.3269 16.1211 16.1211 17.2849 17.2849 21.5739 21.5739 22.2007 22.2007 25.9312 25.9312 k = 0.1044 0.1809-0.0000 ( 429 PWs) bands (ev): -2.4041 -2.4041 16.3290 16.3290 17.5439 17.5439 21.5095 21.5095 22.1484 22.1484 25.8654 25.8654 k = 0.1004 0.1739-0.0000 ( 425 PWs) bands (ev): -2.4785 -2.4785 16.5353 16.5353 17.8044 17.8044 21.4476 21.4476 22.1011 22.1011 25.8015 25.8015 k = 0.0964 0.1669-0.0000 ( 425 PWs) bands (ev): -2.5499 -2.5499 16.7393 16.7393 18.0662 18.0662 21.3881 21.3881 22.0593 22.0593 25.7395 25.7395 k = 0.0924 0.1600-0.0000 ( 425 PWs) bands (ev): -2.6185 -2.6185 16.9407 16.9407 18.3293 18.3293 21.3309 21.3309 22.0233 22.0233 25.6792 25.6792 k = 0.0884 0.1530-0.0000 ( 421 PWs) bands (ev): -2.6841 -2.6841 17.1389 17.1389 18.5934 18.5934 21.2763 21.2763 21.9936 21.9936 25.6208 25.6208 k = 0.0843 0.1461-0.0000 ( 421 PWs) bands (ev): -2.7469 -2.7469 17.3332 17.3332 18.8582 18.8582 21.2240 21.2240 21.9707 21.9707 25.5639 25.5639 k = 0.0803 0.1391-0.0000 ( 421 PWs) bands (ev): -2.8067 -2.8067 17.5229 17.5229 19.1237 19.1237 21.1741 21.1741 21.9550 21.9550 25.5086 25.5086 k = 0.0763 0.1322-0.0000 ( 421 PWs) bands (ev): -2.8637 -2.8637 17.7073 17.7073 19.3894 19.3894 21.1267 21.1267 21.9473 21.9473 25.4548 25.4548 k = 0.0723 0.1252-0.0000 ( 421 PWs) bands (ev): -2.9178 -2.9178 17.8855 17.8855 19.6551 19.6551 21.0818 21.0818 21.9482 21.9482 25.4022 25.4022 k = 0.0683 0.1183-0.0000 ( 421 PWs) bands (ev): -2.9689 -2.9689 18.0566 18.0566 19.9204 19.9204 21.0392 21.0392 21.9584 21.9584 25.3507 25.3507 k = 0.0643 0.1113-0.0000 ( 421 PWs) bands (ev): -3.0172 -3.0172 18.2197 18.2197 20.1849 20.1849 20.9992 20.9992 21.9786 21.9786 25.3001 25.3001 k = 0.0602 0.1043-0.0000 ( 421 PWs) bands (ev): -3.0625 -3.0625 18.3738 18.3738 20.4481 20.4481 20.9617 20.9617 22.0096 22.0096 25.2502 25.2502 k = 0.0562 0.0974-0.0000 ( 421 PWs) bands (ev): -3.1049 -3.1049 18.5180 18.5180 20.7088 20.7088 20.9272 20.9272 22.0519 22.0519 25.2007 25.2007 k = 0.0522 0.0904-0.0000 ( 417 PWs) bands (ev): -3.1444 -3.1444 18.6516 18.6516 20.8891 20.8891 20.9732 20.9732 22.1061 22.1061 25.1513 25.1513 k = 0.0482 0.0835-0.0000 ( 415 PWs) bands (ev): -3.1810 -3.1810 18.7740 18.7740 20.8616 20.8616 21.2260 21.2260 22.1724 22.1724 25.1017 25.1017 k = 0.0442 0.0765-0.0000 ( 415 PWs) bands (ev): -3.2146 -3.2146 18.8845 18.8845 20.8340 20.8340 21.4774 21.4774 22.2507 22.2507 25.0513 25.0513 k = 0.0402 0.0696-0.0000 ( 415 PWs) bands (ev): -3.2454 -3.2454 18.9832 18.9832 20.8086 20.8086 21.7238 21.7238 22.3409 22.3409 24.9998 24.9998 k = 0.0361 0.0626-0.0000 ( 415 PWs) bands (ev): -3.2732 -3.2732 19.0700 19.0700 20.7855 20.7855 21.9638 21.9638 22.4421 22.4421 24.9467 24.9467 k = 0.0321 0.0556-0.0000 ( 415 PWs) bands (ev): -3.2981 -3.2981 19.1453 19.1453 20.7649 20.7649 22.1958 22.1958 22.5534 22.5534 24.8915 24.8915 k = 0.0281 0.0487-0.0000 ( 411 PWs) bands (ev): -3.3200 -3.3200 19.2095 19.2095 20.7466 20.7466 22.4178 22.4178 22.6732 22.6732 24.8340 24.8340 k = 0.0241 0.0417-0.0000 ( 411 PWs) bands (ev): -3.3391 -3.3391 19.2632 19.2632 20.7308 20.7308 22.6273 22.6273 22.7997 22.7997 24.7739 24.7739 k = 0.0201 0.0348-0.0000 ( 411 PWs) bands (ev): -3.3552 -3.3552 19.3072 19.3072 20.7174 20.7174 22.8206 22.8206 22.9305 22.9305 24.7118 24.7118 k = 0.0161 0.0278-0.0000 ( 411 PWs) bands (ev): -3.3684 -3.3684 19.3421 19.3421 20.7065 20.7065 22.9927 22.9927 23.0629 23.0629 24.6489 24.6490 k = 0.0120 0.0209-0.0000 ( 411 PWs) bands (ev): -3.3786 -3.3786 19.3686 19.3686 20.6980 20.6980 23.1368 23.1368 23.1918 23.1918 24.5883 24.5884 k = 0.0080 0.0139-0.0000 ( 413 PWs) bands (ev): -3.3860 -3.3860 19.3871 19.3871 20.6919 20.6919 23.2491 23.2491 23.3042 23.3042 24.5353 24.5353 k = 0.0040 0.0070-0.0000 ( 417 PWs) bands (ev): -3.3904 -3.3904 19.3980 19.3980 20.6882 20.6882 23.3237 23.3237 23.3821 23.3821 24.4977 24.4982 k = 0.0000 0.0000 0.0000 ( 417 PWs) bands (ev): -3.3918 -3.3918 19.4016 19.4016 20.6870 20.6870 23.3505 23.3505 23.4102 23.4102 24.4833 24.4841 k = 0.0000 0.0000 0.0000 ( 417 PWs) bands (ev): -3.3918 -3.3918 19.4016 19.4016 20.6870 20.6870 23.3505 23.3505 23.4102 23.4102 24.4833 24.4843 k = 0.0000 0.0000 0.0079 ( 417 PWs) bands (ev): -3.3904 -3.3904 19.3371 19.3371 20.7510 20.7510 23.3516 23.3516 23.4113 23.4113 24.4852 24.4859 k = 0.0000 0.0000 0.0159 ( 417 PWs) bands (ev): -3.3862 -3.3862 19.1716 19.1716 20.9147 20.9147 23.3548 23.3548 23.4145 23.4145 24.4878 24.4878 k = 0.0000 0.0000 0.0238 ( 417 PWs) bands (ev): -3.3791 -3.3791 18.9499 18.9499 21.1335 21.1335 23.3602 23.3602 23.4199 23.4199 24.4936 24.4936 k = 0.0000 0.0000 0.0318 ( 417 PWs) bands (ev): -3.3691 -3.3691 18.6994 18.6994 21.3798 21.3798 23.3678 23.3678 23.4275 23.4275 24.5020 24.5031 k = 0.0000 0.0000 0.0397 ( 417 PWs) bands (ev): -3.3564 -3.3564 18.4336 18.4336 21.6403 21.6403 23.3776 23.3776 23.4372 23.4372 24.5125 24.5136 k = 0.0000 0.0000 0.0477 ( 417 PWs) bands (ev): -3.3408 -3.3408 18.1590 18.1590 21.9082 21.9082 23.3896 23.3896 23.4491 23.4491 24.5246 24.5262 k = 0.0000 0.0000 0.0556 ( 417 PWs) bands (ev): -3.3224 -3.3224 17.8791 17.8791 22.1800 22.1800 23.4037 23.4037 23.4631 23.4631 24.5395 24.5395 k = 0.0000 0.0000 0.0636 ( 417 PWs) bands (ev): -3.3011 -3.3011 17.5960 17.5960 22.4536 22.4536 23.4201 23.4201 23.4793 23.4793 24.5568 24.5583 k = 0.0000 0.0000 0.0715 ( 417 PWs) bands (ev): -3.2770 -3.2770 17.3108 17.3108 22.7276 22.7276 23.4387 23.4387 23.4977 23.4977 24.5762 24.5775 k = 0.0000 0.0000 0.0795 ( 417 PWs) bands (ev): -3.2501 -3.2501 17.0243 17.0243 23.0010 23.0010 23.4597 23.4597 23.5182 23.5182 24.5978 24.5978 k = 0.0000 0.0000 0.0874 ( 417 PWs) bands (ev): -3.2204 -3.2204 16.7373 16.7373 23.2722 23.2722 23.4840 23.4840 23.5409 23.5409 24.6217 24.6217 k = 0.0000 0.0000 0.0954 ( 417 PWs) bands (ev): -3.1878 -3.1878 16.4499 16.4499 23.4942 23.4942 23.5582 23.5582 23.5657 23.5657 24.6479 24.6479 k = 0.0000 0.0000 0.1033 ( 417 PWs) bands (ev): -3.1524 -3.1524 16.1626 16.1626 23.5309 23.5309 23.5927 23.5927 23.8180 23.8180 24.6762 24.6762 k = 0.0000 0.0000 0.1113 ( 423 PWs) bands (ev): -3.1143 -3.1143 15.8756 15.8756 23.5611 23.5611 23.6219 23.6219 24.0840 24.0840 24.7067 24.7067 k = 0.0000 0.0000 0.1192 ( 423 PWs) bands (ev): -3.0732 -3.0732 15.5891 15.5891 23.5928 23.5928 23.6532 23.6532 24.3480 24.3480 24.7394 24.7400 k = 0.0000 0.0000 0.1272 ( 429 PWs) bands (ev): -3.0294 -3.0294 15.3033 15.3033 23.6265 23.6265 23.6867 23.6867 24.6094 24.6094 24.7742 24.7742 k = 0.0000 0.0000 0.1351 ( 429 PWs) bands (ev): -2.9828 -2.9828 15.0183 15.0183 23.6623 23.6623 23.7223 23.7223 24.8111 24.8111 24.8128 24.8128 k = 0.0000 0.0000 0.1430 ( 429 PWs) bands (ev): -2.9334 -2.9334 14.7342 14.7342 23.7003 23.7003 23.7601 23.7601 24.8502 24.8502 24.8519 24.8519 k = 0.0000 0.0000 0.1510 ( 429 PWs) bands (ev): -2.8811 -2.8811 14.4512 14.4512 23.7404 23.7404 23.8001 23.8001 24.8913 24.8913 24.8930 24.8930 k = 0.0000 0.0000 0.1589 ( 429 PWs) bands (ev): -2.8261 -2.8261 14.1693 14.1693 23.7826 23.7826 23.8422 23.8422 24.9344 24.9344 24.9361 24.9361 k = 0.0000 0.0000 0.1669 ( 429 PWs) bands (ev): -2.7683 -2.7683 13.8886 13.8886 23.8270 23.8270 23.8865 23.8865 24.9795 24.9795 24.9812 24.9812 k = 0.0000 0.0000 0.1748 ( 429 PWs) bands (ev): -2.7077 -2.7077 13.6093 13.6093 23.8736 23.8736 23.9329 23.9329 25.0265 25.0265 25.0282 25.0282 k = 0.0000 0.0000 0.1828 ( 429 PWs) bands (ev): -2.6443 -2.6443 13.3313 13.3313 23.9223 23.9223 23.9815 23.9815 25.0755 25.0755 25.0772 25.0772 k = 0.0000 0.0000 0.1907 ( 429 PWs) bands (ev): -2.5782 -2.5782 13.0548 13.0548 23.9731 23.9731 24.0323 24.0323 25.1263 25.1263 25.1280 25.1280 k = 0.0000 0.0000 0.1987 ( 429 PWs) bands (ev): -2.5092 -2.5092 12.7798 12.7798 24.0262 24.0262 24.0852 24.0852 25.1790 25.1790 25.1807 25.1807 k = 0.0000 0.0000 0.2066 ( 429 PWs) bands (ev): -2.4376 -2.4376 12.5064 12.5064 24.0813 24.0813 24.1403 24.1403 25.2335 25.2335 25.2352 25.2352 k = 0.0000 0.0000 0.2146 ( 429 PWs) bands (ev): -2.3631 -2.3631 12.2347 12.2347 24.1387 24.1387 24.1975 24.1975 25.2896 25.2896 25.2913 25.2913 k = 0.0000 0.0000 0.2225 ( 423 PWs) bands (ev): -2.2859 -2.2859 11.9646 11.9646 24.1981 24.1981 24.2569 24.2569 25.3475 25.3475 25.3492 25.3492 k = 0.0000 0.0000 0.2305 ( 423 PWs) bands (ev): -2.2060 -2.2060 11.6963 11.6963 24.2598 24.2598 24.3184 24.3184 25.4069 25.4069 25.4086 25.4086 k = 0.0000 0.0000 0.2384 ( 423 PWs) bands (ev): -2.1234 -2.1234 11.4298 11.4298 24.3236 24.3236 24.3821 24.3821 25.4679 25.4679 25.4696 25.4696 k = 0.0000 0.0000 0.2464 ( 423 PWs) bands (ev): -2.0380 -2.0380 11.1651 11.1651 24.3895 24.3895 24.4479 24.4479 25.5303 25.5303 25.5320 25.5320 k = 0.0000 0.0000 0.2543 ( 435 PWs) bands (ev): -1.9499 -1.9499 10.9022 10.9022 24.4575 24.4575 24.5159 24.5159 25.5941 25.5941 25.5958 25.5958 k = 0.0000 0.0000 0.2623 ( 435 PWs) bands (ev): -1.8591 -1.8591 10.6413 10.6413 24.5277 24.5277 24.5860 24.5860 25.6592 25.6592 25.6609 25.6609 k = 0.0000 0.0000 0.2702 ( 435 PWs) bands (ev): -1.7657 -1.7657 10.3824 10.3824 24.6001 24.6001 24.6583 24.6583 25.7256 25.7256 25.7273 25.7273 k = 0.0000 0.0000 0.2781 ( 435 PWs) bands (ev): -1.6696 -1.6696 10.1255 10.1255 24.6745 24.6745 24.7326 24.7326 25.7930 25.7930 25.7947 25.7947 k = 0.0000 0.0000 0.2861 ( 436 PWs) bands (ev): -1.5708 -1.5708 9.8707 9.8707 24.7511 24.7511 24.8091 24.8091 25.8615 25.8615 25.8632 25.8632 k = 0.0000 0.0000 0.2940 ( 424 PWs) bands (ev): -1.4693 -1.4693 9.6179 9.6179 24.8298 24.8298 24.8877 24.8877 25.9309 25.9309 25.9326 25.9326 k = 0.0000 0.0000 0.3020 ( 424 PWs) bands (ev): -1.3653 -1.3653 9.3673 9.3673 24.9105 24.9105 24.9685 24.9685 26.0010 26.0010 26.0027 26.0027 k = 0.0000 0.0000 0.3099 ( 424 PWs) bands (ev): -1.2586 -1.2586 9.1189 9.1189 24.9934 24.9934 25.0513 25.0513 26.0718 26.0718 26.0736 26.0736 k = 0.0000 0.0000 0.3179 ( 424 PWs) bands (ev): -1.1494 -1.1494 8.8727 8.8727 25.0783 25.0783 25.1361 25.1361 26.1432 26.1432 26.1449 26.1449 k = 0.0000 0.0000 0.3258 ( 424 PWs) bands (ev): -1.0376 -1.0376 8.6288 8.6288 25.1653 25.1653 25.2231 25.2231 26.2148 26.2148 26.2166 26.2166 k = 0.0000 0.0000 0.3338 ( 424 PWs) bands (ev): -0.9232 -0.9232 8.3872 8.3872 25.2543 25.2543 25.3121 25.3121 26.2868 26.2868 26.2885 26.2885 k = 0.0000 0.0000 0.3417 ( 424 PWs) bands (ev): -0.8064 -0.8064 8.1479 8.1479 25.3453 25.3453 25.4031 25.4031 26.3587 26.3587 26.3605 26.3605 k = 0.0000 0.0000 0.3497 ( 424 PWs) bands (ev): -0.6871 -0.6871 7.9111 7.9111 25.4383 25.4383 25.4962 25.4962 26.4306 26.4306 26.4323 26.4323 k = 0.0000 0.0000 0.3576 ( 436 PWs) bands (ev): -0.5653 -0.5653 7.6767 7.6767 25.5333 25.5333 25.5912 25.5912 26.5021 26.5021 26.5038 26.5038 k = 0.0000 0.0000 0.3656 ( 436 PWs) bands (ev): -0.4412 -0.4412 7.4449 7.4449 25.6302 25.6302 25.6881 25.6881 26.5731 26.5731 26.5749 26.5749 k = 0.0000 0.0000 0.3735 ( 430 PWs) bands (ev): -0.3147 -0.3147 7.2156 7.2156 25.7290 25.7290 25.7870 25.7870 26.6434 26.6434 26.6452 26.6452 k = 0.0000 0.0000 0.3815 ( 430 PWs) bands (ev): -0.1860 -0.1860 6.9890 6.9890 25.8295 25.8295 25.8877 25.8877 26.7128 26.7128 26.7146 26.7146 k = 0.0000 0.0000 0.3894 ( 430 PWs) bands (ev): -0.0551 -0.0551 6.7652 6.7652 25.9319 25.9319 25.9902 25.9902 26.7810 26.7810 26.7828 26.7828 k = 0.0000 0.0000 0.3973 ( 430 PWs) bands (ev): 0.0779 0.0779 6.5442 6.5442 26.0359 26.0359 26.0945 26.0945 26.8478 26.8478 26.8495 26.8495 k = 0.0000 0.0000 0.4053 ( 430 PWs) bands (ev): 0.2129 0.2129 6.3263 6.3263 26.1415 26.1415 26.2003 26.2003 26.9129 26.9129 26.9146 26.9146 k = 0.0000 0.0000 0.4132 ( 430 PWs) bands (ev): 0.3498 0.3498 6.1114 6.1114 26.2485 26.2485 26.3077 26.3077 26.9760 26.9760 26.9778 26.9778 k = 0.0000 0.0000 0.4212 ( 436 PWs) bands (ev): 0.4884 0.4884 5.8998 5.8998 26.3569 26.3569 26.4165 26.4165 27.0370 27.0370 27.0387 27.0387 k = 0.0000 0.0000 0.4291 ( 436 PWs) bands (ev): 0.6284 0.6284 5.6917 5.6917 26.4663 26.4663 26.5265 26.5265 27.0954 27.0954 27.0971 27.0971 k = 0.0000 0.0000 0.4371 ( 436 PWs) bands (ev): 0.7697 0.7697 5.4875 5.4875 26.5767 26.5767 26.6374 26.6374 27.1510 27.1510 27.1528 27.1528 k = 0.0000 0.0000 0.4450 ( 436 PWs) bands (ev): 0.9119 0.9119 5.2873 5.2873 26.6875 26.6875 26.7491 26.7491 27.2036 27.2036 27.2053 27.2053 k = 0.0000 0.0000 0.4530 ( 436 PWs) bands (ev): 1.0544 1.0544 5.0918 5.0918 26.7986 26.7986 26.8610 26.8610 27.2528 27.2528 27.2545 27.2545 k = 0.0000 0.0000 0.4609 ( 436 PWs) bands (ev): 1.1968 1.1968 4.9016 4.9016 26.9092 26.9092 26.9728 26.9728 27.2983 27.2983 27.3001 27.3001 k = 0.0000 0.0000 0.4689 ( 430 PWs) bands (ev): 1.3381 1.3381 4.7174 4.7174 27.0186 27.0186 27.0836 27.0836 27.3400 27.3400 27.3417 27.3417 k = 0.0000 0.0000 0.4768 ( 430 PWs) bands (ev): 1.4772 1.4772 4.5404 4.5404 27.1258 27.1258 27.1925 27.1925 27.3774 27.3774 27.3792 27.3792 k = 0.0000 0.0000 0.4848 ( 430 PWs) bands (ev): 1.6123 1.6123 4.3724 4.3724 27.2294 27.2294 27.2980 27.2980 27.4104 27.4104 27.4122 27.4122 k = 0.0000 0.0000 0.4927 ( 430 PWs) bands (ev): 1.7412 1.7412 4.2158 4.2158 27.3274 27.3274 27.3983 27.3983 27.4388 27.4388 27.4405 27.4405 k = 0.0000 0.0000 0.5007 ( 430 PWs) bands (ev): 1.8602 1.8602 4.0740 4.0740 27.4171 27.4171 27.4622 27.4622 27.4640 27.4640 27.4906 27.4906 k = 0.0000 0.0000 0.5086 ( 430 PWs) bands (ev): 1.9647 1.9647 3.9519 3.9519 27.4807 27.4807 27.4825 27.4825 27.4947 27.4947 27.5710 27.5710 k = 0.0000 0.0000 0.5166 ( 430 PWs) bands (ev): 2.0479 2.0479 3.8560 3.8560 27.4940 27.4940 27.4957 27.4957 27.5557 27.5557 27.6347 27.6347 k = 0.0000 0.0000 0.5245 ( 430 PWs) bands (ev): 2.1024 2.1024 3.7939 3.7939 27.5020 27.5020 27.5038 27.5038 27.5951 27.5951 27.6761 27.6761 k = 0.0000 0.0000 0.5324 ( 430 PWs) bands (ev): 2.1215 2.1215 3.7723 3.7723 27.5046 27.5046 27.5064 27.5064 27.6088 27.6088 27.6906 27.6906 k = 0.0000 0.0000 0.5324 ( 430 PWs) bands (ev): 2.1215 2.1215 3.7723 3.7723 27.5046 27.5046 27.5064 27.5064 27.6088 27.6088 27.6906 27.6906 k = 0.0069 0.0040 0.5324 ( 430 PWs) bands (ev): 2.1230 2.1230 3.7737 3.7737 27.3793 27.3793 27.4071 27.4071 27.7262 27.7262 27.7844 27.7844 k = 0.0139 0.0080 0.5324 ( 430 PWs) bands (ev): 2.1273 2.1273 3.7777 3.7777 27.2008 27.2008 27.2513 27.2513 27.8720 27.8720 27.9326 27.9326 k = 0.0208 0.0120 0.5324 ( 434 PWs) bands (ev): 2.1345 2.1345 3.7845 3.7845 27.0037 27.0037 27.0930 27.0930 28.0005 28.0005 28.0931 28.0931 k = 0.0278 0.0160 0.5324 ( 438 PWs) bands (ev): 2.1446 2.1446 3.7940 3.7940 26.7917 26.7917 26.9367 26.9367 28.1091 28.1091 28.2611 28.2611 k = 0.0347 0.0200 0.5324 ( 438 PWs) bands (ev): 2.1575 2.1575 3.8063 3.8063 26.5674 26.5674 26.7829 26.7829 28.1995 28.1995 28.4335 28.4335 k = 0.0417 0.0241 0.5324 ( 438 PWs) bands (ev): 2.1734 2.1734 3.8212 3.8212 26.3325 26.3325 26.6314 26.6314 28.2724 28.2724 28.3738 28.3738 k = 0.0486 0.0281 0.5324 ( 438 PWs) bands (ev): 2.1921 2.1921 3.8389 3.8389 26.0886 26.0886 26.4823 26.4823 28.1568 28.1568 28.3300 28.3300 k = 0.0556 0.0321 0.5324 ( 438 PWs) bands (ev): 2.2137 2.2137 3.8592 3.8592 25.8369 25.8369 26.3354 26.3354 27.9254 27.9254 28.3714 28.3714 k = 0.0625 0.0361 0.5324 ( 440 PWs) bands (ev): 2.2382 2.2382 3.8823 3.8823 25.5784 25.5784 26.1909 26.1909 27.6817 27.6817 28.3986 28.3986 k = 0.0694 0.0401 0.5324 ( 440 PWs) bands (ev): 2.2655 2.2655 3.9081 3.9081 25.3142 25.3142 26.0487 26.0487 27.4281 27.4281 28.4127 28.4127 k = 0.0764 0.0441 0.5324 ( 440 PWs) bands (ev): 2.2957 2.2957 3.9366 3.9366 25.0451 25.0451 25.9088 25.9088 27.1667 27.1667 28.4148 28.4148 k = 0.0833 0.0481 0.5324 ( 440 PWs) bands (ev): 2.3288 2.3288 3.9678 3.9678 24.7720 24.7720 25.7713 25.7713 26.8989 26.8989 28.4059 28.4059 k = 0.0903 0.0521 0.5324 ( 440 PWs) bands (ev): 2.3648 2.3648 4.0018 4.0018 24.4954 24.4954 25.6360 25.6360 26.6259 26.6259 28.3873 28.3873 k = 0.0972 0.0561 0.5324 ( 440 PWs) bands (ev): 2.4036 2.4036 4.0384 4.0384 24.2160 24.2160 25.5031 25.5031 26.3487 26.3487 28.3600 28.3600 k = 0.1042 0.0601 0.5324 ( 440 PWs) bands (ev): 2.4452 2.4452 4.0777 4.0777 23.9343 23.9343 25.3725 25.3725 26.0681 26.0681 28.2861 28.2861 k = 0.1111 0.0642 0.5324 ( 436 PWs) bands (ev): 2.4897 2.4897 4.1197 4.1197 23.6509 23.6509 25.2442 25.2442 25.7848 25.7848 28.1941 28.1941 k = 0.1181 0.0682 0.5324 ( 436 PWs) bands (ev): 2.5371 2.5371 4.1644 4.1644 23.3660 23.3660 25.1182 25.1182 25.4992 25.4992 28.1000 28.1000 k = 0.1250 0.0722 0.5324 ( 440 PWs) bands (ev): 2.5873 2.5873 4.2118 4.2118 23.0802 23.0802 24.9943 24.9943 25.2121 25.2121 28.0040 28.0040 k = 0.1319 0.0762 0.5324 ( 440 PWs) bands (ev): 2.6403 2.6403 4.2619 4.2619 22.7937 22.7937 24.8713 24.8713 24.9252 24.9252 27.9066 27.9066 k = 0.1389 0.0802 0.5324 ( 440 PWs) bands (ev): 2.6962 2.6962 4.3147 4.3147 22.5067 22.5067 24.6324 24.6324 24.7555 24.7555 27.8081 27.8081 k = 0.1458 0.0842 0.5324 ( 434 PWs) bands (ev): 2.7549 2.7549 4.3701 4.3701 22.2196 22.2196 24.3427 24.3427 24.6383 24.6383 27.7088 27.7088 k = 0.1528 0.0882 0.5324 ( 434 PWs) bands (ev): 2.8164 2.8164 4.4282 4.4282 21.9326 21.9326 24.0522 24.0522 24.5238 24.5238 27.6090 27.6090 k = 0.1597 0.0922 0.5324 ( 434 PWs) bands (ev): 2.8807 2.8807 4.4890 4.4890 21.6459 21.6459 23.7615 23.7615 24.4117 24.4117 27.5090 27.5090 k = 0.1667 0.0962 0.5324 ( 434 PWs) bands (ev): 2.9478 2.9478 4.5524 4.5524 21.3597 21.3597 23.4709 23.4709 24.3020 24.3020 27.4089 27.4089 k = 0.1736 0.1002 0.5324 ( 434 PWs) bands (ev): 3.0178 3.0178 4.6185 4.6185 21.0741 21.0741 23.1805 23.1805 24.1946 24.1946 27.3091 27.3091 k = 0.1806 0.1042 0.5324 ( 434 PWs) bands (ev): 3.0905 3.0905 4.6873 4.6873 20.7892 20.7892 22.8907 22.8907 24.0895 24.0895 27.2096 27.2096 k = 0.1875 0.1083 0.5324 ( 438 PWs) bands (ev): 3.1660 3.1660 4.7586 4.7586 20.5053 20.5053 22.6015 22.6015 23.9867 23.9867 27.1108 27.1108 k = 0.1944 0.1123 0.5324 ( 438 PWs) bands (ev): 3.2443 3.2443 4.8326 4.8326 20.2224 20.2224 22.3131 22.3131 23.8862 23.8862 27.0127 27.0127 k = 0.2014 0.1163 0.5324 ( 438 PWs) bands (ev): 3.3254 3.3254 4.9092 4.9092 19.9406 19.9406 22.0256 22.0256 23.7881 23.7881 26.9156 26.9156 k = 0.2083 0.1203 0.5324 ( 438 PWs) bands (ev): 3.4092 3.4092 4.9884 4.9884 19.6600 19.6600 21.7393 21.7393 23.6922 23.6922 26.8195 26.8195 k = 0.2153 0.1243 0.5324 ( 438 PWs) bands (ev): 3.4958 3.4958 5.0703 5.0703 19.3808 19.3808 21.4541 21.4541 23.5986 23.5986 26.7246 26.7246 k = 0.2222 0.1283 0.5324 ( 438 PWs) bands (ev): 3.5851 3.5851 5.1546 5.1546 19.1029 19.1029 21.1704 21.1704 23.5074 23.5074 26.6310 26.6310 k = 0.2292 0.1323 0.5324 ( 438 PWs) bands (ev): 3.6771 3.6771 5.2416 5.2416 18.8265 18.8265 20.8880 20.8880 23.4184 23.4184 26.5389 26.5389 k = 0.2361 0.1363 0.5324 ( 438 PWs) bands (ev): 3.7719 3.7719 5.3311 5.3311 18.5517 18.5517 20.6073 20.6073 23.3317 23.3317 26.4482 26.4482 k = 0.2431 0.1403 0.5324 ( 442 PWs) bands (ev): 3.8694 3.8694 5.4232 5.4232 18.2784 18.2784 20.3282 20.3282 23.2473 23.2473 26.3592 26.3592 k = 0.2500 0.1443 0.5324 ( 446 PWs) bands (ev): 3.9695 3.9695 5.5177 5.5177 18.0067 18.0067 20.0509 20.0509 23.1652 23.1652 26.2719 26.2719 k = 0.2569 0.1483 0.5324 ( 446 PWs) bands (ev): 4.0724 4.0724 5.6148 5.6148 17.7369 17.7369 19.7755 19.7755 23.0854 23.0854 26.1863 26.1863 k = 0.2639 0.1524 0.5324 ( 446 PWs) bands (ev): 4.1779 4.1779 5.7143 5.7143 17.4688 17.4688 19.5020 19.5020 23.0079 23.0079 26.1026 26.1026 k = 0.2708 0.1564 0.5324 ( 442 PWs) bands (ev): 4.2861 4.2861 5.8163 5.8163 17.2025 17.2025 19.2306 19.2306 22.9326 22.9326 26.0209 26.0209 k = 0.2778 0.1604 0.5324 ( 446 PWs) bands (ev): 4.3969 4.3969 5.9207 5.9207 16.9380 16.9380 18.9613 18.9613 22.8596 22.8596 25.9411 25.9411 k = 0.2847 0.1644 0.5324 ( 442 PWs) bands (ev): 4.5103 4.5103 6.0275 6.0275 16.6755 16.6755 18.6942 18.6942 22.7889 22.7889 25.8633 25.8633 k = 0.2917 0.1684 0.5324 ( 442 PWs) bands (ev): 4.6263 4.6263 6.1366 6.1366 16.4150 16.4150 18.4295 18.4295 22.7205 22.7205 25.7876 25.7876 k = 0.2986 0.1724 0.5324 ( 444 PWs) bands (ev): 4.7449 4.7449 6.2480 6.2480 16.1564 16.1564 18.1671 18.1671 22.6543 22.6543 25.7141 25.7141 k = 0.3056 0.1764 0.5324 ( 444 PWs) bands (ev): 4.8661 4.8661 6.3617 6.3617 15.8999 15.8999 17.9073 17.9073 22.5905 22.5905 25.6427 25.6427 k = 0.3125 0.1804 0.5324 ( 440 PWs) bands (ev): 4.9898 4.9898 6.4776 6.4776 15.6455 15.6455 17.6501 17.6501 22.5288 22.5288 25.5736 25.5736 k = 0.3194 0.1844 0.5324 ( 440 PWs) bands (ev): 5.1159 5.1159 6.5957 6.5957 15.3932 15.3932 17.3956 17.3956 22.4695 22.4695 25.5067 25.5067 k = 0.3264 0.1884 0.5324 ( 436 PWs) bands (ev): 5.2446 5.2446 6.7158 6.7158 15.1431 15.1431 17.1438 17.1438 22.4124 22.4124 25.4421 25.4421 k = 0.3333 0.1925 0.5324 ( 436 PWs) bands (ev): 5.3757 5.3757 6.8379 6.8379 14.8953 14.8953 16.8950 16.8950 22.3575 22.3575 25.3798 25.3798 k = 0.3403 0.1965 0.5324 ( 436 PWs) bands (ev): 5.5092 5.5092 6.9620 6.9620 14.6497 14.6497 16.6493 16.6493 22.3049 22.3049 25.3199 25.3199 k = 0.3472 0.2005 0.5324 ( 434 PWs) bands (ev): 5.6451 5.6451 7.0878 7.0878 14.4064 14.4064 16.4067 16.4067 22.2546 22.2546 25.2624 25.2624 k = 0.3542 0.2045 0.5324 ( 434 PWs) bands (ev): 5.7833 5.7833 7.2154 7.2154 14.1656 14.1656 16.1674 16.1674 22.2065 22.2065 25.2072 25.2072 k = 0.3611 0.2085 0.5324 ( 432 PWs) bands (ev): 5.9237 5.9237 7.3445 7.3445 13.9272 13.9272 15.9316 15.9316 22.1607 22.1607 25.1545 25.1545 k = 0.3681 0.2125 0.5324 ( 432 PWs) bands (ev): 6.0663 6.0663 7.4750 7.4750 13.6914 13.6914 15.6995 15.6995 22.1171 22.1171 25.1042 25.1042 k = 0.3750 0.2165 0.5324 ( 432 PWs) bands (ev): 6.2110 6.2110 7.6067 7.6067 13.4582 13.4582 15.4712 15.4712 22.0758 22.0758 25.0565 25.0565 k = 0.3819 0.2205 0.5324 ( 428 PWs) bands (ev): 6.3577 6.3577 7.7394 7.7394 13.2277 13.2277 15.2471 15.2471 22.0367 22.0367 25.0112 25.0112 k = 0.3889 0.2245 0.5324 ( 432 PWs) bands (ev): 6.5064 6.5064 7.8728 7.8728 13.0001 13.0001 15.0274 15.0274 21.9998 21.9998 24.9684 24.9684 k = 0.3958 0.2285 0.5324 ( 432 PWs) bands (ev): 6.6568 6.6568 8.0065 8.0065 12.7755 12.7755 14.8124 14.8124 21.9652 21.9652 24.9281 24.9281 k = 0.4028 0.2325 0.5324 ( 432 PWs) bands (ev): 6.8087 6.8087 8.1403 8.1403 12.5540 12.5540 14.6027 14.6027 21.9328 21.9328 24.8904 24.8904 k = 0.4097 0.2366 0.5324 ( 432 PWs) bands (ev): 6.9621 6.9621 8.2737 8.2737 12.3360 12.3360 14.3985 14.3985 21.9027 21.9027 24.8552 24.8552 k = 0.4167 0.2406 0.5324 ( 432 PWs) bands (ev): 7.1166 7.1166 8.4060 8.4060 12.1216 12.1216 14.2006 14.2006 21.8748 21.8748 24.8225 24.8225 k = 0.4236 0.2446 0.5324 ( 432 PWs) bands (ev): 7.2718 7.2718 8.5366 8.5366 11.9112 11.9112 14.0095 14.0095 21.8492 21.8492 24.7925 24.7925 k = 0.4306 0.2486 0.5324 ( 432 PWs) bands (ev): 7.4272 7.4272 8.6647 8.6647 11.7054 11.7054 13.8262 13.8262 21.8257 21.8257 24.7650 24.7650 k = 0.4375 0.2526 0.5324 ( 432 PWs) bands (ev): 7.5823 7.5823 8.7892 8.7892 11.5047 11.5047 13.6517 13.6517 21.8045 21.8045 24.7401 24.7401 k = 0.4444 0.2566 0.5324 ( 432 PWs) bands (ev): 7.7361 7.7361 8.9090 8.9090 11.3101 11.3101 13.4872 13.4872 21.7856 21.7856 24.7179 24.7179 k = 0.4514 0.2606 0.5324 ( 436 PWs) bands (ev): 7.8875 7.8875 9.0225 9.0225 11.1227 11.1227 13.3342 13.3342 21.7689 21.7689 24.6982 24.6982 k = 0.4583 0.2646 0.5324 ( 440 PWs) bands (ev): 8.0347 8.0347 9.1279 9.1279 10.9443 10.9443 13.1945 13.1945 21.7544 21.7544 24.6811 24.6811 k = 0.4653 0.2686 0.5324 ( 440 PWs) bands (ev): 8.1750 8.1750 9.2233 9.2233 10.7775 10.7775 13.0701 13.0701 21.7421 21.7421 24.6667 24.6667 k = 0.4722 0.2726 0.5324 ( 440 PWs) bands (ev): 8.3050 8.3050 9.3063 9.3063 10.6260 10.6260 12.9635 12.9635 21.7321 21.7321 24.6548 24.6549 k = 0.4792 0.2766 0.5324 ( 440 PWs) bands (ev): 8.4192 8.4192 9.3744 9.3744 10.4949 10.4949 12.8769 12.8769 21.7243 21.7243 24.6456 24.6456 k = 0.4861 0.2807 0.5324 ( 440 PWs) bands (ev): 8.5105 8.5105 9.4252 9.4252 10.3915 10.3915 12.8130 12.8130 21.7187 21.7187 24.6391 24.6391 k = 0.4931 0.2847 0.5324 ( 440 PWs) bands (ev): 8.5705 8.5705 9.4567 9.4567 10.3243 10.3243 12.7736 12.7736 21.7154 21.7154 24.6351 24.6351 k = 0.5000 0.2887 0.5324 ( 440 PWs) bands (ev): 8.5916 8.5916 9.4673 9.4673 10.3008 10.3008 12.7603 12.7603 21.7143 21.7143 24.6338 24.6338 k = 0.5000 0.2887 0.5324 ( 440 PWs) bands (ev): 8.5916 8.5916 9.4673 9.4673 10.3008 10.3008 12.7603 12.7603 21.7143 21.7143 24.6338 24.6338 k = 0.4960 0.2955 0.5324 ( 440 PWs) bands (ev): 8.5929 8.5929 9.4684 9.4684 10.3020 10.3020 12.7618 12.7618 21.6902 21.6902 24.6046 24.6046 k = 0.4921 0.3024 0.5324 ( 438 PWs) bands (ev): 8.5968 8.5968 9.4717 9.4717 10.3056 10.3056 12.7661 12.7661 21.6198 21.6198 24.5198 24.5198 k = 0.4881 0.3093 0.5324 ( 438 PWs) bands (ev): 8.6033 8.6033 9.4771 9.4771 10.3116 10.3116 12.7733 12.7733 21.5084 21.5084 24.3864 24.3864 k = 0.4841 0.3162 0.5324 ( 438 PWs) bands (ev): 8.6124 8.6124 9.4847 9.4847 10.3199 10.3199 12.7834 12.7834 21.3627 21.3627 24.2135 24.2135 k = 0.4802 0.3230 0.5324 ( 438 PWs) bands (ev): 8.6241 8.6241 9.4944 9.4944 10.3306 10.3306 12.7963 12.7963 21.1895 21.1895 24.0102 24.0102 k = 0.4762 0.3299 0.5324 ( 438 PWs) bands (ev): 8.6384 8.6384 9.5063 9.5063 10.3436 10.3436 12.8121 12.8121 20.9952 20.9952 23.7840 23.7840 k = 0.4722 0.3368 0.5324 ( 438 PWs) bands (ev): 8.6553 8.6553 9.5203 9.5203 10.3590 10.3590 12.8309 12.8309 20.7848 20.7848 23.5411 23.5411 k = 0.4683 0.3437 0.5324 ( 434 PWs) bands (ev): 8.6748 8.6748 9.5364 9.5364 10.3766 10.3766 12.8524 12.8524 20.5623 20.5623 23.2860 23.2860 k = 0.4643 0.3505 0.5324 ( 434 PWs) bands (ev): 8.6969 8.6969 9.5546 9.5546 10.3965 10.3965 12.8769 12.8769 20.3308 20.3308 23.0223 23.0223 k = 0.4603 0.3574 0.5324 ( 434 PWs) bands (ev): 8.7216 8.7216 9.5749 9.5749 10.4187 10.4187 12.9042 12.9042 20.0927 20.0927 22.7526 22.7526 k = 0.4563 0.3643 0.5324 ( 438 PWs) bands (ev): 8.7489 8.7489 9.5972 9.5972 10.4430 10.4430 12.9344 12.9344 19.8499 19.8499 22.4788 22.4788 k = 0.4524 0.3712 0.5324 ( 438 PWs) bands (ev): 8.7789 8.7789 9.6216 9.6216 10.4695 10.4695 12.9675 12.9675 19.6037 19.6037 22.2024 22.2024 k = 0.4484 0.3780 0.5324 ( 434 PWs) bands (ev): 8.8114 8.8114 9.6480 9.6480 10.4981 10.4981 13.0035 13.0035 19.3553 19.3553 21.9246 21.9246 k = 0.4444 0.3849 0.5324 ( 434 PWs) bands (ev): 8.8465 8.8465 9.6762 9.6762 10.5288 10.5288 13.0423 13.0423 19.1056 19.1056 21.6464 21.6464 k = 0.4405 0.3918 0.5324 ( 434 PWs) bands (ev): 8.8842 8.8842 9.7064 9.7064 10.5614 10.5614 13.0840 13.0840 18.8554 18.8554 21.3683 21.3683 k = 0.4365 0.3986 0.5324 ( 438 PWs) bands (ev): 8.9246 8.9246 9.7385 9.7385 10.5959 10.5959 13.1285 13.1285 18.6051 18.6051 21.0910 21.0910 k = 0.4325 0.4055 0.5324 ( 438 PWs) bands (ev): 8.9675 8.9675 9.7724 9.7724 10.6321 10.6321 13.1760 13.1760 18.3554 18.3554 20.8150 20.8150 k = 0.4286 0.4124 0.5324 ( 438 PWs) bands (ev): 9.0130 9.0130 9.8080 9.8080 10.6701 10.6701 13.2263 13.2263 18.1068 18.1068 20.5407 20.5407 k = 0.4246 0.4193 0.5324 ( 438 PWs) bands (ev): 9.0612 9.0612 9.8453 9.8453 10.7096 10.7096 13.2794 13.2794 17.8596 17.8596 20.2685 20.2685 k = 0.4206 0.4261 0.5324 ( 438 PWs) bands (ev): 9.1119 9.1119 9.8842 9.8842 10.7505 10.7505 13.3355 13.3355 17.6142 17.6142 19.9986 19.9986 k = 0.4167 0.4330 0.5324 ( 438 PWs) bands (ev): 9.1653 9.1653 9.9245 9.9245 10.7926 10.7926 13.3943 13.3943 17.3710 17.3710 19.7313 19.7313 k = 0.4127 0.4399 0.5324 ( 438 PWs) bands (ev): 9.2212 9.2212 9.9663 9.9663 10.8357 10.8357 13.4561 13.4561 17.1303 17.1303 19.4670 19.4670 k = 0.4087 0.4468 0.5324 ( 438 PWs) bands (ev): 9.2798 9.2798 10.0094 10.0094 10.8796 10.8796 13.5207 13.5207 16.8927 16.8927 19.2058 19.2058 k = 0.4048 0.4536 0.5324 ( 442 PWs) bands (ev): 9.3410 9.3410 10.0537 10.0537 10.9240 10.9240 13.5881 13.5881 16.6583 16.6583 18.9480 18.9480 k = 0.4008 0.4605 0.5324 ( 438 PWs) bands (ev): 9.4047 9.4047 10.0990 10.0990 10.9686 10.9686 13.6584 13.6584 16.4278 16.4278 18.6938 18.6938 k = 0.3968 0.4674 0.5324 ( 438 PWs) bands (ev): 9.4711 9.4711 10.1452 10.1452 11.0128 11.0128 13.7316 13.7316 16.2016 16.2016 18.4435 18.4435 k = 0.3929 0.4743 0.5324 ( 442 PWs) bands (ev): 9.5401 9.5401 10.1920 10.1920 11.0563 11.0563 13.8076 13.8076 15.9803 15.9803 18.1974 18.1974 k = 0.3889 0.4811 0.5324 ( 444 PWs) bands (ev): 9.6117 9.6117 10.2392 10.2392 11.0983 11.0983 13.8864 13.8864 15.7645 15.7645 17.9557 17.9557 k = 0.3849 0.4880 0.5324 ( 444 PWs) bands (ev): 9.6859 9.6859 10.2867 10.2867 11.1384 11.1384 13.9681 13.9681 15.5550 15.5550 17.7188 17.7188 k = 0.3810 0.4949 0.5324 ( 440 PWs) bands (ev): 9.7627 9.7627 10.3341 10.3341 11.1754 11.1754 14.0527 14.0527 15.3528 15.3528 17.4869 17.4869 k = 0.3770 0.5017 0.5324 ( 436 PWs) bands (ev): 9.8421 9.8421 10.3811 10.3811 11.2085 11.2085 14.1400 14.1400 15.1589 15.1589 17.2605 17.2605 k = 0.3730 0.5086 0.5324 ( 436 PWs) bands (ev): 9.9241 9.9241 10.4273 10.4273 11.2364 11.2364 14.2302 14.2302 14.9746 14.9746 17.0399 17.0399 k = 0.3690 0.5155 0.5324 ( 436 PWs) bands (ev): 10.0087 10.0087 10.4723 10.4723 11.2576 11.2576 14.3232 14.3232 14.8012 14.8012 16.8256 16.8256 k = 0.3651 0.5224 0.5324 ( 436 PWs) bands (ev): 10.0959 10.0959 10.5157 10.5157 11.2705 11.2705 14.4191 14.4191 14.6406 14.6406 16.6181 16.6181 k = 0.3611 0.5292 0.5324 ( 436 PWs) bands (ev): 10.1857 10.1857 10.5568 10.5568 11.2735 11.2735 14.4945 14.4945 14.5178 14.5178 16.4180 16.4180 k = 0.3571 0.5361 0.5324 ( 436 PWs) bands (ev): 10.2780 10.2780 10.5952 10.5952 11.2645 11.2645 14.3647 14.3647 14.6192 14.6192 16.2260 16.2260 k = 0.3532 0.5430 0.5324 ( 436 PWs) bands (ev): 10.3728 10.3728 10.6300 10.6300 11.2418 11.2418 14.2531 14.2531 14.7235 14.7235 16.0426 16.0426 k = 0.3492 0.5499 0.5324 ( 432 PWs) bands (ev): 10.4701 10.4701 10.6608 10.6608 11.2040 11.2040 14.1613 14.1613 14.8306 14.8306 15.8689 15.8689 k = 0.3452 0.5567 0.5324 ( 432 PWs) bands (ev): 10.5693 10.5693 10.6870 10.6870 11.1500 11.1500 14.0901 14.0901 14.9405 14.9405 15.7055 15.7055 k = 0.3413 0.5636 0.5324 ( 432 PWs) bands (ev): 10.6664 10.6664 10.7117 10.7117 11.0795 11.0795 14.0401 14.0401 15.0532 15.0532 15.5534 15.5534 k = 0.3373 0.5705 0.5324 ( 432 PWs) bands (ev): 10.7108 10.7108 10.7844 10.7844 10.9932 10.9932 14.0109 14.0109 15.1687 15.1687 15.4136 15.4136 k = 0.3333 0.5774 0.5324 ( 432 PWs) bands (ev): 10.7171 10.7171 10.8777 10.8777 10.9039 10.9039 14.0014 14.0014 15.2868 15.2868 15.2872 15.2872 k = 0.3333 0.5774 0.5324 ( 432 PWs) bands (ev): 10.7171 10.7171 10.8777 10.8777 10.9039 10.9039 14.0014 14.0014 15.2868 15.2868 15.2872 15.2872 k = 0.3293 0.5704 0.5324 ( 432 PWs) bands (ev): 10.7099 10.7099 10.7757 10.7757 11.0029 11.0029 14.0105 14.0105 15.1733 15.1733 15.4095 15.4095 k = 0.3253 0.5634 0.5324 ( 432 PWs) bands (ev): 10.6364 10.6364 10.7053 10.7053 11.1170 11.1170 14.0366 14.0366 15.0750 15.0750 15.5349 15.5349 k = 0.3213 0.5565 0.5324 ( 432 PWs) bands (ev): 10.4994 10.4994 10.6772 10.6772 11.2341 11.2341 14.0777 14.0777 14.9928 14.9928 15.6631 15.6631 k = 0.3173 0.5495 0.5324 ( 436 PWs) bands (ev): 10.3513 10.3513 10.6401 10.6401 11.3541 11.3541 14.1320 14.1320 14.9273 14.9273 15.7941 15.7941 k = 0.3133 0.5426 0.5324 ( 436 PWs) bands (ev): 10.1959 10.1959 10.5919 10.5919 11.4768 11.4768 14.1978 14.1978 14.8787 14.8787 15.9279 15.9279 k = 0.3092 0.5356 0.5324 ( 436 PWs) bands (ev): 10.0349 10.0349 10.5324 10.5324 11.6022 11.6022 14.2738 14.2738 14.8470 14.8470 16.0645 16.0645 k = 0.3052 0.5287 0.5324 ( 436 PWs) bands (ev): 9.8697 9.8697 10.4617 10.4617 11.7303 11.7303 14.3587 14.3587 14.8320 14.8320 16.2040 16.2040 k = 0.3012 0.5217 0.5324 ( 434 PWs) bands (ev): 9.7012 9.7012 10.3805 10.3805 11.8611 11.8611 14.4513 14.4513 14.8331 14.8331 16.3462 16.3462 k = 0.2972 0.5147 0.5324 ( 434 PWs) bands (ev): 9.5305 9.5305 10.2893 10.2893 11.9945 11.9945 14.5508 14.5508 14.8495 14.8495 16.4912 16.4912 k = 0.2932 0.5078 0.5324 ( 434 PWs) bands (ev): 9.3581 9.3581 10.1891 10.1891 12.1307 12.1307 14.6566 14.6566 14.8805 14.8805 16.6390 16.6390 k = 0.2892 0.5008 0.5324 ( 434 PWs) bands (ev): 9.1849 9.1849 10.0810 10.0810 12.2695 12.2695 14.7679 14.7679 14.9251 14.9251 16.7895 16.7895 k = 0.2851 0.4939 0.5324 ( 434 PWs) bands (ev): 9.0111 9.0111 9.9657 9.9657 12.4110 12.4110 14.8842 14.8842 14.9822 14.9822 16.9427 16.9427 k = 0.2811 0.4869 0.5324 ( 434 PWs) bands (ev): 8.8374 8.8374 9.8444 9.8444 12.5552 12.5552 15.0050 15.0050 15.0510 15.0510 17.0987 17.0987 k = 0.2771 0.4800 0.5324 ( 434 PWs) bands (ev): 8.6639 8.6639 9.7181 9.7181 12.7020 12.7020 15.1258 15.1258 15.1347 15.1347 17.2574 17.2574 k = 0.2731 0.4730 0.5324 ( 434 PWs) bands (ev): 8.4911 8.4911 9.5874 9.5874 12.8515 12.8515 15.2183 15.2183 15.2604 15.2604 17.4188 17.4188 k = 0.2691 0.4661 0.5324 ( 430 PWs) bands (ev): 8.3192 8.3192 9.4533 9.4533 13.0036 13.0036 15.3165 15.3165 15.3931 15.3931 17.5829 17.5829 k = 0.2651 0.4591 0.5324 ( 430 PWs) bands (ev): 8.1483 8.1483 9.3165 9.3165 13.1584 13.1584 15.4227 15.4227 15.5295 15.5295 17.7496 17.7496 k = 0.2610 0.4521 0.5324 ( 430 PWs) bands (ev): 7.9787 7.9787 9.1777 9.1777 13.3159 13.3159 15.5365 15.5365 15.6692 15.6692 17.9190 17.9190 k = 0.2570 0.4452 0.5324 ( 434 PWs) bands (ev): 7.8106 7.8106 9.0373 9.0373 13.4760 13.4760 15.6573 15.6573 15.8119 15.8119 18.0910 18.0910 k = 0.2530 0.4382 0.5324 ( 434 PWs) bands (ev): 7.6440 7.6440 8.8959 8.8959 13.6387 13.6387 15.7846 15.7846 15.9577 15.9577 18.2656 18.2656 k = 0.2490 0.4313 0.5324 ( 434 PWs) bands (ev): 7.4790 7.4790 8.7539 8.7539 13.8041 13.8041 15.9180 15.9180 16.1062 16.1062 18.4428 18.4428 k = 0.2450 0.4243 0.5324 ( 434 PWs) bands (ev): 7.3159 7.3159 8.6117 8.6117 13.9721 13.9721 16.0571 16.0571 16.2575 16.2575 18.6225 18.6225 k = 0.2410 0.4174 0.5324 ( 438 PWs) bands (ev): 7.1546 7.1546 8.4696 8.4696 14.1428 14.1428 16.2016 16.2016 16.4113 16.4113 18.8048 18.8048 k = 0.2369 0.4104 0.5324 ( 438 PWs) bands (ev): 6.9953 6.9953 8.3280 8.3280 14.3161 14.3161 16.3511 16.3511 16.5677 16.5677 18.9896 18.9896 k = 0.2329 0.4034 0.5324 ( 438 PWs) bands (ev): 6.8380 6.8380 8.1870 8.1870 14.4920 14.4920 16.5055 16.5055 16.7264 16.7264 19.1768 19.1768 k = 0.2289 0.3965 0.5324 ( 438 PWs) bands (ev): 6.6828 6.6828 8.0469 8.0469 14.6705 14.6705 16.6645 16.6645 16.8874 16.8874 19.3665 19.3665 k = 0.2249 0.3895 0.5324 ( 442 PWs) bands (ev): 6.5298 6.5298 7.9080 7.9080 14.8517 14.8517 16.8278 16.8278 17.0507 17.0507 19.5586 19.5586 k = 0.2209 0.3826 0.5324 ( 442 PWs) bands (ev): 6.3789 6.3789 7.7703 7.7703 15.0354 15.0354 16.9954 16.9954 17.2161 17.2161 19.7531 19.7531 k = 0.2169 0.3756 0.5324 ( 440 PWs) bands (ev): 6.2303 6.2303 7.6340 7.6340 15.2218 15.2218 17.1671 17.1671 17.3836 17.3836 19.9499 19.9499 k = 0.2129 0.3687 0.5324 ( 440 PWs) bands (ev): 6.0840 6.0840 7.4993 7.4993 15.4107 15.4107 17.3427 17.3427 17.5532 17.5532 20.1490 20.1490 k = 0.2088 0.3617 0.5324 ( 440 PWs) bands (ev): 5.9400 5.9400 7.3662 7.3662 15.6022 15.6022 17.5220 17.5220 17.7246 17.7246 20.3503 20.3503 k = 0.2048 0.3548 0.5324 ( 444 PWs) bands (ev): 5.7984 5.7984 7.2349 7.2349 15.7962 15.7962 17.7051 17.7051 17.8980 17.8980 20.5538 20.5538 k = 0.2008 0.3478 0.5324 ( 444 PWs) bands (ev): 5.6592 5.6592 7.1055 7.1055 15.9928 15.9928 17.8917 17.8917 18.0732 18.0732 20.7594 20.7594 k = 0.1968 0.3408 0.5324 ( 440 PWs) bands (ev): 5.5224 5.5224 6.9781 6.9781 16.1920 16.1920 18.0818 18.0818 18.2502 18.2502 20.9671 20.9671 k = 0.1928 0.3339 0.5324 ( 440 PWs) bands (ev): 5.3881 5.3881 6.8527 6.8527 16.3936 16.3936 18.2754 18.2754 18.4288 18.4288 21.1768 21.1768 k = 0.1888 0.3269 0.5324 ( 440 PWs) bands (ev): 5.2562 5.2562 6.7293 6.7293 16.5978 16.5978 18.4722 18.4722 18.6092 18.6092 21.3884 21.3884 k = 0.1847 0.3200 0.5324 ( 436 PWs) bands (ev): 5.1269 5.1269 6.6081 6.6081 16.8045 16.8045 18.6723 18.6723 18.7912 18.7912 21.6019 21.6019 k = 0.1807 0.3130 0.5324 ( 436 PWs) bands (ev): 5.0001 5.0001 6.4891 6.4891 17.0136 17.0136 18.8755 18.8755 18.9747 18.9747 21.8171 21.8171 k = 0.1767 0.3061 0.5324 ( 436 PWs) bands (ev): 4.8758 4.8758 6.3724 6.3724 17.2252 17.2252 19.0817 19.0817 19.1599 19.1599 22.0340 22.0340 k = 0.1727 0.2991 0.5324 ( 436 PWs) bands (ev): 4.7542 4.7542 6.2580 6.2580 17.4393 17.4393 19.2907 19.2907 19.3467 19.3467 22.2525 22.2525 k = 0.1687 0.2922 0.5324 ( 440 PWs) bands (ev): 4.6350 4.6350 6.1459 6.1459 17.6557 17.6557 19.5017 19.5017 19.5360 19.5360 22.4724 22.4724 k = 0.1647 0.2852 0.5324 ( 440 PWs) bands (ev): 4.5186 4.5186 6.0361 6.0361 17.8746 17.8746 19.7103 19.7103 19.7318 19.7318 22.6937 22.6937 k = 0.1606 0.2782 0.5324 ( 440 PWs) bands (ev): 4.4047 4.4047 5.9288 5.9288 18.0958 18.0958 19.9076 19.9076 19.9432 19.9432 22.9162 22.9162 k = 0.1566 0.2713 0.5324 ( 440 PWs) bands (ev): 4.2935 4.2935 5.8239 5.8239 18.3193 18.3193 20.1005 20.1005 20.1630 20.1630 23.1397 23.1397 k = 0.1526 0.2643 0.5324 ( 440 PWs) bands (ev): 4.1849 4.1849 5.7214 5.7214 18.5451 18.5451 20.2936 20.2936 20.3866 20.3866 23.3641 23.3641 k = 0.1486 0.2574 0.5324 ( 440 PWs) bands (ev): 4.0790 4.0790 5.6214 5.6214 18.7732 18.7732 20.4873 20.4873 20.6133 20.6133 23.5892 23.5892 k = 0.1446 0.2504 0.5324 ( 436 PWs) bands (ev): 3.9758 3.9758 5.5240 5.5240 19.0036 19.0036 20.6820 20.6820 20.8428 20.8428 23.8149 23.8149 k = 0.1406 0.2435 0.5324 ( 438 PWs) bands (ev): 3.8753 3.8753 5.4290 5.4290 19.2361 19.2361 20.8774 20.8774 21.0751 21.0751 24.0408 24.0408 k = 0.1365 0.2365 0.5324 ( 438 PWs) bands (ev): 3.7775 3.7775 5.3366 5.3366 19.4707 19.4707 21.0737 21.0737 21.3101 21.3101 24.2669 24.2669 k = 0.1325 0.2295 0.5324 ( 438 PWs) bands (ev): 3.6824 3.6824 5.2467 5.2467 19.7074 19.7074 21.2707 21.2707 21.5476 21.5476 24.4927 24.4927 k = 0.1285 0.2226 0.5324 ( 438 PWs) bands (ev): 3.5900 3.5900 5.1594 5.1594 19.9462 19.9462 21.4683 21.4683 21.7877 21.7877 24.7181 24.7181 k = 0.1245 0.2156 0.5324 ( 434 PWs) bands (ev): 3.5004 3.5004 5.0747 5.0747 20.1869 20.1869 21.6667 21.6667 22.0302 22.0302 24.9427 24.9427 k = 0.1205 0.2087 0.5324 ( 434 PWs) bands (ev): 3.4135 3.4135 4.9926 4.9926 20.4295 20.4295 21.8655 21.8655 22.2751 22.2751 25.1661 25.1661 k = 0.1165 0.2017 0.5324 ( 434 PWs) bands (ev): 3.3294 3.3294 4.9131 4.9131 20.6739 20.6739 22.0648 22.0648 22.5223 22.5223 25.3881 25.3881 k = 0.1124 0.1948 0.5324 ( 434 PWs) bands (ev): 3.2481 3.2481 4.8362 4.8362 20.9201 20.9201 22.2645 22.2645 22.7718 22.7718 25.6081 25.6081 k = 0.1084 0.1878 0.5324 ( 434 PWs) bands (ev): 3.1695 3.1695 4.7620 4.7620 21.1679 21.1679 22.4644 22.4644 23.0234 23.0234 25.8259 25.8259 k = 0.1044 0.1809 0.5324 ( 434 PWs) bands (ev): 3.0937 3.0937 4.6903 4.6903 21.4172 21.4172 22.6646 22.6646 23.2771 23.2771 26.0408 26.0408 k = 0.1004 0.1739 0.5324 ( 434 PWs) bands (ev): 3.0208 3.0208 4.6214 4.6214 21.6680 21.6680 22.8649 22.8649 23.5327 23.5327 26.2524 26.2524 k = 0.0964 0.1669 0.5324 ( 434 PWs) bands (ev): 2.9506 2.9506 4.5551 4.5551 21.9201 21.9201 23.0652 23.0652 23.7901 23.7901 26.4601 26.4601 k = 0.0924 0.1600 0.5324 ( 438 PWs) bands (ev): 2.8832 2.8832 4.4914 4.4914 22.1733 22.1733 23.2655 23.2655 24.0492 24.0492 26.6634 26.6634 k = 0.0884 0.1530 0.5324 ( 438 PWs) bands (ev): 2.8187 2.8187 4.4304 4.4304 22.4275 22.4275 23.4655 23.4655 24.3099 24.3099 26.8616 26.8616 k = 0.0843 0.1461 0.5324 ( 438 PWs) bands (ev): 2.7570 2.7570 4.3721 4.3721 22.6825 22.6825 23.6653 23.6653 24.5720 24.5720 27.0543 27.0543 k = 0.0803 0.1391 0.5324 ( 442 PWs) bands (ev): 2.6981 2.6981 4.3165 4.3165 22.9381 22.9381 23.8647 23.8647 24.8352 24.8352 27.2406 27.2406 k = 0.0763 0.1322 0.5324 ( 442 PWs) bands (ev): 2.6420 2.6420 4.2635 4.2635 23.1942 23.1942 24.0636 24.0636 25.0995 25.0995 27.4201 27.4201 k = 0.0723 0.1252 0.5324 ( 442 PWs) bands (ev): 2.5888 2.5888 4.2133 4.2133 23.4504 23.4504 24.2619 24.2619 25.3644 25.3644 27.5921 27.5921 k = 0.0683 0.1183 0.5324 ( 442 PWs) bands (ev): 2.5385 2.5385 4.1657 4.1657 23.7065 23.7065 24.4594 24.4594 25.6296 25.6296 27.7560 27.7560 k = 0.0643 0.1113 0.5324 ( 442 PWs) bands (ev): 2.4909 2.4909 4.1209 4.1209 23.9621 23.9621 24.6561 24.6561 25.8949 25.8949 27.9114 27.9114 k = 0.0602 0.1043 0.5324 ( 446 PWs) bands (ev): 2.4463 2.4463 4.0787 4.0787 24.2169 24.2169 24.8517 24.8517 26.1597 26.1597 28.0577 28.0577 k = 0.0562 0.0974 0.5324 ( 446 PWs) bands (ev): 2.4045 2.4045 4.0393 4.0393 24.4706 24.4706 25.0463 25.0463 26.4236 26.4236 28.1946 28.1946 k = 0.0522 0.0904 0.5324 ( 446 PWs) bands (ev): 2.3656 2.3656 4.0025 4.0025 24.7227 24.7227 25.2396 25.2396 26.6859 26.6859 28.3218 28.3218 k = 0.0482 0.0835 0.5324 ( 446 PWs) bands (ev): 2.3295 2.3295 3.9685 3.9685 24.9727 24.9727 25.4315 25.4315 26.9458 26.9458 28.4390 28.4390 k = 0.0442 0.0765 0.5324 ( 446 PWs) bands (ev): 2.2963 2.2963 3.9372 3.9372 25.2200 25.2200 25.6218 25.6218 27.2022 27.2022 28.5462 28.5462 k = 0.0402 0.0696 0.5324 ( 442 PWs) bands (ev): 2.2660 2.2660 3.9086 3.9086 25.4641 25.4641 25.8106 25.8106 27.4541 27.4541 28.6433 28.6434 k = 0.0361 0.0626 0.5324 ( 442 PWs) bands (ev): 2.2386 2.2386 3.8827 3.8827 25.7043 25.7043 25.9975 25.9975 27.6997 27.6997 28.6805 28.6805 k = 0.0321 0.0556 0.5324 ( 442 PWs) bands (ev): 2.2140 2.2140 3.8595 3.8595 25.9399 25.9399 26.1825 26.1825 27.9372 27.9372 28.5920 28.5920 k = 0.0281 0.0487 0.5324 ( 442 PWs) bands (ev): 2.1923 2.1923 3.8391 3.8391 26.1700 26.1700 26.3654 26.3654 28.1639 28.1639 28.4965 28.4965 k = 0.0241 0.0417 0.5324 ( 438 PWs) bands (ev): 2.1736 2.1736 3.8214 3.8214 26.3939 26.3939 26.5462 26.5462 28.3740 28.3740 28.3958 28.3958 k = 0.0201 0.0348 0.5324 ( 438 PWs) bands (ev): 2.1577 2.1577 3.8064 3.8064 26.6105 26.6105 26.7248 26.7248 28.2799 28.2799 28.3669 28.3669 k = 0.0161 0.0278 0.5324 ( 434 PWs) bands (ev): 2.1447 2.1447 3.7941 3.7941 26.8189 26.8189 26.9010 26.9010 28.1569 28.1569 28.2212 28.2212 k = 0.0120 0.0209 0.5324 ( 434 PWs) bands (ev): 2.1345 2.1345 3.7846 3.7846 27.0175 27.0175 27.0747 27.0747 28.0226 28.0226 28.0750 28.0750 k = 0.0080 0.0139 0.5324 ( 430 PWs) bands (ev): 2.1273 2.1273 3.7778 3.7778 27.2051 27.2051 27.2451 27.2451 27.8778 27.8778 27.9286 27.9286 k = 0.0040 0.0070 0.5324 ( 430 PWs) bands (ev): 2.1230 2.1230 3.7737 3.7737 27.3794 27.3794 27.4063 27.4063 27.7268 27.7268 27.7844 27.7844 k = 0.0000 0.0000 0.5324 ( 430 PWs) bands (ev): 2.1215 2.1215 3.7723 3.7723 27.5046 27.5046 27.5064 27.5064 27.6088 27.6088 27.6906 27.6906 k = 0.5000 0.2887 0.5324 ( 440 PWs) bands (ev): 8.5916 8.5916 9.4673 9.4673 10.3008 10.3008 12.7603 12.7603 21.7143 21.7143 24.6338 24.6338 k = 0.5000 0.2887 0.5245 ( 440 PWs) bands (ev): 8.5847 8.5847 9.4344 9.4344 10.3357 10.3357 12.7700 12.7700 21.7060 21.7060 24.6445 24.6445 k = 0.5000 0.2887 0.5166 ( 436 PWs) bands (ev): 8.5642 8.5642 9.3483 9.3483 10.4276 10.4276 12.7987 12.7987 21.6817 21.6817 24.6762 24.6762 k = 0.5000 0.2887 0.5086 ( 436 PWs) bands (ev): 8.5308 8.5308 9.2310 9.2310 10.5547 10.5547 12.8460 12.8460 21.6423 21.6423 24.7279 24.7279 k = 0.5000 0.2887 0.5007 ( 436 PWs) bands (ev): 8.4851 8.4851 9.0975 9.0975 10.7017 10.7017 12.9109 12.9109 21.5892 21.5892 24.7981 24.7981 k = 0.5000 0.2887 0.4927 ( 436 PWs) bands (ev): 8.4285 8.4285 8.9559 8.9559 10.8607 10.8607 12.9925 12.9925 21.5244 21.5244 24.8850 24.8850 k = 0.5000 0.2887 0.4848 ( 436 PWs) bands (ev): 8.3619 8.3619 8.8104 8.8104 11.0274 11.0274 13.0894 13.0894 21.4495 21.4495 24.9867 24.9867 k = 0.5000 0.2887 0.4768 ( 436 PWs) bands (ev): 8.2868 8.2868 8.6632 8.6632 11.1996 11.1996 13.2004 13.2004 21.3665 21.3665 25.0279 25.0279 k = 0.5000 0.2887 0.4689 ( 438 PWs) bands (ev): 8.2042 8.2042 8.5157 8.5157 11.3759 11.3759 13.3243 13.3243 21.2768 21.2768 24.9332 24.9332 k = 0.5000 0.2887 0.4609 ( 438 PWs) bands (ev): 8.1155 8.1155 8.3687 8.3687 11.5555 11.5555 13.4599 13.4599 21.1820 21.1820 24.8333 24.8333 k = 0.5000 0.2887 0.4530 ( 438 PWs) bands (ev): 8.0217 8.0217 8.2227 8.2227 11.7377 11.7377 13.6061 13.6061 21.0831 21.0831 24.7299 24.7299 k = 0.5000 0.2887 0.4450 ( 438 PWs) bands (ev): 7.9236 7.9236 8.0780 8.0780 11.9223 11.9223 13.7619 13.7619 20.9813 20.9813 24.6240 24.6240 k = 0.5000 0.2887 0.4371 ( 438 PWs) bands (ev): 7.8223 7.8223 7.9349 7.9349 12.1089 12.1089 13.9266 13.9266 20.8773 20.8773 24.5165 24.5165 k = 0.5000 0.2887 0.4291 ( 438 PWs) bands (ev): 7.7182 7.7182 7.7938 7.7938 12.2973 12.2973 14.0992 14.0992 20.7719 20.7719 24.4085 24.4085 k = 0.5000 0.2887 0.4212 ( 442 PWs) bands (ev): 7.6117 7.6117 7.6551 7.6551 12.4871 12.4871 14.2793 14.2793 20.6657 20.6657 24.3004 24.3004 k = 0.5000 0.2887 0.4132 ( 440 PWs) bands (ev): 7.5009 7.5009 7.5214 7.5214 12.6784 12.6784 14.4661 14.4661 20.5591 20.5591 24.1931 24.1931 k = 0.5000 0.2887 0.4053 ( 440 PWs) bands (ev): 7.3761 7.3761 7.4030 7.4030 12.8708 12.8708 14.6592 14.6592 20.4525 20.4525 24.0869 24.0869 k = 0.5000 0.2887 0.3973 ( 444 PWs) bands (ev): 7.2446 7.2446 7.2931 7.2931 13.0642 13.0642 14.8582 14.8582 20.3463 20.3463 23.9823 23.9824 k = 0.5000 0.2887 0.3894 ( 444 PWs) bands (ev): 7.1140 7.1140 7.1844 7.1844 13.2585 13.2585 15.0627 15.0627 20.2408 20.2408 23.8799 23.8799 k = 0.5000 0.2887 0.3815 ( 442 PWs) bands (ev): 6.9854 6.9854 7.0764 7.0764 13.4534 13.4534 15.2724 15.2724 20.1361 20.1361 23.7799 23.7799 k = 0.5000 0.2887 0.3735 ( 434 PWs) bands (ev): 6.8589 6.8589 6.9691 6.9691 13.6488 13.6488 15.4870 15.4870 20.0326 20.0326 23.6827 23.6827 k = 0.5000 0.2887 0.3656 ( 434 PWs) bands (ev): 6.7347 6.7347 6.8626 6.8626 13.8444 13.8444 15.7062 15.7062 19.9302 19.9302 23.5887 23.5887 k = 0.5000 0.2887 0.3576 ( 434 PWs) bands (ev): 6.6128 6.6128 6.7572 6.7572 14.0401 14.0401 15.9298 15.9298 19.8293 19.8293 23.4981 23.4981 k = 0.5000 0.2887 0.3497 ( 434 PWs) bands (ev): 6.4934 6.4934 6.6530 6.6530 14.2357 14.2357 16.1577 16.1577 19.7299 19.7299 23.4113 23.4113 k = 0.5000 0.2887 0.3417 ( 434 PWs) bands (ev): 6.3763 6.3763 6.5501 6.5501 14.4308 14.4308 16.3897 16.3897 19.6321 19.6321 23.3287 23.3287 k = 0.5000 0.2887 0.3338 ( 434 PWs) bands (ev): 6.2617 6.2617 6.4488 6.4488 14.6253 14.6253 16.6257 16.6257 19.5360 19.5360 23.2504 23.2504 k = 0.5000 0.2887 0.3258 ( 442 PWs) bands (ev): 6.1495 6.1495 6.3491 6.3491 14.8188 14.8188 16.8654 16.8654 19.4417 19.4417 23.1769 23.1769 k = 0.5000 0.2887 0.3179 ( 442 PWs) bands (ev): 6.0398 6.0398 6.2511 6.2511 15.0110 15.0110 17.1088 17.1088 19.3493 19.3493 23.1086 23.1086 k = 0.5000 0.2887 0.3099 ( 440 PWs) bands (ev): 5.9326 5.9326 6.1549 6.1549 15.2017 15.2017 17.3558 17.3558 19.2588 19.2588 23.0457 23.0457 k = 0.5000 0.2887 0.3020 ( 440 PWs) bands (ev): 5.8280 5.8280 6.0606 6.0606 15.3903 15.3903 17.6062 17.6062 19.1703 19.1703 22.9887 22.9887 k = 0.5000 0.2887 0.2940 ( 440 PWs) bands (ev): 5.7259 5.7259 5.9683 5.9683 15.5766 15.5766 17.8601 17.8601 19.0837 19.0837 22.9380 22.9380 k = 0.5000 0.2887 0.2861 ( 440 PWs) bands (ev): 5.6263 5.6263 5.8780 5.8780 15.7600 15.7600 18.1172 18.1172 18.9993 18.9993 22.8939 22.8939 k = 0.5000 0.2887 0.2781 ( 440 PWs) bands (ev): 5.5293 5.5293 5.7898 5.7898 15.9402 15.9402 18.3776 18.3776 18.9170 18.9170 22.8571 22.8571 k = 0.5000 0.2887 0.2702 ( 440 PWs) bands (ev): 5.4350 5.4350 5.7038 5.7038 16.1166 16.1166 18.6409 18.6409 18.8369 18.8369 22.8279 22.8279 k = 0.5000 0.2887 0.2623 ( 440 PWs) bands (ev): 5.3432 5.3432 5.6199 5.6199 16.2887 16.2887 18.7580 18.7580 18.9084 18.9084 22.8069 22.8069 k = 0.5000 0.2887 0.2543 ( 440 PWs) bands (ev): 5.2540 5.2540 5.5383 5.5383 16.4559 16.4559 18.6824 18.6824 19.1777 19.1777 22.7945 22.7945 k = 0.5000 0.2887 0.2464 ( 440 PWs) bands (ev): 5.1675 5.1675 5.4589 5.4589 16.6177 16.6177 18.6087 18.6087 19.4503 19.4503 22.7913 22.7913 k = 0.5000 0.2887 0.2384 ( 440 PWs) bands (ev): 5.0836 5.0836 5.3819 5.3819 16.7736 16.7736 18.5373 18.5373 19.7257 19.7257 22.7978 22.7978 k = 0.5000 0.2887 0.2305 ( 440 PWs) bands (ev): 5.0024 5.0024 5.3072 5.3072 16.9229 16.9229 18.4680 18.4680 20.0040 20.0040 22.8145 22.8145 k = 0.5000 0.2887 0.2225 ( 440 PWs) bands (ev): 4.9238 4.9238 5.2348 5.2348 17.0652 17.0652 18.4010 18.4010 20.2849 20.2849 22.8419 22.8419 k = 0.5000 0.2887 0.2146 ( 440 PWs) bands (ev): 4.8479 4.8479 5.1648 5.1648 17.1999 17.1999 18.3363 18.3363 20.5686 20.5686 22.8804 22.8804 k = 0.5000 0.2887 0.2066 ( 438 PWs) bands (ev): 4.7747 4.7747 5.0972 5.0972 17.3267 17.3267 18.2738 18.2738 20.8548 20.8548 22.9303 22.9303 k = 0.5000 0.2887 0.1987 ( 438 PWs) bands (ev): 4.7041 4.7041 5.0321 5.0321 17.4451 17.4451 18.2136 18.2136 21.1435 21.1435 22.9919 22.9919 k = 0.5000 0.2887 0.1907 ( 438 PWs) bands (ev): 4.6363 4.6363 4.9694 4.9694 17.5551 17.5551 18.1558 18.1558 21.4346 21.4346 23.0652 23.0652 k = 0.5000 0.2887 0.1828 ( 438 PWs) bands (ev): 4.5712 4.5712 4.9091 4.9091 17.6564 17.6564 18.1003 18.1003 21.7279 21.7279 23.1503 23.1503 k = 0.5000 0.2887 0.1748 ( 432 PWs) bands (ev): 4.5088 4.5088 4.8514 4.8514 17.7490 17.7490 18.0471 18.0471 22.0235 22.0235 23.2470 23.2470 k = 0.5000 0.2887 0.1669 ( 432 PWs) bands (ev): 4.4491 4.4491 4.7961 4.7961 17.8328 17.8328 17.9965 17.9965 22.3210 22.3210 23.3550 23.3550 k = 0.5000 0.2887 0.1589 ( 432 PWs) bands (ev): 4.3921 4.3921 4.7433 4.7433 17.9065 17.9065 17.9502 17.9502 22.6204 22.6204 23.4740 23.4740 k = 0.5000 0.2887 0.1510 ( 432 PWs) bands (ev): 4.3379 4.3379 4.6931 4.6931 17.8994 17.8994 17.9790 17.9790 22.9214 22.9214 23.6034 23.6034 k = 0.5000 0.2887 0.1430 ( 432 PWs) bands (ev): 4.2864 4.2864 4.6453 4.6453 17.8563 17.8563 18.0386 18.0386 23.2239 23.2239 23.7424 23.7424 k = 0.5000 0.2887 0.1351 ( 432 PWs) bands (ev): 4.2377 4.2377 4.6001 4.6001 17.8150 17.8150 18.0917 18.0917 23.5276 23.5276 23.8904 23.8904 k = 0.5000 0.2887 0.1272 ( 436 PWs) bands (ev): 4.1917 4.1917 4.5575 4.5575 17.7759 17.7759 18.1384 18.1384 23.8321 23.8321 24.0464 24.0464 k = 0.5000 0.2887 0.1192 ( 438 PWs) bands (ev): 4.1485 4.1485 4.5174 4.5174 17.7391 17.7391 18.1792 18.1792 24.1367 24.1367 24.2098 24.2098 k = 0.5000 0.2887 0.1113 ( 438 PWs) bands (ev): 4.1080 4.1080 4.4798 4.4798 17.7046 17.7046 18.2146 18.2146 24.3774 24.3774 24.4433 24.4433 k = 0.5000 0.2887 0.1033 ( 442 PWs) bands (ev): 4.0704 4.0704 4.4448 4.4448 17.6725 17.6725 18.2451 18.2451 24.5517 24.5517 24.7473 24.7473 k = 0.5000 0.2887 0.0954 ( 442 PWs) bands (ev): 4.0355 4.0355 4.4124 4.4124 17.6428 17.6428 18.2712 18.2712 24.7291 24.7291 25.0505 25.0505 k = 0.5000 0.2887 0.0874 ( 442 PWs) bands (ev): 4.0033 4.0033 4.3826 4.3826 17.6154 17.6154 18.2934 18.2934 24.9085 24.9085 25.3514 25.3514 k = 0.5000 0.2887 0.0795 ( 442 PWs) bands (ev): 3.9740 3.9740 4.3553 4.3553 17.5904 17.5904 18.3122 18.3122 25.0884 25.0884 25.6490 25.6490 k = 0.5000 0.2887 0.0715 ( 442 PWs) bands (ev): 3.9474 3.9474 4.3306 4.3306 17.5677 17.5677 18.3281 18.3281 25.2670 25.2670 25.9415 25.9415 k = 0.5000 0.2887 0.0636 ( 442 PWs) bands (ev): 3.9237 3.9237 4.3086 4.3086 17.5475 17.5475 18.3412 18.3412 25.4420 25.4420 26.2269 26.2269 k = 0.5000 0.2887 0.0556 ( 442 PWs) bands (ev): 3.9027 3.9027 4.2891 4.2891 17.5296 17.5296 18.3521 18.3521 25.6110 25.6110 26.5025 26.5025 k = 0.5000 0.2887 0.0477 ( 442 PWs) bands (ev): 3.8845 3.8845 4.2722 4.2722 17.5141 17.5141 18.3610 18.3610 25.7708 25.7708 26.7644 26.7644 k = 0.5000 0.2887 0.0397 ( 442 PWs) bands (ev): 3.8691 3.8691 4.2578 4.2578 17.5010 17.5010 18.3681 18.3681 25.9178 25.9178 27.0078 27.0078 k = 0.5000 0.2887 0.0318 ( 442 PWs) bands (ev): 3.8565 3.8565 4.2461 4.2461 17.4903 17.4903 18.3736 18.3736 26.0478 26.0478 27.2262 27.2262 k = 0.5000 0.2887 0.0238 ( 438 PWs) bands (ev): 3.8467 3.8467 4.2370 4.2370 17.4819 17.4819 18.3777 18.3777 26.1563 26.1563 27.4115 27.4115 k = 0.5000 0.2887 0.0159 ( 438 PWs) bands (ev): 3.8397 3.8397 4.2305 4.2305 17.4760 17.4760 18.3806 18.3806 26.2383 26.2383 27.5543 27.5543 k = 0.5000 0.2887 0.0079 ( 438 PWs) bands (ev): 3.8355 3.8355 4.2266 4.2266 17.4724 17.4724 18.3822 18.3822 26.2895 26.2895 27.6451 27.6451 k = 0.5000 0.2887-0.0000 ( 438 PWs) bands (ev): 3.8341 3.8341 4.2253 4.2253 17.4712 17.4712 18.3828 18.3828 26.3070 26.3070 27.6763 27.6763 k = 0.3333 0.5774-0.0000 ( 441 PWs) bands (ev): 6.0951 6.0951 6.6039 6.6039 6.6262 6.6262 27.5429 27.5429 28.2402 28.2402 29.9995 29.9997 k = 0.3333 0.5774 0.0079 ( 441 PWs) bands (ev): 6.0965 6.0965 6.6052 6.6052 6.6275 6.6275 27.4568 27.4568 28.3263 28.3263 29.9681 29.9683 k = 0.3333 0.5774 0.0159 ( 441 PWs) bands (ev): 6.1006 6.1006 6.6091 6.6091 6.6314 6.6314 27.2661 27.2661 28.5170 28.5170 29.8776 29.8779 k = 0.3333 0.5774 0.0238 ( 438 PWs) bands (ev): 6.1074 6.1074 6.6155 6.6155 6.6378 6.6378 27.0384 27.0384 28.7448 28.7448 29.7360 29.7366 k = 0.3333 0.5774 0.0318 ( 438 PWs) bands (ev): 6.1170 6.1170 6.6246 6.6246 6.6469 6.6469 26.7967 26.7967 28.9867 28.9867 29.5520 29.5523 k = 0.3333 0.5774 0.0397 ( 438 PWs) bands (ev): 6.1292 6.1292 6.6362 6.6362 6.6585 6.6585 26.5486 26.5486 29.2347 29.2347 29.3360 29.3363 k = 0.3333 0.5774 0.0477 ( 438 PWs) bands (ev): 6.1443 6.1443 6.6504 6.6504 6.6727 6.6727 26.2974 26.2974 29.0955 29.0955 29.0973 29.0973 k = 0.3333 0.5774 0.0556 ( 438 PWs) bands (ev): 6.1620 6.1620 6.6672 6.6672 6.6895 6.6895 26.0444 26.0444 28.8370 28.8370 28.8392 28.8392 k = 0.3333 0.5774 0.0636 ( 438 PWs) bands (ev): 6.1824 6.1824 6.6866 6.6866 6.7089 6.7089 25.7906 25.7906 28.5653 28.5653 28.5677 28.5677 k = 0.3333 0.5774 0.0715 ( 438 PWs) bands (ev): 6.2056 6.2056 6.7085 6.7085 6.7308 6.7308 25.5363 25.5363 28.2839 28.2839 28.2866 28.2866 k = 0.3333 0.5774 0.0795 ( 438 PWs) bands (ev): 6.2315 6.2315 6.7330 6.7330 6.7553 6.7553 25.2820 25.2820 27.9954 27.9954 27.9983 27.9983 k = 0.3333 0.5774 0.0874 ( 438 PWs) bands (ev): 6.2601 6.2601 6.7601 6.7601 6.7824 6.7824 25.0277 25.0277 27.7019 27.7019 27.7051 27.7051 k = 0.3333 0.5774 0.0954 ( 438 PWs) bands (ev): 6.2913 6.2913 6.7897 6.7897 6.8120 6.8120 24.7738 24.7738 27.4049 27.4049 27.4083 27.4083 k = 0.3333 0.5774 0.1033 ( 438 PWs) bands (ev): 6.3253 6.3253 6.8219 6.8219 6.8442 6.8442 24.5202 24.5202 27.1056 27.1056 27.1092 27.1092 k = 0.3333 0.5774 0.1113 ( 438 PWs) bands (ev): 6.3619 6.3619 6.8566 6.8566 6.8790 6.8790 24.2672 24.2672 26.8049 26.8049 26.8087 26.8087 k = 0.3333 0.5774 0.1192 ( 438 PWs) bands (ev): 6.4013 6.4013 6.8939 6.8939 6.9162 6.9162 24.0148 24.0148 26.5035 26.5035 26.5076 26.5076 k = 0.3333 0.5774 0.1272 ( 438 PWs) bands (ev): 6.4432 6.4432 6.9337 6.9337 6.9560 6.9560 23.7631 23.7631 26.2021 26.2021 26.2063 26.2063 k = 0.3333 0.5774 0.1351 ( 438 PWs) bands (ev): 6.4879 6.4879 6.9761 6.9761 6.9984 6.9984 23.5121 23.5121 25.9010 25.9010 25.9054 25.9054 k = 0.3333 0.5774 0.1430 ( 444 PWs) bands (ev): 6.5351 6.5351 7.0209 7.0209 7.0432 7.0432 23.2619 23.2619 25.6007 25.6007 25.6053 25.6053 k = 0.3333 0.5774 0.1510 ( 444 PWs) bands (ev): 6.5850 6.5850 7.0683 7.0683 7.0906 7.0906 23.0127 23.0127 25.3015 25.3015 25.3062 25.3062 k = 0.3333 0.5774 0.1589 ( 444 PWs) bands (ev): 6.6376 6.6376 7.1181 7.1181 7.1405 7.1405 22.7645 22.7645 25.0036 25.0036 25.0085 25.0085 k = 0.3333 0.5774 0.1669 ( 444 PWs) bands (ev): 6.6927 6.6927 7.1705 7.1705 7.1928 7.1928 22.5172 22.5172 24.7074 24.7074 24.7124 24.7124 k = 0.3333 0.5774 0.1748 ( 438 PWs) bands (ev): 6.7504 6.7504 7.2253 7.2253 7.2477 7.2477 22.2711 22.2711 24.4129 24.4129 24.4180 24.4180 k = 0.3333 0.5774 0.1828 ( 438 PWs) bands (ev): 6.8107 6.8107 7.2826 7.2826 7.3050 7.3050 22.0260 22.0260 24.1203 24.1203 24.1256 24.1256 k = 0.3333 0.5774 0.1907 ( 438 PWs) bands (ev): 6.8735 6.8735 7.3423 7.3423 7.3647 7.3647 21.7822 21.7822 23.8298 23.8298 23.8352 23.8352 k = 0.3333 0.5774 0.1987 ( 438 PWs) bands (ev): 6.9389 6.9389 7.4045 7.4045 7.4269 7.4269 21.5396 21.5396 23.5415 23.5415 23.5470 23.5470 k = 0.3333 0.5774 0.2066 ( 444 PWs) bands (ev): 7.0068 7.0068 7.4690 7.4690 7.4914 7.4914 21.2982 21.2982 23.2556 23.2556 23.2611 23.2611 k = 0.3333 0.5774 0.2146 ( 444 PWs) bands (ev): 7.0772 7.0772 7.5360 7.5360 7.5584 7.5584 21.0582 21.0582 22.9720 22.9720 22.9777 22.9777 k = 0.3333 0.5774 0.2225 ( 447 PWs) bands (ev): 7.1501 7.1501 7.6053 7.6053 7.6277 7.6277 20.8196 20.8196 22.6910 22.6910 22.6967 22.6967 k = 0.3333 0.5774 0.2305 ( 447 PWs) bands (ev): 7.2254 7.2254 7.6769 7.6769 7.6994 7.6994 20.5825 20.5825 22.4126 22.4126 22.4184 22.4184 k = 0.3333 0.5774 0.2384 ( 447 PWs) bands (ev): 7.3032 7.3032 7.7509 7.7509 7.7734 7.7734 20.3468 20.3468 22.1369 22.1369 22.1428 22.1428 k = 0.3333 0.5774 0.2464 ( 447 PWs) bands (ev): 7.3833 7.3833 7.8272 7.8272 7.8497 7.8497 20.1127 20.1127 21.8640 21.8640 21.8699 21.8699 k = 0.3333 0.5774 0.2543 ( 447 PWs) bands (ev): 7.4658 7.4658 7.9057 7.9057 7.9282 7.9282 19.8802 19.8802 21.5939 21.5939 21.5999 21.5999 k = 0.3333 0.5774 0.2623 ( 447 PWs) bands (ev): 7.5506 7.5506 7.9864 7.9864 8.0090 8.0090 19.6493 19.6493 21.3268 21.3268 21.3328 21.3328 k = 0.3333 0.5774 0.2702 ( 447 PWs) bands (ev): 7.6378 7.6378 8.0693 8.0693 8.0919 8.0919 19.4202 19.4202 21.0626 21.0626 21.0686 21.0686 k = 0.3333 0.5774 0.2781 ( 447 PWs) bands (ev): 7.7271 7.7271 8.1543 8.1543 8.1769 8.1769 19.1928 19.1928 20.8015 20.8015 20.8076 20.8076 k = 0.3333 0.5774 0.2861 ( 447 PWs) bands (ev): 7.8187 7.8187 8.2414 8.2414 8.2641 8.2641 18.9673 18.9673 20.5436 20.5436 20.5497 20.5497 k = 0.3333 0.5774 0.2940 ( 447 PWs) bands (ev): 7.9125 7.9125 8.3305 8.3305 8.3532 8.3532 18.7438 18.7438 20.2889 20.2889 20.2950 20.2950 k = 0.3333 0.5774 0.3020 ( 447 PWs) bands (ev): 8.0083 8.0083 8.4215 8.4215 8.4444 8.4444 18.5222 18.5222 20.0376 20.0376 20.0437 20.0437 k = 0.3333 0.5774 0.3099 ( 447 PWs) bands (ev): 8.1062 8.1062 8.5145 8.5145 8.5374 8.5374 18.3026 18.3026 19.7897 19.7897 19.7957 19.7957 k = 0.3333 0.5774 0.3179 ( 447 PWs) bands (ev): 8.2061 8.2061 8.6092 8.6092 8.6322 8.6322 18.0852 18.0852 19.5452 19.5452 19.5513 19.5513 k = 0.3333 0.5774 0.3258 ( 447 PWs) bands (ev): 8.3079 8.3079 8.7057 8.7057 8.7288 8.7288 17.8701 17.8701 19.3044 19.3044 19.3104 19.3104 k = 0.3333 0.5774 0.3338 ( 450 PWs) bands (ev): 8.4115 8.4115 8.8038 8.8038 8.8269 8.8269 17.6573 17.6573 19.0674 19.0674 19.0733 19.0733 k = 0.3333 0.5774 0.3417 ( 450 PWs) bands (ev): 8.5168 8.5168 8.9034 8.9034 8.9266 8.9266 17.4469 17.4469 18.8342 18.8342 18.8400 18.8400 k = 0.3333 0.5774 0.3497 ( 450 PWs) bands (ev): 8.6238 8.6238 9.0044 9.0044 9.0277 9.0277 17.2390 17.2390 18.6050 18.6050 18.6107 18.6107 k = 0.3333 0.5774 0.3576 ( 450 PWs) bands (ev): 8.7323 8.7323 9.1066 9.1066 9.1300 9.1300 17.0339 17.0339 18.3799 18.3799 18.3856 18.3856 k = 0.3333 0.5774 0.3656 ( 450 PWs) bands (ev): 8.8421 8.8421 9.2099 9.2099 9.2334 9.2334 16.8316 16.8316 18.1592 18.1592 18.1648 18.1648 k = 0.3333 0.5774 0.3735 ( 450 PWs) bands (ev): 8.9532 8.9532 9.3140 9.3140 9.3377 9.3377 16.6323 16.6323 17.9430 17.9430 17.9485 17.9485 k = 0.3333 0.5774 0.3815 ( 444 PWs) bands (ev): 9.0654 9.0654 9.4189 9.4189 9.4427 9.4427 16.4361 16.4361 17.7316 17.7316 17.7369 17.7369 k = 0.3333 0.5774 0.3894 ( 444 PWs) bands (ev): 9.1784 9.1784 9.5241 9.5241 9.5481 9.5481 16.2434 16.2434 17.5252 17.5252 17.5304 17.5304 k = 0.3333 0.5774 0.3973 ( 444 PWs) bands (ev): 9.2920 9.2920 9.6295 9.6295 9.6536 9.6536 16.0543 16.0543 17.3242 17.3242 17.3291 17.3291 k = 0.3333 0.5774 0.4053 ( 444 PWs) bands (ev): 9.4059 9.4059 9.7347 9.7347 9.7590 9.7590 15.8691 15.8691 17.1287 17.1287 17.1334 17.1334 k = 0.3333 0.5774 0.4132 ( 438 PWs) bands (ev): 9.5198 9.5198 9.8393 9.8393 9.8638 9.8638 15.6882 15.6882 16.9393 16.9393 16.9438 16.9438 k = 0.3333 0.5774 0.4212 ( 438 PWs) bands (ev): 9.6333 9.6333 9.9429 9.9429 9.9677 9.9677 15.5120 15.5120 16.7563 16.7563 16.7605 16.7605 k = 0.3333 0.5774 0.4291 ( 438 PWs) bands (ev): 9.7460 9.7460 10.0451 10.0451 10.0700 10.0700 15.3409 15.3409 16.5802 16.5803 16.5842 16.5842 k = 0.3333 0.5774 0.4371 ( 438 PWs) bands (ev): 9.8574 9.8574 10.1452 10.1452 10.1703 10.1703 15.1754 15.1754 16.4117 16.4117 16.4154 16.4154 k = 0.3333 0.5774 0.4450 ( 438 PWs) bands (ev): 9.9667 9.9667 10.2426 10.2426 10.2680 10.2680 15.0162 15.0162 16.2514 16.2514 16.2548 16.2548 k = 0.3333 0.5774 0.4530 ( 438 PWs) bands (ev): 10.0732 10.0732 10.3366 10.3366 10.3622 10.3622 14.8641 14.8641 16.0999 16.0999 16.1030 16.1030 k = 0.3333 0.5774 0.4609 ( 432 PWs) bands (ev): 10.1761 10.1761 10.4265 10.4265 10.4522 10.4522 14.7199 14.7199 15.9582 15.9582 15.9609 15.9609 k = 0.3333 0.5774 0.4689 ( 429 PWs) bands (ev): 10.2742 10.2742 10.5111 10.5111 10.5371 10.5371 14.5848 14.5848 15.8271 15.8271 15.8295 15.8295 k = 0.3333 0.5774 0.4768 ( 429 PWs) bands (ev): 10.3664 10.3664 10.5896 10.5896 10.6158 10.6158 14.4599 14.4599 15.7077 15.7077 15.7097 15.7097 k = 0.3333 0.5774 0.4848 ( 432 PWs) bands (ev): 10.4513 10.4513 10.6609 10.6609 10.6872 10.6872 14.3466 14.3466 15.6010 15.6010 15.6026 15.6026 k = 0.3333 0.5774 0.4927 ( 432 PWs) bands (ev): 10.5272 10.5272 10.7239 10.7239 10.7502 10.7502 14.2466 14.2466 15.5081 15.5081 15.5094 15.5094 k = 0.3333 0.5774 0.5007 ( 432 PWs) bands (ev): 10.5925 10.5925 10.7774 10.7774 10.8038 10.8038 14.1614 14.1614 15.4302 15.4302 15.4311 15.4311 k = 0.3333 0.5774 0.5086 ( 432 PWs) bands (ev): 10.6456 10.6456 10.8204 10.8204 10.8467 10.8467 14.0929 14.0929 15.3683 15.3683 15.3690 15.3690 k = 0.3333 0.5774 0.5166 ( 432 PWs) bands (ev): 10.6848 10.6848 10.8519 10.8519 10.8782 10.8782 14.0426 14.0426 15.3233 15.3233 15.3238 15.3238 k = 0.3333 0.5774 0.5245 ( 432 PWs) bands (ev): 10.7089 10.7089 10.8712 10.8712 10.8974 10.8974 14.0118 14.0118 15.2960 15.2960 15.2964 15.2964 k = 0.3333 0.5774 0.5324 ( 432 PWs) bands (ev): 10.7171 10.7171 10.8777 10.8777 10.9039 10.9039 14.0014 14.0014 15.2868 15.2868 15.2872 15.2872 Writing output data file Si.save init_run : 0.06s CPU 0.18s WALL ( 1 calls) electrons : 22.46s CPU 23.37s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.00s CPU 0.02s WALL ( 1 calls) Called by electrons: c_bands : 22.45s CPU 23.36s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.01s CPU 0.01s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.01s WALL ( 604 calls) cegterg : 20.20s CPU 20.85s WALL ( 624 calls) Called by sum_band: Called by *egterg: h_psi : 7.76s CPU 8.24s WALL ( 9138 calls) s_psi : 0.32s CPU 0.32s WALL ( 9138 calls) g_psi : 0.03s CPU 0.02s WALL ( 7910 calls) cdiaghg : 11.36s CPU 11.50s WALL ( 8514 calls) cegterg:over : 0.60s CPU 0.66s WALL ( 7910 calls) cegterg:upda : 0.52s CPU 0.48s WALL ( 7910 calls) cegterg:last : 0.22s CPU 0.26s WALL ( 1853 calls) cdiaghg:chol : 0.78s CPU 0.73s WALL ( 8514 calls) cdiaghg:inve : 0.20s CPU 0.18s WALL ( 8514 calls) cdiaghg:para : 0.94s CPU 0.94s WALL ( 17028 calls) Called by h_psi: h_psi:vloc : 6.95s CPU 7.41s WALL ( 9138 calls) h_psi:vnl : 0.77s CPU 0.80s WALL ( 9138 calls) add_vuspsi : 0.38s CPU 0.39s WALL ( 9138 calls) General routines calbec : 0.36s CPU 0.39s WALL ( 9138 calls) fft : 0.00s CPU 0.00s WALL ( 15 calls) fftw : 6.57s CPU 7.04s WALL ( 274540 calls) davcio : 0.10s CPU 0.09s WALL ( 1208 calls) Parallel routines fft_scatter : 4.20s CPU 4.47s WALL ( 274555 calls) PWSCF : 27.74s CPU 46.83s WALL This run was terminated on: 21:15:47 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=