Program PWSCF v.5.4.0 starts on 20Mar2017 at 23:33:29 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 & OpenMP), running on 144 processor cores Number of MPI processes: 72 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 72 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: ./CoBW.save/ file B.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 27 23 6 1397 1103 166 Max 28 24 7 1405 1118 175 Sum 1955 1683 479 100891 79845 12309 bravais-lattice index = 14 lattice parameter (alat) = 6.0528 a.u. unit-cell volume = 826.0298 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 136.00 number of Kohn-Sham states= 164 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 374.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.052792 celldm(2)= 1.793631 celldm(3)= 2.076803 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.793631 0.000000 ) a(3) = ( 0.000000 0.000000 2.076803 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.557528 -0.000000 ) b(3) = ( 0.000000 0.000000 0.481509 ) PseudoPot. # 1 for W read from file: /users/gautes/Pseudo/W.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 434a31466ac5fb6822520d5f43d3a35f Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1273 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Co read from file: /users/gautes/Pseudo/Co.rel-pbe-oncvpsp.UPF MD5 check sum: 638ceb3e57836b9ea4bada7149e48805 Pseudo is Norm-conserving, Zval = 17.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1388 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 PseudoPot. # 3 for B read from file: /users/gautes/Pseudo/B.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e6935728e521ae6844adca162131706c Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1059 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential W 14.00 183.84000 W( 1.00) Co 17.00 58.93320 Co( 1.00) B 3.00 10.81100 B( 1.00) 8 Sym. Ops., with inversion, found ( 6 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.8968155 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.0384015 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.8968155 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.0384015 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 inversion cryst. s( 5) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 6) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 6) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.8968155 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.0384015 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.8968155 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.0384015 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) double point group D_2h (mmm) there are 10 classes and 2 irreducible representations the character table: E -E C2 C2' C2'' i -i s_v s_v' s_v'' -C2 -C2' -C2'' -s_v -s_v' -s_v' G_5+ 2.00 -2.00 0.00 0.00 0.00 2.00 -2.00 0.00 0.00 0.00 G_5- 2.00 -2.00 0.00 0.00 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 C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] C2' -C2' 3 -3 180 deg rotation - cart. axis [0,1,0] C2'' -C2'' 4 -4 180 deg rotation - cart. axis [1,0,0] i 5 inversion -i -5 inversion E s_v -s_v 6 -6 inv. 180 deg rotation - cart. axis [0,0,1] s_v'-s_v' 7 -7 inv. 180 deg rotation - cart. axis [0,1,0] s_v''-s_v' 8 -8 inv. 180 deg rotation - cart. axis [1,0,0] Cartesian axes number of k points= 420 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 2) = ( 0.0100000 -0.0000000 -0.0000000), wk = 0.0023810 k( 3) = ( 0.0200000 -0.0000000 -0.0000000), wk = 0.0023810 k( 4) = ( 0.0300000 -0.0000000 -0.0000000), wk = 0.0023810 k( 5) = ( 0.0400000 -0.0000000 -0.0000000), wk = 0.0023810 k( 6) = ( 0.0500000 -0.0000000 -0.0000000), wk = 0.0023810 k( 7) = ( 0.0600000 -0.0000000 -0.0000000), wk = 0.0023810 k( 8) = ( 0.0700000 -0.0000000 -0.0000000), wk = 0.0023810 k( 9) = ( 0.0800000 -0.0000000 -0.0000000), wk = 0.0023810 k( 10) = ( 0.0900000 -0.0000000 -0.0000000), wk = 0.0023810 k( 11) = ( 0.1000000 -0.0000000 -0.0000000), wk = 0.0023810 k( 12) = ( 0.1100000 -0.0000000 -0.0000000), wk = 0.0023810 k( 13) = ( 0.1200000 -0.0000000 -0.0000000), wk = 0.0023810 k( 14) = ( 0.1300000 -0.0000000 -0.0000000), wk = 0.0023810 k( 15) = ( 0.1400000 -0.0000000 -0.0000000), wk = 0.0023810 k( 16) = ( 0.1500000 -0.0000000 -0.0000000), wk = 0.0023810 k( 17) = ( 0.1600000 -0.0000000 -0.0000000), wk = 0.0023810 k( 18) = ( 0.1700000 -0.0000000 -0.0000000), wk = 0.0023810 k( 19) = ( 0.1800000 -0.0000000 -0.0000000), wk = 0.0023810 k( 20) = ( 0.1900000 -0.0000000 -0.0000000), wk = 0.0023810 k( 21) = ( 0.2000000 -0.0000000 -0.0000000), wk = 0.0023810 k( 22) = ( 0.2100000 -0.0000000 -0.0000000), wk = 0.0023810 k( 23) = ( 0.2200000 -0.0000000 -0.0000000), wk = 0.0023810 k( 24) = ( 0.2300000 -0.0000000 -0.0000000), wk = 0.0023810 k( 25) = ( 0.2400000 -0.0000000 -0.0000000), wk = 0.0023810 k( 26) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0023810 k( 27) = ( 0.2600000 -0.0000000 -0.0000000), wk = 0.0023810 k( 28) = ( 0.2700000 -0.0000000 -0.0000000), wk = 0.0023810 k( 29) = ( 0.2800000 -0.0000000 -0.0000000), wk = 0.0023810 k( 30) = ( 0.2900000 -0.0000000 -0.0000000), wk = 0.0023810 k( 31) = ( 0.3000000 -0.0000000 -0.0000000), wk = 0.0023810 k( 32) = ( 0.3100000 -0.0000000 -0.0000000), wk = 0.0023810 k( 33) = ( 0.3200000 -0.0000000 -0.0000000), wk = 0.0023810 k( 34) = ( 0.3300000 -0.0000000 -0.0000000), wk = 0.0023810 k( 35) = ( 0.3400000 -0.0000000 -0.0000000), wk = 0.0023810 k( 36) = ( 0.3500000 -0.0000000 -0.0000000), wk = 0.0023810 k( 37) = ( 0.3600000 -0.0000000 -0.0000000), wk = 0.0023810 k( 38) = ( 0.3700000 -0.0000000 -0.0000000), wk = 0.0023810 k( 39) = ( 0.3800000 -0.0000000 -0.0000000), wk = 0.0023810 k( 40) = ( 0.3900000 -0.0000000 -0.0000000), wk = 0.0023810 k( 41) = ( 0.4000000 -0.0000000 -0.0000000), wk = 0.0023810 k( 42) = ( 0.4100000 -0.0000000 -0.0000000), wk = 0.0023810 k( 43) = ( 0.4200000 -0.0000000 -0.0000000), wk = 0.0023810 k( 44) = ( 0.4300000 -0.0000000 -0.0000000), wk = 0.0023810 k( 45) = ( 0.4400000 -0.0000000 -0.0000000), wk = 0.0023810 k( 46) = ( 0.4500000 -0.0000000 -0.0000000), wk = 0.0023810 k( 47) = ( 0.4600000 -0.0000000 -0.0000000), wk = 0.0023810 k( 48) = ( 0.4700000 -0.0000000 -0.0000000), wk = 0.0023810 k( 49) = ( 0.4800000 -0.0000000 -0.0000000), wk = 0.0023810 k( 50) = ( 0.4900000 -0.0000000 -0.0000000), wk = 0.0023810 k( 51) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023810 k( 52) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023810 k( 53) = ( 0.5000000 0.0099559 -0.0000000), wk = 0.0023810 k( 54) = ( 0.5000000 0.0199117 -0.0000000), wk = 0.0023810 k( 55) = ( 0.5000000 0.0298676 -0.0000000), wk = 0.0023810 k( 56) = ( 0.5000000 0.0398234 -0.0000000), wk = 0.0023810 k( 57) = ( 0.5000000 0.0497793 -0.0000000), wk = 0.0023810 k( 58) = ( 0.5000000 0.0597352 -0.0000000), wk = 0.0023810 k( 59) = ( 0.5000000 0.0696910 -0.0000000), wk = 0.0023810 k( 60) = ( 0.5000000 0.0796469 -0.0000000), wk = 0.0023810 k( 61) = ( 0.5000000 0.0896028 -0.0000000), wk = 0.0023810 k( 62) = ( 0.5000000 0.0995586 -0.0000000), wk = 0.0023810 k( 63) = ( 0.5000000 0.1095145 -0.0000000), wk = 0.0023810 k( 64) = ( 0.5000000 0.1194703 -0.0000000), wk = 0.0023810 k( 65) = ( 0.5000000 0.1294262 -0.0000000), wk = 0.0023810 k( 66) = ( 0.5000000 0.1393821 -0.0000000), wk = 0.0023810 k( 67) = ( 0.5000000 0.1493379 -0.0000000), wk = 0.0023810 k( 68) = ( 0.5000000 0.1592938 -0.0000000), wk = 0.0023810 k( 69) = ( 0.5000000 0.1692497 -0.0000000), wk = 0.0023810 k( 70) = ( 0.5000000 0.1792055 -0.0000000), wk = 0.0023810 k( 71) = ( 0.5000000 0.1891614 -0.0000000), wk = 0.0023810 k( 72) = ( 0.5000000 0.1991172 -0.0000000), wk = 0.0023810 k( 73) = ( 0.5000000 0.2090731 -0.0000000), wk = 0.0023810 k( 74) = ( 0.5000000 0.2190290 -0.0000000), wk = 0.0023810 k( 75) = ( 0.5000000 0.2289848 -0.0000000), wk = 0.0023810 k( 76) = ( 0.5000000 0.2389407 -0.0000000), wk = 0.0023810 k( 77) = ( 0.5000000 0.2488966 -0.0000000), wk = 0.0023810 k( 78) = ( 0.5000000 0.2588524 -0.0000000), wk = 0.0023810 k( 79) = ( 0.5000000 0.2688083 -0.0000000), wk = 0.0023810 k( 80) = ( 0.5000000 0.2787641 -0.0000000), wk = 0.0023810 k( 81) = ( 0.5000000 0.2787641 -0.0000000), wk = 0.0023810 k( 82) = ( 0.4900000 0.2787641 -0.0000000), wk = 0.0023810 k( 83) = ( 0.4800000 0.2787641 -0.0000000), wk = 0.0023810 k( 84) = ( 0.4700000 0.2787641 -0.0000000), wk = 0.0023810 k( 85) = ( 0.4600000 0.2787641 -0.0000000), wk = 0.0023810 k( 86) = ( 0.4500000 0.2787641 -0.0000000), wk = 0.0023810 k( 87) = ( 0.4400000 0.2787641 -0.0000000), wk = 0.0023810 k( 88) = ( 0.4300000 0.2787641 -0.0000000), wk = 0.0023810 k( 89) = ( 0.4200000 0.2787641 -0.0000000), wk = 0.0023810 k( 90) = ( 0.4100000 0.2787641 -0.0000000), wk = 0.0023810 k( 91) = ( 0.4000000 0.2787641 -0.0000000), wk = 0.0023810 k( 92) = ( 0.3900000 0.2787641 -0.0000000), wk = 0.0023810 k( 93) = ( 0.3800000 0.2787641 -0.0000000), wk = 0.0023810 k( 94) = ( 0.3700000 0.2787641 -0.0000000), wk = 0.0023810 k( 95) = ( 0.3600000 0.2787641 -0.0000000), wk = 0.0023810 k( 96) = ( 0.3500000 0.2787641 -0.0000000), wk = 0.0023810 k( 97) = ( 0.3400000 0.2787641 -0.0000000), wk = 0.0023810 k( 98) = ( 0.3300000 0.2787641 -0.0000000), wk = 0.0023810 k( 99) = ( 0.3200000 0.2787641 -0.0000000), wk = 0.0023810 k( 100) = ( 0.3100000 0.2787641 -0.0000000), wk = 0.0023810 k( 101) = ( 0.3000000 0.2787641 -0.0000000), wk = 0.0023810 k( 102) = ( 0.2900000 0.2787641 -0.0000000), wk = 0.0023810 k( 103) = ( 0.2800000 0.2787641 -0.0000000), wk = 0.0023810 k( 104) = ( 0.2700000 0.2787641 -0.0000000), wk = 0.0023810 k( 105) = ( 0.2600000 0.2787641 -0.0000000), wk = 0.0023810 k( 106) = ( 0.2500000 0.2787641 -0.0000000), wk = 0.0023810 k( 107) = ( 0.2400000 0.2787641 -0.0000000), wk = 0.0023810 k( 108) = ( 0.2300000 0.2787641 -0.0000000), wk = 0.0023810 k( 109) = ( 0.2200000 0.2787641 -0.0000000), wk = 0.0023810 k( 110) = ( 0.2100000 0.2787641 -0.0000000), wk = 0.0023810 k( 111) = ( 0.2000000 0.2787641 -0.0000000), wk = 0.0023810 k( 112) = ( 0.1900000 0.2787641 -0.0000000), wk = 0.0023810 k( 113) = ( 0.1800000 0.2787641 -0.0000000), wk = 0.0023810 k( 114) = ( 0.1700000 0.2787641 -0.0000000), wk = 0.0023810 k( 115) = ( 0.1600000 0.2787641 -0.0000000), wk = 0.0023810 k( 116) = ( 0.1500000 0.2787641 -0.0000000), wk = 0.0023810 k( 117) = ( 0.1400000 0.2787641 -0.0000000), wk = 0.0023810 k( 118) = ( 0.1300000 0.2787641 -0.0000000), wk = 0.0023810 k( 119) = ( 0.1200000 0.2787641 -0.0000000), wk = 0.0023810 k( 120) = ( 0.1100000 0.2787641 -0.0000000), wk = 0.0023810 k( 121) = ( 0.1000000 0.2787641 -0.0000000), wk = 0.0023810 k( 122) = ( 0.0900000 0.2787641 -0.0000000), wk = 0.0023810 k( 123) = ( 0.0800000 0.2787641 -0.0000000), wk = 0.0023810 k( 124) = ( 0.0700000 0.2787641 -0.0000000), wk = 0.0023810 k( 125) = ( 0.0600000 0.2787641 -0.0000000), wk = 0.0023810 k( 126) = ( 0.0500000 0.2787641 -0.0000000), wk = 0.0023810 k( 127) = ( 0.0400000 0.2787641 -0.0000000), wk = 0.0023810 k( 128) = ( 0.0300000 0.2787641 -0.0000000), wk = 0.0023810 k( 129) = ( 0.0200000 0.2787641 -0.0000000), wk = 0.0023810 k( 130) = ( 0.0100000 0.2787641 -0.0000000), wk = 0.0023810 k( 131) = ( 0.0000000 0.2787641 -0.0000000), wk = 0.0023810 k( 132) = ( 0.0000000 0.2787641 -0.0000000), wk = 0.0023810 k( 133) = ( 0.0000000 0.2688083 -0.0000000), wk = 0.0023810 k( 134) = ( 0.0000000 0.2588524 -0.0000000), wk = 0.0023810 k( 135) = ( 0.0000000 0.2488966 -0.0000000), wk = 0.0023810 k( 136) = ( 0.0000000 0.2389407 -0.0000000), wk = 0.0023810 k( 137) = ( 0.0000000 0.2289848 -0.0000000), wk = 0.0023810 k( 138) = ( 0.0000000 0.2190290 -0.0000000), wk = 0.0023810 k( 139) = ( 0.0000000 0.2090731 -0.0000000), wk = 0.0023810 k( 140) = ( 0.0000000 0.1991172 -0.0000000), wk = 0.0023810 k( 141) = ( 0.0000000 0.1891614 -0.0000000), wk = 0.0023810 k( 142) = ( 0.0000000 0.1792055 -0.0000000), wk = 0.0023810 k( 143) = ( 0.0000000 0.1692497 -0.0000000), wk = 0.0023810 k( 144) = ( 0.0000000 0.1592938 -0.0000000), wk = 0.0023810 k( 145) = ( 0.0000000 0.1493379 -0.0000000), wk = 0.0023810 k( 146) = ( 0.0000000 0.1393821 -0.0000000), wk = 0.0023810 k( 147) = ( 0.0000000 0.1294262 -0.0000000), wk = 0.0023810 k( 148) = ( 0.0000000 0.1194703 -0.0000000), wk = 0.0023810 k( 149) = ( 0.0000000 0.1095145 -0.0000000), wk = 0.0023810 k( 150) = ( 0.0000000 0.0995586 -0.0000000), wk = 0.0023810 k( 151) = ( 0.0000000 0.0896028 -0.0000000), wk = 0.0023810 k( 152) = ( 0.0000000 0.0796469 -0.0000000), wk = 0.0023810 k( 153) = ( 0.0000000 0.0696910 -0.0000000), wk = 0.0023810 k( 154) = ( 0.0000000 0.0597352 -0.0000000), wk = 0.0023810 k( 155) = ( 0.0000000 0.0497793 -0.0000000), wk = 0.0023810 k( 156) = ( 0.0000000 0.0398234 -0.0000000), wk = 0.0023810 k( 157) = ( 0.0000000 0.0298676 -0.0000000), wk = 0.0023810 k( 158) = ( 0.0000000 0.0199117 -0.0000000), wk = 0.0023810 k( 159) = ( 0.0000000 0.0099559 -0.0000000), wk = 0.0023810 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 161) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 162) = ( 0.0000000 0.0000000 0.0100314), wk = 0.0023810 k( 163) = ( 0.0000000 0.0000000 0.0200629), wk = 0.0023810 k( 164) = ( 0.0000000 0.0000000 0.0300943), wk = 0.0023810 k( 165) = ( 0.0000000 0.0000000 0.0401258), wk = 0.0023810 k( 166) = ( 0.0000000 0.0000000 0.0501572), wk = 0.0023810 k( 167) = ( 0.0000000 0.0000000 0.0601887), wk = 0.0023810 k( 168) = ( 0.0000000 0.0000000 0.0702201), wk = 0.0023810 k( 169) = ( 0.0000000 0.0000000 0.0802516), wk = 0.0023810 k( 170) = ( 0.0000000 0.0000000 0.0902830), wk = 0.0023810 k( 171) = ( 0.0000000 0.0000000 0.1003144), wk = 0.0023810 k( 172) = ( 0.0000000 0.0000000 0.1103459), wk = 0.0023810 k( 173) = ( 0.0000000 0.0000000 0.1203773), wk = 0.0023810 k( 174) = ( 0.0000000 0.0000000 0.1304088), wk = 0.0023810 k( 175) = ( 0.0000000 0.0000000 0.1404402), wk = 0.0023810 k( 176) = ( 0.0000000 0.0000000 0.1504717), wk = 0.0023810 k( 177) = ( 0.0000000 0.0000000 0.1605031), wk = 0.0023810 k( 178) = ( 0.0000000 0.0000000 0.1705346), wk = 0.0023810 k( 179) = ( 0.0000000 0.0000000 0.1805660), wk = 0.0023810 k( 180) = ( 0.0000000 0.0000000 0.1905974), wk = 0.0023810 k( 181) = ( 0.0000000 0.0000000 0.2006289), wk = 0.0023810 k( 182) = ( 0.0000000 0.0000000 0.2106603), wk = 0.0023810 k( 183) = ( 0.0000000 0.0000000 0.2206918), wk = 0.0023810 k( 184) = ( 0.0000000 0.0000000 0.2307232), wk = 0.0023810 k( 185) = ( 0.0000000 0.0000000 0.2407547), wk = 0.0023810 k( 186) = ( 0.0000000 0.0000000 0.2407547), wk = 0.0023810 k( 187) = ( 0.0100000 -0.0000000 0.2407547), wk = 0.0023810 k( 188) = ( 0.0200000 -0.0000000 0.2407547), wk = 0.0023810 k( 189) = ( 0.0300000 -0.0000000 0.2407547), wk = 0.0023810 k( 190) = ( 0.0400000 -0.0000000 0.2407547), wk = 0.0023810 k( 191) = ( 0.0500000 -0.0000000 0.2407547), wk = 0.0023810 k( 192) = ( 0.0600000 -0.0000000 0.2407547), wk = 0.0023810 k( 193) = ( 0.0700000 -0.0000000 0.2407547), wk = 0.0023810 k( 194) = ( 0.0800000 -0.0000000 0.2407547), wk = 0.0023810 k( 195) = ( 0.0900000 -0.0000000 0.2407547), wk = 0.0023810 k( 196) = ( 0.1000000 -0.0000000 0.2407547), wk = 0.0023810 k( 197) = ( 0.1100000 -0.0000000 0.2407547), wk = 0.0023810 k( 198) = ( 0.1200000 -0.0000000 0.2407547), wk = 0.0023810 k( 199) = ( 0.1300000 -0.0000000 0.2407547), wk = 0.0023810 k( 200) = ( 0.1400000 -0.0000000 0.2407547), wk = 0.0023810 k( 201) = ( 0.1500000 -0.0000000 0.2407547), wk = 0.0023810 k( 202) = ( 0.1600000 -0.0000000 0.2407547), wk = 0.0023810 k( 203) = ( 0.1700000 -0.0000000 0.2407547), wk = 0.0023810 k( 204) = ( 0.1800000 -0.0000000 0.2407547), wk = 0.0023810 k( 205) = ( 0.1900000 -0.0000000 0.2407547), wk = 0.0023810 k( 206) = ( 0.2000000 -0.0000000 0.2407547), wk = 0.0023810 k( 207) = ( 0.2100000 -0.0000000 0.2407547), wk = 0.0023810 k( 208) = ( 0.2200000 -0.0000000 0.2407547), wk = 0.0023810 k( 209) = ( 0.2300000 -0.0000000 0.2407547), wk = 0.0023810 k( 210) = ( 0.2400000 -0.0000000 0.2407547), wk = 0.0023810 k( 211) = ( 0.2500000 -0.0000000 0.2407547), wk = 0.0023810 k( 212) = ( 0.2600000 -0.0000000 0.2407547), wk = 0.0023810 k( 213) = ( 0.2700000 -0.0000000 0.2407547), wk = 0.0023810 k( 214) = ( 0.2800000 -0.0000000 0.2407547), wk = 0.0023810 k( 215) = ( 0.2900000 -0.0000000 0.2407547), wk = 0.0023810 k( 216) = ( 0.3000000 -0.0000000 0.2407547), wk = 0.0023810 k( 217) = ( 0.3100000 -0.0000000 0.2407547), wk = 0.0023810 k( 218) = ( 0.3200000 -0.0000000 0.2407547), wk = 0.0023810 k( 219) = ( 0.3300000 -0.0000000 0.2407547), wk = 0.0023810 k( 220) = ( 0.3400000 -0.0000000 0.2407547), wk = 0.0023810 k( 221) = ( 0.3500000 -0.0000000 0.2407547), wk = 0.0023810 k( 222) = ( 0.3600000 -0.0000000 0.2407547), wk = 0.0023810 k( 223) = ( 0.3700000 -0.0000000 0.2407547), wk = 0.0023810 k( 224) = ( 0.3800000 -0.0000000 0.2407547), wk = 0.0023810 k( 225) = ( 0.3900000 -0.0000000 0.2407547), wk = 0.0023810 k( 226) = ( 0.4000000 -0.0000000 0.2407547), wk = 0.0023810 k( 227) = ( 0.4100000 -0.0000000 0.2407547), wk = 0.0023810 k( 228) = ( 0.4200000 -0.0000000 0.2407547), wk = 0.0023810 k( 229) = ( 0.4300000 -0.0000000 0.2407547), wk = 0.0023810 k( 230) = ( 0.4400000 -0.0000000 0.2407547), wk = 0.0023810 k( 231) = ( 0.4500000 -0.0000000 0.2407547), wk = 0.0023810 k( 232) = ( 0.4600000 -0.0000000 0.2407547), wk = 0.0023810 k( 233) = ( 0.4700000 -0.0000000 0.2407547), wk = 0.0023810 k( 234) = ( 0.4800000 -0.0000000 0.2407547), wk = 0.0023810 k( 235) = ( 0.4900000 -0.0000000 0.2407547), wk = 0.0023810 k( 236) = ( 0.5000000 -0.0000000 0.2407547), wk = 0.0023810 k( 237) = ( 0.5000000 -0.0000000 0.2407547), wk = 0.0023810 k( 238) = ( 0.5000000 0.0099559 0.2407547), wk = 0.0023810 k( 239) = ( 0.5000000 0.0199117 0.2407547), wk = 0.0023810 k( 240) = ( 0.5000000 0.0298676 0.2407547), wk = 0.0023810 k( 241) = ( 0.5000000 0.0398234 0.2407547), wk = 0.0023810 k( 242) = ( 0.5000000 0.0497793 0.2407547), wk = 0.0023810 k( 243) = ( 0.5000000 0.0597352 0.2407547), wk = 0.0023810 k( 244) = ( 0.5000000 0.0696910 0.2407547), wk = 0.0023810 k( 245) = ( 0.5000000 0.0796469 0.2407547), wk = 0.0023810 k( 246) = ( 0.5000000 0.0896028 0.2407547), wk = 0.0023810 k( 247) = ( 0.5000000 0.0995586 0.2407547), wk = 0.0023810 k( 248) = ( 0.5000000 0.1095145 0.2407547), wk = 0.0023810 k( 249) = ( 0.5000000 0.1194703 0.2407547), wk = 0.0023810 k( 250) = ( 0.5000000 0.1294262 0.2407547), wk = 0.0023810 k( 251) = ( 0.5000000 0.1393821 0.2407547), wk = 0.0023810 k( 252) = ( 0.5000000 0.1493379 0.2407547), wk = 0.0023810 k( 253) = ( 0.5000000 0.1592938 0.2407547), wk = 0.0023810 k( 254) = ( 0.5000000 0.1692497 0.2407547), wk = 0.0023810 k( 255) = ( 0.5000000 0.1792055 0.2407547), wk = 0.0023810 k( 256) = ( 0.5000000 0.1891614 0.2407547), wk = 0.0023810 k( 257) = ( 0.5000000 0.1991172 0.2407547), wk = 0.0023810 k( 258) = ( 0.5000000 0.2090731 0.2407547), wk = 0.0023810 k( 259) = ( 0.5000000 0.2190290 0.2407547), wk = 0.0023810 k( 260) = ( 0.5000000 0.2289848 0.2407547), wk = 0.0023810 k( 261) = ( 0.5000000 0.2389407 0.2407547), wk = 0.0023810 k( 262) = ( 0.5000000 0.2488966 0.2407547), wk = 0.0023810 k( 263) = ( 0.5000000 0.2588524 0.2407547), wk = 0.0023810 k( 264) = ( 0.5000000 0.2688083 0.2407547), wk = 0.0023810 k( 265) = ( 0.5000000 0.2787641 0.2407547), wk = 0.0023810 k( 266) = ( 0.5000000 0.2787641 0.2407547), wk = 0.0023810 k( 267) = ( 0.4900000 0.2787641 0.2407547), wk = 0.0023810 k( 268) = ( 0.4800000 0.2787641 0.2407547), wk = 0.0023810 k( 269) = ( 0.4700000 0.2787641 0.2407547), wk = 0.0023810 k( 270) = ( 0.4600000 0.2787641 0.2407547), wk = 0.0023810 k( 271) = ( 0.4500000 0.2787641 0.2407547), wk = 0.0023810 k( 272) = ( 0.4400000 0.2787641 0.2407547), wk = 0.0023810 k( 273) = ( 0.4300000 0.2787641 0.2407547), wk = 0.0023810 k( 274) = ( 0.4200000 0.2787641 0.2407547), wk = 0.0023810 k( 275) = ( 0.4100000 0.2787641 0.2407547), wk = 0.0023810 k( 276) = ( 0.4000000 0.2787641 0.2407547), wk = 0.0023810 k( 277) = ( 0.3900000 0.2787641 0.2407547), wk = 0.0023810 k( 278) = ( 0.3800000 0.2787641 0.2407547), wk = 0.0023810 k( 279) = ( 0.3700000 0.2787641 0.2407547), wk = 0.0023810 k( 280) = ( 0.3600000 0.2787641 0.2407547), wk = 0.0023810 k( 281) = ( 0.3500000 0.2787641 0.2407547), wk = 0.0023810 k( 282) = ( 0.3400000 0.2787641 0.2407547), wk = 0.0023810 k( 283) = ( 0.3300000 0.2787641 0.2407547), wk = 0.0023810 k( 284) = ( 0.3200000 0.2787641 0.2407547), wk = 0.0023810 k( 285) = ( 0.3100000 0.2787641 0.2407547), wk = 0.0023810 k( 286) = ( 0.3000000 0.2787641 0.2407547), wk = 0.0023810 k( 287) = ( 0.2900000 0.2787641 0.2407547), wk = 0.0023810 k( 288) = ( 0.2800000 0.2787641 0.2407547), wk = 0.0023810 k( 289) = ( 0.2700000 0.2787641 0.2407547), wk = 0.0023810 k( 290) = ( 0.2600000 0.2787641 0.2407547), wk = 0.0023810 k( 291) = ( 0.2500000 0.2787641 0.2407547), wk = 0.0023810 k( 292) = ( 0.2400000 0.2787641 0.2407547), wk = 0.0023810 k( 293) = ( 0.2300000 0.2787641 0.2407547), wk = 0.0023810 k( 294) = ( 0.2200000 0.2787641 0.2407547), wk = 0.0023810 k( 295) = ( 0.2100000 0.2787641 0.2407547), wk = 0.0023810 k( 296) = ( 0.2000000 0.2787641 0.2407547), wk = 0.0023810 k( 297) = ( 0.1900000 0.2787641 0.2407547), wk = 0.0023810 k( 298) = ( 0.1800000 0.2787641 0.2407547), wk = 0.0023810 k( 299) = ( 0.1700000 0.2787641 0.2407547), wk = 0.0023810 k( 300) = ( 0.1600000 0.2787641 0.2407547), wk = 0.0023810 k( 301) = ( 0.1500000 0.2787641 0.2407547), wk = 0.0023810 k( 302) = ( 0.1400000 0.2787641 0.2407547), wk = 0.0023810 k( 303) = ( 0.1300000 0.2787641 0.2407547), wk = 0.0023810 k( 304) = ( 0.1200000 0.2787641 0.2407547), wk = 0.0023810 k( 305) = ( 0.1100000 0.2787641 0.2407547), wk = 0.0023810 k( 306) = ( 0.1000000 0.2787641 0.2407547), wk = 0.0023810 k( 307) = ( 0.0900000 0.2787641 0.2407547), wk = 0.0023810 k( 308) = ( 0.0800000 0.2787641 0.2407547), wk = 0.0023810 k( 309) = ( 0.0700000 0.2787641 0.2407547), wk = 0.0023810 k( 310) = ( 0.0600000 0.2787641 0.2407547), wk = 0.0023810 k( 311) = ( 0.0500000 0.2787641 0.2407547), wk = 0.0023810 k( 312) = ( 0.0400000 0.2787641 0.2407547), wk = 0.0023810 k( 313) = ( 0.0300000 0.2787641 0.2407547), wk = 0.0023810 k( 314) = ( 0.0200000 0.2787641 0.2407547), wk = 0.0023810 k( 315) = ( 0.0100000 0.2787641 0.2407547), wk = 0.0023810 k( 316) = ( 0.0000000 0.2787641 0.2407547), wk = 0.0023810 k( 317) = ( 0.0000000 0.2787641 0.2407547), wk = 0.0023810 k( 318) = ( 0.0000000 0.2688083 0.2407547), wk = 0.0023810 k( 319) = ( 0.0000000 0.2588524 0.2407547), wk = 0.0023810 k( 320) = ( 0.0000000 0.2488966 0.2407547), wk = 0.0023810 k( 321) = ( 0.0000000 0.2389407 0.2407547), wk = 0.0023810 k( 322) = ( 0.0000000 0.2289848 0.2407547), wk = 0.0023810 k( 323) = ( 0.0000000 0.2190290 0.2407547), wk = 0.0023810 k( 324) = ( 0.0000000 0.2090731 0.2407547), wk = 0.0023810 k( 325) = ( 0.0000000 0.1991172 0.2407547), wk = 0.0023810 k( 326) = ( 0.0000000 0.1891614 0.2407547), wk = 0.0023810 k( 327) = ( 0.0000000 0.1792055 0.2407547), wk = 0.0023810 k( 328) = ( 0.0000000 0.1692497 0.2407547), wk = 0.0023810 k( 329) = ( 0.0000000 0.1592938 0.2407547), wk = 0.0023810 k( 330) = ( 0.0000000 0.1493379 0.2407547), wk = 0.0023810 k( 331) = ( 0.0000000 0.1393821 0.2407547), wk = 0.0023810 k( 332) = ( 0.0000000 0.1294262 0.2407547), wk = 0.0023810 k( 333) = ( 0.0000000 0.1194703 0.2407547), wk = 0.0023810 k( 334) = ( 0.0000000 0.1095145 0.2407547), wk = 0.0023810 k( 335) = ( 0.0000000 0.0995586 0.2407547), wk = 0.0023810 k( 336) = ( 0.0000000 0.0896028 0.2407547), wk = 0.0023810 k( 337) = ( 0.0000000 0.0796469 0.2407547), wk = 0.0023810 k( 338) = ( 0.0000000 0.0696910 0.2407547), wk = 0.0023810 k( 339) = ( 0.0000000 0.0597352 0.2407547), wk = 0.0023810 k( 340) = ( 0.0000000 0.0497793 0.2407547), wk = 0.0023810 k( 341) = ( 0.0000000 0.0398234 0.2407547), wk = 0.0023810 k( 342) = ( 0.0000000 0.0298676 0.2407547), wk = 0.0023810 k( 343) = ( 0.0000000 0.0199117 0.2407547), wk = 0.0023810 k( 344) = ( 0.0000000 0.0099559 0.2407547), wk = 0.0023810 k( 345) = ( 0.0000000 0.0000000 0.2407547), wk = 0.0023810 k( 346) = ( 0.0000000 0.2787641 -0.0000000), wk = 0.0023810 k( 347) = ( 0.0000000 0.2787641 0.0100314), wk = 0.0023810 k( 348) = ( 0.0000000 0.2787641 0.0200629), wk = 0.0023810 k( 349) = ( 0.0000000 0.2787641 0.0300943), wk = 0.0023810 k( 350) = ( 0.0000000 0.2787641 0.0401258), wk = 0.0023810 k( 351) = ( 0.0000000 0.2787641 0.0501572), wk = 0.0023810 k( 352) = ( 0.0000000 0.2787641 0.0601887), wk = 0.0023810 k( 353) = ( 0.0000000 0.2787641 0.0702201), wk = 0.0023810 k( 354) = ( 0.0000000 0.2787641 0.0802516), wk = 0.0023810 k( 355) = ( 0.0000000 0.2787641 0.0902830), wk = 0.0023810 k( 356) = ( 0.0000000 0.2787641 0.1003144), wk = 0.0023810 k( 357) = ( 0.0000000 0.2787641 0.1103459), wk = 0.0023810 k( 358) = ( 0.0000000 0.2787641 0.1203773), wk = 0.0023810 k( 359) = ( 0.0000000 0.2787641 0.1304088), wk = 0.0023810 k( 360) = ( 0.0000000 0.2787641 0.1404402), wk = 0.0023810 k( 361) = ( 0.0000000 0.2787641 0.1504717), wk = 0.0023810 k( 362) = ( 0.0000000 0.2787641 0.1605031), wk = 0.0023810 k( 363) = ( 0.0000000 0.2787641 0.1705346), wk = 0.0023810 k( 364) = ( 0.0000000 0.2787641 0.1805660), wk = 0.0023810 k( 365) = ( 0.0000000 0.2787641 0.1905974), wk = 0.0023810 k( 366) = ( 0.0000000 0.2787641 0.2006289), wk = 0.0023810 k( 367) = ( 0.0000000 0.2787641 0.2106603), wk = 0.0023810 k( 368) = ( 0.0000000 0.2787641 0.2206918), wk = 0.0023810 k( 369) = ( 0.0000000 0.2787641 0.2307232), wk = 0.0023810 k( 370) = ( 0.0000000 0.2787641 0.2407547), wk = 0.0023810 k( 371) = ( 0.5000000 -0.0000000 0.2407547), wk = 0.0023810 k( 372) = ( 0.5000000 -0.0000000 0.2307232), wk = 0.0023810 k( 373) = ( 0.5000000 -0.0000000 0.2206918), wk = 0.0023810 k( 374) = ( 0.5000000 -0.0000000 0.2106603), wk = 0.0023810 k( 375) = ( 0.5000000 -0.0000000 0.2006289), wk = 0.0023810 k( 376) = ( 0.5000000 -0.0000000 0.1905974), wk = 0.0023810 k( 377) = ( 0.5000000 -0.0000000 0.1805660), wk = 0.0023810 k( 378) = ( 0.5000000 -0.0000000 0.1705346), wk = 0.0023810 k( 379) = ( 0.5000000 -0.0000000 0.1605031), wk = 0.0023810 k( 380) = ( 0.5000000 -0.0000000 0.1504717), wk = 0.0023810 k( 381) = ( 0.5000000 -0.0000000 0.1404402), wk = 0.0023810 k( 382) = ( 0.5000000 -0.0000000 0.1304088), wk = 0.0023810 k( 383) = ( 0.5000000 -0.0000000 0.1203773), wk = 0.0023810 k( 384) = ( 0.5000000 -0.0000000 0.1103459), wk = 0.0023810 k( 385) = ( 0.5000000 -0.0000000 0.1003144), wk = 0.0023810 k( 386) = ( 0.5000000 -0.0000000 0.0902830), wk = 0.0023810 k( 387) = ( 0.5000000 -0.0000000 0.0802516), wk = 0.0023810 k( 388) = ( 0.5000000 -0.0000000 0.0702201), wk = 0.0023810 k( 389) = ( 0.5000000 -0.0000000 0.0601887), wk = 0.0023810 k( 390) = ( 0.5000000 -0.0000000 0.0501572), wk = 0.0023810 k( 391) = ( 0.5000000 -0.0000000 0.0401258), wk = 0.0023810 k( 392) = ( 0.5000000 -0.0000000 0.0300943), wk = 0.0023810 k( 393) = ( 0.5000000 -0.0000000 0.0200629), wk = 0.0023810 k( 394) = ( 0.5000000 -0.0000000 0.0100314), wk = 0.0023810 k( 395) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023810 k( 396) = ( 0.5000000 0.2787641 -0.0000000), wk = 0.0023810 k( 397) = ( 0.5000000 0.2787641 0.0100314), wk = 0.0023810 k( 398) = ( 0.5000000 0.2787641 0.0200629), wk = 0.0023810 k( 399) = ( 0.5000000 0.2787641 0.0300943), wk = 0.0023810 k( 400) = ( 0.5000000 0.2787641 0.0401258), wk = 0.0023810 k( 401) = ( 0.5000000 0.2787641 0.0501572), wk = 0.0023810 k( 402) = ( 0.5000000 0.2787641 0.0601887), wk = 0.0023810 k( 403) = ( 0.5000000 0.2787641 0.0702201), wk = 0.0023810 k( 404) = ( 0.5000000 0.2787641 0.0802516), wk = 0.0023810 k( 405) = ( 0.5000000 0.2787641 0.0902830), wk = 0.0023810 k( 406) = ( 0.5000000 0.2787641 0.1003144), wk = 0.0023810 k( 407) = ( 0.5000000 0.2787641 0.1103459), wk = 0.0023810 k( 408) = ( 0.5000000 0.2787641 0.1203773), wk = 0.0023810 k( 409) = ( 0.5000000 0.2787641 0.1304088), wk = 0.0023810 k( 410) = ( 0.5000000 0.2787641 0.1404402), wk = 0.0023810 k( 411) = ( 0.5000000 0.2787641 0.1504717), wk = 0.0023810 k( 412) = ( 0.5000000 0.2787641 0.1605031), wk = 0.0023810 k( 413) = ( 0.5000000 0.2787641 0.1705346), wk = 0.0023810 k( 414) = ( 0.5000000 0.2787641 0.1805660), wk = 0.0023810 k( 415) = ( 0.5000000 0.2787641 0.1905974), wk = 0.0023810 k( 416) = ( 0.5000000 0.2787641 0.2006289), wk = 0.0023810 k( 417) = ( 0.5000000 0.2787641 0.2106603), wk = 0.0023810 k( 418) = ( 0.5000000 0.2787641 0.2206918), wk = 0.0023810 k( 419) = ( 0.5000000 0.2787641 0.2307232), wk = 0.0023810 k( 420) = ( 0.5000000 0.2787641 0.2407547), wk = 0.0023810 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 2) = ( 0.0100000 -0.0000000 -0.0000000), wk = 0.0023810 k( 3) = ( 0.0200000 -0.0000000 -0.0000000), wk = 0.0023810 k( 4) = ( 0.0300000 -0.0000000 -0.0000000), wk = 0.0023810 k( 5) = ( 0.0400000 -0.0000000 -0.0000000), wk = 0.0023810 k( 6) = ( 0.0500000 -0.0000000 0.0000000), wk = 0.0023810 k( 7) = ( 0.0600000 -0.0000000 -0.0000000), wk = 0.0023810 k( 8) = ( 0.0700000 -0.0000000 -0.0000000), wk = 0.0023810 k( 9) = ( 0.0800000 -0.0000000 -0.0000000), wk = 0.0023810 k( 10) = ( 0.0900000 0.0000000 -0.0000000), wk = 0.0023810 k( 11) = ( 0.1000000 -0.0000000 0.0000000), wk = 0.0023810 k( 12) = ( 0.1100000 -0.0000000 -0.0000000), wk = 0.0023810 k( 13) = ( 0.1200000 -0.0000000 -0.0000000), wk = 0.0023810 k( 14) = ( 0.1300000 -0.0000000 -0.0000000), wk = 0.0023810 k( 15) = ( 0.1400000 -0.0000000 -0.0000000), wk = 0.0023810 k( 16) = ( 0.1500000 0.0000000 -0.0000000), wk = 0.0023810 k( 17) = ( 0.1600000 -0.0000000 -0.0000000), wk = 0.0023810 k( 18) = ( 0.1700000 0.0000000 -0.0000000), wk = 0.0023810 k( 19) = ( 0.1800000 0.0000000 -0.0000000), wk = 0.0023810 k( 20) = ( 0.1900000 -0.0000000 -0.0000000), wk = 0.0023810 k( 21) = ( 0.2000000 -0.0000000 0.0000000), wk = 0.0023810 k( 22) = ( 0.2100000 -0.0000000 -0.0000000), wk = 0.0023810 k( 23) = ( 0.2200000 -0.0000000 -0.0000000), wk = 0.0023810 k( 24) = ( 0.2300000 -0.0000000 -0.0000000), wk = 0.0023810 k( 25) = ( 0.2400000 -0.0000000 -0.0000000), wk = 0.0023810 k( 26) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0023810 k( 27) = ( 0.2600000 -0.0000000 -0.0000000), wk = 0.0023810 k( 28) = ( 0.2700000 0.0000000 -0.0000000), wk = 0.0023810 k( 29) = ( 0.2800000 -0.0000000 -0.0000000), wk = 0.0023810 k( 30) = ( 0.2900000 -0.0000000 0.0000000), wk = 0.0023810 k( 31) = ( 0.3000000 0.0000000 -0.0000000), wk = 0.0023810 k( 32) = ( 0.3100000 0.0000000 -0.0000000), wk = 0.0023810 k( 33) = ( 0.3200000 -0.0000000 -0.0000000), wk = 0.0023810 k( 34) = ( 0.3300000 -0.0000000 -0.0000000), wk = 0.0023810 k( 35) = ( 0.3400000 0.0000000 -0.0000000), wk = 0.0023810 k( 36) = ( 0.3500000 -0.0000000 0.0000000), wk = 0.0023810 k( 37) = ( 0.3600000 0.0000000 -0.0000000), wk = 0.0023810 k( 38) = ( 0.3700000 0.0000000 0.0000000), wk = 0.0023810 k( 39) = ( 0.3800000 -0.0000000 -0.0000000), wk = 0.0023810 k( 40) = ( 0.3900000 -0.0000000 -0.0000000), wk = 0.0023810 k( 41) = ( 0.4000000 -0.0000000 0.0000000), wk = 0.0023810 k( 42) = ( 0.4100000 0.0000000 0.0000000), wk = 0.0023810 k( 43) = ( 0.4200000 -0.0000000 -0.0000000), wk = 0.0023810 k( 44) = ( 0.4300000 0.0000000 0.0000000), wk = 0.0023810 k( 45) = ( 0.4400000 -0.0000000 -0.0000000), wk = 0.0023810 k( 46) = ( 0.4500000 -0.0000000 -0.0000000), wk = 0.0023810 k( 47) = ( 0.4600000 -0.0000000 -0.0000000), wk = 0.0023810 k( 48) = ( 0.4700000 0.0000000 0.0000000), wk = 0.0023810 k( 49) = ( 0.4800000 -0.0000000 -0.0000000), wk = 0.0023810 k( 50) = ( 0.4900000 0.0000000 0.0000000), wk = 0.0023810 k( 51) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0023810 k( 52) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0023810 k( 53) = ( 0.5000000 0.0178571 0.0000000), wk = 0.0023810 k( 54) = ( 0.5000000 0.0357143 -0.0000000), wk = 0.0023810 k( 55) = ( 0.5000000 0.0535714 -0.0000000), wk = 0.0023810 k( 56) = ( 0.5000000 0.0714286 -0.0000000), wk = 0.0023810 k( 57) = ( 0.5000000 0.0892857 -0.0000000), wk = 0.0023810 k( 58) = ( 0.5000000 0.1071429 -0.0000000), wk = 0.0023810 k( 59) = ( 0.5000000 0.1250000 0.0000000), wk = 0.0023810 k( 60) = ( 0.5000000 0.1428571 0.0000000), wk = 0.0023810 k( 61) = ( 0.5000000 0.1607143 -0.0000000), wk = 0.0023810 k( 62) = ( 0.5000000 0.1785714 0.0000000), wk = 0.0023810 k( 63) = ( 0.5000000 0.1964286 -0.0000000), wk = 0.0023810 k( 64) = ( 0.5000000 0.2142857 0.0000000), wk = 0.0023810 k( 65) = ( 0.5000000 0.2321429 -0.0000000), wk = 0.0023810 k( 66) = ( 0.5000000 0.2500000 -0.0000000), wk = 0.0023810 k( 67) = ( 0.5000000 0.2678571 0.0000000), wk = 0.0023810 k( 68) = ( 0.5000000 0.2857143 0.0000000), wk = 0.0023810 k( 69) = ( 0.5000000 0.3035714 -0.0000000), wk = 0.0023810 k( 70) = ( 0.5000000 0.3214286 0.0000000), wk = 0.0023810 k( 71) = ( 0.5000000 0.3392857 -0.0000000), wk = 0.0023810 k( 72) = ( 0.5000000 0.3571429 0.0000000), wk = 0.0023810 k( 73) = ( 0.5000000 0.3750000 0.0000000), wk = 0.0023810 k( 74) = ( 0.5000000 0.3928571 -0.0000000), wk = 0.0023810 k( 75) = ( 0.5000000 0.4107143 -0.0000000), wk = 0.0023810 k( 76) = ( 0.5000000 0.4285714 -0.0000000), wk = 0.0023810 k( 77) = ( 0.5000000 0.4464286 0.0000000), wk = 0.0023810 k( 78) = ( 0.5000000 0.4642857 0.0000000), wk = 0.0023810 k( 79) = ( 0.5000000 0.4821429 -0.0000000), wk = 0.0023810 k( 80) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023810 k( 81) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023810 k( 82) = ( 0.4900000 0.5000000 -0.0000000), wk = 0.0023810 k( 83) = ( 0.4800000 0.5000000 0.0000000), wk = 0.0023810 k( 84) = ( 0.4700000 0.5000000 0.0000000), wk = 0.0023810 k( 85) = ( 0.4600000 0.5000000 -0.0000000), wk = 0.0023810 k( 86) = ( 0.4500000 0.5000000 0.0000000), wk = 0.0023810 k( 87) = ( 0.4400000 0.5000000 0.0000000), wk = 0.0023810 k( 88) = ( 0.4300000 0.5000000 -0.0000000), wk = 0.0023810 k( 89) = ( 0.4200000 0.5000000 0.0000000), wk = 0.0023810 k( 90) = ( 0.4100000 0.5000000 -0.0000000), wk = 0.0023810 k( 91) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0023810 k( 92) = ( 0.3900000 0.5000000 0.0000000), wk = 0.0023810 k( 93) = ( 0.3800000 0.5000000 0.0000000), wk = 0.0023810 k( 94) = ( 0.3700000 0.5000000 -0.0000000), wk = 0.0023810 k( 95) = ( 0.3600000 0.5000000 0.0000000), wk = 0.0023810 k( 96) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0023810 k( 97) = ( 0.3400000 0.5000000 -0.0000000), wk = 0.0023810 k( 98) = ( 0.3300000 0.5000000 -0.0000000), wk = 0.0023810 k( 99) = ( 0.3200000 0.5000000 0.0000000), wk = 0.0023810 k( 100) = ( 0.3100000 0.5000000 -0.0000000), wk = 0.0023810 k( 101) = ( 0.3000000 0.5000000 0.0000000), wk = 0.0023810 k( 102) = ( 0.2900000 0.5000000 -0.0000000), wk = 0.0023810 k( 103) = ( 0.2800000 0.5000000 -0.0000000), wk = 0.0023810 k( 104) = ( 0.2700000 0.5000000 0.0000000), wk = 0.0023810 k( 105) = ( 0.2600000 0.5000000 -0.0000000), wk = 0.0023810 k( 106) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0023810 k( 107) = ( 0.2400000 0.5000000 0.0000000), wk = 0.0023810 k( 108) = ( 0.2300000 0.5000000 0.0000000), wk = 0.0023810 k( 109) = ( 0.2200000 0.5000000 0.0000000), wk = 0.0023810 k( 110) = ( 0.2100000 0.5000000 0.0000000), wk = 0.0023810 k( 111) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0023810 k( 112) = ( 0.1900000 0.5000000 0.0000000), wk = 0.0023810 k( 113) = ( 0.1800000 0.5000000 0.0000000), wk = 0.0023810 k( 114) = ( 0.1700000 0.5000000 0.0000000), wk = 0.0023810 k( 115) = ( 0.1600000 0.5000000 0.0000000), wk = 0.0023810 k( 116) = ( 0.1500000 0.5000000 0.0000000), wk = 0.0023810 k( 117) = ( 0.1400000 0.5000000 0.0000000), wk = 0.0023810 k( 118) = ( 0.1300000 0.5000000 0.0000000), wk = 0.0023810 k( 119) = ( 0.1200000 0.5000000 0.0000000), wk = 0.0023810 k( 120) = ( 0.1100000 0.5000000 0.0000000), wk = 0.0023810 k( 121) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0023810 k( 122) = ( 0.0900000 0.5000000 0.0000000), wk = 0.0023810 k( 123) = ( 0.0800000 0.5000000 0.0000000), wk = 0.0023810 k( 124) = ( 0.0700000 0.5000000 -0.0000000), wk = 0.0023810 k( 125) = ( 0.0600000 0.5000000 0.0000000), wk = 0.0023810 k( 126) = ( 0.0500000 0.5000000 0.0000000), wk = 0.0023810 k( 127) = ( 0.0400000 0.5000000 0.0000000), wk = 0.0023810 k( 128) = ( 0.0300000 0.5000000 0.0000000), wk = 0.0023810 k( 129) = ( 0.0200000 0.5000000 0.0000000), wk = 0.0023810 k( 130) = ( 0.0100000 0.5000000 0.0000000), wk = 0.0023810 k( 131) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023810 k( 132) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023810 k( 133) = ( 0.0000000 0.4821429 -0.0000000), wk = 0.0023810 k( 134) = ( 0.0000000 0.4642857 0.0000000), wk = 0.0023810 k( 135) = ( 0.0000000 0.4464286 0.0000000), wk = 0.0023810 k( 136) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0023810 k( 137) = ( 0.0000000 0.4107143 -0.0000000), wk = 0.0023810 k( 138) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0023810 k( 139) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0023810 k( 140) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0023810 k( 141) = ( 0.0000000 0.3392857 0.0000000), wk = 0.0023810 k( 142) = ( 0.0000000 0.3214286 0.0000000), wk = 0.0023810 k( 143) = ( 0.0000000 0.3035714 -0.0000000), wk = 0.0023810 k( 144) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0023810 k( 145) = ( 0.0000000 0.2678571 -0.0000000), wk = 0.0023810 k( 146) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0023810 k( 147) = ( 0.0000000 0.2321429 0.0000000), wk = 0.0023810 k( 148) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0023810 k( 149) = ( 0.0000000 0.1964286 -0.0000000), wk = 0.0023810 k( 150) = ( 0.0000000 0.1785714 0.0000000), wk = 0.0023810 k( 151) = ( 0.0000000 0.1607143 0.0000000), wk = 0.0023810 k( 152) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0023810 k( 153) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0023810 k( 154) = ( 0.0000000 0.1071429 0.0000000), wk = 0.0023810 k( 155) = ( 0.0000000 0.0892857 0.0000000), wk = 0.0023810 k( 156) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0023810 k( 157) = ( 0.0000000 0.0535714 0.0000000), wk = 0.0023810 k( 158) = ( 0.0000000 0.0357143 0.0000000), wk = 0.0023810 k( 159) = ( 0.0000000 0.0178571 0.0000000), wk = 0.0023810 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 161) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 162) = ( 0.0000000 0.0000000 0.0208333), wk = 0.0023810 k( 163) = ( 0.0000000 0.0000000 0.0416667), wk = 0.0023810 k( 164) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0023810 k( 165) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0023810 k( 166) = ( 0.0000000 0.0000000 0.1041667), wk = 0.0023810 k( 167) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0023810 k( 168) = ( 0.0000000 0.0000000 0.1458333), wk = 0.0023810 k( 169) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0023810 k( 170) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0023810 k( 171) = ( 0.0000000 0.0000000 0.2083333), wk = 0.0023810 k( 172) = ( 0.0000000 0.0000000 0.2291667), wk = 0.0023810 k( 173) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0023810 k( 174) = ( 0.0000000 0.0000000 0.2708333), wk = 0.0023810 k( 175) = ( 0.0000000 0.0000000 0.2916667), wk = 0.0023810 k( 176) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0023810 k( 177) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0023810 k( 178) = ( 0.0000000 0.0000000 0.3541667), wk = 0.0023810 k( 179) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0023810 k( 180) = ( 0.0000000 0.0000000 0.3958333), wk = 0.0023810 k( 181) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0023810 k( 182) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0023810 k( 183) = ( 0.0000000 0.0000000 0.4583333), wk = 0.0023810 k( 184) = ( 0.0000000 0.0000000 0.4791667), wk = 0.0023810 k( 185) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023810 k( 186) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023810 k( 187) = ( 0.0100000 -0.0000000 0.5000000), wk = 0.0023810 k( 188) = ( 0.0200000 -0.0000000 0.5000000), wk = 0.0023810 k( 189) = ( 0.0300000 -0.0000000 0.5000000), wk = 0.0023810 k( 190) = ( 0.0400000 -0.0000000 0.5000000), wk = 0.0023810 k( 191) = ( 0.0500000 -0.0000000 0.5000000), wk = 0.0023810 k( 192) = ( 0.0600000 -0.0000000 0.5000000), wk = 0.0023810 k( 193) = ( 0.0700000 -0.0000000 0.5000000), wk = 0.0023810 k( 194) = ( 0.0800000 -0.0000000 0.5000000), wk = 0.0023810 k( 195) = ( 0.0900000 0.0000000 0.5000000), wk = 0.0023810 k( 196) = ( 0.1000000 -0.0000000 0.5000000), wk = 0.0023810 k( 197) = ( 0.1100000 -0.0000000 0.5000000), wk = 0.0023810 k( 198) = ( 0.1200000 -0.0000000 0.5000000), wk = 0.0023810 k( 199) = ( 0.1300000 -0.0000000 0.5000000), wk = 0.0023810 k( 200) = ( 0.1400000 -0.0000000 0.5000000), wk = 0.0023810 k( 201) = ( 0.1500000 0.0000000 0.5000000), wk = 0.0023810 k( 202) = ( 0.1600000 -0.0000000 0.5000000), wk = 0.0023810 k( 203) = ( 0.1700000 0.0000000 0.5000000), wk = 0.0023810 k( 204) = ( 0.1800000 0.0000000 0.5000000), wk = 0.0023810 k( 205) = ( 0.1900000 -0.0000000 0.5000000), wk = 0.0023810 k( 206) = ( 0.2000000 -0.0000000 0.5000000), wk = 0.0023810 k( 207) = ( 0.2100000 -0.0000000 0.5000000), wk = 0.0023810 k( 208) = ( 0.2200000 -0.0000000 0.5000000), wk = 0.0023810 k( 209) = ( 0.2300000 -0.0000000 0.5000000), wk = 0.0023810 k( 210) = ( 0.2400000 -0.0000000 0.5000000), wk = 0.0023810 k( 211) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0023810 k( 212) = ( 0.2600000 -0.0000000 0.5000000), wk = 0.0023810 k( 213) = ( 0.2700000 0.0000000 0.5000000), wk = 0.0023810 k( 214) = ( 0.2800000 -0.0000000 0.5000000), wk = 0.0023810 k( 215) = ( 0.2900000 -0.0000000 0.5000000), wk = 0.0023810 k( 216) = ( 0.3000000 0.0000000 0.5000000), wk = 0.0023810 k( 217) = ( 0.3100000 0.0000000 0.5000000), wk = 0.0023810 k( 218) = ( 0.3200000 -0.0000000 0.5000000), wk = 0.0023810 k( 219) = ( 0.3300000 -0.0000000 0.5000000), wk = 0.0023810 k( 220) = ( 0.3400000 0.0000000 0.5000000), wk = 0.0023810 k( 221) = ( 0.3500000 -0.0000000 0.5000000), wk = 0.0023810 k( 222) = ( 0.3600000 0.0000000 0.5000000), wk = 0.0023810 k( 223) = ( 0.3700000 0.0000000 0.5000000), wk = 0.0023810 k( 224) = ( 0.3800000 -0.0000000 0.5000000), wk = 0.0023810 k( 225) = ( 0.3900000 -0.0000000 0.5000000), wk = 0.0023810 k( 226) = ( 0.4000000 -0.0000000 0.5000000), wk = 0.0023810 k( 227) = ( 0.4100000 0.0000000 0.5000000), wk = 0.0023810 k( 228) = ( 0.4200000 -0.0000000 0.5000000), wk = 0.0023810 k( 229) = ( 0.4300000 0.0000000 0.5000000), wk = 0.0023810 k( 230) = ( 0.4400000 -0.0000000 0.5000000), wk = 0.0023810 k( 231) = ( 0.4500000 -0.0000000 0.5000000), wk = 0.0023810 k( 232) = ( 0.4600000 -0.0000000 0.5000000), wk = 0.0023810 k( 233) = ( 0.4700000 0.0000000 0.5000000), wk = 0.0023810 k( 234) = ( 0.4800000 -0.0000000 0.5000000), wk = 0.0023810 k( 235) = ( 0.4900000 0.0000000 0.5000000), wk = 0.0023810 k( 236) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023810 k( 237) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023810 k( 238) = ( 0.5000000 0.0178571 0.5000000), wk = 0.0023810 k( 239) = ( 0.5000000 0.0357143 0.5000000), wk = 0.0023810 k( 240) = ( 0.5000000 0.0535714 0.5000000), wk = 0.0023810 k( 241) = ( 0.5000000 0.0714286 0.5000000), wk = 0.0023810 k( 242) = ( 0.5000000 0.0892857 0.5000000), wk = 0.0023810 k( 243) = ( 0.5000000 0.1071429 0.5000000), wk = 0.0023810 k( 244) = ( 0.5000000 0.1250000 0.5000000), wk = 0.0023810 k( 245) = ( 0.5000000 0.1428571 0.5000000), wk = 0.0023810 k( 246) = ( 0.5000000 0.1607143 0.5000000), wk = 0.0023810 k( 247) = ( 0.5000000 0.1785714 0.5000000), wk = 0.0023810 k( 248) = ( 0.5000000 0.1964286 0.5000000), wk = 0.0023810 k( 249) = ( 0.5000000 0.2142857 0.5000000), wk = 0.0023810 k( 250) = ( 0.5000000 0.2321429 0.5000000), wk = 0.0023810 k( 251) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0023810 k( 252) = ( 0.5000000 0.2678571 0.5000000), wk = 0.0023810 k( 253) = ( 0.5000000 0.2857143 0.5000000), wk = 0.0023810 k( 254) = ( 0.5000000 0.3035714 0.5000000), wk = 0.0023810 k( 255) = ( 0.5000000 0.3214286 0.5000000), wk = 0.0023810 k( 256) = ( 0.5000000 0.3392857 0.5000000), wk = 0.0023810 k( 257) = ( 0.5000000 0.3571429 0.5000000), wk = 0.0023810 k( 258) = ( 0.5000000 0.3750000 0.5000000), wk = 0.0023810 k( 259) = ( 0.5000000 0.3928571 0.5000000), wk = 0.0023810 k( 260) = ( 0.5000000 0.4107143 0.5000000), wk = 0.0023810 k( 261) = ( 0.5000000 0.4285714 0.5000000), wk = 0.0023810 k( 262) = ( 0.5000000 0.4464286 0.5000000), wk = 0.0023810 k( 263) = ( 0.5000000 0.4642857 0.5000000), wk = 0.0023810 k( 264) = ( 0.5000000 0.4821429 0.5000000), wk = 0.0023810 k( 265) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023810 k( 266) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023810 k( 267) = ( 0.4900000 0.5000000 0.5000000), wk = 0.0023810 k( 268) = ( 0.4800000 0.5000000 0.5000000), wk = 0.0023810 k( 269) = ( 0.4700000 0.5000000 0.5000000), wk = 0.0023810 k( 270) = ( 0.4600000 0.5000000 0.5000000), wk = 0.0023810 k( 271) = ( 0.4500000 0.5000000 0.5000000), wk = 0.0023810 k( 272) = ( 0.4400000 0.5000000 0.5000000), wk = 0.0023810 k( 273) = ( 0.4300000 0.5000000 0.5000000), wk = 0.0023810 k( 274) = ( 0.4200000 0.5000000 0.5000000), wk = 0.0023810 k( 275) = ( 0.4100000 0.5000000 0.5000000), wk = 0.0023810 k( 276) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0023810 k( 277) = ( 0.3900000 0.5000000 0.5000000), wk = 0.0023810 k( 278) = ( 0.3800000 0.5000000 0.5000000), wk = 0.0023810 k( 279) = ( 0.3700000 0.5000000 0.5000000), wk = 0.0023810 k( 280) = ( 0.3600000 0.5000000 0.5000000), wk = 0.0023810 k( 281) = ( 0.3500000 0.5000000 0.5000000), wk = 0.0023810 k( 282) = ( 0.3400000 0.5000000 0.5000000), wk = 0.0023810 k( 283) = ( 0.3300000 0.5000000 0.5000000), wk = 0.0023810 k( 284) = ( 0.3200000 0.5000000 0.5000000), wk = 0.0023810 k( 285) = ( 0.3100000 0.5000000 0.5000000), wk = 0.0023810 k( 286) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0023810 k( 287) = ( 0.2900000 0.5000000 0.5000000), wk = 0.0023810 k( 288) = ( 0.2800000 0.5000000 0.5000000), wk = 0.0023810 k( 289) = ( 0.2700000 0.5000000 0.5000000), wk = 0.0023810 k( 290) = ( 0.2600000 0.5000000 0.5000000), wk = 0.0023810 k( 291) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0023810 k( 292) = ( 0.2400000 0.5000000 0.5000000), wk = 0.0023810 k( 293) = ( 0.2300000 0.5000000 0.5000000), wk = 0.0023810 k( 294) = ( 0.2200000 0.5000000 0.5000000), wk = 0.0023810 k( 295) = ( 0.2100000 0.5000000 0.5000000), wk = 0.0023810 k( 296) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0023810 k( 297) = ( 0.1900000 0.5000000 0.5000000), wk = 0.0023810 k( 298) = ( 0.1800000 0.5000000 0.5000000), wk = 0.0023810 k( 299) = ( 0.1700000 0.5000000 0.5000000), wk = 0.0023810 k( 300) = ( 0.1600000 0.5000000 0.5000000), wk = 0.0023810 k( 301) = ( 0.1500000 0.5000000 0.5000000), wk = 0.0023810 k( 302) = ( 0.1400000 0.5000000 0.5000000), wk = 0.0023810 k( 303) = ( 0.1300000 0.5000000 0.5000000), wk = 0.0023810 k( 304) = ( 0.1200000 0.5000000 0.5000000), wk = 0.0023810 k( 305) = ( 0.1100000 0.5000000 0.5000000), wk = 0.0023810 k( 306) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0023810 k( 307) = ( 0.0900000 0.5000000 0.5000000), wk = 0.0023810 k( 308) = ( 0.0800000 0.5000000 0.5000000), wk = 0.0023810 k( 309) = ( 0.0700000 0.5000000 0.5000000), wk = 0.0023810 k( 310) = ( 0.0600000 0.5000000 0.5000000), wk = 0.0023810 k( 311) = ( 0.0500000 0.5000000 0.5000000), wk = 0.0023810 k( 312) = ( 0.0400000 0.5000000 0.5000000), wk = 0.0023810 k( 313) = ( 0.0300000 0.5000000 0.5000000), wk = 0.0023810 k( 314) = ( 0.0200000 0.5000000 0.5000000), wk = 0.0023810 k( 315) = ( 0.0100000 0.5000000 0.5000000), wk = 0.0023810 k( 316) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023810 k( 317) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023810 k( 318) = ( 0.0000000 0.4821429 0.5000000), wk = 0.0023810 k( 319) = ( 0.0000000 0.4642857 0.5000000), wk = 0.0023810 k( 320) = ( 0.0000000 0.4464286 0.5000000), wk = 0.0023810 k( 321) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0023810 k( 322) = ( 0.0000000 0.4107143 0.5000000), wk = 0.0023810 k( 323) = ( 0.0000000 0.3928571 0.5000000), wk = 0.0023810 k( 324) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0023810 k( 325) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0023810 k( 326) = ( 0.0000000 0.3392857 0.5000000), wk = 0.0023810 k( 327) = ( 0.0000000 0.3214286 0.5000000), wk = 0.0023810 k( 328) = ( 0.0000000 0.3035714 0.5000000), wk = 0.0023810 k( 329) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0023810 k( 330) = ( 0.0000000 0.2678571 0.5000000), wk = 0.0023810 k( 331) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0023810 k( 332) = ( 0.0000000 0.2321429 0.5000000), wk = 0.0023810 k( 333) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0023810 k( 334) = ( 0.0000000 0.1964286 0.5000000), wk = 0.0023810 k( 335) = ( 0.0000000 0.1785714 0.5000000), wk = 0.0023810 k( 336) = ( 0.0000000 0.1607143 0.5000000), wk = 0.0023810 k( 337) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0023810 k( 338) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0023810 k( 339) = ( 0.0000000 0.1071429 0.5000000), wk = 0.0023810 k( 340) = ( 0.0000000 0.0892857 0.5000000), wk = 0.0023810 k( 341) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0023810 k( 342) = ( 0.0000000 0.0535714 0.5000000), wk = 0.0023810 k( 343) = ( 0.0000000 0.0357143 0.5000000), wk = 0.0023810 k( 344) = ( 0.0000000 0.0178571 0.5000000), wk = 0.0023810 k( 345) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023810 k( 346) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023810 k( 347) = ( 0.0000000 0.5000000 0.0208333), wk = 0.0023810 k( 348) = ( 0.0000000 0.5000000 0.0416667), wk = 0.0023810 k( 349) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0023810 k( 350) = ( 0.0000000 0.5000000 0.0833333), wk = 0.0023810 k( 351) = ( 0.0000000 0.5000000 0.1041667), wk = 0.0023810 k( 352) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0023810 k( 353) = ( 0.0000000 0.5000000 0.1458333), wk = 0.0023810 k( 354) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0023810 k( 355) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0023810 k( 356) = ( 0.0000000 0.5000000 0.2083333), wk = 0.0023810 k( 357) = ( 0.0000000 0.5000000 0.2291667), wk = 0.0023810 k( 358) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0023810 k( 359) = ( 0.0000000 0.5000000 0.2708333), wk = 0.0023810 k( 360) = ( 0.0000000 0.5000000 0.2916667), wk = 0.0023810 k( 361) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0023810 k( 362) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0023810 k( 363) = ( 0.0000000 0.5000000 0.3541667), wk = 0.0023810 k( 364) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0023810 k( 365) = ( 0.0000000 0.5000000 0.3958333), wk = 0.0023810 k( 366) = ( 0.0000000 0.5000000 0.4166667), wk = 0.0023810 k( 367) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0023810 k( 368) = ( 0.0000000 0.5000000 0.4583333), wk = 0.0023810 k( 369) = ( 0.0000000 0.5000000 0.4791667), wk = 0.0023810 k( 370) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023810 k( 371) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023810 k( 372) = ( 0.5000000 0.0000000 0.4791667), wk = 0.0023810 k( 373) = ( 0.5000000 0.0000000 0.4583333), wk = 0.0023810 k( 374) = ( 0.5000000 0.0000000 0.4375000), wk = 0.0023810 k( 375) = ( 0.5000000 0.0000000 0.4166667), wk = 0.0023810 k( 376) = ( 0.5000000 0.0000000 0.3958333), wk = 0.0023810 k( 377) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0023810 k( 378) = ( 0.5000000 0.0000000 0.3541667), wk = 0.0023810 k( 379) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0023810 k( 380) = ( 0.5000000 0.0000000 0.3125000), wk = 0.0023810 k( 381) = ( 0.5000000 0.0000000 0.2916667), wk = 0.0023810 k( 382) = ( 0.5000000 0.0000000 0.2708333), wk = 0.0023810 k( 383) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0023810 k( 384) = ( 0.5000000 0.0000000 0.2291667), wk = 0.0023810 k( 385) = ( 0.5000000 0.0000000 0.2083333), wk = 0.0023810 k( 386) = ( 0.5000000 0.0000000 0.1875000), wk = 0.0023810 k( 387) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0023810 k( 388) = ( 0.5000000 0.0000000 0.1458333), wk = 0.0023810 k( 389) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0023810 k( 390) = ( 0.5000000 0.0000000 0.1041667), wk = 0.0023810 k( 391) = ( 0.5000000 0.0000000 0.0833333), wk = 0.0023810 k( 392) = ( 0.5000000 0.0000000 0.0625000), wk = 0.0023810 k( 393) = ( 0.5000000 0.0000000 0.0416667), wk = 0.0023810 k( 394) = ( 0.5000000 0.0000000 0.0208333), wk = 0.0023810 k( 395) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0023810 k( 396) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023810 k( 397) = ( 0.5000000 0.5000000 0.0208333), wk = 0.0023810 k( 398) = ( 0.5000000 0.5000000 0.0416667), wk = 0.0023810 k( 399) = ( 0.5000000 0.5000000 0.0625000), wk = 0.0023810 k( 400) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0023810 k( 401) = ( 0.5000000 0.5000000 0.1041667), wk = 0.0023810 k( 402) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0023810 k( 403) = ( 0.5000000 0.5000000 0.1458333), wk = 0.0023810 k( 404) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0023810 k( 405) = ( 0.5000000 0.5000000 0.1875000), wk = 0.0023810 k( 406) = ( 0.5000000 0.5000000 0.2083333), wk = 0.0023810 k( 407) = ( 0.5000000 0.5000000 0.2291667), wk = 0.0023810 k( 408) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0023810 k( 409) = ( 0.5000000 0.5000000 0.2708333), wk = 0.0023810 k( 410) = ( 0.5000000 0.5000000 0.2916667), wk = 0.0023810 k( 411) = ( 0.5000000 0.5000000 0.3125000), wk = 0.0023810 k( 412) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0023810 k( 413) = ( 0.5000000 0.5000000 0.3541667), wk = 0.0023810 k( 414) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0023810 k( 415) = ( 0.5000000 0.5000000 0.3958333), wk = 0.0023810 k( 416) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0023810 k( 417) = ( 0.5000000 0.5000000 0.4375000), wk = 0.0023810 k( 418) = ( 0.5000000 0.5000000 0.4583333), wk = 0.0023810 k( 419) = ( 0.5000000 0.5000000 0.4791667), wk = 0.0023810 k( 420) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023810 Dense grid: 100891 G-vectors FFT dimensions: ( 40, 72, 80) Smooth grid: 79845 G-vectors FFT dimensions: ( 36, 64, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.72 Mb ( 288, 164) NL pseudopotentials 0.72 Mb ( 144, 328) Each V/rho on FFT grid 0.09 Mb ( 5760) Each G-vector array 0.01 Mb ( 1399) G-vector shells 0.01 Mb ( 713) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.88 Mb ( 288, 656) Each subspace H/S matrix 0.18 Mb ( 109, 109) Each matrix 1.64 Mb ( 328, 2, 164) The potential is recalculated from file : ./CoBW.save/charge-density.dat negative rho (up, down): 1.971E+02 0.000E+00 Starting wfc are 216 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 11.4 secs Computing kpt #: 2 total cpu time spent up to now is 20.1 secs Computing kpt #: 3 total cpu time spent up to now is 27.1 secs Computing kpt #: 4 total cpu time spent up to now is 34.1 secs Computing kpt #: 5 total cpu time spent up to now is 42.3 secs Computing kpt #: 6 total cpu time spent up to now is 49.6 secs Computing kpt #: 7 total cpu time spent up to now is 56.8 secs Computing kpt #: 8 total cpu time spent up to now is 63.9 secs Computing kpt #: 9 total cpu time spent up to now is 70.8 secs Computing kpt #: 10 total cpu time spent up to now is 77.8 secs Computing kpt #: 11 total cpu time spent up to now is 84.6 secs Computing kpt #: 12 total cpu time spent up to now is 91.7 secs Computing kpt #: 13 total cpu time spent up to now is 99.6 secs Computing kpt #: 14 total cpu time spent up to now is 107.5 secs Computing kpt #: 15 total cpu time spent up to now is 115.0 secs Computing kpt #: 16 total cpu time spent up to now is 122.2 secs Computing kpt #: 17 total cpu time spent up to now is 129.4 secs Computing kpt #: 18 total cpu time spent up to now is 136.8 secs Computing kpt #: 19 total cpu time spent up to now is 143.9 secs Computing kpt #: 20 total cpu time spent up to now is 151.3 secs Computing kpt #: 21 total cpu time spent up to now is 161.8 secs Computing kpt #: 22 total cpu time spent up to now is 172.6 secs Computing kpt #: 23 total cpu time spent up to now is 181.0 secs Computing kpt #: 24 total cpu time spent up to now is 188.1 secs Computing kpt #: 25 total cpu time spent up to now is 196.1 secs Computing kpt #: 26 total cpu time spent up to now is 203.7 secs Computing kpt #: 27 total cpu time spent up to now is 209.6 secs Computing kpt #: 28 total cpu time spent up to now is 217.1 secs Computing kpt #: 29 total cpu time spent up to now is 225.6 secs Computing kpt #: 30 total cpu time spent up to now is 234.4 secs Computing kpt #: 31 total cpu time spent up to now is 244.5 secs Computing kpt #: 32 total cpu time spent up to now is 255.0 secs Computing kpt #: 33 total cpu time spent up to now is 264.6 secs Computing kpt #: 34 total cpu time spent up to now is 274.2 secs Computing kpt #: 35 total cpu time spent up to now is 283.5 secs Computing kpt #: 36 total cpu time spent up to now is 294.0 secs Computing kpt #: 37 total cpu time spent up to now is 302.6 secs Computing kpt #: 38 total cpu time spent up to now is 313.7 secs Computing kpt #: 39 total cpu time spent up to now is 322.6 secs Computing kpt #: 40 total cpu time spent up to now is 331.2 secs Computing kpt #: 41 total cpu time spent up to now is 340.2 secs Computing kpt #: 42 total cpu time spent up to now is 348.6 secs Computing kpt #: 43 total cpu time spent up to now is 356.5 secs Computing kpt #: 44 total cpu time spent up to now is 364.6 secs Computing kpt #: 45 total cpu time spent up to now is 373.6 secs Computing kpt #: 46 total cpu time spent up to now is 382.9 secs Computing kpt #: 47 total cpu time spent up to now is 393.3 secs Computing kpt #: 48 total cpu time spent up to now is 401.9 secs Computing kpt #: 49 total cpu time spent up to now is 410.4 secs Computing kpt #: 50 total cpu time spent up to now is 419.9 secs Computing kpt #: 51 total cpu time spent up to now is 426.8 secs Computing kpt #: 52 total cpu time spent up to now is 436.8 secs Computing kpt #: 53 total cpu time spent up to now is 444.6 secs Computing kpt #: 54 total cpu time spent up to now is 455.5 secs Computing kpt #: 55 total cpu time spent up to now is 462.9 secs Computing kpt #: 56 total cpu time spent up to now is 471.7 secs Computing kpt #: 57 total cpu time spent up to now is 481.5 secs Computing kpt #: 58 total cpu time spent up to now is 490.9 secs Computing kpt #: 59 total cpu time spent up to now is 500.9 secs Computing kpt #: 60 total cpu time spent up to now is 510.7 secs Computing kpt #: 61 total cpu time spent up to now is 521.3 secs Computing kpt #: 62 total cpu time spent up to now is 534.9 secs Computing kpt #: 63 total cpu time spent up to now is 546.5 secs Computing kpt #: 64 total cpu time spent up to now is 559.3 secs Computing kpt #: 65 total cpu time spent up to now is 571.4 secs Computing kpt #: 66 total cpu time spent up to now is 587.6 secs Computing kpt #: 67 total cpu time spent up to now is 604.4 secs Computing kpt #: 68 total cpu time spent up to now is 617.5 secs Computing kpt #: 69 total cpu time spent up to now is 630.5 secs Computing kpt #: 70 total cpu time spent up to now is 644.2 secs Computing kpt #: 71 total cpu time spent up to now is 658.1 secs Computing kpt #: 72 total cpu time spent up to now is 671.4 secs Computing kpt #: 73 total cpu time spent up to now is 683.2 secs Computing kpt #: 74 total cpu time spent up to now is 695.6 secs Computing kpt #: 75 total cpu time spent up to now is 708.1 secs Computing kpt #: 76 total cpu time spent up to now is 720.3 secs Computing kpt #: 77 total cpu time spent up to now is 731.8 secs Computing kpt #: 78 total cpu time spent up to now is 743.9 secs Computing kpt #: 79 total cpu time spent up to now is 754.7 secs Computing kpt #: 80 total cpu time spent up to now is 764.8 secs Computing kpt #: 81 total cpu time spent up to now is 774.3 secs Computing kpt #: 82 total cpu time spent up to now is 786.5 secs Computing kpt #: 83 total cpu time spent up to now is 801.8 secs Computing kpt #: 84 total cpu time spent up to now is 815.2 secs Computing kpt #: 85 total cpu time spent up to now is 828.7 secs Computing kpt #: 86 total cpu time spent up to now is 839.7 secs Computing kpt #: 87 total cpu time spent up to now is 851.2 secs Computing kpt #: 88 total cpu time spent up to now is 861.0 secs Computing kpt #: 89 total cpu time spent up to now is 871.6 secs Computing kpt #: 90 total cpu time spent up to now is 883.1 secs Computing kpt #: 91 total cpu time spent up to now is 892.9 secs Computing kpt #: 92 total cpu time spent up to now is 903.0 secs Computing kpt #: 93 total cpu time spent up to now is 915.4 secs Computing kpt #: 94 total cpu time spent up to now is 931.2 secs Computing kpt #: 95 total cpu time spent up to now is 944.0 secs Computing kpt #: 96 total cpu time spent up to now is 956.8 secs Computing kpt #: 97 total cpu time spent up to now is 969.7 secs Computing kpt #: 98 total cpu time spent up to now is 980.5 secs Computing kpt #: 99 total cpu time spent up to now is 990.3 secs Computing kpt #: 100 total cpu time spent up to now is 1000.8 secs Computing kpt #: 101 total cpu time spent up to now is 1010.9 secs Computing kpt #: 102 total cpu time spent up to now is 1022.2 secs Computing kpt #: 103 total cpu time spent up to now is 1031.7 secs Computing kpt #: 104 total cpu time spent up to now is 1040.5 secs Computing kpt #: 105 total cpu time spent up to now is 1050.1 secs Computing kpt #: 106 total cpu time spent up to now is 1056.9 secs Computing kpt #: 107 total cpu time spent up to now is 1063.9 secs Computing kpt #: 108 total cpu time spent up to now is 1070.5 secs Computing kpt #: 109 total cpu time spent up to now is 1077.0 secs Computing kpt #: 110 total cpu time spent up to now is 1084.1 secs Computing kpt #: 111 total cpu time spent up to now is 1091.5 secs Computing kpt #: 112 total cpu time spent up to now is 1098.7 secs Computing kpt #: 113 total cpu time spent up to now is 1105.8 secs Computing kpt #: 114 total cpu time spent up to now is 1113.0 secs Computing kpt #: 115 total cpu time spent up to now is 1119.7 secs Computing kpt #: 116 total cpu time spent up to now is 1126.6 secs Computing kpt #: 117 total cpu time spent up to now is 1134.4 secs Computing kpt #: 118 total cpu time spent up to now is 1141.7 secs Computing kpt #: 119 total cpu time spent up to now is 1149.6 secs Computing kpt #: 120 total cpu time spent up to now is 1157.1 secs Computing kpt #: 121 total cpu time spent up to now is 1163.8 secs Computing kpt #: 122 total cpu time spent up to now is 1170.5 secs Computing kpt #: 123 total cpu time spent up to now is 1176.7 secs Computing kpt #: 124 total cpu time spent up to now is 1183.4 secs Computing kpt #: 125 total cpu time spent up to now is 1189.8 secs Computing kpt #: 126 total cpu time spent up to now is 1196.0 secs Computing kpt #: 127 total cpu time spent up to now is 1201.7 secs Computing kpt #: 128 total cpu time spent up to now is 1208.0 secs Computing kpt #: 129 total cpu time spent up to now is 1214.5 secs Computing kpt #: 130 total cpu time spent up to now is 1221.2 secs Computing kpt #: 131 total cpu time spent up to now is 1228.1 secs Computing kpt #: 132 total cpu time spent up to now is 1234.6 secs Computing kpt #: 133 total cpu time spent up to now is 1241.2 secs Computing kpt #: 134 total cpu time spent up to now is 1248.4 secs Computing kpt #: 135 total cpu time spent up to now is 1256.0 secs Computing kpt #: 136 total cpu time spent up to now is 1264.3 secs Computing kpt #: 137 total cpu time spent up to now is 1273.7 secs Computing kpt #: 138 total cpu time spent up to now is 1284.5 secs Computing kpt #: 139 total cpu time spent up to now is 1297.6 secs Computing kpt #: 140 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1317.1 secs Computing kpt #: 141 total cpu time spent up to now is 1328.1 secs Computing kpt #: 142 total cpu time spent up to now is 1338.9 secs Computing kpt #: 143 total cpu time spent up to now is 1348.1 secs Computing kpt #: 144 total cpu time spent up to now is 1356.7 secs Computing kpt #: 145 total cpu time spent up to now is 1365.6 secs Computing kpt #: 146 total cpu time spent up to now is 1375.8 secs Computing kpt #: 147 total cpu time spent up to now is 1387.6 secs Computing kpt #: 148 total cpu time spent up to now is 1397.3 secs Computing kpt #: 149 total cpu time spent up to now is 1406.2 secs Computing kpt #: 150 total cpu time spent up to now is 1416.4 secs Computing kpt #: 151 total cpu time spent up to now is 1426.6 secs Computing kpt #: 152 total cpu time spent up to now is 1435.8 secs Computing kpt #: 153 total cpu time spent up to now is 1445.7 secs Computing kpt #: 154 total cpu time spent up to now is 1454.6 secs Computing kpt #: 155 total cpu time spent up to now is 1463.1 secs Computing kpt #: 156 total cpu time spent up to now is 1471.9 secs Computing kpt #: 157 total cpu time spent up to now is 1480.1 secs Computing kpt #: 158 total cpu time spent up to now is 1488.9 secs Computing kpt #: 159 total cpu time spent up to now is 1498.7 secs Computing kpt #: 160 total cpu time spent up to now is 1508.7 secs Computing kpt #: 161 total cpu time spent up to now is 1518.5 secs Computing kpt #: 162 total cpu time spent up to now is 1528.2 secs Computing kpt #: 163 total cpu time spent up to now is 1536.8 secs Computing kpt #: 164 total cpu time spent up to now is 1543.9 secs Computing kpt #: 165 total cpu time spent up to now is 1551.1 secs Computing kpt #: 166 total cpu time spent up to now is 1558.3 secs Computing kpt #: 167 total cpu time spent up to now is 1566.0 secs Computing kpt #: 168 total cpu time spent up to now is 1573.4 secs Computing kpt #: 169 total cpu time spent up to now is 1586.5 secs Computing kpt #: 170 total cpu time spent up to now is 1596.2 secs Computing kpt #: 171 total cpu time spent up to now is 1608.7 secs Computing kpt #: 172 total cpu time spent up to now is 1625.4 secs Computing kpt #: 173 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1646.1 secs Computing kpt #: 174 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1665.4 secs Computing kpt #: 175 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1686.6 secs Computing kpt #: 176 total cpu time spent up to now is 1705.8 secs Computing kpt #: 177 total cpu time spent up to now is 1715.5 secs Computing kpt #: 178 total cpu time spent up to now is 1725.7 secs Computing kpt #: 179 total cpu time spent up to now is 1734.4 secs Computing kpt #: 180 total cpu time spent up to now is 1743.0 secs Computing kpt #: 181 total cpu time spent up to now is 1750.6 secs Computing kpt #: 182 total cpu time spent up to now is 1759.0 secs Computing kpt #: 183 total cpu time spent up to now is 1766.8 secs Computing kpt #: 184 total cpu time spent up to now is 1776.7 secs Computing kpt #: 185 total cpu time spent up to now is 1787.2 secs Computing kpt #: 186 total cpu time spent up to now is 1798.1 secs Computing kpt #: 187 total cpu time spent up to now is 1807.8 secs Computing kpt #: 188 total cpu time spent up to now is 1818.4 secs Computing kpt #: 189 total cpu time spent up to now is 1827.0 secs Computing kpt #: 190 total cpu time spent up to now is 1837.4 secs Computing kpt #: 191 total cpu time spent up to now is 1844.8 secs Computing kpt #: 192 total cpu time spent up to now is 1854.9 secs Computing kpt #: 193 total cpu time spent up to now is 1864.1 secs Computing kpt #: 194 total cpu time spent up to now is 1873.4 secs Computing kpt #: 195 total cpu time spent up to now is 1882.3 secs Computing kpt #: 196 total cpu time spent up to now is 1891.1 secs Computing kpt #: 197 total cpu time spent up to now is 1900.2 secs Computing kpt #: 198 total cpu time spent up to now is 1909.8 secs Computing kpt #: 199 total cpu time spent up to now is 1919.0 secs Computing kpt #: 200 total cpu time spent up to now is 1928.5 secs Computing kpt #: 201 total cpu time spent up to now is 1937.6 secs Computing kpt #: 202 total cpu time spent up to now is 1946.4 secs Computing kpt #: 203 total cpu time spent up to now is 1957.0 secs Computing kpt #: 204 total cpu time spent up to now is 1967.3 secs Computing kpt #: 205 total cpu time spent up to now is 1977.9 secs Computing kpt #: 206 total cpu time spent up to now is 1987.3 secs Computing kpt #: 207 total cpu time spent up to now is 1996.7 secs Computing kpt #: 208 total cpu time spent up to now is 2006.1 secs Computing kpt #: 209 total cpu time spent up to now is 2015.6 secs Computing kpt #: 210 total cpu time spent up to now is 2024.1 secs Computing kpt #: 211 total cpu time spent up to now is 2033.5 secs Computing kpt #: 212 total cpu time spent up to now is 2041.6 secs Computing kpt #: 213 total cpu time spent up to now is 2049.6 secs Computing kpt #: 214 total cpu time spent up to now is 2056.6 secs Computing kpt #: 215 total cpu time spent up to now is 2064.2 secs Computing kpt #: 216 total cpu time spent up to now is 2072.4 secs Computing kpt #: 217 total cpu time spent up to now is 2081.0 secs Computing kpt #: 218 total cpu time spent up to now is 2088.8 secs Computing kpt #: 219 total cpu time spent up to now is 2096.7 secs Computing kpt #: 220 total cpu time spent up to now is 2104.4 secs Computing kpt #: 221 total cpu time spent up to now is 2112.4 secs Computing kpt #: 222 total cpu time spent up to now is 2121.0 secs Computing kpt #: 223 total cpu time spent up to now is 2130.3 secs Computing kpt #: 224 total cpu time spent up to now is 2140.2 secs Computing kpt #: 225 total cpu time spent up to now is 2149.5 secs Computing kpt #: 226 total cpu time spent up to now is 2157.5 secs Computing kpt #: 227 total cpu time spent up to now is 2166.9 secs Computing kpt #: 228 total cpu time spent up to now is 2178.0 secs Computing kpt #: 229 total cpu time spent up to now is 2189.9 secs Computing kpt #: 230 total cpu time spent up to now is 2199.8 secs Computing kpt #: 231 total cpu time spent up to now is 2209.8 secs Computing kpt #: 232 total cpu time spent up to now is 2218.6 secs Computing kpt #: 233 total cpu time spent up to now is 2227.9 secs Computing kpt #: 234 total cpu time spent up to now is 2237.3 secs Computing kpt #: 235 total cpu time spent up to now is 2247.2 secs Computing kpt #: 236 total cpu time spent up to now is 2256.1 secs Computing kpt #: 237 total cpu time spent up to now is 2265.2 secs Computing kpt #: 238 total cpu time spent up to now is 2274.9 secs Computing kpt #: 239 total cpu time spent up to now is 2284.4 secs Computing kpt #: 240 total cpu time spent up to now is 2293.9 secs Computing kpt #: 241 total cpu time spent up to now is 2304.4 secs Computing kpt #: 242 total cpu time spent up to now is 2313.8 secs Computing kpt #: 243 total cpu time spent up to now is 2323.5 secs Computing kpt #: 244 total cpu time spent up to now is 2333.6 secs Computing kpt #: 245 total cpu time spent up to now is 2345.1 secs Computing kpt #: 246 total cpu time spent up to now is 2356.9 secs Computing kpt #: 247 total cpu time spent up to now is 2366.5 secs Computing kpt #: 248 total cpu time spent up to now is 2375.9 secs Computing kpt #: 249 total cpu time spent up to now is 2384.1 secs Computing kpt #: 250 total cpu time spent up to now is 2392.6 secs Computing kpt #: 251 total cpu time spent up to now is 2401.5 secs Computing kpt #: 252 total cpu time spent up to now is 2411.0 secs Computing kpt #: 253 total cpu time spent up to now is 2420.0 secs Computing kpt #: 254 total cpu time spent up to now is 2428.7 secs Computing kpt #: 255 total cpu time spent up to now is 2437.6 secs Computing kpt #: 256 total cpu time spent up to now is 2446.3 secs Computing kpt #: 257 total cpu time spent up to now is 2455.1 secs Computing kpt #: 258 total cpu time spent up to now is 2464.9 secs Computing kpt #: 259 total cpu time spent up to now is 2474.5 secs Computing kpt #: 260 total cpu time spent up to now is 2484.6 secs Computing kpt #: 261 total cpu time spent up to now is 2494.1 secs Computing kpt #: 262 total cpu time spent up to now is 2502.8 secs Computing kpt #: 263 total cpu time spent up to now is 2512.0 secs Computing kpt #: 264 total cpu time spent up to now is 2522.9 secs Computing kpt #: 265 total cpu time spent up to now is 2533.5 secs Computing kpt #: 266 total cpu time spent up to now is 2543.2 secs Computing kpt #: 267 total cpu time spent up to now is 2552.8 secs Computing kpt #: 268 total cpu time spent up to now is 2560.9 secs Computing kpt #: 269 total cpu time spent up to now is 2570.1 secs Computing kpt #: 270 total cpu time spent up to now is 2579.8 secs Computing kpt #: 271 total cpu time spent up to now is 2589.4 secs Computing kpt #: 272 total cpu time spent up to now is 2598.6 secs Computing kpt #: 273 total cpu time spent up to now is 2607.5 secs Computing kpt #: 274 total cpu time spent up to now is 2616.6 secs Computing kpt #: 275 total cpu time spent up to now is 2625.4 secs Computing kpt #: 276 total cpu time spent up to now is 2634.7 secs Computing kpt #: 277 total cpu time spent up to now is 2643.5 secs Computing kpt #: 278 total cpu time spent up to now is 2654.7 secs Computing kpt #: 279 total cpu time spent up to now is 2661.5 secs Computing kpt #: 280 total cpu time spent up to now is 2668.4 secs Computing kpt #: 281 total cpu time spent up to now is 2676.0 secs Computing kpt #: 282 total cpu time spent up to now is 2683.8 secs Computing kpt #: 283 total cpu time spent up to now is 2691.3 secs Computing kpt #: 284 total cpu time spent up to now is 2698.8 secs Computing kpt #: 285 total cpu time spent up to now is 2705.8 secs Computing kpt #: 286 total cpu time spent up to now is 2712.4 secs Computing kpt #: 287 total cpu time spent up to now is 2718.6 secs Computing kpt #: 288 total cpu time spent up to now is 2725.2 secs Computing kpt #: 289 total cpu time spent up to now is 2731.8 secs Computing kpt #: 290 total cpu time spent up to now is 2739.5 secs Computing kpt #: 291 total cpu time spent up to now is 2746.2 secs Computing kpt #: 292 total cpu time spent up to now is 2753.8 secs Computing kpt #: 293 total cpu time spent up to now is 2761.0 secs Computing kpt #: 294 total cpu time spent up to now is 2767.7 secs Computing kpt #: 295 total cpu time spent up to now is 2774.3 secs Computing kpt #: 296 total cpu time spent up to now is 2783.4 secs Computing kpt #: 297 total cpu time spent up to now is 2792.3 secs Computing kpt #: 298 total cpu time spent up to now is 2801.0 secs Computing kpt #: 299 total cpu time spent up to now is 2810.1 secs Computing kpt #: 300 total cpu time spent up to now is 2819.1 secs Computing kpt #: 301 total cpu time spent up to now is 2828.0 secs Computing kpt #: 302 total cpu time spent up to now is 2837.4 secs Computing kpt #: 303 total cpu time spent up to now is 2847.0 secs Computing kpt #: 304 total cpu time spent up to now is 2857.1 secs Computing kpt #: 305 total cpu time spent up to now is 2868.0 secs Computing kpt #: 306 total cpu time spent up to now is 2878.7 secs Computing kpt #: 307 total cpu time spent up to now is 2888.8 secs Computing kpt #: 308 total cpu time spent up to now is 2899.0 secs Computing kpt #: 309 total cpu time spent up to now is 2910.5 secs Computing kpt #: 310 total cpu time spent up to now is 2920.3 secs Computing kpt #: 311 total cpu time spent up to now is 2932.0 secs Computing kpt #: 312 total cpu time spent up to now is 2941.9 secs Computing kpt #: 313 total cpu time spent up to now is 2954.2 secs Computing kpt #: 314 total cpu time spent up to now is 2966.6 secs Computing kpt #: 315 total cpu time spent up to now is 2980.5 secs Computing kpt #: 316 total cpu time spent up to now is 2992.9 secs Computing kpt #: 317 total cpu time spent up to now is 3004.5 secs Computing kpt #: 318 total cpu time spent up to now is 3015.4 secs Computing kpt #: 319 total cpu time spent up to now is 3024.6 secs Computing kpt #: 320 total cpu time spent up to now is 3034.4 secs Computing kpt #: 321 total cpu time spent up to now is 3042.7 secs Computing kpt #: 322 total cpu time spent up to now is 3050.9 secs Computing kpt #: 323 total cpu time spent up to now is 3057.9 secs Computing kpt #: 324 total cpu time spent up to now is 3065.4 secs Computing kpt #: 325 total cpu time spent up to now is 3074.6 secs Computing kpt #: 326 total cpu time spent up to now is 3083.7 secs Computing kpt #: 327 total cpu time spent up to now is 3090.8 secs Computing kpt #: 328 total cpu time spent up to now is 3097.4 secs Computing kpt #: 329 total cpu time spent up to now is 3104.0 secs Computing kpt #: 330 total cpu time spent up to now is 3110.9 secs Computing kpt #: 331 total cpu time spent up to now is 3117.6 secs Computing kpt #: 332 total cpu time spent up to now is 3124.5 secs Computing kpt #: 333 total cpu time spent up to now is 3131.7 secs Computing kpt #: 334 total cpu time spent up to now is 3139.2 secs Computing kpt #: 335 total cpu time spent up to now is 3146.4 secs Computing kpt #: 336 total cpu time spent up to now is 3153.7 secs Computing kpt #: 337 total cpu time spent up to now is 3160.7 secs Computing kpt #: 338 total cpu time spent up to now is 3167.5 secs Computing kpt #: 339 total cpu time spent up to now is 3174.6 secs Computing kpt #: 340 total cpu time spent up to now is 3181.8 secs Computing kpt #: 341 total cpu time spent up to now is 3189.6 secs Computing kpt #: 342 total cpu time spent up to now is 3196.8 secs Computing kpt #: 343 total cpu time spent up to now is 3205.7 secs Computing kpt #: 344 total cpu time spent up to now is 3213.9 secs Computing kpt #: 345 total cpu time spent up to now is 3222.9 secs Computing kpt #: 346 total cpu time spent up to now is 3230.1 secs Computing kpt #: 347 total cpu time spent up to now is 3237.3 secs Computing kpt #: 348 total cpu time spent up to now is 3244.7 secs Computing kpt #: 349 total cpu time spent up to now is 3251.8 secs Computing kpt #: 350 total cpu time spent up to now is 3259.2 secs Computing kpt #: 351 total cpu time spent up to now is 3266.3 secs Computing kpt #: 352 total cpu time spent up to now is 3273.0 secs Computing kpt #: 353 total cpu time spent up to now is 3279.9 secs Computing kpt #: 354 total cpu time spent up to now is 3286.6 secs Computing kpt #: 355 total cpu time spent up to now is 3293.9 secs Computing kpt #: 356 total cpu time spent up to now is 3301.9 secs Computing kpt #: 357 total cpu time spent up to now is 3309.5 secs Computing kpt #: 358 total cpu time spent up to now is 3316.7 secs Computing kpt #: 359 total cpu time spent up to now is 3323.4 secs Computing kpt #: 360 total cpu time spent up to now is 3330.0 secs Computing kpt #: 361 total cpu time spent up to now is 3336.5 secs Computing kpt #: 362 total cpu time spent up to now is 3343.3 secs Computing kpt #: 363 total cpu time spent up to now is 3350.6 secs Computing kpt #: 364 total cpu time spent up to now is 3361.3 secs Computing kpt #: 365 total cpu time spent up to now is 3369.9 secs Computing kpt #: 366 total cpu time spent up to now is 3378.8 secs Computing kpt #: 367 total cpu time spent up to now is 3387.5 secs Computing kpt #: 368 total cpu time spent up to now is 3396.6 secs Computing kpt #: 369 total cpu time spent up to now is 3406.9 secs Computing kpt #: 370 total cpu time spent up to now is 3421.4 secs Computing kpt #: 371 total cpu time spent up to now is 3430.5 secs Computing kpt #: 372 total cpu time spent up to now is 3440.3 secs Computing kpt #: 373 total cpu time spent up to now is 3450.2 secs Computing kpt #: 374 total cpu time spent up to now is 3460.2 secs Computing kpt #: 375 total cpu time spent up to now is 3469.3 secs Computing kpt #: 376 total cpu time spent up to now is 3478.0 secs Computing kpt #: 377 total cpu time spent up to now is 3487.2 secs Computing kpt #: 378 total cpu time spent up to now is 3497.0 secs Computing kpt #: 379 total cpu time spent up to now is 3505.8 secs Computing kpt #: 380 total cpu time spent up to now is 3515.6 secs Computing kpt #: 381 total cpu time spent up to now is 3524.8 secs Computing kpt #: 382 total cpu time spent up to now is 3534.5 secs Computing kpt #: 383 total cpu time spent up to now is 3543.2 secs Computing kpt #: 384 total cpu time spent up to now is 3549.9 secs Computing kpt #: 385 total cpu time spent up to now is 3559.2 secs Computing kpt #: 386 total cpu time spent up to now is 3567.2 secs Computing kpt #: 387 total cpu time spent up to now is 3574.6 secs Computing kpt #: 388 total cpu time spent up to now is 3581.7 secs Computing kpt #: 389 total cpu time spent up to now is 3591.3 secs Computing kpt #: 390 total cpu time spent up to now is 3598.2 secs Computing kpt #: 391 total cpu time spent up to now is 3607.4 secs Computing kpt #: 392 total cpu time spent up to now is 3616.3 secs Computing kpt #: 393 total cpu time spent up to now is 3626.3 secs Computing kpt #: 394 total cpu time spent up to now is 3635.0 secs Computing kpt #: 395 total cpu time spent up to now is 3641.4 secs Computing kpt #: 396 total cpu time spent up to now is 3651.4 secs Computing kpt #: 397 total cpu time spent up to now is 3663.2 secs Computing kpt #: 398 total cpu time spent up to now is 3673.9 secs Computing kpt #: 399 total cpu time spent up to now is 3685.5 secs Computing kpt #: 400 total cpu time spent up to now is 3698.2 secs Computing kpt #: 401 total cpu time spent up to now is 3712.8 secs Computing kpt #: 402 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3732.2 secs Computing kpt #: 403 total cpu time spent up to now is 3744.9 secs Computing kpt #: 404 total cpu time spent up to now is 3755.1 secs Computing kpt #: 405 total cpu time spent up to now is 3764.7 secs Computing kpt #: 406 total cpu time spent up to now is 3776.6 secs Computing kpt #: 407 total cpu time spent up to now is 3787.2 secs Computing kpt #: 408 total cpu time spent up to now is 3799.2 secs Computing kpt #: 409 total cpu time spent up to now is 3809.3 secs Computing kpt #: 410 total cpu time spent up to now is 3818.8 secs Computing kpt #: 411 total cpu time spent up to now is 3829.2 secs Computing kpt #: 412 total cpu time spent up to now is 3840.5 secs Computing kpt #: 413 total cpu time spent up to now is 3849.2 secs Computing kpt #: 414 total cpu time spent up to now is 3857.7 secs Computing kpt #: 415 total cpu time spent up to now is 3865.6 secs Computing kpt #: 416 total cpu time spent up to now is 3873.5 secs Computing kpt #: 417 total cpu time spent up to now is 3881.2 secs Computing kpt #: 418 total cpu time spent up to now is 3889.0 secs Computing kpt #: 419 total cpu time spent up to now is 3896.8 secs Computing kpt #: 420 total cpu time spent up to now is 3905.2 secs ethr = 7.35E-09, avg # of iterations = 38.4 total cpu time spent up to now is 3905.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 9957 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3956 -82.3956 -82.3955 -82.3955 -82.3513 -82.3513 -82.3498 -82.3498 -48.5199 -48.5199 -48.5195 -48.5195 -48.4339 -48.4339 -48.4316 -48.4316 -46.8897 -46.8897 -46.8887 -46.8887 -46.8101 -46.8101 -46.8072 -46.8072 -46.8022 -46.8022 -46.8010 -46.8010 -46.6847 -46.6847 -46.6826 -46.6826 -35.5566 -35.5566 -35.4066 -35.4066 -35.3940 -35.3940 -35.2582 -35.2582 -16.0606 -16.0606 -16.0029 -16.0029 -15.3489 -15.3489 -15.2565 -15.2565 -14.6121 -14.6121 -14.5812 -14.5812 -13.8808 -13.8808 -13.7926 -13.7926 -12.5290 -12.5290 -12.1850 -12.1850 -12.1816 -12.1816 -11.8653 -11.8653 -5.1266 -5.1266 -3.2077 -3.2077 -1.9177 -1.9177 -1.1369 -1.1369 0.4830 0.4830 1.5177 1.5177 1.7951 1.7951 2.1594 2.1594 2.4322 2.4322 2.9726 2.9726 3.0648 3.0648 3.2976 3.2976 3.7971 3.7971 3.9308 3.9308 3.9683 3.9683 4.4407 4.4407 4.8773 4.8773 5.2739 5.2739 5.3525 5.3525 5.5245 5.5245 5.5836 5.5836 5.7409 5.7409 6.2064 6.2064 6.2797 6.2797 6.4859 6.4859 6.5045 6.5045 7.1418 7.1418 7.2874 7.2874 7.3095 7.3095 8.0134 8.0134 8.4811 8.4811 8.7235 8.7235 9.5643 9.5643 9.6377 9.6377 9.6589 9.6589 10.9828 10.9828 11.2435 11.2435 11.9369 11.9369 12.3321 12.3321 12.3847 12.3847 12.4304 12.4304 13.0775 13.0775 k = 0.0100-0.0000-0.0000 ( 9963 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3957 -82.3957 -82.3954 -82.3954 -82.3515 -82.3515 -82.3499 -82.3499 -48.5199 -48.5199 -48.5195 -48.5195 -48.4339 -48.4339 -48.4317 -48.4317 -46.8898 -46.8898 -46.8887 -46.8887 -46.8103 -46.8103 -46.8075 -46.8075 -46.8019 -46.8019 -46.8008 -46.8008 -46.6847 -46.6847 -46.6826 -46.6826 -35.5566 -35.5566 -35.4068 -35.4068 -35.3940 -35.3940 -35.2579 -35.2579 -16.0606 -16.0606 -16.0030 -16.0030 -15.3494 -15.3494 -15.2571 -15.2571 -14.6124 -14.6124 -14.5812 -14.5812 -13.8811 -13.8811 -13.7930 -13.7930 -12.5294 -12.5294 -12.1880 -12.1880 -12.1790 -12.1790 -11.8657 -11.8657 -5.1246 -5.1246 -3.2068 -3.2068 -1.9165 -1.9165 -1.1371 -1.1371 0.4846 0.4846 1.5191 1.5191 1.7955 1.7955 2.1581 2.1581 2.4318 2.4318 2.9721 2.9721 3.0654 3.0654 3.2982 3.2982 3.7954 3.7954 3.9272 3.9272 3.9706 3.9706 4.4431 4.4431 4.8753 4.8753 5.2701 5.2701 5.3516 5.3516 5.5271 5.5271 5.5840 5.5840 5.7401 5.7401 6.2041 6.2041 6.2806 6.2806 6.4849 6.4849 6.5067 6.5067 7.1435 7.1435 7.2799 7.2799 7.3160 7.3160 8.0141 8.0141 8.4790 8.4790 8.7208 8.7208 9.5635 9.5635 9.6287 9.6287 9.6654 9.6654 10.9817 10.9817 11.2436 11.2436 11.9294 11.9294 12.3213 12.3213 12.4015 12.4015 12.4326 12.4326 13.0751 13.0751 k = 0.0200-0.0000-0.0000 ( 9975 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3958 -82.3958 -82.3957 -82.3957 -82.3517 -82.3517 -82.3500 -82.3500 -48.5198 -48.5198 -48.5195 -48.5195 -48.4340 -48.4340 -48.4318 -48.4318 -46.8898 -46.8898 -46.8887 -46.8887 -46.8109 -46.8109 -46.8084 -46.8084 -46.8011 -46.8011 -46.8002 -46.8002 -46.6847 -46.6847 -46.6827 -46.6827 -35.5563 -35.5563 -35.4077 -35.4077 -35.3943 -35.3943 -35.2584 -35.2584 -16.0604 -16.0604 -16.0032 -16.0032 -15.3507 -15.3507 -15.2589 -15.2589 -14.6131 -14.6131 -14.5812 -14.5812 -13.8822 -13.8822 -13.7939 -13.7939 -12.5303 -12.5303 -12.1928 -12.1928 -12.1758 -12.1758 -11.8667 -11.8667 -5.1188 -5.1188 -3.2044 -3.2044 -1.9127 -1.9127 -1.1379 -1.1379 0.4896 0.4896 1.5233 1.5233 1.7968 1.7968 2.1536 2.1536 2.4314 2.4314 2.9706 2.9706 3.0674 3.0674 3.2999 3.2999 3.7908 3.7908 3.9176 3.9176 3.9765 3.9765 4.4499 4.4499 4.8691 4.8691 5.2583 5.2583 5.3486 5.3486 5.5344 5.5344 5.5854 5.5854 5.7370 5.7370 6.1975 6.1975 6.2833 6.2833 6.4827 6.4827 6.5125 6.5125 7.1489 7.1489 7.2659 7.2659 7.3269 7.3269 8.0173 8.0173 8.4725 8.4725 8.7128 8.7128 9.5611 9.5611 9.6114 9.6114 9.6752 9.6752 10.9784 10.9784 11.2440 11.2440 11.9081 11.9081 12.3063 12.3063 12.4325 12.4325 12.4413 12.4413 13.0681 13.0681 k = 0.0300-0.0000-0.0000 ( 9971 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3957 -82.3957 -82.3955 -82.3955 -82.3517 -82.3517 -82.3500 -82.3500 -48.5198 -48.5198 -48.5194 -48.5194 -48.4341 -48.4341 -48.4319 -48.4319 -46.8898 -46.8898 -46.8888 -46.8888 -46.8117 -46.8117 -46.8095 -46.8095 -46.8000 -46.8000 -46.7992 -46.7992 -46.6848 -46.6848 -46.6827 -46.6827 -35.5545 -35.5545 -35.4071 -35.4071 -35.3943 -35.3943 -35.2583 -35.2583 -16.0603 -16.0603 -16.0032 -16.0032 -15.3524 -15.3524 -15.2617 -15.2617 -14.6141 -14.6141 -14.5806 -14.5806 -13.8839 -13.8839 -13.7954 -13.7954 -12.5318 -12.5318 -12.1983 -12.1983 -12.1729 -12.1729 -11.8682 -11.8682 -5.1090 -5.1090 -3.2004 -3.2004 -1.9065 -1.9065 -1.1391 -1.1391 0.4981 0.4981 1.5303 1.5303 1.7991 1.7991 2.1460 2.1460 2.4314 2.4314 2.9681 2.9681 3.0706 3.0706 3.3032 3.3032 3.7829 3.7829 3.9038 3.9038 3.9856 3.9856 4.4609 4.4609 4.8591 4.8591 5.2410 5.2410 5.3444 5.3444 5.5434 5.5434 5.5898 5.5898 5.7325 5.7325 6.1879 6.1879 6.2869 6.2869 6.4808 6.4808 6.5210 6.5210 7.1581 7.1581 7.2504 7.2504 7.3381 7.3381 8.0229 8.0229 8.4620 8.4620 8.7000 8.7000 9.5570 9.5570 9.5905 9.5905 9.6842 9.6842 10.9727 10.9727 11.2446 11.2446 11.8748 11.8748 12.2976 12.2976 12.4478 12.4478 12.4752 12.4752 13.0573 13.0573 k = 0.0400-0.0000-0.0000 ( 9979 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3956 -82.3956 -82.3956 -82.3956 -82.3519 -82.3519 -82.3503 -82.3503 -48.5197 -48.5197 -48.5194 -48.5194 -48.4344 -48.4344 -48.4321 -48.4321 -46.8899 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12.5154 12.5154 13.0436 13.0436 k = 0.0500-0.0000-0.0000 ( 9979 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3956 -82.3956 -82.3954 -82.3954 -82.3520 -82.3520 -82.3503 -82.3503 -48.5196 -48.5196 -48.5192 -48.5192 -48.4346 -48.4346 -48.4324 -48.4324 -46.8900 -46.8900 -46.8890 -46.8890 -46.8138 -46.8138 -46.8120 -46.8120 -46.7976 -46.7976 -46.7968 -46.7968 -46.6851 -46.6851 -46.6830 -46.6830 -35.5534 -35.5534 -35.4059 -35.4059 -35.3942 -35.3942 -35.2581 -35.2581 -16.0598 -16.0598 -16.0034 -16.0034 -15.3580 -15.3580 -15.2710 -15.2710 -14.6170 -14.6170 -14.5790 -14.5790 -13.8892 -13.8892 -13.8002 -13.8002 -12.5366 -12.5366 -12.2108 -12.2108 -12.1684 -12.1684 -11.8732 -11.8732 -5.0780 -5.0780 -3.1873 -3.1873 -1.8867 -1.8867 -1.1431 -1.1431 0.5249 0.5249 1.5523 1.5523 1.8062 1.8062 2.1181 2.1181 2.4369 2.4369 2.9593 2.9593 3.0796 3.0796 3.3157 3.3157 3.7558 3.7558 3.8674 3.8674 4.0117 4.0117 4.4905 4.4905 4.8284 4.8284 5.1949 5.1949 5.3310 5.3310 5.5531 5.5531 5.6124 5.6124 5.7181 5.7181 6.1619 6.1619 6.2947 6.2947 6.4778 6.4778 6.5423 6.5423 7.1827 7.1827 7.2181 7.2181 7.3586 7.3586 8.0403 8.0403 8.4283 8.4283 8.6614 8.6614 9.5400 9.5400 9.5427 9.5427 9.6973 9.6973 10.9519 10.9519 11.2428 11.2428 11.7822 11.7822 12.3027 12.3027 12.4811 12.4811 12.5569 12.5569 13.0284 13.0284 k = 0.0600-0.0000-0.0000 ( 9987 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3956 -82.3956 -82.3952 -82.3952 -82.3521 -82.3521 -82.3506 -82.3506 -48.5194 -48.5194 -48.5191 -48.5191 -48.4349 -48.4349 -48.4328 -48.4328 -46.8901 -46.8901 -46.8892 -46.8892 -46.8149 -46.8149 -46.8133 -46.8133 -46.7963 -46.7963 -46.7955 -46.7955 -46.6852 -46.6852 -46.6832 -46.6832 -35.5528 -35.5528 -35.4054 -35.4054 -35.3939 -35.3939 -35.2582 -35.2582 -16.0596 -16.0596 -16.0034 -16.0034 -15.3618 -15.3618 -15.2773 -15.2773 -14.6187 -14.6187 -14.5781 -14.5781 -13.8928 -13.8928 -13.8035 -13.8035 -12.5398 -12.5398 -12.2179 -12.2179 -12.1668 -12.1668 -11.8765 -11.8765 -5.0569 -5.0569 -3.1783 -3.1783 -1.8733 -1.8733 -1.1459 -1.1459 0.5432 0.5432 1.5673 1.5673 1.8105 1.8105 2.0971 2.0971 2.4439 2.4439 2.9528 2.9528 3.0847 3.0847 3.3261 3.3261 3.7363 3.7363 3.8461 3.8461 4.0284 4.0284 4.5072 4.5072 4.8084 4.8084 5.1687 5.1687 5.3218 5.3218 5.5532 5.5532 5.6285 5.6285 5.7092 5.7092 6.1466 6.1466 6.2985 6.2985 6.4770 6.4770 6.5545 6.5545 7.1887 7.1887 7.2100 7.2100 7.3685 7.3685 8.0522 8.0522 8.4051 8.4051 8.6367 8.6367 9.5110 9.5110 9.5322 9.5322 9.7018 9.7018 10.9353 10.9353 11.2389 11.2389 11.7291 11.7291 12.3151 12.3151 12.5037 12.5037 12.5986 12.5986 13.0132 13.0132 k = 0.0700-0.0000-0.0000 ( 9991 PWs) bands (ev): ************************************************************************ ************************************************************************ 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8.0659 8.3782 8.3782 8.6094 8.6094 9.4798 9.4798 9.5193 9.5193 9.7051 9.7051 10.9134 10.9134 11.2317 11.2317 11.6759 11.6759 12.3336 12.3336 12.5304 12.5304 12.6404 12.6404 12.9993 12.9993 k = 0.0800-0.0000-0.0000 ( 10005 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3954 -82.3954 -82.3953 -82.3953 -82.3524 -82.3524 -82.3513 -82.3513 -48.5191 -48.5191 -48.5188 -48.5188 -48.4358 -48.4358 -48.4336 -48.4336 -46.8903 -46.8903 -46.8895 -46.8895 -46.8174 -46.8174 -46.8160 -46.8160 -46.7935 -46.7935 -46.7927 -46.7927 -46.6857 -46.6857 -46.6837 -46.6837 -35.5501 -35.5501 -35.4034 -35.4034 -35.3942 -35.3942 -35.2589 -35.2589 -16.0590 -16.0590 -16.0038 -16.0038 -15.3718 -15.3718 -15.2932 -15.2932 -14.6227 -14.6227 -14.5764 -14.5764 -13.9017 -13.9017 -13.8118 -13.8118 -12.5477 -12.5477 -12.2336 -12.2336 -12.1647 -12.1647 -11.8848 -11.8848 -5.0035 -5.0035 -3.1554 -3.1554 -1.8398 -1.8398 -1.1529 -1.1529 0.5893 0.5893 1.6042 1.6042 1.8187 1.8187 2.0427 2.0427 2.4679 2.4679 2.9348 2.9348 3.0954 3.0954 3.3562 3.3562 3.6868 3.6868 3.8002 3.8002 4.0684 4.0684 4.5398 4.5398 4.7619 4.7619 5.1134 5.1134 5.2988 5.2988 5.5483 5.5483 5.6529 5.6529 5.6976 5.6976 6.1137 6.1137 6.3057 6.3057 6.4772 6.4772 6.5799 6.5799 7.1594 7.1594 7.2353 7.2353 7.3906 7.3906 8.0808 8.0808 8.3476 8.3476 8.5796 8.5796 9.4460 9.4460 9.5036 9.5036 9.7077 9.7077 10.8847 10.8847 11.2205 11.2205 11.6250 11.6250 12.3573 12.3573 12.5604 12.5604 12.6821 12.6821 12.9880 12.9880 k = 0.0900-0.0000-0.0000 ( 10009 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3953 -82.3953 -82.3950 -82.3950 -82.3526 -82.3526 -82.3515 -82.3515 -48.5189 -48.5189 -48.5186 -48.5186 -48.4363 -48.4363 -48.4341 -48.4341 -46.8905 -46.8905 -46.8897 -46.8897 -46.8187 -46.8187 -46.8173 -46.8173 -46.7921 -46.7921 -46.7913 -46.7913 -46.6859 -46.6859 -46.6840 -46.6840 -35.5489 -35.5489 -35.4012 -35.4012 -35.3937 -35.3937 -35.2586 -35.2586 -16.0586 -16.0586 -16.0038 -16.0038 -15.3780 -15.3780 -15.3025 -15.3025 -14.6249 -14.6249 -14.5755 -14.5755 -13.9069 -13.9069 -13.8166 -13.8166 -12.5523 -12.5523 -12.2421 -12.2421 -12.1642 -12.1642 -11.8897 -11.8897 -4.9712 -4.9712 -3.1414 -3.1414 -1.8199 -1.8199 -1.1573 -1.1573 0.6169 0.6169 1.6259 1.6259 1.8204 1.8204 2.0124 2.0124 2.4844 2.4844 2.9237 2.9237 3.1008 3.1008 3.3759 3.3759 3.6582 3.6582 3.7756 3.7756 4.0909 4.0909 4.5524 4.5524 4.7374 4.7374 5.0860 5.0860 5.2856 5.2856 5.5444 5.5444 5.6502 5.6502 5.7047 5.7047 6.0965 6.0965 6.3096 6.3096 6.4786 6.4786 6.5923 6.5923 7.1418 7.1418 7.2484 7.2484 7.4046 7.4046 8.0965 8.0965 8.3149 8.3149 8.5490 8.5490 9.4098 9.4098 9.4853 9.4853 9.7089 9.7089 10.8483 10.8483 11.2049 11.2049 11.5796 11.5796 12.3860 12.3860 12.5941 12.5941 12.7238 12.7238 12.9806 12.9806 k = 0.1000-0.0000-0.0000 ( 10005 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3952 -82.3952 -82.3945 -82.3945 -82.3526 -82.3526 -82.3518 -82.3518 -48.5186 -48.5186 -48.5184 -48.5184 -48.4368 -48.4368 -48.4347 -48.4347 -46.8906 -46.8906 -46.8898 -46.8898 -46.8199 -46.8199 -46.8187 -46.8187 -46.7906 -46.7906 -46.7898 -46.7898 -46.6862 -46.6862 -46.6843 -46.6843 -35.5468 -35.5468 -35.3998 -35.3998 -35.3930 -35.3930 -35.2586 -35.2586 -16.0581 -16.0581 -16.0039 -16.0039 -15.3847 -15.3847 -15.3128 -15.3128 -14.6270 -14.6270 -14.5745 -14.5745 -13.9124 -13.9124 -13.8219 -13.8219 -12.5572 -12.5572 -12.2511 -12.2511 -12.1638 -12.1638 -11.8949 -11.8949 -4.9354 -4.9354 -3.1257 -3.1257 -1.7979 -1.7979 -1.1622 -1.1622 0.6475 0.6475 1.6494 1.6494 1.8175 1.8175 1.9842 1.9842 2.5031 2.5031 2.9115 2.9115 3.1063 3.1063 3.3986 3.3986 3.6282 3.6282 3.7504 3.7504 4.1148 4.1148 4.5600 4.5600 4.7145 4.7145 5.0591 5.0591 5.2713 5.2713 5.5393 5.5393 5.6396 5.6396 5.7178 5.7178 6.0791 6.0791 6.3135 6.3135 6.4809 6.4809 6.6044 6.6044 7.1245 7.1245 7.2584 7.2584 7.4213 7.4213 8.1105 8.1105 8.2817 8.2817 8.5182 8.5182 9.3717 9.3717 9.4643 9.4643 9.7095 9.7095 10.8035 10.8035 11.1851 11.1851 11.5410 11.5410 12.4196 12.4196 12.6307 12.6307 12.7657 12.7657 12.9781 12.9781 k = 0.1100-0.0000-0.0000 ( 10001 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3949 -82.3949 -82.3944 -82.3944 -82.3526 -82.3526 -82.3521 -82.3521 -48.5183 -48.5183 -48.5181 -48.5181 -48.4374 -48.4374 -48.4353 -48.4353 -46.8907 -46.8907 -46.8900 -46.8900 -46.8213 -46.8213 -46.8201 -46.8201 -46.7892 -46.7892 -46.7883 -46.7883 -46.6865 -46.6865 -46.6846 -46.6846 -35.5442 -35.5442 -35.3975 -35.3975 -35.3918 -35.3918 -35.2559 -35.2559 -16.0577 -16.0577 -16.0040 -16.0040 -15.3924 -15.3924 -15.3241 -15.3241 -14.6293 -14.6293 -14.5737 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-48.5180 -48.5180 -48.5178 -48.5178 -48.4380 -48.4380 -48.4360 -48.4360 -46.8909 -46.8909 -46.8902 -46.8902 -46.8226 -46.8226 -46.8215 -46.8215 -46.7876 -46.7876 -46.7868 -46.7868 -46.6869 -46.6869 -46.6850 -46.6850 -35.5419 -35.5419 -35.3950 -35.3950 -35.3904 -35.3904 -35.2550 -35.2550 -16.0574 -16.0574 -16.0042 -16.0042 -15.4010 -15.4010 -15.3365 -15.3365 -14.6316 -14.6316 -14.5730 -14.5730 -13.9247 -13.9247 -13.8341 -13.8341 -12.5680 -12.5680 -12.2704 -12.2704 -12.1639 -12.1639 -11.9067 -11.9067 -4.8534 -4.8534 -3.0895 -3.0895 -1.7485 -1.7485 -1.1736 -1.1736 0.7169 0.7169 1.6980 1.6980 1.7835 1.7835 1.9523 1.9523 2.5437 2.5437 2.8851 2.8851 3.1174 3.1174 3.4493 3.4493 3.5690 3.5690 3.6964 3.6964 4.1654 4.1654 4.5472 4.5472 4.6840 4.6840 5.0089 5.0089 5.2417 5.2417 5.5238 5.5238 5.6123 5.6123 5.7440 5.7440 6.0433 6.0433 6.3224 6.3224 6.4892 6.4892 6.6257 6.6257 7.0908 7.0908 7.2685 7.2685 7.4630 7.4630 8.1100 8.1100 8.2336 8.2336 8.4598 8.4598 9.2895 9.2895 9.4134 9.4134 9.7087 9.7087 10.6878 10.6878 11.1326 11.1326 11.4879 11.4879 12.5000 12.5000 12.7102 12.7102 12.8469 12.8469 12.9924 12.9924 k = 0.1300-0.0000-0.0000 ( 9995 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3943 -82.3943 -82.3937 -82.3937 -82.3529 -82.3529 -82.3526 -82.3526 -48.5177 -48.5177 -48.5175 -48.5175 -48.4387 -48.4387 -48.4367 -48.4367 -46.8910 -46.8910 -46.8904 -46.8904 -46.8240 -46.8240 -46.8229 -46.8229 -46.7861 -46.7861 -46.7852 -46.7852 -46.6873 -46.6873 -46.6854 -46.6854 -35.5392 -35.5392 -35.3928 -35.3928 -35.3894 -35.3894 -35.2541 -35.2541 -16.0569 -16.0569 -16.0043 -16.0043 -15.4099 -15.4099 -15.3496 -15.3496 -14.6337 -14.6337 -14.5722 -14.5722 -13.9313 -13.9313 -13.8406 -13.8406 -12.5738 -12.5738 -12.2806 -12.2806 -12.1642 -12.1642 -11.9129 -11.9129 -4.8075 -4.8075 -3.0689 -3.0689 -1.7213 -1.7213 -1.1802 -1.1802 0.7554 0.7554 1.7119 1.7119 1.7606 1.7606 1.9524 1.9524 2.5633 2.5633 2.8721 2.8721 3.1231 3.1231 3.4718 3.4718 3.5469 3.5469 3.6679 3.6679 4.1917 4.1917 4.5246 4.5246 4.6781 4.6781 4.9862 4.9862 5.2277 5.2277 5.5126 5.5126 5.5994 5.5994 5.7545 5.7545 6.0253 6.0253 6.3272 6.3272 6.4951 6.4951 6.6351 6.6351 7.0749 7.0749 7.2691 7.2691 7.4867 7.4867 8.0827 8.0827 8.2288 8.2288 8.4370 8.4370 9.2457 9.2457 9.3838 9.3838 9.7066 9.7066 10.6185 10.6185 11.1013 11.1013 11.4728 11.4728 12.5465 12.5465 12.7509 12.7509 12.8858 12.8858 13.0121 13.0121 k = 0.1400-0.0000-0.0000 ( 9991 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3940 -82.3940 -82.3933 -82.3933 -82.3532 -82.3532 -82.3529 -82.3529 -48.5173 -48.5173 -48.5171 -48.5171 -48.4394 -48.4394 -48.4375 -48.4375 -46.8911 -46.8911 -46.8906 -46.8906 -46.8253 -46.8253 -46.8243 -46.8243 -46.7845 -46.7845 -46.7837 -46.7837 -46.6877 -46.6877 -46.6859 -46.6859 -35.5363 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************************************************************************ ************************************************************************ -82.3937 -82.3937 -82.3929 -82.3929 -82.3537 -82.3537 -82.3528 -82.3528 -48.5169 -48.5169 -48.5167 -48.5167 -48.4402 -48.4402 -48.4383 -48.4383 -46.8913 -46.8913 -46.8909 -46.8909 -46.8267 -46.8267 -46.8257 -46.8257 -46.7829 -46.7829 -46.7821 -46.7821 -46.6881 -46.6881 -46.6864 -46.6864 -35.5339 -35.5339 -35.3883 -35.3883 -35.3873 -35.3873 -35.2531 -35.2531 -16.0562 -16.0562 -16.0044 -16.0044 -15.4303 -15.4303 -15.3781 -15.3781 -14.6379 -14.6379 -14.5708 -14.5708 -13.9452 -13.9452 -13.8547 -13.8547 -12.5858 -12.5858 -12.3020 -12.3020 -12.1652 -12.1652 -11.9262 -11.9262 -4.7061 -4.7061 -3.0227 -3.0227 -1.6626 -1.6626 -1.1949 -1.1949 0.8386 0.8386 1.6413 1.6413 1.7931 1.7931 1.9728 1.9728 2.5942 2.5942 2.8496 2.8496 3.1350 3.1350 3.4607 3.4607 3.5700 3.5700 3.6084 3.6084 4.2448 4.2448 4.4598 4.4598 4.6715 4.6715 4.9458 4.9458 5.2045 5.2045 5.4811 5.4811 5.5771 5.5771 5.7678 5.7678 5.9899 5.9899 6.3364 6.3364 6.5109 6.5109 6.6505 6.6505 7.0455 7.0455 7.2645 7.2645 7.5350 7.5350 7.9954 7.9954 8.2171 8.2171 8.4254 8.4254 9.1516 9.1516 9.3165 9.3165 9.6998 9.6998 10.4633 10.4633 11.0336 11.0336 11.4605 11.4605 12.6499 12.6499 12.8235 12.8235 12.9631 12.9631 13.0795 13.0795 k = 0.1600-0.0000-0.0000 ( 9989 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3934 -82.3934 -82.3925 -82.3925 -82.3539 -82.3539 -82.3531 -82.3531 -48.5165 -48.5165 -48.5163 -48.5163 -48.4411 -48.4411 -48.4392 -48.4392 -46.8914 -46.8914 -46.8911 -46.8911 -46.8281 -46.8281 -46.8271 -46.8271 -46.7813 -46.7813 -46.7805 -46.7805 -46.6886 -46.6886 -46.6869 -46.6869 -35.5308 -35.5308 -35.3875 -35.3875 -35.3844 -35.3844 -35.2524 -35.2524 -16.0559 -16.0559 -16.0046 -16.0046 -15.4418 -15.4418 -15.3933 -15.3933 -14.6399 -14.6399 -14.5703 -14.5703 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10.2963 10.9664 10.9664 11.4669 11.4669 12.7584 12.7584 12.8771 12.8771 13.0539 13.0539 13.1762 13.1762 k = 0.1800-0.0000-0.0000 ( 9993 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3927 -82.3927 -82.3918 -82.3918 -82.3546 -82.3546 -82.3539 -82.3539 -48.5156 -48.5156 -48.5154 -48.5154 -48.4429 -48.4429 -48.4411 -48.4411 -46.8916 -46.8916 -46.8914 -46.8914 -46.8310 -46.8310 -46.8300 -46.8300 -46.7780 -46.7780 -46.7773 -46.7773 -46.6897 -46.6897 -46.6880 -46.6880 -35.5240 -35.5240 -35.3863 -35.3863 -35.3796 -35.3796 -35.2513 -35.2513 -16.0558 -16.0558 -16.0053 -16.0053 -15.4675 -15.4675 -15.4256 -15.4256 -14.6435 -14.6435 -14.5695 -14.5695 -13.9672 -13.9672 -13.8782 -13.8782 -12.6045 -12.6045 -12.3365 -12.3365 -12.1671 -12.1671 -11.9475 -11.9475 -4.5317 -4.5317 -2.9415 -2.9415 -1.5665 -1.5665 -1.2210 -1.2210 0.9715 0.9715 1.4890 1.4890 1.8612 1.8612 2.0344 2.0344 2.6028 2.6028 2.8255 2.8255 3.1595 3.1595 3.4091 3.4091 3.5170 3.5170 3.6773 3.6773 4.3072 4.3072 4.3587 4.3587 4.6488 4.6488 4.8946 4.8946 5.1896 5.1896 5.4156 5.4156 5.5506 5.5506 5.7642 5.7642 5.9422 5.9422 6.3470 6.3470 6.5449 6.5449 6.6649 6.6649 7.0048 7.0048 7.2517 7.2517 7.6002 7.6002 7.8399 7.8399 8.1315 8.1315 8.5022 8.5022 8.9963 8.9963 9.1976 9.1976 9.6823 9.6823 10.2116 10.2116 10.9344 10.9344 11.4754 11.4754 12.8043 12.8043 12.9055 12.9055 13.1053 13.1053 13.2317 13.2317 k = 0.1900-0.0000-0.0000 ( 9993 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3924 -82.3924 -82.3911 -82.3911 -82.3550 -82.3550 -82.3542 -82.3542 -48.5151 -48.5151 -48.5149 -48.5149 -48.4439 -48.4439 -48.4421 -48.4421 -46.8917 -46.8917 -46.8916 -46.8916 -46.8325 -46.8325 -46.8315 -46.8315 -46.7764 -46.7764 -46.7756 -46.7756 -46.6903 -46.6903 -46.6886 -46.6886 -35.5199 -35.5199 -35.3860 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************************************************************************ -82.3919 -82.3919 -82.3904 -82.3904 -82.3554 -82.3554 -82.3544 -82.3544 -48.5146 -48.5146 -48.5143 -48.5143 -48.4449 -48.4449 -48.4432 -48.4432 -46.8918 -46.8918 -46.8917 -46.8917 -46.8340 -46.8340 -46.8330 -46.8330 -46.7747 -46.7747 -46.7740 -46.7740 -46.6909 -46.6909 -46.6893 -46.6893 -35.5168 -35.5168 -35.3837 -35.3837 -35.3731 -35.3731 -35.2503 -35.2503 -16.0558 -16.0558 -16.0059 -16.0059 -15.4965 -15.4965 -15.4595 -15.4595 -14.6463 -14.6463 -14.5688 -14.5688 -13.9820 -13.9820 -13.8952 -13.8952 -12.6168 -12.6168 -12.3606 -12.3606 -12.1682 -12.1682 -11.9621 -11.9621 -4.4017 -4.4017 -2.8797 -2.8797 -1.4990 -1.4990 -1.2408 -1.2408 1.0497 1.0497 1.4020 1.4020 1.8872 1.8872 2.0920 2.0920 2.5834 2.5834 2.8042 2.8042 3.1904 3.1904 3.3899 3.3899 3.4631 3.4631 3.7549 3.7549 4.2492 4.2492 4.3850 4.3850 4.6242 4.6242 4.8645 4.8645 5.1963 5.1963 5.3656 5.3656 5.5335 5.5335 5.7449 5.7449 5.9176 5.9176 6.3504 6.3504 6.5738 6.5738 6.6705 6.6705 6.9779 6.9779 7.2442 7.2442 7.6301 7.6301 7.7377 7.7377 8.0526 8.0526 8.5827 8.5827 8.8834 8.8834 9.1093 9.1093 9.6613 9.6613 10.0470 10.0470 10.8764 10.8764 11.5013 11.5013 12.8389 12.8389 13.0059 13.0059 13.2146 13.2146 13.3520 13.3520 k = 0.2100-0.0000-0.0000 ( 9987 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3916 -82.3916 -82.3900 -82.3900 -82.3558 -82.3558 -82.3548 -82.3548 -48.5141 -48.5141 -48.5138 -48.5138 -48.4459 -48.4459 -48.4443 -48.4443 -46.8919 -46.8919 -46.8917 -46.8917 -46.8355 -46.8355 -46.8345 -46.8345 -46.7730 -46.7730 -46.7723 -46.7723 -46.6915 -46.6915 -46.6899 -46.6899 -35.5130 -35.5130 -35.3830 -35.3830 -35.3698 -35.3698 -35.2497 -35.2497 -16.0561 -16.0561 -16.0062 -16.0062 -15.5123 -15.5123 -15.4768 -15.4768 -14.6475 -14.6475 -14.5685 -14.5685 -13.9894 -13.9894 -13.9038 -13.9038 -12.6227 -12.6227 -12.3728 -12.3728 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13.3271 13.4777 13.4777 k = 0.2300-0.0000-0.0000 ( 9987 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3903 -82.3903 -82.3894 -82.3894 -82.3565 -82.3565 -82.3558 -82.3558 -48.5128 -48.5128 -48.5126 -48.5126 -48.4482 -48.4482 -48.4466 -48.4466 -46.8921 -46.8921 -46.8917 -46.8917 -46.8385 -46.8385 -46.8375 -46.8375 -46.7695 -46.7695 -46.7689 -46.7689 -46.6929 -46.6929 -46.6914 -46.6914 -35.5041 -35.5041 -35.3817 -35.3817 -35.3614 -35.3614 -35.2491 -35.2491 -16.0568 -16.0568 -16.0067 -16.0067 -15.5463 -15.5463 -15.5118 -15.5118 -14.6490 -14.6490 -14.5680 -14.5680 -14.0038 -14.0038 -13.9217 -13.9217 -12.6340 -12.6340 -12.3975 -12.3975 -12.1694 -12.1694 -11.9839 -11.9839 -4.1882 -4.1882 -2.7768 -2.7768 -1.3972 -1.3972 -1.2739 -1.2739 1.0592 1.0592 1.3916 1.3916 1.8849 1.8849 2.1910 2.1910 2.5268 2.5268 2.7605 2.7605 3.2658 3.2658 3.3409 3.3409 3.4404 3.4404 3.8647 3.8647 4.1354 4.1354 4.4440 4.4440 4.5895 4.5895 4.8282 4.8282 5.2229 5.2229 5.2877 5.2877 5.5038 5.5038 5.6949 5.6949 5.8931 5.8931 6.3490 6.3490 6.6208 6.6208 6.6739 6.6739 6.9314 6.9314 7.2388 7.2388 7.5623 7.5623 7.6797 7.6797 7.9263 7.9263 8.6643 8.6643 8.7563 8.7563 8.9683 8.9683 9.5946 9.5946 9.8405 9.8405 10.8109 10.8109 11.5578 11.5578 12.7892 12.7892 13.2092 13.2092 13.3838 13.3838 13.5398 13.5398 k = 0.2400-0.0000-0.0000 ( 9983 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3898 -82.3898 -82.3888 -82.3888 -82.3569 -82.3569 -82.3560 -82.3560 -48.5122 -48.5122 -48.5119 -48.5119 -48.4494 -48.4494 -48.4478 -48.4478 -46.8921 -46.8921 -46.8917 -46.8917 -46.8401 -46.8401 -46.8390 -46.8390 -46.7678 -46.7678 -46.7672 -46.7672 -46.6937 -46.6937 -46.6922 -46.6922 -35.5002 -35.5002 -35.3809 -35.3809 -35.3579 -35.3579 -35.2486 -35.2486 -16.0573 -16.0573 -16.0068 -16.0068 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8.5523 8.5523 8.8288 8.8288 8.8790 8.8790 9.5009 9.5009 9.7610 9.7610 10.7828 10.7828 11.6053 11.6053 12.7094 12.7094 13.3426 13.3426 13.4969 13.4969 13.6556 13.6556 k = 0.2600-0.0000-0.0000 ( 9975 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3889 -82.3889 -82.3876 -82.3876 -82.3575 -82.3575 -82.3568 -82.3568 -48.5108 -48.5108 -48.5105 -48.5105 -48.4518 -48.4518 -48.4503 -48.4503 -46.8921 -46.8921 -46.8915 -46.8915 -46.8432 -46.8432 -46.8421 -46.8421 -46.7643 -46.7643 -46.7638 -46.7638 -46.6952 -46.6952 -46.6938 -46.6938 -35.4924 -35.4924 -35.3802 -35.3802 -35.3507 -35.3507 -35.2456 -35.2456 -16.0585 -16.0585 -16.0070 -16.0070 -15.6027 -15.6027 -15.5645 -15.5645 -14.6494 -14.6494 -14.5667 -14.5667 -14.0242 -14.0242 -13.9484 -13.9484 -12.6490 -12.6490 -12.4345 -12.4345 -12.1694 -12.1694 -12.0049 -12.0049 -3.9553 -3.9553 -2.6631 -2.6631 -1.3103 -1.3103 -1.3008 -1.3008 0.9394 0.9394 1.5263 1.5263 1.8317 1.8317 2.2833 2.2833 2.4330 2.4330 2.7440 2.7440 3.2731 3.2731 3.3705 3.3705 3.4681 3.4681 3.9155 3.9155 4.0748 4.0748 4.4640 4.4640 4.5850 4.5850 4.8157 4.8157 5.2121 5.2121 5.2632 5.2632 5.4680 5.4680 5.6310 5.6310 5.8835 5.8835 6.3380 6.3380 6.6506 6.6506 6.6885 6.6885 6.8747 6.8747 7.2343 7.2343 7.4315 7.4315 7.6638 7.6638 7.8143 7.8143 8.4873 8.4873 8.8148 8.8148 8.8936 8.8936 9.4406 9.4406 9.7386 9.7386 10.7734 10.7734 11.6315 11.6315 12.6575 12.6575 13.4025 13.4025 13.5536 13.5536 13.7083 13.7083 k = 0.2700-0.0000-0.0000 ( 9979 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3883 -82.3883 -82.3870 -82.3870 -82.3579 -82.3579 -82.3576 -82.3576 -48.5100 -48.5100 -48.5098 -48.5098 -48.4530 -48.4530 -48.4516 -48.4516 -46.8920 -46.8920 -46.8914 -46.8914 -46.8448 -46.8448 -46.8436 -46.8436 -46.7626 -46.7626 -46.7620 -46.7620 -46.6961 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************************************************************************ ************************************************************************ -82.3878 -82.3878 -82.3862 -82.3862 -82.3584 -82.3584 -82.3580 -82.3580 -48.5093 -48.5093 -48.5090 -48.5090 -48.4543 -48.4543 -48.4530 -48.4530 -46.8919 -46.8919 -46.8912 -46.8912 -46.8463 -46.8463 -46.8452 -46.8452 -46.7608 -46.7608 -46.7603 -46.7603 -46.6969 -46.6969 -46.6956 -46.6956 -35.4842 -35.4842 -35.3786 -35.3786 -35.3429 -35.3429 -35.2454 -35.2454 -16.0601 -16.0601 -16.0070 -16.0070 -15.6425 -15.6425 -15.5998 -15.5998 -14.6480 -14.6480 -14.5659 -14.5659 -14.0370 -14.0370 -13.9662 -13.9662 -12.6575 -12.6575 -12.4587 -12.4587 -12.1687 -12.1687 -12.0183 -12.0183 -3.7907 -3.7907 -2.5826 -2.5826 -1.3358 -1.3358 -1.2443 -1.2443 0.8482 0.8482 1.6333 1.6333 1.7720 1.7720 2.3265 2.3265 2.3575 2.3575 2.7585 2.7585 3.2488 3.2488 3.4416 3.4416 3.4893 3.4893 3.8781 3.8781 4.0989 4.0989 4.4606 4.4606 4.5945 4.5945 4.8263 4.8263 5.1672 5.1672 5.2930 5.2930 5.4408 5.4408 5.5873 5.5873 5.8851 5.8851 6.3252 6.3252 6.6481 6.6481 6.7123 6.7123 6.8305 6.8305 7.2115 7.2115 7.3758 7.3758 7.6119 7.6119 7.7697 7.7697 8.3557 8.3557 8.7218 8.7218 8.9906 8.9906 9.3087 9.3087 9.7120 9.7120 10.7629 10.7629 11.6874 11.6874 12.5350 12.5350 13.4988 13.4988 13.6669 13.6669 13.8065 13.8065 k = 0.2900-0.0000-0.0000 ( 9969 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3872 -82.3872 -82.3856 -82.3856 -82.3587 -82.3587 -82.3585 -82.3585 -48.5085 -48.5085 -48.5082 -48.5082 -48.4556 -48.4556 -48.4543 -48.4543 -46.8918 -46.8918 -46.8910 -46.8910 -46.8479 -46.8479 -46.8467 -46.8467 -46.7590 -46.7590 -46.7586 -46.7586 -46.6978 -46.6978 -46.6965 -46.6965 -35.4798 -35.4798 -35.3782 -35.3782 -35.3398 -35.3398 -35.2446 -35.2446 -16.0608 -16.0608 -16.0067 -16.0067 -15.6627 -15.6627 -15.6174 -15.6174 -14.6469 -14.6469 -14.5654 -14.5654 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10.7625 10.7625 11.7482 11.7482 12.3960 12.3960 13.5609 13.5609 13.7676 13.7676 13.8935 13.8935 k = 0.3100-0.0000-0.0000 ( 9965 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3860 -82.3860 -82.3839 -82.3839 -82.3598 -82.3598 -82.3597 -82.3597 -48.5068 -48.5068 -48.5065 -48.5065 -48.4582 -48.4582 -48.4571 -48.4571 -46.8914 -46.8914 -46.8905 -46.8905 -46.8510 -46.8510 -46.8498 -46.8498 -46.7555 -46.7555 -46.7551 -46.7551 -46.6997 -46.6997 -46.6985 -46.6985 -35.4712 -35.4712 -35.3775 -35.3775 -35.3313 -35.3313 -35.2457 -35.2457 -16.0622 -16.0622 -16.0059 -16.0059 -15.7034 -15.7034 -15.6524 -15.6524 -14.6435 -14.6435 -14.5642 -14.5642 -14.0547 -14.0547 -13.9924 -13.9924 -12.6677 -12.6677 -12.4938 -12.4938 -12.1665 -12.1665 -12.0371 -12.0371 -3.5321 -3.5321 -2.4570 -2.4570 -1.3761 -1.3761 -1.1787 -1.1787 0.7243 0.7243 1.6486 1.6486 1.7801 1.7801 2.2558 2.2558 2.3528 2.3528 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14.0760 14.0760 k = 0.3600-0.0000-0.0000 ( 9975 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3825 -82.3825 -82.3811 -82.3811 -82.3630 -82.3630 -82.3626 -82.3626 -48.5021 -48.5021 -48.5017 -48.5017 -48.4653 -48.4653 -48.4643 -48.4643 -46.8896 -46.8896 -46.8884 -46.8884 -46.8589 -46.8589 -46.8575 -46.8575 -46.7468 -46.7468 -46.7463 -46.7463 -46.7050 -46.7050 -46.7040 -46.7040 -35.4506 -35.4506 -35.3794 -35.3794 -35.3124 -35.3124 -35.2483 -35.2483 -16.0635 -16.0635 -15.9997 -15.9997 -15.8024 -15.8024 -15.7384 -15.7384 -14.6300 -14.6300 -14.5615 -14.5615 -14.0798 -14.0798 -14.0330 -14.0330 -12.6768 -12.6768 -12.5473 -12.5473 -12.1598 -12.1598 -12.0653 -12.0653 -3.0786 -3.0786 -2.2437 -2.2437 -1.4480 -1.4480 -1.1502 -1.1502 0.5856 0.5856 1.4056 1.4056 1.8028 1.8028 2.2506 2.2506 2.3379 2.3379 2.9234 2.9234 3.3562 3.3562 3.4929 3.4929 3.6888 3.6888 3.7300 3.7300 4.2167 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0.5538 1.2477 1.2477 1.7391 1.7391 2.1572 2.1572 2.4737 2.4737 2.9806 2.9806 3.4097 3.4097 3.5074 3.5074 3.6495 3.6495 3.8179 3.8179 4.2667 4.2667 4.5062 4.5062 4.6357 4.6357 4.8902 4.8902 5.0795 5.0795 5.1939 5.1939 5.4980 5.4980 5.5214 5.5214 5.9587 5.9587 6.1733 6.1733 6.5060 6.5060 6.6299 6.6299 6.7567 6.7567 6.8454 6.8454 7.1248 7.1248 7.4554 7.4554 7.5238 7.5238 7.9574 7.9574 8.2582 8.2582 8.6555 8.6555 9.4725 9.4725 9.6983 9.6983 10.8602 10.8602 11.7362 11.7362 12.0698 12.0698 13.1676 13.1676 13.8386 13.8386 14.2245 14.2245 k = 0.4000-0.0000-0.0000 ( 9974 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3795 -82.3795 -82.3788 -82.3788 -82.3653 -82.3653 -82.3652 -82.3652 -48.4978 -48.4978 -48.4974 -48.4974 -48.4711 -48.4711 -48.4702 -48.4702 -46.8872 -46.8872 -46.8859 -46.8859 -46.8649 -46.8649 -46.8634 -46.8634 -46.7399 -46.7399 -46.7395 -46.7395 -46.7099 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************************************************************************ ************************************************************************ -82.3789 -82.3789 -82.3780 -82.3780 -82.3660 -82.3660 -82.3658 -82.3658 -48.4966 -48.4966 -48.4962 -48.4962 -48.4725 -48.4725 -48.4717 -48.4717 -46.8865 -46.8865 -46.8851 -46.8851 -46.8663 -46.8663 -46.8648 -46.8648 -46.7383 -46.7383 -46.7378 -46.7378 -46.7112 -46.7112 -46.7102 -46.7102 -35.4295 -35.4295 -35.3851 -35.3851 -35.2947 -35.2947 -35.2541 -35.2541 -16.0565 -16.0565 -15.9852 -15.9852 -15.8900 -15.8900 -15.8166 -15.8166 -14.6104 -14.6104 -14.5606 -14.5606 -14.0977 -14.0977 -14.0669 -14.0669 -12.6760 -12.6760 -12.5923 -12.5923 -12.1497 -12.1497 -12.0893 -12.0893 -2.6144 -2.6144 -2.0413 -2.0413 -1.5292 -1.5292 -1.2591 -1.2591 0.5546 0.5546 1.1432 1.1432 1.7068 1.7068 2.0832 2.0832 2.5710 2.5710 3.0033 3.0033 3.4110 3.4110 3.5489 3.5489 3.6406 3.6406 3.8614 3.8614 4.3111 4.3111 4.5125 4.5125 4.6438 4.6438 4.8757 4.8757 5.0638 5.0638 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10.9487 10.9487 11.4995 11.4995 12.2133 12.2133 12.8940 12.8940 13.9668 13.9668 14.3069 14.3069 k = 0.4400-0.0000-0.0000 ( 9990 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3764 -82.3764 -82.3763 -82.3763 -82.3684 -82.3684 -82.3681 -82.3681 -48.4931 -48.4931 -48.4926 -48.4926 -48.4768 -48.4768 -48.4761 -48.4761 -46.8841 -46.8841 -46.8827 -46.8827 -46.8705 -46.8705 -46.8690 -46.8690 -46.7333 -46.7333 -46.7328 -46.7328 -46.7152 -46.7152 -46.7143 -46.7143 -35.4184 -35.4184 -35.3902 -35.3902 -35.2854 -35.2854 -35.2595 -35.2595 -16.0460 -16.0460 -15.9719 -15.9719 -15.9343 -15.9343 -15.8581 -15.8581 -14.5978 -14.5978 -14.5628 -14.5628 -14.1040 -14.1040 -14.0833 -14.0833 -12.6709 -12.6709 -12.6149 -12.6149 -12.1421 -12.1421 -12.1021 -12.1021 -2.3415 -2.3415 -1.9336 -1.9336 -1.5853 -1.5853 -1.3915 -1.3915 0.5856 0.5856 0.9931 0.9931 1.6890 1.6890 1.9691 1.9691 2.7055 2.7055 3.0056 3.0056 3.4157 3.4157 3.5508 3.5508 3.7020 3.7020 3.8964 3.8964 4.3911 4.3911 4.5238 4.5238 4.6493 4.6493 4.8302 4.8302 5.0365 5.0365 5.1270 5.1270 5.6030 5.6030 5.6209 5.6209 5.9293 5.9293 6.0506 6.0506 6.4287 6.4287 6.6550 6.6550 6.6979 6.6979 6.7608 6.7608 6.9563 6.9563 7.2224 7.2224 7.6600 7.6600 7.9782 7.9782 8.1273 8.1273 8.4306 8.4306 9.6067 9.6067 9.7068 9.7068 10.9750 10.9750 11.4457 11.4457 12.2510 12.2510 12.8312 12.8312 14.0019 14.0019 14.3142 14.3142 k = 0.4500-0.0000-0.0000 ( 9996 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3758 -82.3758 -82.3757 -82.3757 -82.3691 -82.3691 -82.3689 -82.3689 -48.4918 -48.4918 -48.4914 -48.4914 -48.4783 -48.4783 -48.4775 -48.4775 -46.8832 -46.8832 -46.8818 -46.8818 -46.8719 -46.8719 -46.8703 -46.8703 -46.7317 -46.7317 -46.7311 -46.7311 -46.7166 -46.7166 -46.7157 -46.7157 -35.4156 -35.4156 -35.3906 -35.3906 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************************************************************************ -82.3752 -82.3752 -82.3751 -82.3751 -82.3698 -82.3698 -82.3696 -82.3696 -48.4906 -48.4906 -48.4901 -48.4901 -48.4797 -48.4797 -48.4790 -48.4790 -46.8823 -46.8823 -46.8808 -46.8808 -46.8732 -46.8732 -46.8716 -46.8716 -46.7301 -46.7301 -46.7295 -46.7295 -46.7180 -46.7180 -46.7172 -46.7172 -35.4130 -35.4130 -35.3926 -35.3926 -35.2802 -35.2802 -35.2630 -35.2630 -16.0354 -16.0354 -15.9675 -15.9675 -15.9527 -15.9527 -15.8831 -15.8831 -14.5897 -14.5897 -14.5657 -14.5657 -14.1056 -14.1056 -14.0919 -14.0919 -12.6654 -12.6654 -12.6282 -12.6282 -12.1365 -12.1365 -12.1100 -12.1100 -2.1674 -2.1674 -1.8722 -1.8722 -1.6264 -1.6264 -1.5000 -1.5000 0.6244 0.6244 0.9003 0.9003 1.7003 1.7003 1.8966 1.8966 2.7835 2.7835 2.9863 2.9863 3.4299 3.4299 3.5282 3.5282 3.7611 3.7611 3.8986 3.8986 4.4476 4.4476 4.5320 4.5320 4.6521 4.6521 4.7833 4.7833 5.0332 5.0332 5.1049 5.1049 5.6524 5.6524 5.6705 5.6705 5.8958 5.8958 5.9869 5.9869 6.4393 6.4393 6.6097 6.6097 6.7035 6.7035 6.7567 6.7567 6.9301 6.9301 7.1392 7.1392 7.7211 7.7211 7.9539 7.9539 8.1294 8.1294 8.3526 8.3526 9.6427 9.6427 9.7051 9.7051 11.0329 11.0329 11.3453 11.3453 12.3306 12.3306 12.7136 12.7136 14.0743 14.0743 14.3071 14.3071 k = 0.4700-0.0000-0.0000 ( 10000 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3745 -82.3745 -82.3744 -82.3744 -82.3705 -82.3705 -82.3703 -82.3703 -48.4893 -48.4893 -48.4888 -48.4888 -48.4811 -48.4811 -48.4804 -48.4804 -46.8813 -46.8813 -46.8798 -46.8798 -46.8745 -46.8745 -46.8729 -46.8729 -46.7285 -46.7285 -46.7279 -46.7279 -46.7194 -46.7194 -46.7186 -46.7186 -35.4099 -35.4099 -35.3940 -35.3940 -35.2774 -35.2774 -35.2650 -35.2650 -16.0291 -16.0291 -15.9761 -15.9761 -15.9489 -15.9489 -15.8945 -15.8945 -14.5858 -14.5858 -14.5677 -14.5677 -14.1058 -14.1058 -14.0954 -14.0954 -12.6621 -12.6621 -12.6342 -12.6342 -12.1336 -12.1336 -12.1137 -12.1137 -2.0844 -2.0844 -1.8478 -1.8478 -1.6476 -1.6476 -1.5561 -1.5561 0.6488 0.6488 0.8569 0.8569 1.7127 1.7127 1.8624 1.8624 2.8185 2.8185 2.9712 2.9712 3.4399 3.4399 3.5156 3.5156 3.7889 3.7889 3.8938 3.8938 4.4740 4.4740 4.5352 4.5352 4.6553 4.6553 4.7574 4.7574 5.0363 5.0363 5.0933 5.0933 5.6769 5.6769 5.6955 5.6955 5.8782 5.8782 5.9533 5.9533 6.4525 6.4525 6.5846 6.5846 6.7062 6.7062 6.7518 6.7518 6.9338 6.9338 7.1005 7.1005 7.7522 7.7522 7.9311 7.9311 8.1445 8.1445 8.3162 8.3162 9.6573 9.6573 9.7033 9.7033 11.0647 11.0647 11.2986 11.2986 12.3722 12.3722 12.6587 12.6587 14.1109 14.1109 14.2926 14.2926 k = 0.4800-0.0000-0.0000 ( 9992 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3737 -82.3737 -82.3737 -82.3737 -82.3710 -82.3710 -82.3709 -82.3709 -48.4879 -48.4879 -48.4874 -48.4874 -48.4825 -48.4825 -48.4818 -48.4818 -46.8803 -46.8803 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14.1470 14.2717 14.2717 k = 0.4900-0.0000-0.0000 ( 9984 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3729 -82.3729 -82.3729 -82.3729 -82.3716 -82.3716 -82.3715 -82.3715 -48.4866 -48.4866 -48.4861 -48.4861 -48.4838 -48.4838 -48.4832 -48.4832 -46.8792 -46.8792 -46.8776 -46.8776 -46.8769 -46.8769 -46.8753 -46.8753 -46.7254 -46.7254 -46.7247 -46.7247 -46.7223 -46.7223 -46.7216 -46.7216 -35.4034 -35.4034 -35.3985 -35.3985 -35.2721 -35.2721 -35.2684 -35.2684 -16.0140 -16.0140 -15.9961 -15.9961 -15.9336 -15.9336 -15.9153 -15.9153 -14.5783 -14.5783 -14.5723 -14.5723 -14.1043 -14.1043 -14.1008 -14.1008 -12.6542 -12.6542 -12.6449 -12.6449 -12.1272 -12.1272 -12.1207 -12.1207 -1.9337 -1.9337 -1.8385 -1.8385 -1.6796 -1.6796 -1.6494 -1.6494 0.7072 0.7072 0.7769 0.7769 1.7496 1.7496 1.8006 1.8006 2.8805 2.8805 2.9318 2.9318 3.4634 3.4634 3.4893 3.4893 3.8369 3.8369 3.8725 3.8725 4.5157 4.5157 4.5347 4.5347 4.6718 4.6718 4.7078 4.7078 5.0500 5.0500 5.0702 5.0702 5.7198 5.7198 5.7322 5.7322 5.8593 5.8593 5.8912 5.8912 6.4897 6.4897 6.5352 6.5352 6.7166 6.7166 6.7342 6.7342 6.9708 6.9708 7.0299 7.0299 7.8147 7.8147 7.8758 7.8758 8.1904 8.1904 8.2490 8.2490 9.6803 9.6803 9.6950 9.6950 11.1347 11.1347 11.2125 11.2125 12.4601 12.4601 12.5550 12.5550 14.1824 14.1824 14.2456 14.2456 k = 0.5000-0.0000-0.0000 ( 9990 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3723 -82.3723 -82.3723 -82.3723 -82.3723 -82.3723 -82.3723 -82.3723 -48.4854 -48.4854 -48.4854 -48.4854 -48.4845 -48.4845 -48.4845 -48.4845 -46.8781 -46.8781 -46.8781 -46.8781 -46.8765 -46.8765 -46.8765 -46.8765 -46.7239 -46.7239 -46.7239 -46.7239 -46.7231 -46.7231 -46.7231 -46.7231 -35.4024 -35.4024 -35.4024 -35.4024 -35.2704 -35.2704 -35.2704 -35.2704 -16.0055 -16.0055 -16.0055 -16.0055 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7.8455 7.8455 8.2184 8.2184 8.2184 8.2184 9.6886 9.6886 9.6886 9.6886 11.1723 11.1723 11.1723 11.1723 12.5065 12.5065 12.5065 12.5065 14.2153 14.2153 14.2153 14.2153 k = 0.5000 0.0100-0.0000 ( 9986 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3723 -82.3723 -82.3723 -82.3723 -82.3722 -82.3722 -82.3722 -82.3722 -48.4854 -48.4854 -48.4854 -48.4854 -48.4845 -48.4845 -48.4845 -48.4845 -46.8781 -46.8781 -46.8781 -46.8781 -46.8765 -46.8765 -46.8765 -46.8765 -46.7239 -46.7239 -46.7239 -46.7239 -46.7231 -46.7231 -46.7231 -46.7231 -35.4010 -35.4010 -35.4010 -35.4010 -35.2704 -35.2704 -35.2704 -35.2704 -16.0054 -16.0054 -16.0054 -16.0054 -15.9249 -15.9249 -15.9249 -15.9249 -14.5748 -14.5748 -14.5748 -14.5748 -14.1030 -14.1030 -14.1030 -14.1030 -12.6496 -12.6496 -12.6496 -12.6496 -12.1247 -12.1247 -12.1247 -12.1247 -1.8741 -1.8741 -1.8741 -1.8741 -1.6743 -1.6743 -1.6743 -1.6743 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************************************************************************ ************************************************************************ -82.3725 -82.3725 -82.3725 -82.3725 -82.3721 -82.3721 -82.3721 -82.3721 -48.4854 -48.4854 -48.4854 -48.4854 -48.4845 -48.4845 -48.4845 -48.4845 -46.8781 -46.8781 -46.8781 -46.8781 -46.8765 -46.8765 -46.8765 -46.8765 -46.7239 -46.7239 -46.7239 -46.7239 -46.7231 -46.7231 -46.7231 -46.7231 -35.4004 -35.4004 -35.4004 -35.4004 -35.2716 -35.2716 -35.2716 -35.2716 -16.0049 -16.0049 -16.0049 -16.0049 -15.9253 -15.9253 -15.9253 -15.9253 -14.5707 -14.5707 -14.5707 -14.5707 -14.1045 -14.1045 -14.1045 -14.1045 -12.6485 -12.6485 -12.6485 -12.6485 -12.1302 -12.1302 -12.1302 -12.1302 -1.8720 -1.8720 -1.8720 -1.8720 -1.6759 -1.6759 -1.6759 -1.6759 0.7517 0.7517 0.7517 0.7517 1.7567 1.7567 1.7567 1.7567 2.9323 2.9323 2.9323 2.9323 3.4700 3.4700 3.4700 3.4700 3.8446 3.8446 3.8446 3.8446 4.5161 4.5161 4.5161 4.5161 4.7021 4.7021 4.7021 4.7021 5.0600 5.0600 5.0600 5.0600 5.7301 5.7301 5.7301 5.7301 5.8665 5.8665 5.8665 5.8665 6.5131 6.5131 6.5131 6.5131 6.7216 6.7216 6.7216 6.7216 7.0011 7.0011 7.0011 7.0011 7.8416 7.8416 7.8416 7.8416 8.2267 8.2267 8.2267 8.2267 9.6656 9.6656 9.6656 9.6656 11.1957 11.1957 11.1957 11.1957 12.5160 12.5160 12.5160 12.5160 14.2199 14.2199 14.2199 14.2199 k = 0.5000 0.0398-0.0000 ( 9990 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3724 -82.3724 -82.3724 -82.3724 -82.3722 -82.3722 -82.3722 -82.3722 -48.4854 -48.4854 -48.4854 -48.4854 -48.4845 -48.4845 -48.4845 -48.4845 -46.8781 -46.8781 -46.8781 -46.8781 -46.8765 -46.8765 -46.8765 -46.8765 -46.7239 -46.7239 -46.7239 -46.7239 -46.7231 -46.7231 -46.7231 -46.7231 -35.3997 -35.3997 -35.3997 -35.3997 -35.2724 -35.2724 -35.2724 -35.2724 -16.0044 -16.0044 -16.0044 -16.0044 -15.9256 -15.9256 -15.9256 -15.9256 -14.5671 -14.5671 -14.5671 -14.5671 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11.2350 11.2350 11.2350 11.2350 12.5316 12.5316 12.5316 12.5316 14.2287 14.2287 14.2287 14.2287 k = 0.5000 0.0597-0.0000 ( 9988 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3724 -82.3724 -82.3724 -82.3724 -82.3721 -82.3721 -82.3721 -82.3721 -48.4854 -48.4854 -48.4854 -48.4854 -48.4845 -48.4845 -48.4845 -48.4845 -46.8781 -46.8781 -46.8781 -46.8781 -46.8766 -46.8766 -46.8766 -46.8766 -46.7239 -46.7239 -46.7239 -46.7239 -46.7231 -46.7231 -46.7231 -46.7231 -35.3971 -35.3971 -35.3971 -35.3971 -35.2737 -35.2737 -35.2737 -35.2737 -16.0032 -16.0032 -16.0032 -16.0032 -15.9266 -15.9266 -15.9266 -15.9266 -14.5571 -14.5571 -14.5571 -14.5571 -14.1097 -14.1097 -14.1097 -14.1097 -12.6446 -12.6446 -12.6446 -12.6446 -12.1483 -12.1483 -12.1483 -12.1483 -1.8652 -1.8652 -1.8652 -1.8652 -1.6810 -1.6810 -1.6810 -1.6810 0.7843 0.7843 0.7843 0.7843 1.7127 1.7127 1.7127 1.7127 2.9967 2.9967 2.9967 2.9967 3.4536 3.4536 3.4536 3.4536 3.8118 3.8118 3.8118 3.8118 4.4917 4.4917 4.4917 4.4917 4.7344 4.7344 4.7344 4.7344 5.0626 5.0626 5.0626 5.0626 5.7239 5.7239 5.7239 5.7239 5.8603 5.8603 5.8603 5.8603 6.5176 6.5176 6.5176 6.5176 6.7137 6.7137 6.7137 6.7137 7.0090 7.0090 7.0090 7.0090 7.8294 7.8294 7.8294 7.8294 8.2521 8.2521 8.2521 8.2521 9.6033 9.6033 9.6033 9.6033 11.2606 11.2606 11.2606 11.2606 12.5414 12.5414 12.5414 12.5414 14.2352 14.2352 14.2352 14.2352 k = 0.5000 0.0697-0.0000 ( 9982 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3722 -82.3722 -82.3722 -82.3722 -82.3721 -82.3721 -82.3721 -82.3721 -48.4854 -48.4854 -48.4854 -48.4854 -48.4845 -48.4845 -48.4845 -48.4845 -46.8780 -46.8780 -46.8780 -46.8780 -46.8766 -46.8766 -46.8766 -46.8766 -46.7238 -46.7238 -46.7238 -46.7238 -46.7231 -46.7231 -46.7231 -46.7231 -35.3960 -35.3960 -35.3960 -35.3960 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************************************************************************ -82.3722 -82.3722 -82.3722 -82.3722 -82.3720 -82.3720 -82.3720 -82.3720 -48.4854 -48.4854 -48.4854 -48.4854 -48.4845 -48.4845 -48.4845 -48.4845 -46.8780 -46.8780 -46.8780 -46.8780 -46.8766 -46.8766 -46.8766 -46.8766 -46.7238 -46.7238 -46.7238 -46.7238 -46.7231 -46.7231 -46.7231 -46.7231 -35.3942 -35.3942 -35.3942 -35.3942 -35.2759 -35.2759 -35.2759 -35.2759 -16.0011 -16.0011 -16.0011 -16.0011 -15.9278 -15.9278 -15.9278 -15.9278 -14.5433 -14.5433 -14.5433 -14.5433 -14.1151 -14.1151 -14.1151 -14.1151 -12.6401 -12.6401 -12.6401 -12.6401 -12.1663 -12.1663 -12.1663 -12.1663 -1.8587 -1.8587 -1.8587 -1.8587 -1.6858 -1.6858 -1.6858 -1.6858 0.8168 0.8168 0.8168 0.8168 1.6750 1.6750 1.6750 1.6750 3.0493 3.0493 3.0493 3.0493 3.4403 3.4403 3.4403 3.4403 3.7824 3.7824 3.7824 3.7824 4.4751 4.4751 4.4751 4.4751 4.7578 4.7578 4.7578 4.7578 5.0657 5.0657 5.0657 5.0657 5.7179 5.7179 5.7179 5.7179 5.8547 5.8547 5.8547 5.8547 6.5222 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14.2793 14.2793 k = 0.5000 0.1095-0.0000 ( 9942 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3718 -82.3718 -82.3718 -82.3718 -82.3716 -82.3716 -82.3716 -82.3716 -48.4853 -48.4853 -48.4853 -48.4853 -48.4845 -48.4845 -48.4845 -48.4845 -46.8780 -46.8780 -46.8780 -46.8780 -46.8767 -46.8767 -46.8767 -46.8767 -46.7237 -46.7237 -46.7237 -46.7237 -46.7230 -46.7230 -46.7230 -46.7230 -35.3867 -35.3867 -35.3867 -35.3867 -35.2801 -35.2801 -35.2801 -35.2801 -15.9972 -15.9972 -15.9972 -15.9972 -15.9301 -15.9301 -15.9301 -15.9301 -14.5158 -14.5158 -14.5158 -14.5158 -14.1265 -14.1265 -14.1265 -14.1265 -12.6303 -12.6303 -12.6303 -12.6303 -12.2013 -12.2013 -12.2013 -12.2013 -1.8467 -1.8467 -1.8467 -1.8467 -1.6946 -1.6946 -1.6946 -1.6946 0.8792 0.8792 0.8792 0.8792 1.6154 1.6154 1.6154 1.6154 3.1154 3.1154 3.1154 3.1154 3.4241 3.4241 3.4241 3.4241 3.7416 3.7416 3.7416 3.7416 4.4518 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************************************************************************ ************************************************************************ -82.3720 -82.3720 -82.3720 -82.3720 -82.3717 -82.3717 -82.3717 -82.3717 -48.4853 -48.4853 -48.4853 -48.4853 -48.4845 -48.4845 -48.4845 -48.4845 -46.8779 -46.8779 -46.8779 -46.8779 -46.8769 -46.8769 -46.8769 -46.8769 -46.7237 -46.7237 -46.7237 -46.7237 -46.7230 -46.7230 -46.7230 -46.7230 -35.3764 -35.3764 -35.3764 -35.3764 -35.2950 -35.2950 -35.2950 -35.2950 -15.9890 -15.9890 -15.9890 -15.9890 -15.9368 -15.9368 -15.9368 -15.9368 -14.4569 -14.4569 -14.4569 -14.4569 -14.1557 -14.1557 -14.1557 -14.1557 -12.6044 -12.6044 -12.6044 -12.6044 -12.2758 -12.2758 -12.2758 -12.2758 -1.8247 -1.8247 -1.8247 -1.8247 -1.7113 -1.7113 -1.7113 -1.7113 1.0074 1.0074 1.0074 1.0074 1.5255 1.5255 1.5255 1.5255 3.1255 3.1255 3.1255 3.1255 3.3855 3.3855 3.3855 3.3855 3.7673 3.7673 3.7673 3.7673 4.4068 4.4068 4.4068 4.4068 4.8428 4.8428 4.8428 4.8428 5.0813 5.0813 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11.6957 11.6957 11.6957 11.6957 12.5895 12.5895 12.5895 12.5895 14.4022 14.4022 14.4022 14.4022 k = 0.5000 0.1892-0.0000 ( 9946 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3718 -82.3718 -82.3718 -82.3718 -82.3717 -82.3717 -82.3717 -82.3717 -48.4853 -48.4853 -48.4853 -48.4853 -48.4846 -48.4846 -48.4846 -48.4846 -46.8778 -46.8778 -46.8778 -46.8778 -46.8770 -46.8770 -46.8770 -46.8770 -46.7236 -46.7236 -46.7236 -46.7236 -46.7230 -46.7230 -46.7230 -46.7230 -35.3674 -35.3674 -35.3674 -35.3674 -35.3027 -35.3027 -35.3027 -35.3027 -15.9829 -15.9829 -15.9829 -15.9829 -15.9420 -15.9420 -15.9420 -15.9420 -14.4159 -14.4159 -14.4159 -14.4159 -14.1797 -14.1797 -14.1797 -14.1797 -12.5815 -12.5815 -12.5815 -12.5815 -12.3259 -12.3259 -12.3259 -12.3259 -1.8118 -1.8118 -1.8118 -1.8118 -1.7215 -1.7215 -1.7215 -1.7215 1.0900 1.0900 1.0900 1.0900 1.4806 1.4806 1.4806 1.4806 3.0903 3.0903 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************************************************************************ -82.3720 -82.3720 -82.3720 -82.3720 -82.3718 -82.3718 -82.3718 -82.3718 -48.4852 -48.4852 -48.4852 -48.4852 -48.4846 -48.4846 -48.4846 -48.4846 -46.8777 -46.8777 -46.8777 -46.8777 -46.8771 -46.8771 -46.8771 -46.8771 -46.7236 -46.7236 -46.7236 -46.7236 -46.7230 -46.7230 -46.7230 -46.7230 -35.3612 -35.3612 -35.3612 -35.3612 -35.3097 -35.3097 -35.3097 -35.3097 -15.9786 -15.9786 -15.9786 -15.9786 -15.9460 -15.9460 -15.9460 -15.9460 -14.3876 -14.3876 -14.3876 -14.3876 -14.1986 -14.1986 -14.1986 -14.1986 -12.5630 -12.5630 -12.5630 -12.5630 -12.3600 -12.3600 -12.3600 -12.3600 -1.8039 -1.8039 -1.8039 -1.8039 -1.7279 -1.7279 -1.7279 -1.7279 1.1437 1.1437 1.1437 1.1437 1.4531 1.4531 1.4531 1.4531 3.0640 3.0640 3.0640 3.0640 3.2947 3.2947 3.2947 3.2947 3.9260 3.9260 3.9260 3.9260 4.3348 4.3348 4.3348 4.3348 4.9028 4.9028 4.9028 4.9028 5.0710 5.0710 5.0710 5.0710 5.6835 5.6835 5.6835 5.6835 5.8077 5.8077 5.8077 5.8077 6.5586 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14.5523 14.5523 k = 0.5000 0.2389-0.0000 ( 9950 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3719 -82.3719 -82.3719 -82.3719 -82.3717 -82.3717 -82.3717 -82.3717 -48.4852 -48.4852 -48.4852 -48.4852 -48.4846 -48.4846 -48.4846 -48.4846 -46.8776 -46.8776 -46.8776 -46.8776 -46.8772 -46.8772 -46.8772 -46.8772 -46.7236 -46.7236 -46.7236 -46.7236 -46.7230 -46.7230 -46.7230 -46.7230 -35.3510 -35.3510 -35.3510 -35.3510 -35.3201 -35.3201 -35.3201 -35.3201 -15.9717 -15.9717 -15.9717 -15.9717 -15.9522 -15.9522 -15.9522 -15.9522 -14.3453 -14.3453 -14.3453 -14.3453 -14.2301 -14.2301 -14.2301 -14.2301 -12.5302 -12.5302 -12.5302 -12.5302 -12.4098 -12.4098 -12.4098 -12.4098 -1.7939 -1.7939 -1.7939 -1.7939 -1.7364 -1.7364 -1.7364 -1.7364 1.2164 1.2164 1.2164 1.2164 1.4136 1.4136 1.4136 1.4136 3.0317 3.0317 3.0317 3.0317 3.2482 3.2482 3.2482 3.2482 4.0336 4.0336 4.0336 4.0336 4.2728 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************************************************************************ ************************************************************************ -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -48.4853 -48.4853 -48.4853 -48.4853 -48.4847 -48.4847 -48.4847 -48.4847 -46.8775 -46.8775 -46.8775 -46.8775 -46.8774 -46.8774 -46.8774 -46.8774 -46.7236 -46.7236 -46.7236 -46.7236 -46.7230 -46.7230 -46.7230 -46.7230 -35.3372 -35.3372 -35.3372 -35.3372 -35.3366 -35.3366 -35.3366 -35.3366 -15.9647 -15.9647 -15.9647 -15.9647 -15.9595 -15.9595 -15.9595 -15.9595 -14.3057 -14.3057 -14.3057 -14.3057 -14.2648 -14.2648 -14.2648 -14.2648 -12.4889 -12.4889 -12.4889 -12.4889 -12.4603 -12.4603 -12.4603 -12.4603 -1.7878 -1.7878 -1.7878 -1.7878 -1.7418 -1.7418 -1.7418 -1.7418 1.2692 1.2692 1.2692 1.2692 1.3790 1.3790 1.3790 1.3790 3.0139 3.0139 3.0139 3.0139 3.2227 3.2227 3.2227 3.2227 4.1523 4.1523 4.1523 4.1523 4.1779 4.1779 4.1779 4.1779 4.9790 4.9790 4.9790 4.9790 5.0247 5.0247 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14.5264 14.5264 k = 0.4200 0.2788-0.0000 ( 9966 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3775 -82.3775 -82.3774 -82.3774 -82.3667 -82.3667 -82.3667 -82.3667 -48.4955 -48.4955 -48.4950 -48.4950 -48.4739 -48.4739 -48.4732 -48.4732 -46.8854 -46.8854 -46.8851 -46.8851 -46.8672 -46.8672 -46.8671 -46.8671 -46.7365 -46.7365 -46.7356 -46.7356 -46.7120 -46.7120 -46.7118 -46.7118 -35.3605 -35.3605 -35.3599 -35.3599 -35.3217 -35.3217 -35.3210 -35.3210 -16.0216 -16.0216 -16.0113 -16.0113 -15.8635 -15.8635 -15.8627 -15.8627 -14.3689 -14.3689 -14.3231 -14.3231 -14.2318 -14.2318 -14.1973 -14.1973 -12.5283 -12.5283 -12.4983 -12.4983 -12.4344 -12.4344 -12.4096 -12.4096 -2.2212 -2.2212 -2.1710 -2.1710 -1.5675 -1.5675 -1.3772 -1.3772 1.1055 1.1055 1.3136 1.3136 1.5101 1.5101 1.6214 1.6214 2.7552 2.7552 2.9719 2.9719 3.1381 3.1381 3.3481 3.3481 4.0057 4.0057 4.0626 4.0626 4.2754 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************************************************************************ ************************************************************************ -82.3807 -82.3807 -82.3807 -82.3807 -82.3631 -82.3631 -82.3631 -82.3631 -48.5010 -48.5010 -48.5006 -48.5006 -48.4666 -48.4666 -48.4658 -48.4658 -46.8887 -46.8887 -46.8884 -46.8884 -46.8598 -46.8598 -46.8597 -46.8597 -46.7451 -46.7451 -46.7439 -46.7439 -46.7057 -46.7057 -46.7056 -46.7056 -35.3778 -35.3778 -35.3774 -35.3774 -35.3148 -35.3148 -35.3141 -35.3141 -16.0382 -16.0382 -16.0246 -16.0246 -15.7813 -15.7813 -15.7799 -15.7799 -14.3943 -14.3943 -14.3463 -14.3463 -14.1891 -14.1891 -14.1596 -14.1596 -12.5434 -12.5434 -12.5138 -12.5138 -12.3935 -12.3935 -12.3724 -12.3724 -2.5346 -2.5346 -2.4550 -2.4550 -1.5317 -1.5317 -1.2610 -1.2610 1.0760 1.0760 1.3853 1.3853 1.6655 1.6655 1.7993 1.7993 2.5611 2.5611 2.7716 2.7716 3.1525 3.1525 3.3613 3.3613 3.9049 3.9049 4.0355 4.0355 4.3002 4.3002 4.3688 4.3688 4.8205 4.8205 4.8745 4.8745 5.2121 5.2121 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11.3394 11.3394 11.4555 11.4555 12.3381 12.3381 13.1201 13.1201 14.0079 14.0079 14.2273 14.2273 k = 0.3400 0.2788-0.0000 ( 9970 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3830 -82.3830 -82.3829 -82.3829 -82.3617 -82.3617 -82.3616 -82.3616 -48.5041 -48.5041 -48.5037 -48.5037 -48.4623 -48.4623 -48.4616 -48.4616 -46.8902 -46.8902 -46.8899 -46.8899 -46.8553 -46.8553 -46.8552 -46.8552 -46.7504 -46.7504 -46.7491 -46.7491 -46.7023 -46.7023 -46.7022 -46.7022 -35.3906 -35.3906 -35.3902 -35.3902 -35.3138 -35.3138 -35.3131 -35.3131 -16.0438 -16.0438 -16.0283 -16.0283 -15.7276 -15.7276 -15.7249 -15.7249 -14.4027 -14.4027 -14.3537 -14.3537 -14.1670 -14.1670 -14.1411 -14.1411 -12.5485 -12.5485 -12.5194 -12.5194 -12.3667 -12.3667 -12.3483 -12.3483 -2.7191 -2.7191 -2.6310 -2.6310 -1.5436 -1.5436 -1.2410 -1.2410 1.0822 1.0822 1.4613 1.4613 1.7531 1.7531 1.8859 1.8859 2.4505 2.4505 2.6516 2.6516 3.1497 3.1497 3.3581 3.3581 3.8505 3.8505 4.0335 4.0335 4.3026 4.3026 4.4290 4.4290 4.8288 4.8288 4.8373 4.8373 5.2042 5.2042 5.2585 5.2585 5.4956 5.4956 5.5047 5.5047 5.8069 5.8069 5.9495 5.9495 6.7060 6.7060 6.7151 6.7151 6.8534 6.8534 7.0084 7.0084 7.3532 7.3532 7.3819 7.3819 7.7063 7.7063 8.1939 8.1939 8.6286 8.6286 8.9918 8.9918 9.1513 9.1513 9.3081 9.3081 11.3040 11.3040 11.4019 11.4019 12.3492 12.3492 13.1312 13.1312 13.9555 13.9555 14.1771 14.1771 k = 0.3300 0.2788-0.0000 ( 9970 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3837 -82.3837 -82.3837 -82.3837 -82.3610 -82.3610 -82.3610 -82.3610 -48.5050 -48.5050 -48.5046 -48.5046 -48.4609 -48.4609 -48.4601 -48.4601 -46.8906 -46.8906 -46.8902 -46.8902 -46.8537 -46.8537 -46.8536 -46.8536 -46.7522 -46.7522 -46.7508 -46.7508 -46.7013 -46.7013 -46.7011 -46.7011 -35.3941 -35.3941 -35.3937 -35.3937 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************************************************************************ -82.3843 -82.3843 -82.3843 -82.3843 -82.3605 -82.3605 -82.3605 -82.3605 -48.5059 -48.5059 -48.5056 -48.5056 -48.4594 -48.4594 -48.4587 -48.4587 -46.8910 -46.8910 -46.8906 -46.8906 -46.8522 -46.8522 -46.8520 -46.8520 -46.7539 -46.7539 -46.7525 -46.7525 -46.7003 -46.7003 -46.7001 -46.7001 -35.3977 -35.3977 -35.3974 -35.3974 -35.3133 -35.3133 -35.3126 -35.3126 -16.0460 -16.0460 -16.0296 -16.0296 -15.6898 -15.6898 -15.6865 -15.6865 -14.4049 -14.4049 -14.3555 -14.3555 -14.1539 -14.1539 -14.1305 -14.1305 -12.5498 -12.5498 -12.5212 -12.5212 -12.3479 -12.3479 -12.3314 -12.3314 -2.8390 -2.8390 -2.7482 -2.7482 -1.5627 -1.5627 -1.2472 -1.2472 1.0909 1.0909 1.5188 1.5188 1.8071 1.8071 1.9258 1.9258 2.3846 2.3846 2.5805 2.5805 3.1487 3.1487 3.3577 3.3577 3.8163 3.8163 4.0379 4.0379 4.3047 4.3047 4.4694 4.4694 4.8092 4.8092 4.8368 4.8368 5.1947 5.1947 5.2341 5.2341 5.5258 5.5258 5.5461 5.5461 5.8068 5.8068 5.9383 5.9383 6.7097 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13.9473 13.9473 k = 0.2900 0.2788-0.0000 ( 9968 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3861 -82.3861 -82.3861 -82.3861 -82.3588 -82.3588 -82.3587 -82.3587 -48.5084 -48.5084 -48.5082 -48.5082 -48.4553 -48.4553 -48.4546 -48.4546 -46.8917 -46.8917 -46.8913 -46.8913 -46.8475 -46.8475 -46.8473 -46.8473 -46.7593 -46.7593 -46.7577 -46.7577 -46.6974 -46.6974 -46.6971 -46.6971 -35.4098 -35.4098 -35.4095 -35.4095 -35.3145 -35.3145 -35.3138 -35.3138 -16.0477 -16.0477 -16.0303 -16.0303 -15.6322 -15.6322 -15.6277 -15.6277 -14.4028 -14.4028 -14.3533 -14.3533 -14.1369 -14.1369 -14.1176 -14.1176 -12.5488 -12.5488 -12.5211 -12.5211 -12.3182 -12.3182 -12.3049 -12.3049 -3.0122 -3.0122 -2.9210 -2.9210 -1.6039 -1.6039 -1.2812 -1.2812 1.1003 1.1003 1.5971 1.5971 1.8787 1.8787 1.9558 1.9558 2.3045 2.3045 2.4986 2.4986 3.1556 3.1556 3.3648 3.3648 3.7696 3.7696 4.0504 4.0504 4.3118 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************************************************************************ ************************************************************************ -82.3892 -82.3892 -82.3891 -82.3891 -82.3562 -82.3562 -82.3562 -82.3562 -48.5121 -48.5121 -48.5119 -48.5119 -48.4489 -48.4489 -48.4483 -48.4483 -46.8922 -46.8922 -46.8917 -46.8917 -46.8397 -46.8397 -46.8394 -46.8394 -46.7680 -46.7680 -46.7663 -46.7663 -46.6932 -46.6932 -46.6929 -46.6929 -35.4305 -35.4305 -35.4302 -35.4302 -35.3159 -35.3159 -35.3154 -35.3154 -16.0485 -16.0485 -16.0304 -16.0304 -15.5374 -15.5374 -15.5311 -15.5311 -14.3861 -14.3861 -14.3374 -14.3374 -14.1168 -14.1168 -14.1054 -14.1054 -12.5387 -12.5387 -12.5133 -12.5133 -12.2673 -12.2673 -12.2587 -12.2587 -3.2779 -3.2779 -3.1935 -3.1935 -1.6927 -1.6927 -1.3856 -1.3856 1.0768 1.0768 1.5867 1.5867 1.9531 1.9531 2.0293 2.0293 2.2471 2.2471 2.4220 2.4220 3.2102 3.2102 3.3884 3.3884 3.7319 3.7319 4.0721 4.0721 4.3351 4.3351 4.5833 4.5833 4.7052 4.7052 4.8702 4.8702 5.1523 5.1523 5.1782 5.1782 5.6931 5.6931 5.7623 5.7623 5.8372 5.8372 5.9251 5.9251 6.6755 6.6755 6.7380 6.7380 6.9627 6.9627 7.1730 7.1730 7.6336 7.6336 7.8921 7.8921 8.1128 8.1128 8.3066 8.3066 8.9543 8.9543 9.3387 9.3387 9.5650 9.5650 9.7699 9.7699 11.0519 11.0519 11.0583 11.0583 12.3508 12.3508 13.0005 13.0005 13.5013 13.5013 13.6607 13.6607 k = 0.2300 0.2788-0.0000 ( 9980 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3899 -82.3899 -82.3899 -82.3899 -82.3558 -82.3558 -82.3558 -82.3558 -48.5127 -48.5127 -48.5125 -48.5125 -48.4477 -48.4477 -48.4471 -48.4471 -46.8922 -46.8922 -46.8917 -46.8917 -46.8382 -46.8382 -46.8379 -46.8379 -46.7698 -46.7698 -46.7680 -46.7680 -46.6925 -46.6925 -46.6922 -46.6922 -35.4342 -35.4342 -35.4340 -35.4340 -35.3166 -35.3166 -35.3161 -35.3161 -16.0486 -16.0486 -16.0305 -16.0305 -15.5191 -15.5191 -15.5125 -15.5125 -14.3810 -14.3810 -14.3327 -14.3327 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11.0292 11.0292 11.0379 11.0379 12.3265 12.3265 12.9199 12.9199 13.4607 13.4607 13.5931 13.5931 k = 0.2100 0.2788-0.0000 ( 9968 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3907 -82.3907 -82.3907 -82.3907 -82.3548 -82.3548 -82.3548 -82.3548 -48.5139 -48.5139 -48.5137 -48.5137 -48.4454 -48.4454 -48.4449 -48.4449 -46.8921 -46.8921 -46.8916 -46.8916 -46.8352 -46.8352 -46.8348 -46.8348 -46.7732 -46.7732 -46.7714 -46.7714 -46.6911 -46.6911 -46.6908 -46.6908 -35.4410 -35.4410 -35.4407 -35.4407 -35.3168 -35.3168 -35.3163 -35.3163 -16.0486 -16.0486 -16.0308 -16.0308 -15.4834 -15.4834 -15.4764 -15.4764 -14.3691 -14.3691 -14.3220 -14.3220 -14.1100 -14.1100 -14.1033 -14.1033 -12.5282 -12.5282 -12.5046 -12.5046 -12.2365 -12.2365 -12.2307 -12.2307 -3.4201 -3.4201 -3.3429 -3.3429 -1.7497 -1.7497 -1.4647 -1.4647 1.0334 1.0334 1.4822 1.4822 1.9562 1.9562 2.1091 2.1091 2.2706 2.2706 2.4018 2.4018 3.2737 3.2737 3.3870 3.3870 3.7589 3.7589 4.0735 4.0735 4.3507 4.3507 4.5653 4.5653 4.7189 4.7189 4.8875 4.8875 5.1560 5.1560 5.1826 5.1826 5.7532 5.7532 5.8243 5.8243 5.8714 5.8714 5.9551 5.9551 6.6615 6.6615 6.7325 6.7325 6.9850 6.9850 7.1965 7.1965 7.7081 7.7081 7.9999 7.9999 8.1779 8.1779 8.3161 8.3161 9.0864 9.0864 9.4264 9.4264 9.7357 9.7357 9.9029 9.9029 11.0218 11.0218 11.0333 11.0333 12.3113 12.3113 12.8742 12.8742 13.4487 13.4487 13.5649 13.5649 k = 0.2000 0.2788-0.0000 ( 9954 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3909 -82.3909 -82.3909 -82.3909 -82.3543 -82.3543 -82.3542 -82.3542 -48.5144 -48.5144 -48.5143 -48.5143 -48.4443 -48.4443 -48.4438 -48.4438 -46.8920 -46.8920 -46.8915 -46.8915 -46.8337 -46.8337 -46.8332 -46.8332 -46.7749 -46.7749 -46.7731 -46.7731 -46.6905 -46.6905 -46.6901 -46.6901 -35.4441 -35.4441 -35.4439 -35.4439 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************************************************************************ -82.3914 -82.3914 -82.3913 -82.3913 -82.3538 -82.3538 -82.3538 -82.3538 -48.5149 -48.5149 -48.5148 -48.5148 -48.4433 -48.4433 -48.4427 -48.4427 -46.8919 -46.8919 -46.8914 -46.8914 -46.8322 -46.8322 -46.8317 -46.8317 -46.7765 -46.7765 -46.7747 -46.7747 -46.6898 -46.6898 -46.6895 -46.6895 -35.4469 -35.4469 -35.4467 -35.4467 -35.3173 -35.3173 -35.3169 -35.3169 -16.0486 -16.0486 -16.0313 -16.0313 -15.4497 -15.4497 -15.4423 -15.4423 -14.3554 -14.3554 -14.3098 -14.3098 -14.1075 -14.1075 -14.1040 -14.1040 -12.5194 -12.5194 -12.4974 -12.4974 -12.2165 -12.2165 -12.2123 -12.2123 -3.5065 -3.5065 -3.4350 -3.4350 -1.7866 -1.7866 -1.5202 -1.5202 0.9955 0.9955 1.3962 1.3962 1.9438 1.9438 2.1411 2.1411 2.3052 2.3052 2.4141 2.4141 3.3270 3.3270 3.3766 3.3766 3.7983 3.7983 4.0655 4.0655 4.3584 4.3584 4.5434 4.5434 4.7414 4.7414 4.9034 4.9034 5.1699 5.1699 5.1881 5.1881 5.7842 5.7842 5.8537 5.8537 5.9049 5.9049 5.9869 5.9869 6.6551 6.6551 6.7277 6.7277 7.0005 7.0005 7.2012 7.2012 7.7523 7.7523 8.0565 8.0565 8.2094 8.2094 8.3203 8.3203 9.1755 9.1755 9.4760 9.4760 9.8525 9.8525 9.9834 9.9834 11.0140 11.0140 11.0327 11.0327 12.2748 12.2748 12.7745 12.7745 13.4371 13.4371 13.5173 13.5173 k = 0.1800 0.2788-0.0000 ( 9956 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3918 -82.3918 -82.3917 -82.3917 -82.3537 -82.3537 -82.3536 -82.3536 -48.5154 -48.5154 -48.5153 -48.5153 -48.4423 -48.4423 -48.4417 -48.4417 -46.8918 -46.8918 -46.8913 -46.8913 -46.8308 -46.8308 -46.8302 -46.8302 -46.7782 -46.7782 -46.7764 -46.7764 -46.6893 -46.6893 -46.6889 -46.6889 -35.4501 -35.4501 -35.4499 -35.4499 -35.3182 -35.3182 -35.3178 -35.3178 -16.0488 -16.0488 -16.0318 -16.0318 -15.4337 -15.4337 -15.4262 -15.4262 -14.3481 -14.3481 -14.3034 -14.3034 -14.1070 -14.1070 -14.1050 -14.1050 -12.5148 -12.5148 -12.4936 -12.4936 -12.2068 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13.4400 13.4812 13.4812 k = 0.1600 0.2788-0.0000 ( 9968 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3927 -82.3927 -82.3927 -82.3927 -82.3532 -82.3532 -82.3531 -82.3531 -48.5164 -48.5164 -48.5163 -48.5163 -48.4404 -48.4404 -48.4399 -48.4399 -46.8915 -46.8915 -46.8910 -46.8910 -46.8279 -46.8279 -46.8273 -46.8273 -46.7815 -46.7815 -46.7797 -46.7797 -46.6882 -46.6882 -46.6879 -46.6879 -35.4575 -35.4575 -35.4573 -35.4573 -35.3199 -35.3199 -35.3195 -35.3195 -16.0491 -16.0491 -16.0331 -16.0331 -15.4033 -15.4033 -15.3958 -15.3958 -14.3325 -14.3325 -14.2897 -14.2897 -14.1082 -14.1082 -14.1072 -14.1072 -12.5050 -12.5050 -12.4855 -12.4855 -12.1881 -12.1881 -12.1859 -12.1859 -3.6225 -3.6225 -3.5606 -3.5606 -1.8373 -1.8373 -1.6038 -1.6038 0.9318 0.9318 1.2608 1.2608 1.9141 1.9141 2.1277 2.1277 2.3717 2.3717 2.4861 2.4861 3.3562 3.3562 3.4164 3.4164 3.8746 3.8746 4.0390 4.0390 4.3615 4.3615 4.5119 4.5119 4.7818 4.7818 4.9346 4.9346 5.1989 5.1989 5.2023 5.2023 5.8182 5.8182 5.8860 5.8860 5.9652 5.9652 6.0400 6.0400 6.6506 6.6506 6.7185 6.7185 7.0243 7.0243 7.1906 7.1906 7.8063 7.8063 8.1178 8.1178 8.2458 8.2458 8.3260 8.3260 9.3040 9.3040 9.5375 9.5375 10.0226 10.0226 10.0933 10.0933 11.0137 11.0137 11.0402 11.0402 12.2042 12.2042 12.6103 12.6103 13.4455 13.4455 13.4671 13.4671 k = 0.1500 0.2788-0.0000 ( 9980 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3932 -82.3932 -82.3932 -82.3932 -82.3530 -82.3530 -82.3530 -82.3530 -48.5168 -48.5168 -48.5167 -48.5167 -48.4395 -48.4395 -48.4391 -48.4391 -46.8913 -46.8913 -46.8908 -46.8908 -46.8265 -46.8265 -46.8258 -46.8258 -46.7831 -46.7831 -46.7813 -46.7813 -46.6877 -46.6877 -46.6874 -46.6874 -35.4612 -35.4612 -35.4611 -35.4611 -35.3207 -35.3207 -35.3203 -35.3203 -16.0493 -16.0493 -16.0339 -16.0339 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(ev): ************************************************************************ ************************************************************************ -82.3942 -82.3942 -82.3942 -82.3942 -82.3518 -82.3518 -82.3518 -82.3518 -48.5181 -48.5181 -48.5180 -48.5180 -48.4365 -48.4365 -48.4362 -48.4362 -46.8905 -46.8905 -46.8901 -46.8901 -46.8210 -46.8210 -46.8202 -46.8202 -46.7893 -46.7893 -46.7875 -46.7875 -46.6861 -46.6861 -46.6858 -46.6858 -35.4712 -35.4712 -35.4711 -35.4711 -35.3218 -35.3218 -35.3215 -35.3215 -16.0493 -16.0493 -16.0369 -16.0369 -15.3395 -15.3395 -15.3333 -15.3333 -14.2900 -14.2900 -14.2536 -14.2536 -14.1215 -14.1215 -14.1140 -14.1140 -12.4793 -12.4793 -12.4650 -12.4650 -12.1474 -12.1474 -12.1473 -12.1473 -3.7748 -3.7748 -3.7310 -3.7310 -1.9019 -1.9019 -1.7331 -1.7331 0.8324 0.8324 1.0508 1.0508 1.8623 1.8623 2.0294 2.0294 2.4940 2.4940 2.6412 2.6412 3.3472 3.3472 3.5612 3.5612 3.9749 3.9749 4.0015 4.0015 4.3443 4.3443 4.4691 4.4691 4.8605 4.8605 4.9992 4.9992 5.2256 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1.8804 2.6613 2.6613 2.7268 2.7268 3.4727 3.4727 3.6036 3.6036 3.9738 3.9738 4.0543 4.0543 4.3462 4.3462 4.4009 4.4009 4.9848 4.9848 5.0376 5.0376 5.2996 5.2996 5.3299 5.3299 5.9070 5.9070 5.9301 5.9301 6.1724 6.1724 6.1856 6.1856 6.6824 6.6824 6.6905 6.6905 7.0728 7.0728 7.0729 7.0729 7.9599 7.9599 8.0586 8.0586 8.3928 8.3928 8.4104 8.4104 9.6309 9.6309 9.6487 9.6487 10.6136 10.6136 10.6421 10.6421 10.9161 10.9161 10.9180 10.9180 11.8498 11.8498 11.9352 11.9352 13.4251 13.4251 13.4543 13.4543 k = 0.0200 0.2788-0.0000 ( 9972 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3957 -82.3957 -82.3957 -82.3957 -82.3508 -82.3508 -82.3508 -82.3508 -48.5196 -48.5196 -48.5196 -48.5196 -48.4329 -48.4329 -48.4329 -48.4329 -46.8892 -46.8892 -46.8891 -46.8891 -46.8101 -46.8101 -46.8093 -46.8093 -46.8006 -46.8006 -46.7997 -46.7997 -46.6842 -46.6842 -46.6841 -46.6841 -35.4831 -35.4831 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************************************************************************ ************************************************************************ -82.3958 -82.3958 -82.3958 -82.3958 -82.3509 -82.3509 -82.3509 -82.3509 -48.5197 -48.5197 -48.5197 -48.5197 -48.4329 -48.4329 -48.4328 -48.4328 -46.8892 -46.8892 -46.8891 -46.8891 -46.8093 -46.8093 -46.8089 -46.8089 -46.8011 -46.8011 -46.8005 -46.8005 -46.6841 -46.6841 -46.6841 -46.6841 -35.4838 -35.4838 -35.4838 -35.4838 -35.3265 -35.3265 -35.3264 -35.3264 -16.0472 -16.0472 -16.0461 -16.0461 -15.2779 -15.2779 -15.2771 -15.2771 -14.2155 -14.2155 -14.2090 -14.2090 -14.1505 -14.1505 -14.1466 -14.1466 -12.4455 -12.4455 -12.4440 -12.4440 -12.1076 -12.1076 -12.1075 -12.1075 -3.9046 -3.9046 -3.9005 -3.9005 -1.9216 -1.9216 -1.9056 -1.9056 0.7705 0.7705 0.7898 0.7898 1.8412 1.8412 1.8572 1.8572 2.6911 2.6911 2.7136 2.7136 3.5206 3.5206 3.5660 3.5660 4.0027 4.0027 4.0315 4.0315 4.3632 4.3632 4.3820 4.3820 5.0084 5.0084 5.0263 5.0263 5.3164 5.3164 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10.5781 10.6361 10.6361 10.8114 10.8114 11.1189 11.1189 11.6060 11.6060 12.2111 12.2111 13.3117 13.3117 13.6521 13.6521 k = 0.0000 0.2190-0.0000 ( 10003 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3961 -82.3961 -82.3959 -82.3959 -82.3517 -82.3517 -82.3509 -82.3509 -48.5198 -48.5198 -48.5197 -48.5197 -48.4332 -48.4332 -48.4325 -48.4325 -46.8894 -46.8894 -46.8890 -46.8890 -46.8093 -46.8093 -46.8084 -46.8084 -46.8014 -46.8014 -46.8009 -46.8009 -46.6844 -46.6844 -46.6837 -46.6837 -35.5093 -35.5093 -35.4595 -35.4595 -35.3494 -35.3494 -35.3051 -35.3051 -16.0561 -16.0561 -16.0351 -16.0351 -15.2930 -15.2930 -15.2668 -15.2668 -14.3557 -14.3557 -14.2744 -14.2744 -14.0696 -14.0696 -14.0396 -14.0396 -12.4859 -12.4859 -12.3864 -12.3864 -12.1404 -12.1404 -12.0547 -12.0547 -4.2748 -4.2748 -3.5899 -3.5899 -1.9513 -1.9513 -1.7950 -1.7950 0.5730 0.5730 1.0759 1.0759 1.8065 1.8065 1.8542 1.8542 2.5431 2.5431 2.8454 2.8454 3.4592 3.4592 3.6240 3.6240 3.9456 3.9456 4.0406 4.0406 4.2953 4.2953 4.3886 4.3886 4.9207 4.9207 5.1433 5.1433 5.2611 5.2611 5.4182 5.4182 5.8097 5.8097 6.0454 6.0454 6.0725 6.0725 6.3152 6.3152 6.4724 6.4724 6.7747 6.7747 6.9557 6.9557 7.1422 7.1422 7.9424 7.9424 8.0921 8.0921 8.3895 8.3895 8.5210 8.5210 9.2161 9.2161 10.0192 10.0192 10.5428 10.5428 10.6065 10.6065 10.8308 10.8308 11.1704 11.1704 11.5779 11.5779 12.2774 12.2774 13.3024 13.3024 13.7038 13.7038 k = 0.0000 0.2091-0.0000 ( 10001 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3961 -82.3961 -82.3958 -82.3958 -82.3516 -82.3516 -82.3509 -82.3509 -48.5198 -48.5198 -48.5197 -48.5197 -48.4332 -48.4332 -48.4324 -48.4324 -46.8894 -46.8894 -46.8890 -46.8890 -46.8094 -46.8094 -46.8083 -46.8083 -46.8014 -46.8014 -46.8009 -46.8009 -46.6844 -46.6844 -46.6836 -46.6836 -35.5131 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************************************************************************ ************************************************************************ -82.3961 -82.3961 -82.3957 -82.3957 -82.3515 -82.3515 -82.3507 -82.3507 -48.5198 -48.5198 -48.5196 -48.5196 -48.4333 -48.4333 -48.4323 -48.4323 -46.8894 -46.8894 -46.8890 -46.8890 -46.8095 -46.8095 -46.8082 -46.8082 -46.8014 -46.8014 -46.8009 -46.8009 -46.6845 -46.6845 -46.6836 -46.6836 -35.5157 -35.5157 -35.4523 -35.4523 -35.3563 -35.3563 -35.2970 -35.2970 -16.0580 -16.0580 -16.0305 -16.0305 -15.2990 -15.2990 -15.2640 -15.2640 -14.3998 -14.3998 -14.3163 -14.3163 -14.0272 -14.0272 -14.0071 -14.0071 -12.4958 -12.4958 -12.3641 -12.3641 -12.1473 -12.1473 -12.0334 -12.0334 -4.3989 -4.3989 -3.5073 -3.5073 -1.9516 -1.9516 -1.7339 -1.7339 0.5270 0.5270 1.1920 1.1920 1.7847 1.7847 1.8504 1.8504 2.4898 2.4898 2.8846 2.8846 3.4318 3.4318 3.6472 3.6472 3.9113 3.9113 4.0364 4.0364 4.2570 4.2570 4.3840 4.3840 4.9019 4.9019 5.1815 5.1815 5.2516 5.2516 5.4542 5.4542 5.7804 5.7804 6.0151 6.0151 6.1103 6.1103 6.3413 6.3413 6.4065 6.4065 6.7695 6.7695 6.9160 6.9160 7.1572 7.1572 7.9187 7.9187 8.1244 8.1244 8.4051 8.4051 8.5635 8.5635 9.0933 9.0933 10.0908 10.0908 10.4628 10.4628 10.5687 10.5687 10.8739 10.8739 11.2739 11.2739 11.5484 11.5484 12.3942 12.3942 13.3051 13.3051 13.8097 13.8098 k = 0.0000 0.1892-0.0000 ( 9997 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3960 -82.3960 -82.3959 -82.3959 -82.3516 -82.3516 -82.3507 -82.3507 -48.5198 -48.5198 -48.5196 -48.5196 -48.4334 -48.4334 -48.4323 -48.4323 -46.8894 -46.8894 -46.8889 -46.8889 -46.8095 -46.8095 -46.8081 -46.8081 -46.8015 -46.8015 -46.8009 -46.8009 -46.6845 -46.6845 -46.6835 -46.6835 -35.5196 -35.5196 -35.4489 -35.4489 -35.3600 -35.3600 -35.2943 -35.2943 -16.0590 -16.0590 -16.0285 -16.0285 -15.3021 -15.3021 -15.2629 -15.2629 -14.4209 -14.4209 -14.3373 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************************************************************************ ************************************************************************ -82.3963 -82.3963 -82.3957 -82.3957 -82.3511 -82.3511 -82.3509 -82.3509 -48.5198 -48.5198 -48.5197 -48.5197 -48.4337 -48.4337 -48.4319 -48.4319 -46.8897 -46.8897 -46.8888 -46.8888 -46.8100 -46.8100 -46.8075 -46.8075 -46.8020 -46.8020 -46.8010 -46.8010 -46.6846 -46.6846 -46.6829 -46.6829 -35.5438 -35.5438 -35.4198 -35.4198 -35.3862 -35.3862 -35.2711 -35.2711 -16.0620 -16.0620 -16.0115 -16.0115 -15.3318 -15.3318 -15.2574 -15.2574 -14.5643 -14.5643 -14.5009 -14.5009 -13.9113 -13.9113 -13.8516 -13.8516 -12.5235 -12.5235 -12.2519 -12.2519 -12.1641 -12.1641 -11.9205 -11.9205 -4.9224 -4.9224 -3.2652 -3.2652 -1.9280 -1.9280 -1.3467 -1.3467 0.4500 0.4500 1.6054 1.6054 1.8103 1.8103 1.8971 1.8971 2.2583 2.2583 2.9909 2.9909 3.3022 3.3022 3.5426 3.5426 3.7710 3.7710 3.9623 3.9623 4.0502 4.0502 4.3830 4.3830 4.8874 4.8874 5.2482 5.2482 5.3280 5.3280 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************************************************************************ -82.3959 -82.3959 -82.3958 -82.3958 -82.3516 -82.3516 -82.3500 -82.3500 -48.5199 -48.5199 -48.5196 -48.5196 -48.4338 -48.4338 -48.4317 -48.4317 -46.8897 -46.8897 -46.8887 -46.8887 -46.8100 -46.8100 -46.8074 -46.8074 -46.8022 -46.8022 -46.8011 -46.8011 -46.6846 -46.6846 -46.6827 -46.6827 -35.5522 -35.5522 -35.4331 -35.4331 -35.3699 -35.3699 -35.2635 -35.2635 -16.0551 -16.0551 -16.0040 -16.0040 -15.3428 -15.3428 -15.2600 -15.2600 -14.6144 -14.6144 -14.5865 -14.5865 -13.8770 -13.8770 -13.7979 -13.7979 -12.5169 -12.5169 -12.2393 -12.2393 -12.1346 -12.1346 -11.8832 -11.8832 -5.0283 -5.0283 -3.3040 -3.3040 -1.8798 -1.8798 -1.1805 -1.1805 0.4992 0.4992 1.4751 1.4751 1.7681 1.7681 2.2384 2.2384 2.2780 2.2780 2.9985 2.9985 3.2458 3.2458 3.3602 3.3602 3.7842 3.7842 3.8870 3.8870 4.0179 4.0179 4.4275 4.4275 4.8511 4.8511 5.2382 5.2382 5.2856 5.2856 5.3919 5.3919 5.6237 5.6237 5.7798 5.7798 6.1183 6.1183 6.3854 6.3854 6.4575 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5.1450 5.1450 5.6853 5.6853 5.7909 5.7909 6.0588 6.0588 6.1060 6.1060 6.9466 6.9466 7.0250 7.0250 7.0617 7.0617 7.1366 7.1366 7.2279 7.2279 7.2939 7.2939 8.7964 8.7964 8.8108 8.8108 9.0785 9.0785 9.0787 9.0787 10.0478 10.0478 10.1583 10.1583 11.7481 11.7481 11.8339 11.8339 12.8662 12.8662 12.9924 12.9924 13.7386 13.7386 13.7729 13.7729 k = 0.1100-0.0000 0.2408 ( 10006 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3947 -82.3947 -82.3947 -82.3947 -82.3524 -82.3524 -82.3524 -82.3524 -48.5182 -48.5182 -48.5182 -48.5182 -48.4364 -48.4364 -48.4363 -48.4363 -46.8905 -46.8905 -46.8902 -46.8902 -46.8207 -46.8207 -46.8206 -46.8206 -46.7889 -46.7889 -46.7886 -46.7886 -46.6856 -46.6856 -46.6856 -46.6856 -35.4966 -35.4966 -35.4965 -35.4965 -35.3008 -35.3008 -35.3007 -35.3007 -16.0273 -16.0273 -16.0148 -16.0148 -15.3576 -15.3576 -15.3479 -15.3479 -14.6256 -14.6256 -14.6053 -14.6053 -13.8747 -13.8747 -13.8729 -13.8729 -12.4479 -12.4479 -12.4271 -12.4271 -12.0453 -12.0453 -12.0174 -12.0174 -4.0106 -4.0106 -4.0099 -4.0099 -1.5117 -1.5117 -1.4415 -1.4415 1.0814 1.0814 1.1397 1.1397 1.7646 1.7646 1.8635 1.8635 2.7850 2.7850 2.8597 2.8597 3.2359 3.2359 3.3147 3.3147 3.9595 3.9595 4.0061 4.0061 4.4343 4.4343 4.4482 4.4482 4.5379 4.5379 4.6609 4.6609 5.0120 5.0120 5.1207 5.1207 5.6904 5.6904 5.7943 5.7943 6.0513 6.0513 6.1015 6.1015 6.9482 6.9482 7.0213 7.0213 7.0678 7.0678 7.1426 7.1426 7.2252 7.2252 7.3161 7.3161 8.7568 8.7568 8.7775 8.7775 9.0441 9.0441 9.0483 9.0483 10.0349 10.0349 10.1388 10.1388 11.7633 11.7633 11.8573 11.8573 12.8484 12.8484 12.9955 12.9955 13.7409 13.7409 13.7833 13.7833 k = 0.1200-0.0000 0.2408 ( 10018 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3945 -82.3945 -82.3945 -82.3945 -82.3528 -82.3528 -82.3528 -82.3528 -48.5179 -48.5179 -48.5179 -48.5179 -48.4371 -48.4371 -48.4370 -48.4370 -46.8907 -46.8907 -46.8904 -46.8904 -46.8221 -46.8221 -46.8220 -46.8220 -46.7874 -46.7874 -46.7871 -46.7871 -46.6860 -46.6860 -46.6859 -46.6859 -35.4956 -35.4956 -35.4955 -35.4955 -35.3007 -35.3007 -35.3006 -35.3006 -16.0283 -16.0283 -16.0147 -16.0147 -15.3691 -15.3691 -15.3582 -15.3582 -14.6262 -14.6262 -14.6052 -14.6052 -13.8806 -13.8806 -13.8791 -13.8791 -12.4551 -12.4551 -12.4328 -12.4328 -12.0496 -12.0496 -12.0198 -12.0198 -3.9808 -3.9808 -3.9805 -3.9805 -1.5032 -1.5032 -1.4283 -1.4283 1.1131 1.1131 1.1762 1.1762 1.7653 1.7653 1.8667 1.8667 2.7695 2.7695 2.8512 2.8512 3.2024 3.2024 3.2885 3.2885 3.9584 3.9584 4.0055 4.0055 4.4327 4.4327 4.4527 4.4527 4.5499 4.5499 4.6678 4.6678 4.9838 4.9838 5.0955 5.0955 5.6951 5.6951 5.7952 5.7952 6.0456 6.0456 6.0979 6.0979 6.9488 6.9488 7.0151 7.0151 7.0745 7.0745 7.1491 7.1491 7.2224 7.2224 7.3391 7.3391 8.7124 8.7124 8.7406 8.7406 9.0102 9.0102 9.0184 9.0184 10.0212 10.0212 10.1169 10.1169 11.7751 11.7751 11.8779 11.8779 12.8327 12.8327 13.0025 13.0025 13.7423 13.7423 13.7935 13.7935 k = 0.1300-0.0000 0.2408 ( 10010 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3941 -82.3941 -82.3941 -82.3941 -82.3529 -82.3529 -82.3529 -82.3529 -48.5176 -48.5176 -48.5175 -48.5175 -48.4378 -48.4378 -48.4377 -48.4377 -46.8909 -46.8909 -46.8906 -46.8906 -46.8234 -46.8234 -46.8234 -46.8234 -46.7858 -46.7858 -46.7855 -46.7855 -46.6864 -46.6864 -46.6863 -46.6863 -35.4933 -35.4933 -35.4932 -35.4932 -35.3000 -35.3000 -35.2999 -35.2999 -16.0292 -16.0292 -16.0145 -16.0145 -15.3812 -15.3812 -15.3691 -15.3691 -14.6264 -14.6264 -14.6049 -14.6049 -13.8865 -13.8865 -13.8855 -13.8855 -12.4624 -12.4624 -12.4387 -12.4387 -12.0539 -12.0539 -12.0223 -12.0223 -3.9488 -3.9488 -3.9485 -3.9485 -1.4941 -1.4941 -1.4147 -1.4147 1.1473 1.1473 1.2152 1.2152 1.7657 1.7657 1.8676 1.8676 2.7540 2.7540 2.8420 2.8420 3.1687 3.1687 3.2626 3.2626 3.9588 3.9588 4.0046 4.0046 4.4302 4.4302 4.4564 4.4564 4.5633 4.5633 4.6744 4.6744 4.9556 4.9556 5.0702 5.0702 5.6993 5.6993 5.7934 5.7934 6.0425 6.0425 6.0956 6.0956 6.9485 6.9485 7.0075 7.0075 7.0817 7.0817 7.1558 7.1558 7.2207 7.2207 7.3629 7.3629 8.6643 8.6643 8.7008 8.7008 8.9776 8.9776 8.9895 8.9895 10.0067 10.0067 10.0933 10.0933 11.7830 11.7830 11.8948 11.8948 12.8206 12.8206 13.0143 13.0143 13.7427 13.7427 13.8035 13.8035 k = 0.1400-0.0000 0.2408 ( 10006 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3938 -82.3938 -82.3938 -82.3938 -82.3531 -82.3531 -82.3531 -82.3531 -48.5172 -48.5172 -48.5172 -48.5172 -48.4385 -48.4385 -48.4384 -48.4384 -46.8911 -46.8911 -46.8907 -46.8907 -46.8248 -46.8248 -46.8248 -46.8248 -46.7843 -46.7843 -46.7839 -46.7839 -46.6868 -46.6868 -46.6868 -46.6868 -35.4906 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************************************************************************ ************************************************************************ -82.3934 -82.3934 -82.3934 -82.3934 -82.3534 -82.3534 -82.3534 -82.3534 -48.5169 -48.5169 -48.5168 -48.5168 -48.4394 -48.4394 -48.4392 -48.4392 -46.8912 -46.8912 -46.8909 -46.8909 -46.8262 -46.8262 -46.8262 -46.8262 -46.7827 -46.7827 -46.7823 -46.7823 -46.6873 -46.6873 -46.6872 -46.6872 -35.4882 -35.4882 -35.4880 -35.4880 -35.2978 -35.2978 -35.2976 -35.2976 -16.0313 -16.0313 -16.0146 -16.0146 -15.4077 -15.4077 -15.3934 -15.3934 -14.6267 -14.6267 -14.6048 -14.6048 -13.8994 -13.8994 -13.8992 -13.8992 -12.4779 -12.4779 -12.4517 -12.4517 -12.0626 -12.0626 -12.0279 -12.0279 -3.8787 -3.8787 -3.8767 -3.8767 -1.4743 -1.4743 -1.3870 -1.3870 1.2221 1.2221 1.2995 1.2995 1.7638 1.7638 1.8602 1.8602 2.7239 2.7239 2.8221 2.8221 3.1012 3.1012 3.2112 3.2112 3.9633 3.9633 4.0006 4.0006 4.4231 4.4231 4.4608 4.4608 4.5912 4.5912 4.6857 4.6857 4.9000 4.9000 5.0205 5.0205 5.7049 5.7049 5.7815 5.7815 6.0452 6.0452 6.0965 6.0965 6.9446 6.9446 6.9894 6.9894 7.0943 7.0943 7.1665 7.1665 7.2200 7.2200 7.4103 7.4103 8.5583 8.5583 8.6130 8.6130 8.9147 8.9147 8.9341 8.9341 9.9741 9.9741 10.0416 10.0416 11.7835 11.7835 11.9126 11.9126 12.8092 12.8092 13.0528 13.0528 13.7390 13.7390 13.8207 13.8207 k = 0.1600-0.0000 0.2408 ( 10006 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3931 -82.3931 -82.3931 -82.3931 -82.3536 -82.3536 -82.3536 -82.3536 -48.5164 -48.5164 -48.5163 -48.5163 -48.4402 -48.4402 -48.4401 -48.4401 -46.8914 -46.8914 -46.8910 -46.8910 -46.8277 -46.8277 -46.8276 -46.8276 -46.7811 -46.7811 -46.7807 -46.7807 -46.6878 -46.6878 -46.6877 -46.6877 -35.4853 -35.4853 -35.4852 -35.4852 -35.2970 -35.2970 -35.2969 -35.2969 -16.0326 -16.0326 -16.0148 -16.0148 -15.4220 -15.4220 -15.4067 -15.4067 -14.6265 -14.6265 -14.6049 -14.6049 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-48.5160 -48.5159 -48.5159 -48.4411 -48.4411 -48.4410 -48.4410 -46.8915 -46.8915 -46.8912 -46.8912 -46.8291 -46.8291 -46.8290 -46.8290 -46.7795 -46.7795 -46.7791 -46.7791 -46.6883 -46.6883 -46.6883 -46.6883 -35.4828 -35.4828 -35.4826 -35.4826 -35.2958 -35.2958 -35.2957 -35.2957 -16.0338 -16.0338 -16.0150 -16.0150 -15.4372 -15.4372 -15.4206 -15.4206 -14.6261 -14.6261 -14.6050 -14.6050 -13.9144 -13.9144 -13.9124 -13.9124 -12.4940 -12.4940 -12.4657 -12.4657 -12.0713 -12.0713 -12.0341 -12.0341 -3.8000 -3.8000 -3.7954 -3.7954 -1.4533 -1.4533 -1.3593 -1.3593 1.3032 1.3032 1.3908 1.3908 1.7572 1.7572 1.8386 1.8386 2.6963 2.6963 2.8016 2.8016 3.0360 3.0360 3.1617 3.1617 3.9737 3.9737 3.9938 3.9938 4.4136 4.4136 4.4617 4.4617 4.6177 4.6177 4.6947 4.6947 4.8489 4.8489 4.9737 4.9737 5.7057 5.7057 5.7599 5.7599 6.0592 6.0592 6.1051 6.1051 6.9357 6.9357 6.9689 6.9689 7.1027 7.1027 7.1714 7.1714 7.2254 7.2254 7.4563 7.4563 8.4442 8.4442 8.5162 8.5162 8.8538 8.8538 8.8827 8.8827 9.9368 9.9368 9.9860 9.9860 11.7630 11.7630 11.9046 11.9046 12.8198 12.8198 13.1099 13.1099 13.7283 13.7283 13.8307 13.8307 k = 0.1800-0.0000 0.2408 ( 9994 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3923 -82.3923 -82.3923 -82.3923 -82.3541 -82.3541 -82.3541 -82.3541 -48.5155 -48.5155 -48.5154 -48.5154 -48.4421 -48.4421 -48.4419 -48.4419 -46.8917 -46.8917 -46.8913 -46.8913 -46.8306 -46.8306 -46.8305 -46.8305 -46.7779 -46.7779 -46.7774 -46.7774 -46.6889 -46.6889 -46.6888 -46.6888 -35.4799 -35.4799 -35.4797 -35.4797 -35.2945 -35.2945 -35.2944 -35.2944 -16.0350 -16.0350 -16.0154 -16.0154 -15.4531 -15.4531 -15.4351 -15.4351 -14.6257 -14.6257 -14.6052 -14.6052 -13.9222 -13.9222 -13.9193 -13.9193 -12.5022 -12.5022 -12.4732 -12.4732 -12.0755 -12.0755 -12.0374 -12.0374 -3.7575 -3.7575 -3.7514 -3.7514 -1.4426 -1.4426 -1.3456 -1.3456 1.3451 1.3451 1.4384 1.4384 1.7519 1.7519 1.8221 1.8221 2.6834 2.6834 2.7919 2.7919 3.0059 3.0059 3.1382 3.1382 3.9806 3.9806 3.9890 3.9890 4.4077 4.4077 4.4612 4.4612 4.6291 4.6291 4.6985 4.6985 4.8271 4.8271 4.9523 4.9523 5.7042 5.7042 5.7467 5.7467 6.0701 6.0701 6.1126 6.1126 6.9293 6.9293 6.9581 6.9581 7.1047 7.1047 7.1712 7.1712 7.2303 7.2303 7.4778 7.4778 8.3856 8.3856 8.4655 8.4655 8.8235 8.8235 8.8585 8.8585 9.9168 9.9168 9.9576 9.9576 11.7452 11.7452 11.8902 11.8902 12.8338 12.8338 13.1438 13.1438 13.7202 13.7202 13.8315 13.8315 k = 0.1900-0.0000 0.2408 ( 9994 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3919 -82.3919 -82.3919 -82.3919 -82.3544 -82.3544 -82.3544 -82.3544 -48.5150 -48.5150 -48.5149 -48.5149 -48.4431 -48.4431 -48.4429 -48.4429 -46.8918 -46.8918 -46.8914 -46.8914 -46.8321 -46.8321 -46.8319 -46.8319 -46.7762 -46.7762 -46.7757 -46.7757 -46.6895 -46.6895 -46.6894 -46.6894 -35.4768 -35.4768 -35.4766 -35.4766 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7.5194 8.1473 8.1473 8.1473 8.1473 9.7283 9.7283 9.7283 9.7283 10.7286 10.7286 10.7286 10.7286 13.2348 13.2348 13.2348 13.2348 14.0033 14.0033 14.0033 14.0033 k = 0.5000 0.0100 0.2408 ( 9968 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3725 -82.3725 -82.3725 -82.3725 -82.3715 -82.3715 -82.3715 -82.3715 -48.4851 -48.4851 -48.4851 -48.4851 -48.4847 -48.4847 -48.4847 -48.4847 -46.8778 -46.8778 -46.8778 -46.8778 -46.8767 -46.8767 -46.8767 -46.8767 -46.7244 -46.7244 -46.7244 -46.7244 -46.7225 -46.7225 -46.7225 -46.7225 -35.3987 -35.3987 -35.3987 -35.3987 -35.2710 -35.2710 -35.2710 -35.2710 -16.0183 -16.0183 -16.0183 -16.0183 -15.9272 -15.9272 -15.9272 -15.9272 -14.5702 -14.5702 -14.5702 -14.5702 -14.0891 -14.0891 -14.0891 -14.0891 -12.6505 -12.6505 -12.6505 -12.6505 -12.1170 -12.1170 -12.1170 -12.1170 -2.0083 -2.0083 -2.0083 -2.0083 -1.5338 -1.5338 -1.5338 -1.5338 0.5652 0.5652 0.5652 0.5652 1.9836 1.9836 1.9836 1.9836 2.9180 2.9180 2.9180 2.9180 3.4329 3.4329 3.4329 3.4329 3.7300 3.7300 3.7300 3.7300 4.5701 4.5701 4.5701 4.5701 4.6920 4.6920 4.6920 4.6920 4.8945 4.8945 4.8945 4.8945 5.9463 5.9463 5.9463 5.9463 6.1181 6.1181 6.1181 6.1181 6.3849 6.3849 6.3849 6.3849 6.8498 6.8498 6.8498 6.8498 7.1295 7.1295 7.1295 7.1295 7.5202 7.5202 7.5202 7.5202 8.1486 8.1486 8.1486 8.1486 9.7261 9.7261 9.7261 9.7261 10.7309 10.7309 10.7309 10.7309 13.2333 13.2333 13.2333 13.2333 14.0054 14.0054 14.0054 14.0054 k = 0.5000 0.0199 0.2408 ( 9980 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3726 -82.3726 -82.3726 -82.3726 -82.3716 -82.3716 -82.3716 -82.3716 -48.4851 -48.4851 -48.4851 -48.4851 -48.4847 -48.4847 -48.4847 -48.4847 -46.8779 -46.8779 -46.8779 -46.8779 -46.8767 -46.8767 -46.8767 -46.8767 -46.7244 -46.7244 -46.7244 -46.7244 -46.7226 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************************************************************************ ************************************************************************ -82.3726 -82.3726 -82.3726 -82.3726 -82.3720 -82.3720 -82.3720 -82.3720 -48.4851 -48.4851 -48.4851 -48.4851 -48.4848 -48.4848 -48.4848 -48.4848 -46.8779 -46.8779 -46.8779 -46.8779 -46.8767 -46.8767 -46.8767 -46.8767 -46.7244 -46.7244 -46.7244 -46.7244 -46.7226 -46.7226 -46.7226 -46.7226 -35.3996 -35.3996 -35.3996 -35.3996 -35.2732 -35.2732 -35.2732 -35.2732 -16.0180 -16.0180 -16.0180 -16.0180 -15.9279 -15.9279 -15.9279 -15.9279 -14.5664 -14.5664 -14.5664 -14.5664 -14.0908 -14.0908 -14.0908 -14.0908 -12.6497 -12.6497 -12.6497 -12.6497 -12.1226 -12.1226 -12.1226 -12.1226 -2.0052 -2.0052 -2.0052 -2.0052 -1.5370 -1.5370 -1.5370 -1.5370 0.5730 0.5730 0.5730 0.5730 1.9754 1.9754 1.9754 1.9754 2.9145 2.9145 2.9145 2.9145 3.4454 3.4454 3.4454 3.4454 3.7345 3.7345 3.7345 3.7345 4.5296 4.5296 4.5296 4.5296 4.7169 4.7169 4.7169 4.7169 4.8990 4.8990 4.8990 4.8990 5.9421 5.9421 5.9421 5.9421 6.1136 6.1136 6.1136 6.1136 6.3881 6.3881 6.3881 6.3881 6.8450 6.8450 6.8450 6.8450 7.1322 7.1322 7.1322 7.1322 7.5244 7.5244 7.5244 7.5244 8.1561 8.1561 8.1561 8.1561 9.7060 9.7060 9.7060 9.7060 10.7485 10.7485 10.7485 10.7485 13.2212 13.2212 13.2212 13.2212 14.0177 14.0177 14.0177 14.0177 k = 0.5000 0.0398 0.2408 ( 9984 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3723 -82.3723 -82.3723 -82.3723 -82.3720 -82.3720 -82.3720 -82.3720 -48.4851 -48.4851 -48.4851 -48.4851 -48.4848 -48.4848 -48.4848 -48.4848 -46.8779 -46.8779 -46.8779 -46.8779 -46.8767 -46.8767 -46.8767 -46.8767 -46.7243 -46.7243 -46.7243 -46.7243 -46.7226 -46.7226 -46.7226 -46.7226 -35.3989 -35.3989 -35.3989 -35.3989 -35.2731 -35.2731 -35.2731 -35.2731 -16.0174 -16.0174 -16.0174 -16.0174 -15.9281 -15.9281 -15.9281 -15.9281 -14.5626 -14.5626 -14.5626 -14.5626 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************************************************************************ -82.3724 -82.3724 -82.3724 -82.3724 -82.3717 -82.3717 -82.3717 -82.3717 -48.4851 -48.4851 -48.4851 -48.4851 -48.4847 -48.4847 -48.4847 -48.4847 -46.8779 -46.8779 -46.8779 -46.8779 -46.8767 -46.8767 -46.8767 -46.8767 -46.7243 -46.7243 -46.7243 -46.7243 -46.7226 -46.7226 -46.7226 -46.7226 -35.3941 -35.3941 -35.3941 -35.3941 -35.2771 -35.2771 -35.2771 -35.2771 -16.0139 -16.0139 -16.0139 -16.0139 -15.9302 -15.9302 -15.9302 -15.9302 -14.5383 -14.5383 -14.5383 -14.5383 -14.1009 -14.1009 -14.1009 -14.1009 -12.6419 -12.6419 -12.6419 -12.6419 -12.1583 -12.1583 -12.1583 -12.1583 -1.9845 -1.9845 -1.9845 -1.9845 -1.5579 -1.5579 -1.5579 -1.5579 0.6280 0.6280 0.6280 0.6280 1.9208 1.9208 1.9208 1.9208 2.9044 2.9044 2.9044 2.9044 3.5057 3.5057 3.5057 3.5057 3.7761 3.7761 3.7761 3.7761 4.3859 4.3859 4.3859 4.3859 4.7548 4.7548 4.7548 4.7548 4.9402 4.9402 4.9402 4.9402 5.9175 5.9175 5.9175 5.9175 6.0866 6.0866 6.0866 6.0866 6.4120 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11.8091 11.8091 11.8091 11.8091 12.1884 12.1884 12.1884 12.1884 14.2571 14.2571 14.2571 14.2571 k = 0.4700 0.2788 0.2408 ( 9988 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3744 -82.3744 -82.3744 -82.3744 -82.3703 -82.3703 -82.3703 -82.3703 -48.4890 -48.4890 -48.4890 -48.4890 -48.4808 -48.4808 -48.4808 -48.4808 -46.8808 -46.8808 -46.8808 -46.8808 -46.8739 -46.8739 -46.8739 -46.8739 -46.7280 -46.7280 -46.7280 -46.7280 -46.7188 -46.7188 -46.7188 -46.7188 -35.3451 -35.3451 -35.3451 -35.3451 -35.3309 -35.3309 -35.3309 -35.3309 -15.9965 -15.9965 -15.9965 -15.9965 -15.9373 -15.9373 -15.9373 -15.9373 -14.3205 -14.3205 -14.3205 -14.3205 -14.2274 -14.2274 -14.2274 -14.2274 -12.5352 -12.5352 -12.5352 -12.5352 -12.4089 -12.4089 -12.4089 -12.4089 -1.9382 -1.9382 -1.9382 -1.9382 -1.6297 -1.6297 -1.6297 -1.6297 1.1960 1.1960 1.1960 1.1960 1.3754 1.3754 1.3754 1.3754 3.0570 3.0570 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************************************************************************ -82.3757 -82.3757 -82.3757 -82.3757 -82.3688 -82.3688 -82.3688 -82.3688 -48.4916 -48.4916 -48.4916 -48.4916 -48.4779 -48.4779 -48.4779 -48.4779 -46.8827 -46.8827 -46.8827 -46.8827 -46.8713 -46.8713 -46.8713 -46.8713 -46.7312 -46.7312 -46.7312 -46.7312 -46.7160 -46.7160 -46.7160 -46.7160 -35.3509 -35.3509 -35.3509 -35.3509 -35.3272 -35.3272 -35.3272 -35.3272 -16.0085 -16.0085 -16.0085 -16.0085 -15.9137 -15.9137 -15.9137 -15.9137 -14.3292 -14.3292 -14.3292 -14.3292 -14.2164 -14.2164 -14.2164 -14.2164 -12.5368 -12.5368 -12.5368 -12.5368 -12.4041 -12.4041 -12.4041 -12.4041 -2.0428 -2.0428 -2.0428 -2.0428 -1.5572 -1.5572 -1.5572 -1.5572 1.1589 1.1589 1.1589 1.1589 1.4436 1.4436 1.4436 1.4436 3.0415 3.0415 3.0415 3.0415 3.3586 3.3586 3.3586 3.3586 4.0019 4.0019 4.0019 4.0019 4.1521 4.1521 4.1521 4.1521 4.8329 4.8329 4.8329 4.8329 4.9486 4.9486 4.9486 4.9486 5.7040 5.7040 5.7040 5.7040 6.0606 6.0606 6.0606 6.0606 6.5990 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14.1405 14.1405 k = 0.4200 0.2788 0.2408 ( 9972 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3776 -82.3776 -82.3776 -82.3776 -82.3667 -82.3667 -82.3667 -82.3667 -48.4953 -48.4953 -48.4953 -48.4953 -48.4736 -48.4736 -48.4736 -48.4736 -46.8853 -46.8853 -46.8853 -46.8853 -46.8672 -46.8672 -46.8672 -46.8672 -46.7361 -46.7361 -46.7361 -46.7361 -46.7119 -46.7119 -46.7119 -46.7119 -35.3598 -35.3598 -35.3598 -35.3598 -35.3230 -35.3230 -35.3230 -35.3230 -16.0222 -16.0222 -16.0222 -16.0222 -15.8726 -15.8726 -15.8726 -15.8726 -14.3440 -14.3440 -14.3440 -14.3440 -14.1966 -14.1966 -14.1966 -14.1966 -12.5401 -12.5401 -12.5401 -12.5401 -12.3930 -12.3930 -12.3930 -12.3930 -2.2082 -2.2082 -2.2082 -2.2082 -1.4715 -1.4715 -1.4715 -1.4715 1.1271 1.1271 1.1271 1.1271 1.5490 1.5490 1.5490 1.5490 3.0065 3.0065 3.0065 3.0065 3.3304 3.3304 3.3304 3.3304 3.9331 3.9331 3.9331 3.9331 4.1861 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************************************************************************ ************************************************************************ -82.3895 -82.3895 -82.3895 -82.3895 -82.3560 -82.3560 -82.3560 -82.3560 -48.5119 -48.5119 -48.5119 -48.5119 -48.4486 -48.4486 -48.4486 -48.4486 -46.8920 -46.8920 -46.8920 -46.8920 -46.8396 -46.8396 -46.8396 -46.8396 -46.7672 -46.7672 -46.7672 -46.7672 -46.6931 -46.6931 -46.6931 -46.6931 -35.4273 -35.4273 -35.4273 -35.4273 -35.3211 -35.3211 -35.3211 -35.3211 -16.0282 -16.0282 -16.0282 -16.0282 -15.5522 -15.5522 -15.5522 -15.5522 -14.3552 -14.3552 -14.3552 -14.3552 -14.1067 -14.1067 -14.1067 -14.1067 -12.5268 -12.5268 -12.5268 -12.5268 -12.2709 -12.2709 -12.2709 -12.2709 -3.1237 -3.1237 -3.1237 -3.1237 -1.6530 -1.6530 -1.6530 -1.6530 1.3538 1.3538 1.3538 1.3538 1.7243 1.7243 1.7243 1.7243 2.8314 2.8314 2.8314 2.8314 3.1875 3.1875 3.1875 3.1875 3.5838 3.5838 3.5838 3.5838 4.5373 4.5373 4.5373 4.5373 4.8741 4.8741 4.8741 4.8741 5.1677 5.1677 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6.6616 6.6616 6.6616 6.9988 6.9988 6.9988 6.9988 7.4905 7.4905 7.4905 7.4905 8.2332 8.2332 8.2332 8.2332 9.6128 9.6128 9.6128 9.6128 9.9627 9.9627 9.9627 9.9627 11.8271 11.8271 11.8271 11.8271 12.3259 12.3259 12.3259 12.3259 13.1205 13.1205 13.1205 13.1205 k = 0.1800 0.2788 0.2408 ( 9980 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3923 -82.3923 -82.3923 -82.3923 -82.3536 -82.3536 -82.3536 -82.3536 -48.5154 -48.5154 -48.5154 -48.5154 -48.4421 -48.4421 -48.4421 -48.4421 -46.8915 -46.8915 -46.8915 -46.8915 -46.8305 -46.8305 -46.8305 -46.8305 -46.7773 -46.7773 -46.7773 -46.7773 -46.6891 -46.6891 -46.6891 -46.6891 -35.4487 -35.4487 -35.4487 -35.4487 -35.3250 -35.3250 -35.3250 -35.3250 -16.0221 -16.0221 -16.0221 -16.0221 -15.4526 -15.4526 -15.4526 -15.4526 -14.3206 -14.3206 -14.3206 -14.3206 -14.1033 -14.1033 -14.1033 -14.1033 -12.5004 -12.5004 -12.5004 -12.5004 -12.2235 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13.1961 13.1961 k = 0.1600 0.2788 0.2408 ( 9976 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3929 -82.3929 -82.3929 -82.3929 -82.3530 -82.3530 -82.3530 -82.3530 -48.5163 -48.5163 -48.5163 -48.5163 -48.4402 -48.4402 -48.4402 -48.4402 -46.8912 -46.8912 -46.8912 -46.8912 -46.8276 -46.8276 -46.8276 -46.8276 -46.7806 -46.7806 -46.7806 -46.7806 -46.6881 -46.6881 -46.6881 -46.6881 -35.4543 -35.4543 -35.4543 -35.4543 -35.3276 -35.3276 -35.3276 -35.3276 -16.0205 -16.0205 -16.0205 -16.0205 -15.4237 -15.4237 -15.4237 -15.4237 -14.3061 -14.3061 -14.3061 -14.3061 -14.1051 -14.1051 -14.1051 -14.1051 -12.4901 -12.4901 -12.4901 -12.4901 -12.2086 -12.2086 -12.2086 -12.2086 -3.3979 -3.3979 -3.3979 -3.3979 -1.9083 -1.9083 -1.9083 -1.9083 1.2737 1.2737 1.2737 1.2737 1.5076 1.5076 1.5076 1.5076 2.8505 2.8505 2.8505 2.8505 3.3771 3.3771 3.3771 3.3771 3.6700 3.6700 3.6700 3.6700 4.6772 4.6772 4.6772 4.6772 5.0234 5.0234 5.0234 5.0234 5.2280 5.2280 5.2280 5.2280 5.3970 5.3970 5.3970 5.3970 6.3513 6.3513 6.3513 6.3513 6.6664 6.6664 6.6664 6.6664 6.9921 6.9921 6.9921 6.9921 7.4861 7.4861 7.4861 7.4861 8.3246 8.3246 8.3246 8.3246 9.7515 9.7515 9.7515 9.7515 10.0550 10.0550 10.0550 10.0550 11.7459 11.7459 11.7459 11.7459 12.2525 12.2525 12.2525 12.2525 13.2397 13.2397 13.2397 13.2397 k = 0.1500 0.2788 0.2408 ( 9988 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3935 -82.3935 -82.3935 -82.3935 -82.3528 -82.3528 -82.3528 -82.3528 -48.5167 -48.5167 -48.5167 -48.5167 -48.4393 -48.4393 -48.4393 -48.4393 -46.8910 -46.8910 -46.8910 -46.8910 -46.8262 -46.8262 -46.8262 -46.8262 -46.7822 -46.7822 -46.7822 -46.7822 -46.6876 -46.6876 -46.6876 -46.6876 -35.4576 -35.4576 -35.4576 -35.4576 -35.3287 -35.3287 -35.3287 -35.3287 -16.0199 -16.0199 -16.0199 -16.0199 -15.4104 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8.3868 8.3868 9.8429 9.8429 9.8429 9.8429 10.1001 10.1001 10.1001 10.1001 11.6654 11.6654 11.6654 11.6654 12.2175 12.2175 12.2175 12.2175 13.3302 13.3302 13.3302 13.3302 k = 0.1300 0.2788 0.2408 ( 9984 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3942 -82.3942 -82.3942 -82.3942 -82.3521 -82.3521 -82.3521 -82.3521 -48.5174 -48.5174 -48.5174 -48.5174 -48.4378 -48.4378 -48.4378 -48.4378 -46.8907 -46.8907 -46.8907 -46.8907 -46.8234 -46.8234 -46.8234 -46.8234 -46.7854 -46.7854 -46.7854 -46.7854 -46.6867 -46.6867 -46.6867 -46.6867 -35.4628 -35.4628 -35.4628 -35.4628 -35.3313 -35.3313 -35.3313 -35.3313 -16.0189 -16.0189 -16.0189 -16.0189 -15.3858 -15.3858 -15.3858 -15.3858 -14.2830 -14.2830 -14.2830 -14.2830 -14.1111 -14.1111 -14.1111 -14.1111 -12.4743 -12.4743 -12.4743 -12.4743 -12.1884 -12.1884 -12.1884 -12.1884 -3.4730 -3.4730 -3.4730 -3.4730 -1.9941 -1.9941 -1.9941 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************************************************************************ ************************************************************************ -82.3947 -82.3947 -82.3947 -82.3947 -82.3517 -82.3517 -82.3517 -82.3517 -48.5181 -48.5181 -48.5181 -48.5181 -48.4364 -48.4364 -48.4364 -48.4364 -46.8903 -46.8903 -46.8903 -46.8903 -46.8206 -46.8206 -46.8206 -46.8206 -46.7884 -46.7884 -46.7884 -46.7884 -46.6860 -46.6860 -46.6860 -46.6860 -35.4673 -35.4673 -35.4673 -35.4673 -35.3332 -35.3332 -35.3332 -35.3332 -16.0181 -16.0181 -16.0181 -16.0181 -15.3644 -15.3644 -15.3644 -15.3644 -14.2671 -14.2671 -14.2671 -14.2671 -14.1169 -14.1169 -14.1169 -14.1169 -12.4642 -12.4642 -12.4642 -12.4642 -12.1766 -12.1766 -12.1766 -12.1766 -3.5143 -3.5143 -3.5143 -3.5143 -2.0445 -2.0445 -2.0445 -2.0445 1.1838 1.1838 1.1838 1.1838 1.3576 1.3576 1.3576 1.3576 2.8643 2.8643 2.8643 2.8643 3.5235 3.5235 3.5235 3.5235 3.7741 3.7741 3.7741 3.7741 4.7270 4.7270 4.7270 4.7270 5.1123 5.1123 5.1123 5.1123 5.2665 5.2665 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10.2121 10.2121 10.2121 11.4132 11.4132 11.4132 11.4132 12.1592 12.1592 12.1592 12.1592 13.5375 13.5375 13.5375 13.5375 k = 0.0800 0.2788 0.2408 ( 10000 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3956 -82.3956 -82.3956 -82.3956 -82.3513 -82.3513 -82.3513 -82.3513 -48.5188 -48.5188 -48.5188 -48.5188 -48.4348 -48.4348 -48.4348 -48.4348 -46.8898 -46.8898 -46.8898 -46.8898 -46.8166 -46.8166 -46.8166 -46.8166 -46.7928 -46.7928 -46.7928 -46.7928 -46.6851 -46.6851 -46.6851 -46.6851 -35.4727 -35.4727 -35.4727 -35.4727 -35.3349 -35.3349 -35.3349 -35.3349 -16.0175 -16.0175 -16.0175 -16.0175 -15.3387 -15.3387 -15.3387 -15.3387 -14.2435 -14.2435 -14.2435 -14.2435 -14.1281 -14.1281 -14.1281 -14.1281 -12.4507 -12.4507 -12.4507 -12.4507 -12.1620 -12.1620 -12.1620 -12.1620 -3.5632 -3.5632 -3.5632 -3.5632 -2.1074 -2.1074 -2.1074 -2.1074 1.1411 1.1411 1.1411 1.1411 1.2790 1.2790 1.2790 1.2790 2.8668 2.8668 2.8668 2.8668 3.6018 3.6018 3.6018 3.6018 3.8324 3.8324 3.8324 3.8324 4.7431 4.7431 4.7431 4.7431 5.1550 5.1550 5.1550 5.1550 5.2840 5.2840 5.2840 5.2840 5.4383 5.4383 5.4383 5.4383 6.3741 6.3741 6.3741 6.3741 6.6295 6.6295 6.6295 6.6295 7.0106 7.0106 7.0106 7.0106 7.3999 7.3999 7.3999 7.3999 8.5725 8.5725 8.5725 8.5725 10.0256 10.0256 10.0256 10.0256 10.2481 10.2481 10.2481 10.2481 11.3603 11.3603 11.3603 11.3603 12.1494 12.1494 12.1494 12.1494 13.5723 13.5723 13.5723 13.5723 k = 0.0700 0.2788 0.2408 ( 10000 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3958 -82.3958 -82.3958 -82.3958 -82.3511 -82.3511 -82.3511 -82.3511 -48.5190 -48.5190 -48.5190 -48.5190 -48.4343 -48.4343 -48.4343 -48.4343 -46.8896 -46.8896 -46.8896 -46.8896 -46.8153 -46.8153 -46.8153 -46.8153 -46.7943 -46.7943 -46.7943 -46.7943 -46.6849 -46.6849 -46.6849 -46.6849 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************************************************************************ ************************************************************************ -82.3960 -82.3960 -82.3960 -82.3960 -82.3508 -82.3508 -82.3508 -82.3508 -48.5192 -48.5192 -48.5192 -48.5192 -48.4339 -48.4339 -48.4339 -48.4339 -46.8895 -46.8895 -46.8895 -46.8895 -46.8141 -46.8141 -46.8141 -46.8141 -46.7956 -46.7956 -46.7956 -46.7956 -46.6847 -46.6847 -46.6847 -46.6847 -35.4755 -35.4755 -35.4755 -35.4755 -35.3349 -35.3349 -35.3349 -35.3349 -16.0170 -16.0170 -16.0170 -16.0170 -15.3261 -15.3261 -15.3261 -15.3261 -14.2284 -14.2284 -14.2284 -14.2284 -14.1367 -14.1367 -14.1367 -14.1367 -12.4433 -12.4433 -12.4433 -12.4433 -12.1546 -12.1546 -12.1546 -12.1546 -3.5872 -3.5872 -3.5872 -3.5872 -2.1396 -2.1396 -2.1396 -2.1396 1.1207 1.1207 1.1207 1.1207 1.2356 1.2356 1.2356 1.2356 2.8672 2.8672 2.8672 2.8672 3.6443 3.6443 3.6443 3.6443 3.8650 3.8650 3.8650 3.8650 4.7492 4.7492 4.7492 4.7492 5.1782 5.1782 5.1782 5.1782 5.2908 5.2908 5.2908 5.2908 5.4488 5.4488 5.4488 5.4488 6.3912 6.3912 6.3912 6.3912 6.6050 6.6050 6.6050 6.6050 7.0302 7.0302 7.0302 7.0302 7.3687 7.3687 7.3687 7.3687 8.6263 8.6263 8.6263 8.6263 10.0325 10.0325 10.0325 10.0325 10.3303 10.3303 10.3303 10.3303 11.2573 11.2573 11.2573 11.2573 12.1309 12.1309 12.1309 12.1309 13.6343 13.6343 13.6343 13.6343 k = 0.0500 0.2788 0.2408 ( 9996 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3961 -82.3961 -82.3961 -82.3961 -82.3507 -82.3507 -82.3507 -82.3507 -48.5193 -48.5193 -48.5193 -48.5193 -48.4336 -48.4336 -48.4336 -48.4336 -46.8894 -46.8894 -46.8894 -46.8894 -46.8128 -46.8128 -46.8128 -46.8128 -46.7969 -46.7969 -46.7969 -46.7969 -46.6845 -46.6845 -46.6845 -46.6845 -35.4766 -35.4766 -35.4766 -35.4766 -35.3357 -35.3357 -35.3357 -35.3357 -16.0168 -16.0168 -16.0168 -16.0168 -15.3210 -15.3210 -15.3210 -15.3210 -14.2212 -14.2212 -14.2212 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10.4121 10.4121 10.4121 11.1648 11.1648 11.1648 11.1648 12.1155 12.1155 12.1155 12.1155 13.6852 13.6852 13.6852 13.6852 k = 0.0300 0.2788 0.2408 ( 10004 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3963 -82.3963 -82.3963 -82.3963 -82.3507 -82.3507 -82.3507 -82.3507 -48.5195 -48.5195 -48.5195 -48.5195 -48.4331 -48.4331 -48.4331 -48.4331 -46.8892 -46.8892 -46.8892 -46.8892 -46.8106 -46.8106 -46.8106 -46.8106 -46.7993 -46.7993 -46.7993 -46.7993 -46.6842 -46.6842 -46.6842 -46.6842 -35.4791 -35.4791 -35.4791 -35.4791 -35.3364 -35.3364 -35.3364 -35.3364 -16.0169 -16.0169 -16.0169 -16.0169 -15.3137 -15.3137 -15.3137 -15.3137 -14.2086 -14.2086 -14.2086 -14.2086 -14.1502 -14.1502 -14.1502 -14.1502 -12.4358 -12.4358 -12.4358 -12.4358 -12.1473 -12.1473 -12.1473 -12.1473 -3.6101 -3.6101 -3.6101 -3.6101 -2.1716 -2.1716 -2.1716 -2.1716 1.1035 1.1035 1.1035 1.1035 1.1888 1.1888 1.1888 1.1888 2.8668 2.8668 2.8668 2.8668 3.6876 3.6876 3.6876 3.6876 3.8988 3.8988 3.8988 3.8988 4.7536 4.7536 4.7536 4.7536 5.2034 5.2034 5.2034 5.2034 5.2940 5.2940 5.2940 5.2940 5.4613 5.4613 5.4613 5.4613 6.4205 6.4205 6.4205 6.4205 6.5658 6.5658 6.5658 6.5658 7.0602 7.0602 7.0602 7.0602 7.3270 7.3270 7.3270 7.3270 8.6855 8.6855 8.6855 8.6855 10.0238 10.0238 10.0238 10.0238 10.4476 10.4476 10.4476 10.4476 11.1262 11.1262 11.1262 11.1262 12.1096 12.1096 12.1096 12.1096 13.7061 13.7061 13.7061 13.7061 k = 0.0200 0.2788 0.2408 ( 10012 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3965 -82.3965 -82.3965 -82.3965 -82.3507 -82.3507 -82.3507 -82.3507 -48.5196 -48.5196 -48.5196 -48.5196 -48.4330 -48.4330 -48.4330 -48.4330 -46.8892 -46.8892 -46.8892 -46.8892 -46.8097 -46.8097 -46.8097 -46.8097 -46.8002 -46.8002 -46.8002 -46.8002 -46.6842 -46.6842 -46.6842 -46.6842 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************************************************************************ ************************************************************************ -82.3963 -82.3963 -82.3963 -82.3963 -82.3507 -82.3507 -82.3507 -82.3507 -48.5196 -48.5196 -48.5196 -48.5196 -48.4329 -48.4329 -48.4329 -48.4329 -46.8891 -46.8891 -46.8891 -46.8891 -46.8091 -46.8091 -46.8091 -46.8091 -46.8009 -46.8009 -46.8009 -46.8009 -46.6841 -46.6841 -46.6841 -46.6841 -35.4809 -35.4809 -35.4809 -35.4809 -35.3357 -35.3357 -35.3357 -35.3357 -16.0167 -16.0167 -16.0167 -16.0167 -15.3102 -15.3102 -15.3102 -15.3102 -14.2006 -14.2006 -14.2006 -14.2006 -14.1566 -14.1566 -14.1566 -14.1566 -12.4334 -12.4334 -12.4334 -12.4334 -12.1452 -12.1452 -12.1452 -12.1452 -3.6169 -3.6169 -3.6169 -3.6169 -2.1813 -2.1813 -2.1813 -2.1813 1.0992 1.0992 1.0992 1.0992 1.1735 1.1735 1.1735 1.1735 2.8666 2.8666 2.8666 2.8666 3.7009 3.7009 3.7009 3.7009 3.9094 3.9094 3.9094 3.9094 4.7546 4.7546 4.7546 4.7546 5.2119 5.2119 5.2119 5.2119 5.2937 5.2937 5.2937 5.2937 5.4653 5.4653 5.4653 5.4653 6.4351 6.4351 6.4351 6.4351 6.5477 6.5477 6.5477 6.5477 7.0732 7.0732 7.0732 7.0732 7.3110 7.3110 7.3110 7.3110 8.7051 8.7051 8.7051 8.7051 10.0188 10.0188 10.0188 10.0188 10.4950 10.4950 10.4950 10.4950 11.0758 11.0758 11.0758 11.0758 12.1025 12.1025 12.1025 12.1025 13.7350 13.7350 13.7350 13.7350 k = 0.0000 0.2788 0.2408 ( 10004 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3964 -82.3964 -82.3964 -82.3964 -82.3506 -82.3506 -82.3506 -82.3506 -48.5196 -48.5196 -48.5196 -48.5196 -48.4329 -48.4329 -48.4329 -48.4329 -46.8891 -46.8891 -46.8891 -46.8891 -46.8088 -46.8088 -46.8088 -46.8088 -46.8012 -46.8012 -46.8012 -46.8012 -46.6841 -46.6841 -46.6841 -46.6841 -35.4808 -35.4808 -35.4808 -35.4808 -35.3355 -35.3355 -35.3355 -35.3355 -16.0167 -16.0167 -16.0167 -16.0167 -15.3097 -15.3097 -15.3097 -15.3097 -14.1994 -14.1994 -14.1994 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10.5018 10.5018 10.5018 11.0688 11.0688 11.0688 11.0688 12.1016 12.1016 12.1016 12.1016 13.7396 13.7396 13.7396 13.7396 k = 0.0000 0.2688 0.2408 ( 10010 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3965 -82.3965 -82.3965 -82.3965 -82.3507 -82.3507 -82.3507 -82.3507 -48.5196 -48.5196 -48.5196 -48.5196 -48.4329 -48.4329 -48.4329 -48.4329 -46.8891 -46.8891 -46.8891 -46.8891 -46.8088 -46.8088 -46.8088 -46.8088 -46.8011 -46.8011 -46.8011 -46.8011 -46.6841 -46.6841 -46.6841 -46.6841 -35.4808 -35.4808 -35.4808 -35.4808 -35.3366 -35.3366 -35.3366 -35.3366 -16.0167 -16.0167 -16.0167 -16.0167 -15.3098 -15.3098 -15.3098 -15.3098 -14.2090 -14.2090 -14.2090 -14.2090 -14.1481 -14.1481 -14.1481 -14.1481 -12.4331 -12.4331 -12.4331 -12.4331 -12.1445 -12.1445 -12.1445 -12.1445 -3.6202 -3.6202 -3.6202 -3.6202 -2.1798 -2.1798 -2.1798 -2.1798 1.0963 1.0963 1.0963 1.0963 1.1749 1.1749 1.1749 1.1749 2.8667 2.8667 2.8667 2.8667 3.7013 3.7013 3.7013 3.7013 3.9115 3.9115 3.9115 3.9115 4.7548 4.7548 4.7548 4.7548 5.2060 5.2060 5.2060 5.2060 5.2935 5.2935 5.2935 5.2935 5.4717 5.4717 5.4717 5.4717 6.4229 6.4229 6.4229 6.4229 6.5582 6.5582 6.5582 6.5582 7.0747 7.0747 7.0747 7.0747 7.3083 7.3083 7.3083 7.3083 8.7084 8.7084 8.7084 8.7084 10.0144 10.0144 10.0144 10.0144 10.5002 10.5002 10.5002 10.5002 11.0712 11.0712 11.0712 11.0712 12.1062 12.1062 12.1062 12.1062 13.7131 13.7131 13.7131 13.7131 k = 0.0000 0.2589 0.2408 ( 10010 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3965 -82.3965 -82.3965 -82.3965 -82.3507 -82.3507 -82.3507 -82.3507 -48.5196 -48.5196 -48.5196 -48.5196 -48.4329 -48.4329 -48.4329 -48.4329 -46.8891 -46.8891 -46.8891 -46.8891 -46.8088 -46.8088 -46.8088 -46.8088 -46.8012 -46.8012 -46.8012 -46.8012 -46.6841 -46.6841 -46.6841 -46.6841 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************************************************************************ ************************************************************************ -82.3963 -82.3963 -82.3963 -82.3963 -82.3507 -82.3507 -82.3507 -82.3507 -48.5196 -48.5196 -48.5196 -48.5196 -48.4329 -48.4329 -48.4329 -48.4329 -46.8891 -46.8891 -46.8891 -46.8891 -46.8088 -46.8088 -46.8088 -46.8088 -46.8012 -46.8012 -46.8012 -46.8012 -46.6841 -46.6841 -46.6841 -46.6841 -35.4808 -35.4808 -35.4808 -35.4808 -35.3362 -35.3362 -35.3362 -35.3362 -16.0168 -16.0168 -16.0168 -16.0168 -15.3092 -15.3092 -15.3092 -15.3092 -14.2491 -14.2491 -14.2491 -14.2491 -14.1100 -14.1100 -14.1100 -14.1100 -12.4323 -12.4323 -12.4323 -12.4323 -12.1411 -12.1411 -12.1411 -12.1411 -3.6388 -3.6388 -3.6388 -3.6388 -2.1591 -2.1591 -2.1591 -2.1591 1.0817 1.0817 1.0817 1.0817 1.1981 1.1981 1.1981 1.1981 2.8676 2.8676 2.8676 2.8676 3.6930 3.6930 3.6930 3.6930 3.9171 3.9171 3.9171 3.9171 4.7554 4.7554 4.7554 4.7554 5.1595 5.1595 5.1595 5.1595 5.2921 5.2921 5.2921 5.2921 5.5108 5.5108 5.5108 5.5108 6.3534 6.3534 6.3534 6.3534 6.6195 6.6195 6.6195 6.6195 7.0740 7.0740 7.0740 7.0740 7.3069 7.3069 7.3069 7.3069 8.7179 8.7179 8.7179 8.7179 9.9836 9.9836 9.9836 9.9836 10.4902 10.4902 10.4902 10.4902 11.0899 11.0899 11.0899 11.0899 12.1420 12.1420 12.1420 12.1420 13.6225 13.6225 13.6225 13.6225 k = 0.0000 0.2389 0.2408 ( 9996 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3962 -82.3962 -82.3962 -82.3962 -82.3507 -82.3507 -82.3507 -82.3507 -48.5196 -48.5196 -48.5196 -48.5196 -48.4329 -48.4329 -48.4329 -48.4329 -46.8891 -46.8891 -46.8891 -46.8891 -46.8088 -46.8088 -46.8088 -46.8088 -46.8012 -46.8012 -46.8012 -46.8012 -46.6841 -46.6841 -46.6841 -46.6841 -35.4813 -35.4813 -35.4813 -35.4813 -35.3345 -35.3345 -35.3345 -35.3345 -16.0168 -16.0168 -16.0168 -16.0168 -15.3090 -15.3090 -15.3090 -15.3090 -14.2713 -14.2713 -14.2713 -14.2713 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10.4730 10.4730 11.1243 11.1243 11.1243 11.1243 12.2100 12.2100 12.2100 12.2100 13.5340 13.5340 13.5340 13.5340 k = 0.0000 0.2190 0.2408 ( 9990 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3962 -82.3962 -82.3962 -82.3962 -82.3506 -82.3506 -82.3506 -82.3506 -48.5196 -48.5196 -48.5196 -48.5196 -48.4329 -48.4329 -48.4329 -48.4329 -46.8891 -46.8891 -46.8891 -46.8891 -46.8088 -46.8088 -46.8088 -46.8088 -46.8012 -46.8012 -46.8012 -46.8012 -46.6840 -46.6840 -46.6840 -46.6840 -35.4828 -35.4828 -35.4828 -35.4828 -35.3316 -35.3316 -35.3316 -35.3316 -16.0169 -16.0169 -16.0169 -16.0169 -15.3082 -15.3082 -15.3082 -15.3082 -14.3159 -14.3159 -14.3159 -14.3159 -14.0508 -14.0508 -14.0508 -14.0508 -12.4296 -12.4296 -12.4296 -12.4296 -12.1306 -12.1306 -12.1306 -12.1306 -3.6965 -3.6965 -3.6965 -3.6965 -2.0949 -2.0949 -2.0949 -2.0949 1.0539 1.0539 1.0539 1.0539 1.2543 1.2543 1.2543 1.2543 2.8705 2.8705 2.8705 2.8705 3.6682 3.6682 3.6682 3.6682 3.9322 3.9322 3.9322 3.9322 4.7557 4.7557 4.7557 4.7557 5.0512 5.0512 5.0512 5.0512 5.2862 5.2862 5.2862 5.2862 5.5945 5.5945 5.5945 5.5945 6.2311 6.2311 6.2311 6.2311 6.7183 6.7183 6.7183 6.7183 7.0717 7.0717 7.0717 7.0717 7.3008 7.3008 7.3008 7.3008 8.7482 8.7482 8.7482 8.7482 9.8878 9.8878 9.8878 9.8878 10.4631 10.4631 10.4631 10.4631 11.1464 11.1464 11.1464 11.1464 12.2544 12.2544 12.2544 12.2544 13.4929 13.4929 13.4929 13.4929 k = 0.0000 0.2091 0.2408 ( 9998 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3962 -82.3962 -82.3962 -82.3962 -82.3507 -82.3507 -82.3507 -82.3507 -48.5197 -48.5197 -48.5197 -48.5197 -48.4329 -48.4329 -48.4329 -48.4329 -46.8891 -46.8891 -46.8891 -46.8891 -46.8088 -46.8088 -46.8088 -46.8088 -46.8012 -46.8012 -46.8012 -46.8012 -46.6840 -46.6840 -46.6840 -46.6840 -35.4840 -35.4840 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************************************************************************ ************************************************************************ -82.3962 -82.3962 -82.3962 -82.3962 -82.3507 -82.3507 -82.3507 -82.3507 -48.5197 -48.5197 -48.5197 -48.5197 -48.4328 -48.4328 -48.4328 -48.4328 -46.8891 -46.8891 -46.8891 -46.8891 -46.8088 -46.8088 -46.8088 -46.8088 -46.8012 -46.8012 -46.8012 -46.8012 -46.6840 -46.6840 -46.6840 -46.6840 -35.4854 -35.4854 -35.4854 -35.4854 -35.3297 -35.3297 -35.3297 -35.3297 -16.0171 -16.0171 -16.0171 -16.0171 -15.3070 -15.3070 -15.3070 -15.3070 -14.3600 -14.3600 -14.3600 -14.3600 -14.0142 -14.0142 -14.0142 -14.0142 -12.4271 -12.4271 -12.4271 -12.4271 -12.1203 -12.1203 -12.1203 -12.1203 -3.7492 -3.7492 -3.7492 -3.7492 -2.0359 -2.0359 -2.0359 -2.0359 1.0356 1.0356 1.0356 1.0356 1.3010 1.3010 1.3010 1.3010 2.8733 2.8733 2.8733 2.8733 3.6469 3.6469 3.6469 3.6469 3.9438 3.9438 3.9438 3.9438 4.7533 4.7533 4.7533 4.7533 4.9700 4.9700 4.9700 4.9700 5.2798 5.2798 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1.2097 1.2097 2.8647 2.8647 2.8647 2.8647 3.6986 3.6986 3.6986 3.6986 3.9146 3.9146 3.9146 3.9146 4.7445 4.7445 4.7445 4.7445 5.1924 5.1924 5.1924 5.1924 5.3107 5.3107 5.3107 5.3107 5.4805 5.4805 5.4805 5.4805 6.4093 6.4093 6.4093 6.4093 6.5666 6.5666 6.5666 6.5666 7.0721 7.0721 7.0721 7.0721 7.3231 7.3231 7.3231 7.3231 8.7009 8.7009 8.7009 8.7009 10.0096 10.0096 10.0096 10.0096 10.5062 10.5062 10.5062 10.5062 11.0820 11.0820 11.0820 11.0820 12.0798 12.0798 12.0798 12.0798 13.6129 13.6129 13.6129 13.6129 k = 0.0000 0.2788 0.2307 ( 10000 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3964 -82.3964 -82.3964 -82.3964 -82.3505 -82.3505 -82.3505 -82.3505 -48.5196 -48.5196 -48.5196 -48.5196 -48.4329 -48.4329 -48.4329 -48.4329 -46.8891 -46.8891 -46.8891 -46.8891 -46.8088 -46.8088 -46.8088 -46.8088 -46.8011 -46.8011 -46.8011 -46.8011 -46.6841 -46.6841 -46.6841 -46.6841 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14.2971 14.2971 k = 0.5000 0.2788 0.2107 ( 9980 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -48.4851 -48.4851 -48.4850 -48.4850 -48.4849 -48.4849 -48.4849 -48.4849 -46.8779 -46.8779 -46.8779 -46.8779 -46.8771 -46.8771 -46.8771 -46.8771 -46.7236 -46.7236 -46.7235 -46.7235 -46.7231 -46.7231 -46.7230 -46.7230 -35.3370 -35.3370 -35.3368 -35.3368 -35.3367 -35.3367 -35.3366 -35.3366 -15.9808 -15.9808 -15.9790 -15.9790 -15.9598 -15.9598 -15.9594 -15.9594 -14.3184 -14.3184 -14.3091 -14.3091 -14.2392 -14.2392 -14.2325 -14.2325 -12.5356 -12.5356 -12.5302 -12.5302 -12.4158 -12.4158 -12.4101 -12.4101 -1.8353 -1.8353 -1.8218 -1.8218 -1.7221 -1.7221 -1.7189 -1.7189 1.2491 1.2491 1.2638 1.2638 1.2887 1.2887 1.3132 1.3132 3.0543 3.0543 3.0766 3.0766 3.3309 3.3309 3.4074 3.4074 4.0473 4.0473 4.0882 4.0882 4.1030 4.1030 4.1396 4.1396 4.8364 4.8364 4.8755 4.8755 4.9234 4.9234 4.9371 4.9371 5.8514 5.8514 5.8546 5.8546 5.8818 5.8818 5.9026 5.9026 6.5862 6.5862 6.5989 6.5989 6.6138 6.6138 6.6266 6.6266 7.3208 7.3208 7.4243 7.4243 7.4251 7.4251 7.5522 7.5522 8.7188 8.7188 8.7298 8.7298 8.8617 8.8617 8.8707 8.8707 11.7857 11.7857 11.8524 11.8524 12.1388 12.1388 12.2397 12.2397 14.2796 14.2796 14.2856 14.2856 k = 0.5000 0.2788 0.2207 ( 9976 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3722 -82.3722 -82.3722 -82.3722 -82.3721 -82.3721 -82.3721 -82.3721 -48.4850 -48.4850 -48.4850 -48.4850 -48.4849 -48.4849 -48.4849 -48.4849 -46.8779 -46.8779 -46.8779 -46.8779 -46.8771 -46.8771 -46.8770 -46.8770 -46.7236 -46.7236 -46.7235 -46.7235 -46.7231 -46.7231 -46.7230 -46.7230 -35.3367 -35.3367 -35.3366 -35.3366 -35.3364 -35.3364 -35.3363 -35.3363 -15.9808 -15.9808 -15.9795 -15.9795 -15.9598 -15.9598 -15.9594 -15.9594 -14.3171 -14.3171 -14.3109 -14.3109 -14.2374 -14.2374 -14.2329 -14.2329 -12.5353 -12.5353 -12.5318 -12.5318 -12.4141 -12.4141 -12.4104 -12.4104 -1.8339 -1.8339 -1.8248 -1.8248 -1.7212 -1.7212 -1.7191 -1.7191 1.2503 1.2503 1.2601 1.2601 1.2921 1.2921 1.3085 1.3085 3.0584 3.0584 3.0732 3.0732 3.3476 3.3476 3.3993 3.3993 4.0531 4.0531 4.0906 4.0906 4.0950 4.0950 4.1300 4.1300 4.8528 4.8528 4.8805 4.8805 4.9127 4.9127 4.9206 4.9206 5.8543 5.8543 5.8566 5.8566 5.8881 5.8881 5.9018 5.9018 6.5924 6.5924 6.6018 6.6018 6.6119 6.6119 6.6198 6.6198 7.3392 7.3392 7.4092 7.4092 7.4480 7.4480 7.5341 7.5341 8.7193 8.7193 8.7265 8.7265 8.8633 8.8633 8.8691 8.8691 11.7917 11.7917 11.8362 11.8362 12.1537 12.1537 12.2211 12.2211 14.2727 14.2727 14.2770 14.2770 k = 0.5000 0.2788 0.2307 ( 9980 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -48.4850 -48.4850 -48.4850 -48.4850 -48.4849 -48.4849 -48.4849 -48.4849 -46.8779 -46.8779 -46.8779 -46.8779 -46.8771 -46.8771 -46.8771 -46.8771 -46.7236 -46.7236 -46.7235 -46.7235 -46.7231 -46.7231 -46.7230 -46.7230 -35.3372 -35.3372 -35.3372 -35.3372 -35.3370 -35.3370 -35.3369 -35.3369 -15.9807 -15.9807 -15.9800 -15.9800 -15.9598 -15.9598 -15.9596 -15.9596 -14.3157 -14.3157 -14.3126 -14.3126 -14.2360 -14.2360 -14.2337 -14.2337 -12.5348 -12.5348 -12.5330 -12.5330 -12.4128 -12.4128 -12.4109 -12.4109 -1.8321 -1.8321 -1.8276 -1.8276 -1.7205 -1.7205 -1.7194 -1.7194 1.2520 1.2520 1.2569 1.2569 1.2958 1.2958 1.3040 1.3040 3.0623 3.0623 3.0697 3.0697 3.3631 3.3631 3.3892 3.3892 4.0604 4.0604 4.0792 4.0792 4.1028 4.1028 4.1206 4.1206 4.8695 4.8695 4.8867 4.8867 4.9029 4.9029 4.9035 4.9035 5.8563 5.8563 5.8574 5.8574 5.8931 5.8931 5.9000 5.9000 6.5989 6.5989 6.6045 6.6045 6.6096 6.6096 6.6127 6.6127 7.3574 7.3574 7.3925 7.3925 7.4711 7.4711 7.5144 7.5144 8.7203 8.7203 8.7239 8.7239 8.8648 8.8648 8.8678 8.8678 11.7996 11.7996 11.8218 11.8218 12.1693 12.1693 12.2030 12.2030 14.2686 14.2686 14.2709 14.2709 k = 0.5000 0.2788 0.2408 ( 9976 PWs) bands (ev): ************************************************************************ ************************************************************************ -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -82.3722 -48.4850 -48.4850 -48.4850 -48.4850 -48.4849 -48.4849 -48.4849 -48.4849 -46.8779 -46.8779 -46.8779 -46.8779 -46.8771 -46.8771 -46.8771 -46.8771 -46.7236 -46.7236 -46.7236 -46.7236 -46.7230 -46.7230 -46.7230 -46.7230 -35.3368 -35.3368 -35.3368 -35.3368 -35.3365 -35.3365 -35.3365 -35.3365 -15.9804 -15.9804 -15.9804 -15.9804 -15.9596 -15.9596 -15.9596 -15.9596 -14.3142 -14.3142 -14.3142 -14.3142 -14.2347 -14.2347 -14.2347 -14.2347 -12.5341 -12.5341 -12.5341 -12.5341 -12.4117 -12.4117 -12.4117 -12.4117 -1.8300 -1.8300 -1.8300 -1.8300 -1.7199 -1.7199 -1.7199 -1.7199 1.2542 1.2542 1.2542 1.2542 1.2998 1.2998 1.2998 1.2998 3.0661 3.0661 3.0661 3.0661 3.3770 3.3770 3.3770 3.3770 4.0691 4.0691 4.0691 4.0691 4.1114 4.1114 4.1114 4.1114 4.8865 4.8865 4.8865 4.8865 4.8942 4.8942 4.8942 4.8942 5.8574 5.8574 5.8574 5.8574 5.8972 5.8972 5.8972 5.8972 6.6059 6.6059 6.6059 6.6059 6.6072 6.6072 6.6072 6.6072 7.3753 7.3753 7.3753 7.3753 7.4934 7.4934 7.4934 7.4934 8.7218 8.7218 8.7218 8.7218 8.8663 8.8663 8.8663 8.8663 11.8097 11.8097 11.8097 11.8097 12.1858 12.1858 12.1858 12.1858 14.2682 14.2682 14.2682 14.2682 Writing output data file CoBW.save init_run : 1.12s CPU 0.67s WALL ( 1 calls) electrons : 4015.09s CPU 3902.92s WALL ( 1 calls) Called by init_run: wfcinit : 0.01s CPU 0.01s WALL ( 1 calls) potinit : 0.20s CPU 0.13s WALL ( 1 calls) Called by electrons: c_bands : 4015.06s CPU 3902.89s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.47s CPU 0.25s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.64s CPU 0.69s WALL ( 420 calls) cegterg : 3665.76s CPU 3650.84s WALL ( 1060 calls) Called by sum_band: Called by *egterg: h_psi : 1710.91s CPU 1580.82s WALL ( 17611 calls) s_psi : 74.65s CPU 74.05s WALL ( 17611 calls) g_psi : 1.40s CPU 1.44s WALL ( 16131 calls) cdiaghg : 1837.49s CPU 1842.35s WALL ( 16551 calls) cegterg:over : 156.48s CPU 157.32s WALL ( 16131 calls) cegterg:upda : 84.54s CPU 84.68s WALL ( 16131 calls) cegterg:last : 59.43s CPU 59.43s WALL ( 2320 calls) cdiaghg:chol : 54.08s CPU 54.32s WALL ( 16551 calls) cdiaghg:inve : 47.85s CPU 48.29s WALL ( 16551 calls) cdiaghg:para : 128.92s CPU 130.38s WALL ( 33102 calls) Called by h_psi: h_psi:vloc : 1522.89s CPU 1395.86s WALL ( 17611 calls) h_psi:vnl : 186.28s CPU 183.20s WALL ( 17611 calls) add_vuspsi : 87.68s CPU 86.32s WALL ( 17611 calls) General routines calbec : 98.50s CPU 96.80s WALL ( 17611 calls) fft : 0.14s CPU 0.07s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 1497.41s CPU 1371.96s WALL ( 4209640 calls) interpolate : 0.03s CPU 0.02s WALL ( 4 calls) davcio : 0.73s CPU 9.73s WALL ( 840 calls) Parallel routines fft_scatter : 1271.03s CPU 1227.63s WALL ( 4209663 calls) PWSCF : 1h13m CPU 1h13m WALL This run was terminated on: 0:46:34 21Mar2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=