Program PWSCF v.5.4.0 starts on 28Mar2017 at 19:55:26 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: ./TcP3.save/ file Tc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P 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 28 14 4 3656 1386 216 Max 29 15 5 3672 1417 237 Sum 2031 1063 311 263925 100939 16019 bravais-lattice index = 14 lattice parameter (alat) = 5.8430 a.u. unit-cell volume = 1647.9006 (a.u.)^3 number of atoms/cell = 16 number of atomic types = 2 number of electrons = 120.00 number of Kohn-Sham states= 144 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 448.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.843033 celldm(2)= 1.663001 celldm(3)= 4.967335 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 1.663001 0.000000 ) a(3) = ( 0.000000 0.000000 4.967335 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.601322 -0.000000 ) b(3) = ( 0.000000 0.000000 0.201315 ) PseudoPot. # 1 for Tc read from file: /users/gautes/Pseudo/Tc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 20e1f658a7aa6a4afb3e3f899e3635d1 Pseudo is Ultrasoft + core correction, Zval = 15.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1231 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 P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1147 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Tc 15.00 98.00000 Tc( 1.00) P 5.00 30.97380 P( 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 =( -0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.8315006 ) ( 0.0000000 0.0000000 1.0000000 ) ( 2.4836675 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.8315006 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 2.4836675 ) 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 =( -0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 6) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.8315006 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 2.4836675 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.8315006 ) ( 0.0000000 0.0000000 1.0000000 ) ( 2.4836675 ) 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= 384 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 2) = ( 0.0098039 -0.0000000 -0.0000000), wk = 0.0026042 k( 3) = ( 0.0196078 -0.0000000 -0.0000000), wk = 0.0026042 k( 4) = ( 0.0294118 -0.0000000 -0.0000000), wk = 0.0026042 k( 5) = ( 0.0392157 -0.0000000 -0.0000000), wk = 0.0026042 k( 6) = ( 0.0490196 -0.0000000 -0.0000000), wk = 0.0026042 k( 7) = ( 0.0588235 -0.0000000 -0.0000000), wk = 0.0026042 k( 8) = ( 0.0686275 -0.0000000 -0.0000000), wk = 0.0026042 k( 9) = ( 0.0784314 -0.0000000 -0.0000000), wk = 0.0026042 k( 10) = ( 0.0882353 -0.0000000 -0.0000000), wk = 0.0026042 k( 11) = ( 0.0980392 -0.0000000 -0.0000000), wk = 0.0026042 k( 12) = ( 0.1078431 -0.0000000 -0.0000000), wk = 0.0026042 k( 13) = ( 0.1176471 -0.0000000 -0.0000000), wk = 0.0026042 k( 14) = ( 0.1274510 -0.0000000 -0.0000000), wk = 0.0026042 k( 15) = ( 0.1372549 -0.0000000 -0.0000000), wk = 0.0026042 k( 16) = ( 0.1470588 -0.0000000 -0.0000000), wk = 0.0026042 k( 17) = ( 0.1568627 -0.0000000 -0.0000000), wk = 0.0026042 k( 18) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0026042 k( 19) = ( 0.1764706 -0.0000000 -0.0000000), wk = 0.0026042 k( 20) = ( 0.1862745 -0.0000000 -0.0000000), wk = 0.0026042 k( 21) = ( 0.1960784 -0.0000000 -0.0000000), wk = 0.0026042 k( 22) = ( 0.2058823 -0.0000000 -0.0000000), wk = 0.0026042 k( 23) = ( 0.2156863 -0.0000000 -0.0000000), wk = 0.0026042 k( 24) = ( 0.2254902 -0.0000000 -0.0000000), wk = 0.0026042 k( 25) = ( 0.2352941 -0.0000000 -0.0000000), wk = 0.0026042 k( 26) = ( 0.2450980 -0.0000000 -0.0000000), wk = 0.0026042 k( 27) = ( 0.2549020 -0.0000000 -0.0000000), wk = 0.0026042 k( 28) = ( 0.2647059 -0.0000000 -0.0000000), wk = 0.0026042 k( 29) = ( 0.2745098 -0.0000000 -0.0000000), wk = 0.0026042 k( 30) = ( 0.2843137 -0.0000000 -0.0000000), wk = 0.0026042 k( 31) = ( 0.2941177 -0.0000000 -0.0000000), wk = 0.0026042 k( 32) = ( 0.3039216 -0.0000000 -0.0000000), wk = 0.0026042 k( 33) = ( 0.3137255 -0.0000000 -0.0000000), wk = 0.0026042 k( 34) = ( 0.3235294 -0.0000000 -0.0000000), wk = 0.0026042 k( 35) = ( 0.3333333 -0.0000000 -0.0000000), wk = 0.0026042 k( 36) = ( 0.3431373 -0.0000000 -0.0000000), wk = 0.0026042 k( 37) = ( 0.3529412 -0.0000000 -0.0000000), wk = 0.0026042 k( 38) = ( 0.3627451 -0.0000000 -0.0000000), wk = 0.0026042 k( 39) = ( 0.3725490 -0.0000000 -0.0000000), wk = 0.0026042 k( 40) = ( 0.3823529 -0.0000000 -0.0000000), wk = 0.0026042 k( 41) = ( 0.3921569 -0.0000000 -0.0000000), wk = 0.0026042 k( 42) = ( 0.4019608 -0.0000000 -0.0000000), wk = 0.0026042 k( 43) = ( 0.4117647 -0.0000000 -0.0000000), wk = 0.0026042 k( 44) = ( 0.4215686 -0.0000000 -0.0000000), wk = 0.0026042 k( 45) = ( 0.4313726 -0.0000000 -0.0000000), wk = 0.0026042 k( 46) = ( 0.4411765 -0.0000000 -0.0000000), wk = 0.0026042 k( 47) = ( 0.4509804 -0.0000000 -0.0000000), wk = 0.0026042 k( 48) = ( 0.4607843 -0.0000000 -0.0000000), wk = 0.0026042 k( 49) = ( 0.4705882 -0.0000000 -0.0000000), wk = 0.0026042 k( 50) = ( 0.4803922 -0.0000000 -0.0000000), wk = 0.0026042 k( 51) = ( 0.4901961 -0.0000000 -0.0000000), wk = 0.0026042 k( 52) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0026042 k( 53) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0026042 k( 54) = ( 0.5000000 0.0096987 -0.0000000), wk = 0.0026042 k( 55) = ( 0.5000000 0.0193975 -0.0000000), wk = 0.0026042 k( 56) = ( 0.5000000 0.0290962 -0.0000000), wk = 0.0026042 k( 57) = ( 0.5000000 0.0387950 -0.0000000), wk = 0.0026042 k( 58) = ( 0.5000000 0.0484937 -0.0000000), wk = 0.0026042 k( 59) = ( 0.5000000 0.0581925 -0.0000000), wk = 0.0026042 k( 60) = ( 0.5000000 0.0678912 -0.0000000), wk = 0.0026042 k( 61) = ( 0.5000000 0.0775900 -0.0000000), wk = 0.0026042 k( 62) = ( 0.5000000 0.0872887 -0.0000000), wk = 0.0026042 k( 63) = ( 0.5000000 0.0969875 -0.0000000), wk = 0.0026042 k( 64) = ( 0.5000000 0.1066862 -0.0000000), wk = 0.0026042 k( 65) = ( 0.5000000 0.1163850 -0.0000000), wk = 0.0026042 k( 66) = ( 0.5000000 0.1260837 -0.0000000), wk = 0.0026042 k( 67) = ( 0.5000000 0.1357825 -0.0000000), wk = 0.0026042 k( 68) = ( 0.5000000 0.1454812 -0.0000000), wk = 0.0026042 k( 69) = ( 0.5000000 0.1551800 -0.0000000), wk = 0.0026042 k( 70) = ( 0.5000000 0.1648787 -0.0000000), wk = 0.0026042 k( 71) = ( 0.5000000 0.1745775 -0.0000000), wk = 0.0026042 k( 72) = ( 0.5000000 0.1842762 -0.0000000), wk = 0.0026042 k( 73) = ( 0.5000000 0.1939750 -0.0000000), wk = 0.0026042 k( 74) = ( 0.5000000 0.2036737 -0.0000000), wk = 0.0026042 k( 75) = ( 0.5000000 0.2133725 -0.0000000), wk = 0.0026042 k( 76) = ( 0.5000000 0.2230712 -0.0000000), wk = 0.0026042 k( 77) = ( 0.5000000 0.2327700 -0.0000000), wk = 0.0026042 k( 78) = ( 0.5000000 0.2424687 -0.0000000), wk = 0.0026042 k( 79) = ( 0.5000000 0.2521675 -0.0000000), wk = 0.0026042 k( 80) = ( 0.5000000 0.2618662 -0.0000000), wk = 0.0026042 k( 81) = ( 0.5000000 0.2715650 -0.0000000), wk = 0.0026042 k( 82) = ( 0.5000000 0.2812637 -0.0000000), wk = 0.0026042 k( 83) = ( 0.5000000 0.2909625 -0.0000000), wk = 0.0026042 k( 84) = ( 0.5000000 0.3006612 -0.0000000), wk = 0.0026042 k( 85) = ( 0.5000000 0.3006612 -0.0000000), wk = 0.0026042 k( 86) = ( 0.4901961 0.3006612 -0.0000000), wk = 0.0026042 k( 87) = ( 0.4803922 0.3006612 -0.0000000), wk = 0.0026042 k( 88) = ( 0.4705882 0.3006612 -0.0000000), wk = 0.0026042 k( 89) = ( 0.4607843 0.3006612 -0.0000000), wk = 0.0026042 k( 90) = ( 0.4509804 0.3006612 -0.0000000), wk = 0.0026042 k( 91) = ( 0.4411765 0.3006612 -0.0000000), wk = 0.0026042 k( 92) = ( 0.4313726 0.3006612 -0.0000000), wk = 0.0026042 k( 93) = ( 0.4215686 0.3006612 -0.0000000), wk = 0.0026042 k( 94) = ( 0.4117647 0.3006612 -0.0000000), wk = 0.0026042 k( 95) = ( 0.4019608 0.3006612 -0.0000000), wk = 0.0026042 k( 96) = ( 0.3921569 0.3006612 -0.0000000), wk = 0.0026042 k( 97) = ( 0.3823529 0.3006612 -0.0000000), wk = 0.0026042 k( 98) = ( 0.3725490 0.3006612 -0.0000000), wk = 0.0026042 k( 99) = ( 0.3627451 0.3006612 -0.0000000), wk = 0.0026042 k( 100) = ( 0.3529412 0.3006612 -0.0000000), wk = 0.0026042 k( 101) = ( 0.3431373 0.3006612 -0.0000000), wk = 0.0026042 k( 102) = ( 0.3333333 0.3006612 -0.0000000), wk = 0.0026042 k( 103) = ( 0.3235294 0.3006612 -0.0000000), wk = 0.0026042 k( 104) = ( 0.3137255 0.3006612 -0.0000000), wk = 0.0026042 k( 105) = ( 0.3039216 0.3006612 -0.0000000), wk = 0.0026042 k( 106) = ( 0.2941177 0.3006612 -0.0000000), wk = 0.0026042 k( 107) = ( 0.2843137 0.3006612 -0.0000000), wk = 0.0026042 k( 108) = ( 0.2745098 0.3006612 -0.0000000), wk = 0.0026042 k( 109) = ( 0.2647059 0.3006612 -0.0000000), wk = 0.0026042 k( 110) = ( 0.2549020 0.3006612 -0.0000000), wk = 0.0026042 k( 111) = ( 0.2450980 0.3006612 -0.0000000), wk = 0.0026042 k( 112) = ( 0.2352941 0.3006612 -0.0000000), wk = 0.0026042 k( 113) = ( 0.2254902 0.3006612 -0.0000000), wk = 0.0026042 k( 114) = ( 0.2156863 0.3006612 -0.0000000), wk = 0.0026042 k( 115) = ( 0.2058823 0.3006612 -0.0000000), wk = 0.0026042 k( 116) = ( 0.1960784 0.3006612 -0.0000000), wk = 0.0026042 k( 117) = ( 0.1862745 0.3006612 -0.0000000), wk = 0.0026042 k( 118) = ( 0.1764706 0.3006612 -0.0000000), wk = 0.0026042 k( 119) = ( 0.1666667 0.3006612 -0.0000000), wk = 0.0026042 k( 120) = ( 0.1568627 0.3006612 -0.0000000), wk = 0.0026042 k( 121) = ( 0.1470588 0.3006612 -0.0000000), wk = 0.0026042 k( 122) = ( 0.1372549 0.3006612 -0.0000000), wk = 0.0026042 k( 123) = ( 0.1274510 0.3006612 -0.0000000), wk = 0.0026042 k( 124) = ( 0.1176471 0.3006612 -0.0000000), wk = 0.0026042 k( 125) = ( 0.1078431 0.3006612 -0.0000000), wk = 0.0026042 k( 126) = ( 0.0980392 0.3006612 -0.0000000), wk = 0.0026042 k( 127) = ( 0.0882353 0.3006612 -0.0000000), wk = 0.0026042 k( 128) = ( 0.0784314 0.3006612 -0.0000000), wk = 0.0026042 k( 129) = ( 0.0686275 0.3006612 -0.0000000), wk = 0.0026042 k( 130) = ( 0.0588235 0.3006612 -0.0000000), wk = 0.0026042 k( 131) = ( 0.0490196 0.3006612 -0.0000000), wk = 0.0026042 k( 132) = ( 0.0392157 0.3006612 -0.0000000), wk = 0.0026042 k( 133) = ( 0.0294118 0.3006612 -0.0000000), wk = 0.0026042 k( 134) = ( 0.0196078 0.3006612 -0.0000000), wk = 0.0026042 k( 135) = ( 0.0098039 0.3006612 -0.0000000), wk = 0.0026042 k( 136) = ( 0.0000000 0.3006612 -0.0000000), wk = 0.0026042 k( 137) = ( 0.0000000 0.3006612 -0.0000000), wk = 0.0026042 k( 138) = ( 0.0000000 0.2909625 -0.0000000), wk = 0.0026042 k( 139) = ( 0.0000000 0.2812637 -0.0000000), wk = 0.0026042 k( 140) = ( 0.0000000 0.2715650 -0.0000000), wk = 0.0026042 k( 141) = ( 0.0000000 0.2618662 -0.0000000), wk = 0.0026042 k( 142) = ( 0.0000000 0.2521675 -0.0000000), wk = 0.0026042 k( 143) = ( 0.0000000 0.2424687 -0.0000000), wk = 0.0026042 k( 144) = ( 0.0000000 0.2327700 -0.0000000), wk = 0.0026042 k( 145) = ( 0.0000000 0.2230712 -0.0000000), wk = 0.0026042 k( 146) = ( 0.0000000 0.2133725 -0.0000000), wk = 0.0026042 k( 147) = ( 0.0000000 0.2036737 -0.0000000), wk = 0.0026042 k( 148) = ( 0.0000000 0.1939750 -0.0000000), wk = 0.0026042 k( 149) = ( 0.0000000 0.1842762 -0.0000000), wk = 0.0026042 k( 150) = ( 0.0000000 0.1745775 -0.0000000), wk = 0.0026042 k( 151) = ( 0.0000000 0.1648787 -0.0000000), wk = 0.0026042 k( 152) = ( 0.0000000 0.1551800 -0.0000000), wk = 0.0026042 k( 153) = ( 0.0000000 0.1454812 -0.0000000), wk = 0.0026042 k( 154) = ( 0.0000000 0.1357825 -0.0000000), wk = 0.0026042 k( 155) = ( 0.0000000 0.1260837 -0.0000000), wk = 0.0026042 k( 156) = ( 0.0000000 0.1163850 -0.0000000), wk = 0.0026042 k( 157) = ( 0.0000000 0.1066862 -0.0000000), wk = 0.0026042 k( 158) = ( 0.0000000 0.0969875 -0.0000000), wk = 0.0026042 k( 159) = ( 0.0000000 0.0872887 -0.0000000), wk = 0.0026042 k( 160) = ( 0.0000000 0.0775900 -0.0000000), wk = 0.0026042 k( 161) = ( 0.0000000 0.0678912 -0.0000000), wk = 0.0026042 k( 162) = ( 0.0000000 0.0581925 -0.0000000), wk = 0.0026042 k( 163) = ( 0.0000000 0.0484937 -0.0000000), wk = 0.0026042 k( 164) = ( 0.0000000 0.0387950 -0.0000000), wk = 0.0026042 k( 165) = ( 0.0000000 0.0290962 -0.0000000), wk = 0.0026042 k( 166) = ( 0.0000000 0.0193975 -0.0000000), wk = 0.0026042 k( 167) = ( 0.0000000 0.0096987 -0.0000000), wk = 0.0026042 k( 168) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 169) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 170) = ( 0.0000000 0.0000000 0.0091507), wk = 0.0026042 k( 171) = ( 0.0000000 0.0000000 0.0183014), wk = 0.0026042 k( 172) = ( 0.0000000 0.0000000 0.0274521), wk = 0.0026042 k( 173) = ( 0.0000000 0.0000000 0.0366028), wk = 0.0026042 k( 174) = ( 0.0000000 0.0000000 0.0457535), wk = 0.0026042 k( 175) = ( 0.0000000 0.0000000 0.0549041), wk = 0.0026042 k( 176) = ( 0.0000000 0.0000000 0.0640548), wk = 0.0026042 k( 177) = ( 0.0000000 0.0000000 0.0732055), wk = 0.0026042 k( 178) = ( 0.0000000 0.0000000 0.0823562), wk = 0.0026042 k( 179) = ( 0.0000000 0.0000000 0.0915069), wk = 0.0026042 k( 180) = ( 0.0000000 0.0000000 0.1006576), wk = 0.0026042 k( 181) = ( 0.0000000 0.0000000 0.1006576), wk = 0.0026042 k( 182) = ( 0.0098039 -0.0000000 0.1006576), wk = 0.0026042 k( 183) = ( 0.0196078 -0.0000000 0.1006576), wk = 0.0026042 k( 184) = ( 0.0294118 -0.0000000 0.1006576), wk = 0.0026042 k( 185) = ( 0.0392157 -0.0000000 0.1006576), wk = 0.0026042 k( 186) = ( 0.0490196 -0.0000000 0.1006576), wk = 0.0026042 k( 187) = ( 0.0588235 -0.0000000 0.1006576), wk = 0.0026042 k( 188) = ( 0.0686275 -0.0000000 0.1006576), wk = 0.0026042 k( 189) = ( 0.0784314 -0.0000000 0.1006576), wk = 0.0026042 k( 190) = ( 0.0882353 -0.0000000 0.1006576), wk = 0.0026042 k( 191) = ( 0.0980392 -0.0000000 0.1006576), wk = 0.0026042 k( 192) = ( 0.1078431 -0.0000000 0.1006576), wk = 0.0026042 k( 193) = ( 0.1176471 -0.0000000 0.1006576), wk = 0.0026042 k( 194) = ( 0.1274510 -0.0000000 0.1006576), wk = 0.0026042 k( 195) = ( 0.1372549 -0.0000000 0.1006576), wk = 0.0026042 k( 196) = ( 0.1470588 -0.0000000 0.1006576), wk = 0.0026042 k( 197) = ( 0.1568627 -0.0000000 0.1006576), wk = 0.0026042 k( 198) = ( 0.1666667 -0.0000000 0.1006576), wk = 0.0026042 k( 199) = ( 0.1764706 -0.0000000 0.1006576), wk = 0.0026042 k( 200) = ( 0.1862745 -0.0000000 0.1006576), wk = 0.0026042 k( 201) = ( 0.1960784 -0.0000000 0.1006576), wk = 0.0026042 k( 202) = ( 0.2058823 -0.0000000 0.1006576), wk = 0.0026042 k( 203) = ( 0.2156863 -0.0000000 0.1006576), wk = 0.0026042 k( 204) = ( 0.2254902 -0.0000000 0.1006576), wk = 0.0026042 k( 205) = ( 0.2352941 -0.0000000 0.1006576), wk = 0.0026042 k( 206) = ( 0.2450980 -0.0000000 0.1006576), wk = 0.0026042 k( 207) = ( 0.2549020 -0.0000000 0.1006576), wk = 0.0026042 k( 208) = ( 0.2647059 -0.0000000 0.1006576), wk = 0.0026042 k( 209) = ( 0.2745098 -0.0000000 0.1006576), wk = 0.0026042 k( 210) = ( 0.2843137 -0.0000000 0.1006576), wk = 0.0026042 k( 211) = ( 0.2941177 -0.0000000 0.1006576), wk = 0.0026042 k( 212) = ( 0.3039216 -0.0000000 0.1006576), wk = 0.0026042 k( 213) = ( 0.3137255 -0.0000000 0.1006576), wk = 0.0026042 k( 214) = ( 0.3235294 -0.0000000 0.1006576), wk = 0.0026042 k( 215) = ( 0.3333333 -0.0000000 0.1006576), wk = 0.0026042 k( 216) = ( 0.3431373 -0.0000000 0.1006576), wk = 0.0026042 k( 217) = ( 0.3529412 -0.0000000 0.1006576), wk = 0.0026042 k( 218) = ( 0.3627451 -0.0000000 0.1006576), wk = 0.0026042 k( 219) = ( 0.3725490 -0.0000000 0.1006576), wk = 0.0026042 k( 220) = ( 0.3823529 -0.0000000 0.1006576), wk = 0.0026042 k( 221) = ( 0.3921569 -0.0000000 0.1006576), wk = 0.0026042 k( 222) = ( 0.4019608 -0.0000000 0.1006576), wk = 0.0026042 k( 223) = ( 0.4117647 -0.0000000 0.1006576), wk = 0.0026042 k( 224) = ( 0.4215686 -0.0000000 0.1006576), wk = 0.0026042 k( 225) = ( 0.4313726 -0.0000000 0.1006576), wk = 0.0026042 k( 226) = ( 0.4411765 -0.0000000 0.1006576), wk = 0.0026042 k( 227) = ( 0.4509804 -0.0000000 0.1006576), wk = 0.0026042 k( 228) = ( 0.4607843 -0.0000000 0.1006576), wk = 0.0026042 k( 229) = ( 0.4705882 -0.0000000 0.1006576), wk = 0.0026042 k( 230) = ( 0.4803922 -0.0000000 0.1006576), wk = 0.0026042 k( 231) = ( 0.4901961 -0.0000000 0.1006576), wk = 0.0026042 k( 232) = ( 0.5000000 -0.0000000 0.1006576), wk = 0.0026042 k( 233) = ( 0.5000000 -0.0000000 0.1006576), wk = 0.0026042 k( 234) = ( 0.5000000 0.0096987 0.1006576), wk = 0.0026042 k( 235) = ( 0.5000000 0.0193975 0.1006576), wk = 0.0026042 k( 236) = ( 0.5000000 0.0290962 0.1006576), wk = 0.0026042 k( 237) = ( 0.5000000 0.0387950 0.1006576), wk = 0.0026042 k( 238) = ( 0.5000000 0.0484937 0.1006576), wk = 0.0026042 k( 239) = ( 0.5000000 0.0581925 0.1006576), wk = 0.0026042 k( 240) = ( 0.5000000 0.0678912 0.1006576), wk = 0.0026042 k( 241) = ( 0.5000000 0.0775900 0.1006576), wk = 0.0026042 k( 242) = ( 0.5000000 0.0872887 0.1006576), wk = 0.0026042 k( 243) = ( 0.5000000 0.0969875 0.1006576), wk = 0.0026042 k( 244) = ( 0.5000000 0.1066862 0.1006576), wk = 0.0026042 k( 245) = ( 0.5000000 0.1163850 0.1006576), wk = 0.0026042 k( 246) = ( 0.5000000 0.1260837 0.1006576), wk = 0.0026042 k( 247) = ( 0.5000000 0.1357825 0.1006576), wk = 0.0026042 k( 248) = ( 0.5000000 0.1454812 0.1006576), wk = 0.0026042 k( 249) = ( 0.5000000 0.1551800 0.1006576), wk = 0.0026042 k( 250) = ( 0.5000000 0.1648787 0.1006576), wk = 0.0026042 k( 251) = ( 0.5000000 0.1745775 0.1006576), wk = 0.0026042 k( 252) = ( 0.5000000 0.1842762 0.1006576), wk = 0.0026042 k( 253) = ( 0.5000000 0.1939750 0.1006576), wk = 0.0026042 k( 254) = ( 0.5000000 0.2036737 0.1006576), wk = 0.0026042 k( 255) = ( 0.5000000 0.2133725 0.1006576), wk = 0.0026042 k( 256) = ( 0.5000000 0.2230712 0.1006576), wk = 0.0026042 k( 257) = ( 0.5000000 0.2327700 0.1006576), wk = 0.0026042 k( 258) = ( 0.5000000 0.2424687 0.1006576), wk = 0.0026042 k( 259) = ( 0.5000000 0.2521675 0.1006576), wk = 0.0026042 k( 260) = ( 0.5000000 0.2618662 0.1006576), wk = 0.0026042 k( 261) = ( 0.5000000 0.2715650 0.1006576), wk = 0.0026042 k( 262) = ( 0.5000000 0.2812637 0.1006576), wk = 0.0026042 k( 263) = ( 0.5000000 0.2909625 0.1006576), wk = 0.0026042 k( 264) = ( 0.5000000 0.3006612 0.1006576), wk = 0.0026042 k( 265) = ( 0.5000000 0.3006612 0.1006576), wk = 0.0026042 k( 266) = ( 0.4901961 0.3006612 0.1006576), wk = 0.0026042 k( 267) = ( 0.4803922 0.3006612 0.1006576), wk = 0.0026042 k( 268) = ( 0.4705882 0.3006612 0.1006576), wk = 0.0026042 k( 269) = ( 0.4607843 0.3006612 0.1006576), wk = 0.0026042 k( 270) = ( 0.4509804 0.3006612 0.1006576), wk = 0.0026042 k( 271) = ( 0.4411765 0.3006612 0.1006576), wk = 0.0026042 k( 272) = ( 0.4313726 0.3006612 0.1006576), wk = 0.0026042 k( 273) = ( 0.4215686 0.3006612 0.1006576), wk = 0.0026042 k( 274) = ( 0.4117647 0.3006612 0.1006576), wk = 0.0026042 k( 275) = ( 0.4019608 0.3006612 0.1006576), wk = 0.0026042 k( 276) = ( 0.3921569 0.3006612 0.1006576), wk = 0.0026042 k( 277) = ( 0.3823529 0.3006612 0.1006576), wk = 0.0026042 k( 278) = ( 0.3725490 0.3006612 0.1006576), wk = 0.0026042 k( 279) = ( 0.3627451 0.3006612 0.1006576), wk = 0.0026042 k( 280) = ( 0.3529412 0.3006612 0.1006576), wk = 0.0026042 k( 281) = ( 0.3431373 0.3006612 0.1006576), wk = 0.0026042 k( 282) = ( 0.3333333 0.3006612 0.1006576), wk = 0.0026042 k( 283) = ( 0.3235294 0.3006612 0.1006576), wk = 0.0026042 k( 284) = ( 0.3137255 0.3006612 0.1006576), wk = 0.0026042 k( 285) = ( 0.3039216 0.3006612 0.1006576), wk = 0.0026042 k( 286) = ( 0.2941177 0.3006612 0.1006576), wk = 0.0026042 k( 287) = ( 0.2843137 0.3006612 0.1006576), wk = 0.0026042 k( 288) = ( 0.2745098 0.3006612 0.1006576), wk = 0.0026042 k( 289) = ( 0.2647059 0.3006612 0.1006576), wk = 0.0026042 k( 290) = ( 0.2549020 0.3006612 0.1006576), wk = 0.0026042 k( 291) = ( 0.2450980 0.3006612 0.1006576), wk = 0.0026042 k( 292) = ( 0.2352941 0.3006612 0.1006576), wk = 0.0026042 k( 293) = ( 0.2254902 0.3006612 0.1006576), wk = 0.0026042 k( 294) = ( 0.2156863 0.3006612 0.1006576), wk = 0.0026042 k( 295) = ( 0.2058823 0.3006612 0.1006576), wk = 0.0026042 k( 296) = ( 0.1960784 0.3006612 0.1006576), wk = 0.0026042 k( 297) = ( 0.1862745 0.3006612 0.1006576), wk = 0.0026042 k( 298) = ( 0.1764706 0.3006612 0.1006576), wk = 0.0026042 k( 299) = ( 0.1666667 0.3006612 0.1006576), wk = 0.0026042 k( 300) = ( 0.1568627 0.3006612 0.1006576), wk = 0.0026042 k( 301) = ( 0.1470588 0.3006612 0.1006576), wk = 0.0026042 k( 302) = ( 0.1372549 0.3006612 0.1006576), wk = 0.0026042 k( 303) = ( 0.1274510 0.3006612 0.1006576), wk = 0.0026042 k( 304) = ( 0.1176471 0.3006612 0.1006576), wk = 0.0026042 k( 305) = ( 0.1078431 0.3006612 0.1006576), wk = 0.0026042 k( 306) = ( 0.0980392 0.3006612 0.1006576), wk = 0.0026042 k( 307) = ( 0.0882353 0.3006612 0.1006576), wk = 0.0026042 k( 308) = ( 0.0784314 0.3006612 0.1006576), wk = 0.0026042 k( 309) = ( 0.0686275 0.3006612 0.1006576), wk = 0.0026042 k( 310) = ( 0.0588235 0.3006612 0.1006576), wk = 0.0026042 k( 311) = ( 0.0490196 0.3006612 0.1006576), wk = 0.0026042 k( 312) = ( 0.0392157 0.3006612 0.1006576), wk = 0.0026042 k( 313) = ( 0.0294118 0.3006612 0.1006576), wk = 0.0026042 k( 314) = ( 0.0196078 0.3006612 0.1006576), wk = 0.0026042 k( 315) = ( 0.0098039 0.3006612 0.1006576), wk = 0.0026042 k( 316) = ( 0.0000000 0.3006612 0.1006576), wk = 0.0026042 k( 317) = ( 0.0000000 0.3006612 0.1006576), wk = 0.0026042 k( 318) = ( 0.0000000 0.2909625 0.1006576), wk = 0.0026042 k( 319) = ( 0.0000000 0.2812637 0.1006576), wk = 0.0026042 k( 320) = ( 0.0000000 0.2715650 0.1006576), wk = 0.0026042 k( 321) = ( 0.0000000 0.2618662 0.1006576), wk = 0.0026042 k( 322) = ( 0.0000000 0.2521675 0.1006576), wk = 0.0026042 k( 323) = ( 0.0000000 0.2424687 0.1006576), wk = 0.0026042 k( 324) = ( 0.0000000 0.2327700 0.1006576), wk = 0.0026042 k( 325) = ( 0.0000000 0.2230712 0.1006576), wk = 0.0026042 k( 326) = ( 0.0000000 0.2133725 0.1006576), wk = 0.0026042 k( 327) = ( 0.0000000 0.2036737 0.1006576), wk = 0.0026042 k( 328) = ( 0.0000000 0.1939750 0.1006576), wk = 0.0026042 k( 329) = ( 0.0000000 0.1842762 0.1006576), wk = 0.0026042 k( 330) = ( 0.0000000 0.1745775 0.1006576), wk = 0.0026042 k( 331) = ( 0.0000000 0.1648787 0.1006576), wk = 0.0026042 k( 332) = ( 0.0000000 0.1551800 0.1006576), wk = 0.0026042 k( 333) = ( 0.0000000 0.1454812 0.1006576), wk = 0.0026042 k( 334) = ( 0.0000000 0.1357825 0.1006576), wk = 0.0026042 k( 335) = ( 0.0000000 0.1260837 0.1006576), wk = 0.0026042 k( 336) = ( 0.0000000 0.1163850 0.1006576), wk = 0.0026042 k( 337) = ( 0.0000000 0.1066862 0.1006576), wk = 0.0026042 k( 338) = ( 0.0000000 0.0969875 0.1006576), wk = 0.0026042 k( 339) = ( 0.0000000 0.0872887 0.1006576), wk = 0.0026042 k( 340) = ( 0.0000000 0.0775900 0.1006576), wk = 0.0026042 k( 341) = ( 0.0000000 0.0678912 0.1006576), wk = 0.0026042 k( 342) = ( 0.0000000 0.0581925 0.1006576), wk = 0.0026042 k( 343) = ( 0.0000000 0.0484937 0.1006576), wk = 0.0026042 k( 344) = ( 0.0000000 0.0387950 0.1006576), wk = 0.0026042 k( 345) = ( 0.0000000 0.0290962 0.1006576), wk = 0.0026042 k( 346) = ( 0.0000000 0.0193975 0.1006576), wk = 0.0026042 k( 347) = ( 0.0000000 0.0096987 0.1006576), wk = 0.0026042 k( 348) = ( 0.0000000 0.0000000 0.1006576), wk = 0.0026042 k( 349) = ( 0.0000000 0.3006612 -0.0000000), wk = 0.0026042 k( 350) = ( 0.0000000 0.3006612 0.0091507), wk = 0.0026042 k( 351) = ( 0.0000000 0.3006612 0.0183014), wk = 0.0026042 k( 352) = ( 0.0000000 0.3006612 0.0274521), wk = 0.0026042 k( 353) = ( 0.0000000 0.3006612 0.0366028), wk = 0.0026042 k( 354) = ( 0.0000000 0.3006612 0.0457535), wk = 0.0026042 k( 355) = ( 0.0000000 0.3006612 0.0549041), wk = 0.0026042 k( 356) = ( 0.0000000 0.3006612 0.0640548), wk = 0.0026042 k( 357) = ( 0.0000000 0.3006612 0.0732055), wk = 0.0026042 k( 358) = ( 0.0000000 0.3006612 0.0823562), wk = 0.0026042 k( 359) = ( 0.0000000 0.3006612 0.0915069), wk = 0.0026042 k( 360) = ( 0.0000000 0.3006612 0.1006576), wk = 0.0026042 k( 361) = ( 0.5000000 -0.0000000 0.1006576), wk = 0.0026042 k( 362) = ( 0.5000000 -0.0000000 0.0915069), wk = 0.0026042 k( 363) = ( 0.5000000 -0.0000000 0.0823562), wk = 0.0026042 k( 364) = ( 0.5000000 -0.0000000 0.0732055), wk = 0.0026042 k( 365) = ( 0.5000000 -0.0000000 0.0640548), wk = 0.0026042 k( 366) = ( 0.5000000 -0.0000000 0.0549041), wk = 0.0026042 k( 367) = ( 0.5000000 -0.0000000 0.0457535), wk = 0.0026042 k( 368) = ( 0.5000000 -0.0000000 0.0366028), wk = 0.0026042 k( 369) = ( 0.5000000 -0.0000000 0.0274521), wk = 0.0026042 k( 370) = ( 0.5000000 -0.0000000 0.0183014), wk = 0.0026042 k( 371) = ( 0.5000000 -0.0000000 0.0091507), wk = 0.0026042 k( 372) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0026042 k( 373) = ( 0.5000000 0.3006612 -0.0000000), wk = 0.0026042 k( 374) = ( 0.5000000 0.3006612 0.0091507), wk = 0.0026042 k( 375) = ( 0.5000000 0.3006612 0.0183014), wk = 0.0026042 k( 376) = ( 0.5000000 0.3006612 0.0274521), wk = 0.0026042 k( 377) = ( 0.5000000 0.3006612 0.0366028), wk = 0.0026042 k( 378) = ( 0.5000000 0.3006612 0.0457535), wk = 0.0026042 k( 379) = ( 0.5000000 0.3006612 0.0549041), wk = 0.0026042 k( 380) = ( 0.5000000 0.3006612 0.0640548), wk = 0.0026042 k( 381) = ( 0.5000000 0.3006612 0.0732055), wk = 0.0026042 k( 382) = ( 0.5000000 0.3006612 0.0823562), wk = 0.0026042 k( 383) = ( 0.5000000 0.3006612 0.0915069), wk = 0.0026042 k( 384) = ( 0.5000000 0.3006612 0.1006576), wk = 0.0026042 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 2) = ( 0.0098039 0.0000000 0.0000000), wk = 0.0026042 k( 3) = ( 0.0196078 0.0000000 0.0000000), wk = 0.0026042 k( 4) = ( 0.0294118 0.0000000 0.0000000), wk = 0.0026042 k( 5) = ( 0.0392157 0.0000000 0.0000000), wk = 0.0026042 k( 6) = ( 0.0490196 0.0000000 0.0000000), wk = 0.0026042 k( 7) = ( 0.0588235 0.0000000 0.0000000), wk = 0.0026042 k( 8) = ( 0.0686275 0.0000000 0.0000000), wk = 0.0026042 k( 9) = ( 0.0784314 0.0000000 0.0000000), wk = 0.0026042 k( 10) = ( 0.0882353 0.0000000 0.0000000), wk = 0.0026042 k( 11) = ( 0.0980392 0.0000000 0.0000000), wk = 0.0026042 k( 12) = ( 0.1078431 0.0000000 0.0000000), wk = 0.0026042 k( 13) = ( 0.1176471 0.0000000 0.0000000), wk = 0.0026042 k( 14) = ( 0.1274510 0.0000000 0.0000000), wk = 0.0026042 k( 15) = ( 0.1372549 0.0000000 0.0000000), wk = 0.0026042 k( 16) = ( 0.1470588 0.0000000 0.0000000), wk = 0.0026042 k( 17) = ( 0.1568627 0.0000000 0.0000000), wk = 0.0026042 k( 18) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0026042 k( 19) = ( 0.1764706 0.0000000 0.0000000), wk = 0.0026042 k( 20) = ( 0.1862745 0.0000000 0.0000000), wk = 0.0026042 k( 21) = ( 0.1960784 0.0000000 0.0000000), wk = 0.0026042 k( 22) = ( 0.2058823 0.0000000 0.0000000), wk = 0.0026042 k( 23) = ( 0.2156863 0.0000000 0.0000000), wk = 0.0026042 k( 24) = ( 0.2254902 0.0000000 0.0000000), wk = 0.0026042 k( 25) = ( 0.2352941 0.0000000 0.0000000), wk = 0.0026042 k( 26) = ( 0.2450980 0.0000000 -0.0000000), wk = 0.0026042 k( 27) = ( 0.2549020 0.0000000 0.0000000), wk = 0.0026042 k( 28) = ( 0.2647059 0.0000000 0.0000000), wk = 0.0026042 k( 29) = ( 0.2745098 0.0000000 0.0000000), wk = 0.0026042 k( 30) = ( 0.2843137 0.0000000 0.0000000), wk = 0.0026042 k( 31) = ( 0.2941177 0.0000000 0.0000000), wk = 0.0026042 k( 32) = ( 0.3039216 0.0000000 0.0000000), wk = 0.0026042 k( 33) = ( 0.3137255 0.0000000 0.0000000), wk = 0.0026042 k( 34) = ( 0.3235294 0.0000000 -0.0000000), wk = 0.0026042 k( 35) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0026042 k( 36) = ( 0.3431373 0.0000000 -0.0000000), wk = 0.0026042 k( 37) = ( 0.3529412 0.0000000 0.0000000), wk = 0.0026042 k( 38) = ( 0.3627451 0.0000000 0.0000000), wk = 0.0026042 k( 39) = ( 0.3725490 0.0000000 0.0000000), wk = 0.0026042 k( 40) = ( 0.3823529 0.0000000 0.0000000), wk = 0.0026042 k( 41) = ( 0.3921569 0.0000000 0.0000000), wk = 0.0026042 k( 42) = ( 0.4019608 0.0000000 0.0000000), wk = 0.0026042 k( 43) = ( 0.4117647 0.0000000 0.0000000), wk = 0.0026042 k( 44) = ( 0.4215686 0.0000000 0.0000000), wk = 0.0026042 k( 45) = ( 0.4313726 -0.0000000 0.0000000), wk = 0.0026042 k( 46) = ( 0.4411765 0.0000000 0.0000000), wk = 0.0026042 k( 47) = ( 0.4509804 0.0000000 -0.0000000), wk = 0.0026042 k( 48) = ( 0.4607843 0.0000000 0.0000000), wk = 0.0026042 k( 49) = ( 0.4705882 0.0000000 0.0000000), wk = 0.0026042 k( 50) = ( 0.4803922 0.0000000 0.0000000), wk = 0.0026042 k( 51) = ( 0.4901961 0.0000000 -0.0000000), wk = 0.0026042 k( 52) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0026042 k( 53) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0026042 k( 54) = ( 0.5000000 0.0161290 0.0000000), wk = 0.0026042 k( 55) = ( 0.5000000 0.0322581 0.0000000), wk = 0.0026042 k( 56) = ( 0.5000000 0.0483871 0.0000000), wk = 0.0026042 k( 57) = ( 0.5000000 0.0645161 -0.0000000), wk = 0.0026042 k( 58) = ( 0.5000000 0.0806452 0.0000000), wk = 0.0026042 k( 59) = ( 0.5000000 0.0967742 0.0000000), wk = 0.0026042 k( 60) = ( 0.5000000 0.1129032 0.0000000), wk = 0.0026042 k( 61) = ( 0.5000000 0.1290323 0.0000000), wk = 0.0026042 k( 62) = ( 0.5000000 0.1451613 -0.0000000), wk = 0.0026042 k( 63) = ( 0.5000000 0.1612903 -0.0000000), wk = 0.0026042 k( 64) = ( 0.5000000 0.1774193 0.0000000), wk = 0.0026042 k( 65) = ( 0.5000000 0.1935484 0.0000000), wk = 0.0026042 k( 66) = ( 0.5000000 0.2096774 -0.0000000), wk = 0.0026042 k( 67) = ( 0.5000000 0.2258064 0.0000000), wk = 0.0026042 k( 68) = ( 0.5000000 0.2419355 0.0000000), wk = 0.0026042 k( 69) = ( 0.5000000 0.2580645 0.0000000), wk = 0.0026042 k( 70) = ( 0.5000000 0.2741935 0.0000000), wk = 0.0026042 k( 71) = ( 0.5000000 0.2903226 0.0000000), wk = 0.0026042 k( 72) = ( 0.5000000 0.3064516 0.0000000), wk = 0.0026042 k( 73) = ( 0.5000000 0.3225807 0.0000000), wk = 0.0026042 k( 74) = ( 0.5000000 0.3387097 0.0000000), wk = 0.0026042 k( 75) = ( 0.5000000 0.3548387 0.0000000), wk = 0.0026042 k( 76) = ( 0.5000000 0.3709677 0.0000000), wk = 0.0026042 k( 77) = ( 0.5000000 0.3870968 0.0000000), wk = 0.0026042 k( 78) = ( 0.5000000 0.4032258 0.0000000), wk = 0.0026042 k( 79) = ( 0.5000000 0.4193548 0.0000000), wk = 0.0026042 k( 80) = ( 0.5000000 0.4354839 -0.0000000), wk = 0.0026042 k( 81) = ( 0.5000000 0.4516129 -0.0000000), wk = 0.0026042 k( 82) = ( 0.5000000 0.4677419 0.0000000), wk = 0.0026042 k( 83) = ( 0.5000000 0.4838710 -0.0000000), wk = 0.0026042 k( 84) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026042 k( 85) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026042 k( 86) = ( 0.4901961 0.5000000 0.0000000), wk = 0.0026042 k( 87) = ( 0.4803922 0.5000000 0.0000000), wk = 0.0026042 k( 88) = ( 0.4705882 0.5000000 0.0000000), wk = 0.0026042 k( 89) = ( 0.4607843 0.5000000 -0.0000000), wk = 0.0026042 k( 90) = ( 0.4509804 0.5000000 0.0000000), wk = 0.0026042 k( 91) = ( 0.4411765 0.5000000 0.0000000), wk = 0.0026042 k( 92) = ( 0.4313726 0.5000000 0.0000000), wk = 0.0026042 k( 93) = ( 0.4215686 0.5000000 0.0000000), wk = 0.0026042 k( 94) = ( 0.4117647 0.5000000 0.0000000), wk = 0.0026042 k( 95) = ( 0.4019608 0.5000000 0.0000000), wk = 0.0026042 k( 96) = ( 0.3921569 0.5000000 -0.0000000), wk = 0.0026042 k( 97) = ( 0.3823529 0.5000000 -0.0000000), wk = 0.0026042 k( 98) = ( 0.3725490 0.5000000 -0.0000000), wk = 0.0026042 k( 99) = ( 0.3627451 0.5000000 -0.0000000), wk = 0.0026042 k( 100) = ( 0.3529412 0.5000000 -0.0000000), wk = 0.0026042 k( 101) = ( 0.3431373 0.5000000 0.0000000), wk = 0.0026042 k( 102) = ( 0.3333333 0.5000000 0.0000000), wk = 0.0026042 k( 103) = ( 0.3235294 0.5000000 0.0000000), wk = 0.0026042 k( 104) = ( 0.3137255 0.5000000 0.0000000), wk = 0.0026042 k( 105) = ( 0.3039216 0.5000000 0.0000000), wk = 0.0026042 k( 106) = ( 0.2941177 0.5000000 0.0000000), wk = 0.0026042 k( 107) = ( 0.2843137 0.5000000 0.0000000), wk = 0.0026042 k( 108) = ( 0.2745098 0.5000000 -0.0000000), wk = 0.0026042 k( 109) = ( 0.2647059 0.5000000 0.0000000), wk = 0.0026042 k( 110) = ( 0.2549020 0.5000000 0.0000000), wk = 0.0026042 k( 111) = ( 0.2450980 0.5000000 0.0000000), wk = 0.0026042 k( 112) = ( 0.2352941 0.5000000 0.0000000), wk = 0.0026042 k( 113) = ( 0.2254902 0.5000000 0.0000000), wk = 0.0026042 k( 114) = ( 0.2156863 0.5000000 0.0000000), wk = 0.0026042 k( 115) = ( 0.2058823 0.5000000 0.0000000), wk = 0.0026042 k( 116) = ( 0.1960784 0.5000000 0.0000000), wk = 0.0026042 k( 117) = ( 0.1862745 0.5000000 0.0000000), wk = 0.0026042 k( 118) = ( 0.1764706 0.5000000 0.0000000), wk = 0.0026042 k( 119) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0026042 k( 120) = ( 0.1568627 0.5000000 0.0000000), wk = 0.0026042 k( 121) = ( 0.1470588 0.5000000 -0.0000000), wk = 0.0026042 k( 122) = ( 0.1372549 0.5000000 0.0000000), wk = 0.0026042 k( 123) = ( 0.1274510 0.5000000 0.0000000), wk = 0.0026042 k( 124) = ( 0.1176471 0.5000000 0.0000000), wk = 0.0026042 k( 125) = ( 0.1078431 0.5000000 0.0000000), wk = 0.0026042 k( 126) = ( 0.0980392 0.5000000 -0.0000000), wk = 0.0026042 k( 127) = ( 0.0882353 0.5000000 0.0000000), wk = 0.0026042 k( 128) = ( 0.0784314 0.5000000 0.0000000), wk = 0.0026042 k( 129) = ( 0.0686275 0.5000000 0.0000000), wk = 0.0026042 k( 130) = ( 0.0588235 0.5000000 -0.0000000), wk = 0.0026042 k( 131) = ( 0.0490196 0.5000000 0.0000000), wk = 0.0026042 k( 132) = ( 0.0392157 0.5000000 0.0000000), wk = 0.0026042 k( 133) = ( 0.0294118 0.5000000 0.0000000), wk = 0.0026042 k( 134) = ( 0.0196078 0.5000000 0.0000000), wk = 0.0026042 k( 135) = ( 0.0098039 0.5000000 0.0000000), wk = 0.0026042 k( 136) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026042 k( 137) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026042 k( 138) = ( 0.0000000 0.4838710 0.0000000), wk = 0.0026042 k( 139) = ( 0.0000000 0.4677419 0.0000000), wk = 0.0026042 k( 140) = ( 0.0000000 0.4516129 0.0000000), wk = 0.0026042 k( 141) = ( 0.0000000 0.4354839 -0.0000000), wk = 0.0026042 k( 142) = ( 0.0000000 0.4193548 -0.0000000), wk = 0.0026042 k( 143) = ( 0.0000000 0.4032258 0.0000000), wk = 0.0026042 k( 144) = ( 0.0000000 0.3870968 0.0000000), wk = 0.0026042 k( 145) = ( 0.0000000 0.3709677 0.0000000), wk = 0.0026042 k( 146) = ( 0.0000000 0.3548387 -0.0000000), wk = 0.0026042 k( 147) = ( 0.0000000 0.3387097 0.0000000), wk = 0.0026042 k( 148) = ( 0.0000000 0.3225807 0.0000000), wk = 0.0026042 k( 149) = ( 0.0000000 0.3064516 0.0000000), wk = 0.0026042 k( 150) = ( 0.0000000 0.2903226 0.0000000), wk = 0.0026042 k( 151) = ( 0.0000000 0.2741936 0.0000000), wk = 0.0026042 k( 152) = ( 0.0000000 0.2580645 -0.0000000), wk = 0.0026042 k( 153) = ( 0.0000000 0.2419355 -0.0000000), wk = 0.0026042 k( 154) = ( 0.0000000 0.2258064 0.0000000), wk = 0.0026042 k( 155) = ( 0.0000000 0.2096774 -0.0000000), wk = 0.0026042 k( 156) = ( 0.0000000 0.1935484 0.0000000), wk = 0.0026042 k( 157) = ( 0.0000000 0.1774194 0.0000000), wk = 0.0026042 k( 158) = ( 0.0000000 0.1612903 -0.0000000), wk = 0.0026042 k( 159) = ( 0.0000000 0.1451613 0.0000000), wk = 0.0026042 k( 160) = ( 0.0000000 0.1290323 -0.0000000), wk = 0.0026042 k( 161) = ( 0.0000000 0.1129032 -0.0000000), wk = 0.0026042 k( 162) = ( 0.0000000 0.0967742 -0.0000000), wk = 0.0026042 k( 163) = ( 0.0000000 0.0806452 -0.0000000), wk = 0.0026042 k( 164) = ( 0.0000000 0.0645161 -0.0000000), wk = 0.0026042 k( 165) = ( 0.0000000 0.0483871 0.0000000), wk = 0.0026042 k( 166) = ( 0.0000000 0.0322581 0.0000000), wk = 0.0026042 k( 167) = ( 0.0000000 0.0161290 0.0000000), wk = 0.0026042 k( 168) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 169) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026042 k( 170) = ( 0.0000000 0.0000000 0.0454545), wk = 0.0026042 k( 171) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0026042 k( 172) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0026042 k( 173) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0026042 k( 174) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0026042 k( 175) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0026042 k( 176) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0026042 k( 177) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0026042 k( 178) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0026042 k( 179) = ( 0.0000000 0.0000000 0.4545454), wk = 0.0026042 k( 180) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026042 k( 181) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026042 k( 182) = ( 0.0098039 0.0000000 0.5000000), wk = 0.0026042 k( 183) = ( 0.0196078 0.0000000 0.5000000), wk = 0.0026042 k( 184) = ( 0.0294118 0.0000000 0.5000000), wk = 0.0026042 k( 185) = ( 0.0392157 0.0000000 0.5000000), wk = 0.0026042 k( 186) = ( 0.0490196 0.0000000 0.5000000), wk = 0.0026042 k( 187) = ( 0.0588235 0.0000000 0.5000000), wk = 0.0026042 k( 188) = ( 0.0686275 0.0000000 0.5000000), wk = 0.0026042 k( 189) = ( 0.0784314 0.0000000 0.5000000), wk = 0.0026042 k( 190) = ( 0.0882353 0.0000000 0.5000000), wk = 0.0026042 k( 191) = ( 0.0980392 0.0000000 0.5000000), wk = 0.0026042 k( 192) = ( 0.1078431 0.0000000 0.5000000), wk = 0.0026042 k( 193) = ( 0.1176471 0.0000000 0.5000000), wk = 0.0026042 k( 194) = ( 0.1274510 0.0000000 0.5000000), wk = 0.0026042 k( 195) = ( 0.1372549 0.0000000 0.5000000), wk = 0.0026042 k( 196) = ( 0.1470588 0.0000000 0.5000000), wk = 0.0026042 k( 197) = ( 0.1568627 0.0000000 0.5000000), wk = 0.0026042 k( 198) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0026042 k( 199) = ( 0.1764706 0.0000000 0.5000000), wk = 0.0026042 k( 200) = ( 0.1862745 0.0000000 0.5000000), wk = 0.0026042 k( 201) = ( 0.1960784 0.0000000 0.5000000), wk = 0.0026042 k( 202) = ( 0.2058823 0.0000000 0.5000000), wk = 0.0026042 k( 203) = ( 0.2156863 0.0000000 0.5000000), wk = 0.0026042 k( 204) = ( 0.2254902 0.0000000 0.5000000), wk = 0.0026042 k( 205) = ( 0.2352941 0.0000000 0.5000000), wk = 0.0026042 k( 206) = ( 0.2450980 0.0000000 0.5000000), wk = 0.0026042 k( 207) = ( 0.2549020 0.0000000 0.5000000), wk = 0.0026042 k( 208) = ( 0.2647059 0.0000000 0.5000000), wk = 0.0026042 k( 209) = ( 0.2745098 0.0000000 0.5000000), wk = 0.0026042 k( 210) = ( 0.2843137 0.0000000 0.5000000), wk = 0.0026042 k( 211) = ( 0.2941177 0.0000000 0.5000000), wk = 0.0026042 k( 212) = ( 0.3039216 0.0000000 0.5000000), wk = 0.0026042 k( 213) = ( 0.3137255 0.0000000 0.5000000), wk = 0.0026042 k( 214) = ( 0.3235294 0.0000000 0.5000000), wk = 0.0026042 k( 215) = ( 0.3333333 0.0000000 0.5000000), wk = 0.0026042 k( 216) = ( 0.3431373 0.0000000 0.5000000), wk = 0.0026042 k( 217) = ( 0.3529412 0.0000000 0.5000000), wk = 0.0026042 k( 218) = ( 0.3627451 0.0000000 0.5000000), wk = 0.0026042 k( 219) = ( 0.3725490 0.0000000 0.5000000), wk = 0.0026042 k( 220) = ( 0.3823529 0.0000000 0.5000000), wk = 0.0026042 k( 221) = ( 0.3921569 0.0000000 0.5000000), wk = 0.0026042 k( 222) = ( 0.4019608 0.0000000 0.5000000), wk = 0.0026042 k( 223) = ( 0.4117647 0.0000000 0.5000000), wk = 0.0026042 k( 224) = ( 0.4215686 0.0000000 0.5000000), wk = 0.0026042 k( 225) = ( 0.4313726 -0.0000000 0.5000000), wk = 0.0026042 k( 226) = ( 0.4411765 0.0000000 0.5000000), wk = 0.0026042 k( 227) = ( 0.4509804 0.0000000 0.5000000), wk = 0.0026042 k( 228) = ( 0.4607843 0.0000000 0.5000000), wk = 0.0026042 k( 229) = ( 0.4705882 0.0000000 0.5000000), wk = 0.0026042 k( 230) = ( 0.4803922 0.0000000 0.5000000), wk = 0.0026042 k( 231) = ( 0.4901961 0.0000000 0.5000000), wk = 0.0026042 k( 232) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0026042 k( 233) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0026042 k( 234) = ( 0.5000000 0.0161290 0.5000000), wk = 0.0026042 k( 235) = ( 0.5000000 0.0322581 0.5000000), wk = 0.0026042 k( 236) = ( 0.5000000 0.0483871 0.5000000), wk = 0.0026042 k( 237) = ( 0.5000000 0.0645161 0.5000000), wk = 0.0026042 k( 238) = ( 0.5000000 0.0806452 0.5000000), wk = 0.0026042 k( 239) = ( 0.5000000 0.0967742 0.5000000), wk = 0.0026042 k( 240) = ( 0.5000000 0.1129032 0.5000000), wk = 0.0026042 k( 241) = ( 0.5000000 0.1290323 0.5000000), wk = 0.0026042 k( 242) = ( 0.5000000 0.1451613 0.5000000), wk = 0.0026042 k( 243) = ( 0.5000000 0.1612903 0.5000000), wk = 0.0026042 k( 244) = ( 0.5000000 0.1774193 0.5000000), wk = 0.0026042 k( 245) = ( 0.5000000 0.1935484 0.5000000), wk = 0.0026042 k( 246) = ( 0.5000000 0.2096774 0.5000000), wk = 0.0026042 k( 247) = ( 0.5000000 0.2258064 0.5000000), wk = 0.0026042 k( 248) = ( 0.5000000 0.2419355 0.5000000), wk = 0.0026042 k( 249) = ( 0.5000000 0.2580645 0.5000000), wk = 0.0026042 k( 250) = ( 0.5000000 0.2741935 0.5000000), wk = 0.0026042 k( 251) = ( 0.5000000 0.2903226 0.5000000), wk = 0.0026042 k( 252) = ( 0.5000000 0.3064516 0.5000000), wk = 0.0026042 k( 253) = ( 0.5000000 0.3225807 0.5000000), wk = 0.0026042 k( 254) = ( 0.5000000 0.3387097 0.5000000), wk = 0.0026042 k( 255) = ( 0.5000000 0.3548387 0.5000000), wk = 0.0026042 k( 256) = ( 0.5000000 0.3709677 0.5000000), wk = 0.0026042 k( 257) = ( 0.5000000 0.3870968 0.5000000), wk = 0.0026042 k( 258) = ( 0.5000000 0.4032258 0.5000000), wk = 0.0026042 k( 259) = ( 0.5000000 0.4193548 0.5000000), wk = 0.0026042 k( 260) = ( 0.5000000 0.4354839 0.5000000), wk = 0.0026042 k( 261) = ( 0.5000000 0.4516129 0.5000000), wk = 0.0026042 k( 262) = ( 0.5000000 0.4677419 0.5000000), wk = 0.0026042 k( 263) = ( 0.5000000 0.4838710 0.5000000), wk = 0.0026042 k( 264) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026042 k( 265) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026042 k( 266) = ( 0.4901961 0.5000000 0.5000000), wk = 0.0026042 k( 267) = ( 0.4803922 0.5000000 0.5000000), wk = 0.0026042 k( 268) = ( 0.4705882 0.5000000 0.5000000), wk = 0.0026042 k( 269) = ( 0.4607843 0.5000000 0.5000000), wk = 0.0026042 k( 270) = ( 0.4509804 0.5000000 0.5000000), wk = 0.0026042 k( 271) = ( 0.4411765 0.5000000 0.5000000), wk = 0.0026042 k( 272) = ( 0.4313726 0.5000000 0.5000000), wk = 0.0026042 k( 273) = ( 0.4215686 0.5000000 0.5000000), wk = 0.0026042 k( 274) = ( 0.4117647 0.5000000 0.5000000), wk = 0.0026042 k( 275) = ( 0.4019608 0.5000000 0.5000000), wk = 0.0026042 k( 276) = ( 0.3921569 0.5000000 0.5000000), wk = 0.0026042 k( 277) = ( 0.3823529 0.5000000 0.5000000), wk = 0.0026042 k( 278) = ( 0.3725490 0.5000000 0.5000000), wk = 0.0026042 k( 279) = ( 0.3627451 0.5000000 0.5000000), wk = 0.0026042 k( 280) = ( 0.3529412 0.5000000 0.5000000), wk = 0.0026042 k( 281) = ( 0.3431373 0.5000000 0.5000000), wk = 0.0026042 k( 282) = ( 0.3333333 0.5000000 0.5000000), wk = 0.0026042 k( 283) = ( 0.3235294 0.5000000 0.5000000), wk = 0.0026042 k( 284) = ( 0.3137255 0.5000000 0.5000000), wk = 0.0026042 k( 285) = ( 0.3039216 0.5000000 0.5000000), wk = 0.0026042 k( 286) = ( 0.2941177 0.5000000 0.5000000), wk = 0.0026042 k( 287) = ( 0.2843137 0.5000000 0.5000000), wk = 0.0026042 k( 288) = ( 0.2745098 0.5000000 0.5000000), wk = 0.0026042 k( 289) = ( 0.2647059 0.5000000 0.5000000), wk = 0.0026042 k( 290) = ( 0.2549020 0.5000000 0.5000000), wk = 0.0026042 k( 291) = ( 0.2450980 0.5000000 0.5000000), wk = 0.0026042 k( 292) = ( 0.2352941 0.5000000 0.5000000), wk = 0.0026042 k( 293) = ( 0.2254902 0.5000000 0.5000000), wk = 0.0026042 k( 294) = ( 0.2156863 0.5000000 0.5000000), wk = 0.0026042 k( 295) = ( 0.2058823 0.5000000 0.5000000), wk = 0.0026042 k( 296) = ( 0.1960784 0.5000000 0.5000000), wk = 0.0026042 k( 297) = ( 0.1862745 0.5000000 0.5000000), wk = 0.0026042 k( 298) = ( 0.1764706 0.5000000 0.5000000), wk = 0.0026042 k( 299) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0026042 k( 300) = ( 0.1568627 0.5000000 0.5000000), wk = 0.0026042 k( 301) = ( 0.1470588 0.5000000 0.5000000), wk = 0.0026042 k( 302) = ( 0.1372549 0.5000000 0.5000000), wk = 0.0026042 k( 303) = ( 0.1274510 0.5000000 0.5000000), wk = 0.0026042 k( 304) = ( 0.1176471 0.5000000 0.5000000), wk = 0.0026042 k( 305) = ( 0.1078431 0.5000000 0.5000000), wk = 0.0026042 k( 306) = ( 0.0980392 0.5000000 0.5000000), wk = 0.0026042 k( 307) = ( 0.0882353 0.5000000 0.5000000), wk = 0.0026042 k( 308) = ( 0.0784314 0.5000000 0.5000000), wk = 0.0026042 k( 309) = ( 0.0686275 0.5000000 0.5000000), wk = 0.0026042 k( 310) = ( 0.0588235 0.5000000 0.5000000), wk = 0.0026042 k( 311) = ( 0.0490196 0.5000000 0.5000000), wk = 0.0026042 k( 312) = ( 0.0392157 0.5000000 0.5000000), wk = 0.0026042 k( 313) = ( 0.0294118 0.5000000 0.5000000), wk = 0.0026042 k( 314) = ( 0.0196078 0.5000000 0.5000000), wk = 0.0026042 k( 315) = ( 0.0098039 0.5000000 0.5000000), wk = 0.0026042 k( 316) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026042 k( 317) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026042 k( 318) = ( 0.0000000 0.4838710 0.5000000), wk = 0.0026042 k( 319) = ( 0.0000000 0.4677419 0.5000000), wk = 0.0026042 k( 320) = ( 0.0000000 0.4516129 0.5000000), wk = 0.0026042 k( 321) = ( 0.0000000 0.4354839 0.5000000), wk = 0.0026042 k( 322) = ( 0.0000000 0.4193548 0.5000000), wk = 0.0026042 k( 323) = ( 0.0000000 0.4032258 0.5000000), wk = 0.0026042 k( 324) = ( 0.0000000 0.3870968 0.5000000), wk = 0.0026042 k( 325) = ( 0.0000000 0.3709677 0.5000000), wk = 0.0026042 k( 326) = ( 0.0000000 0.3548387 0.5000000), wk = 0.0026042 k( 327) = ( 0.0000000 0.3387097 0.5000000), wk = 0.0026042 k( 328) = ( 0.0000000 0.3225807 0.5000000), wk = 0.0026042 k( 329) = ( 0.0000000 0.3064516 0.5000000), wk = 0.0026042 k( 330) = ( 0.0000000 0.2903226 0.5000000), wk = 0.0026042 k( 331) = ( 0.0000000 0.2741936 0.5000000), wk = 0.0026042 k( 332) = ( 0.0000000 0.2580645 0.5000000), wk = 0.0026042 k( 333) = ( 0.0000000 0.2419355 0.5000000), wk = 0.0026042 k( 334) = ( 0.0000000 0.2258064 0.5000000), wk = 0.0026042 k( 335) = ( 0.0000000 0.2096774 0.5000000), wk = 0.0026042 k( 336) = ( 0.0000000 0.1935484 0.5000000), wk = 0.0026042 k( 337) = ( 0.0000000 0.1774194 0.5000000), wk = 0.0026042 k( 338) = ( 0.0000000 0.1612903 0.5000000), wk = 0.0026042 k( 339) = ( 0.0000000 0.1451613 0.5000000), wk = 0.0026042 k( 340) = ( 0.0000000 0.1290323 0.5000000), wk = 0.0026042 k( 341) = ( 0.0000000 0.1129032 0.5000000), wk = 0.0026042 k( 342) = ( 0.0000000 0.0967742 0.5000000), wk = 0.0026042 k( 343) = ( 0.0000000 0.0806452 0.5000000), wk = 0.0026042 k( 344) = ( 0.0000000 0.0645161 0.5000000), wk = 0.0026042 k( 345) = ( 0.0000000 0.0483871 0.5000000), wk = 0.0026042 k( 346) = ( 0.0000000 0.0322581 0.5000000), wk = 0.0026042 k( 347) = ( 0.0000000 0.0161290 0.5000000), wk = 0.0026042 k( 348) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026042 k( 349) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026042 k( 350) = ( 0.0000000 0.5000000 0.0454546), wk = 0.0026042 k( 351) = ( 0.0000000 0.5000000 0.0909091), wk = 0.0026042 k( 352) = ( 0.0000000 0.5000000 0.1363636), wk = 0.0026042 k( 353) = ( 0.0000000 0.5000000 0.1818182), wk = 0.0026042 k( 354) = ( 0.0000000 0.5000000 0.2272727), wk = 0.0026042 k( 355) = ( 0.0000000 0.5000000 0.2727273), wk = 0.0026042 k( 356) = ( 0.0000000 0.5000000 0.3181818), wk = 0.0026042 k( 357) = ( 0.0000000 0.5000000 0.3636364), wk = 0.0026042 k( 358) = ( 0.0000000 0.5000000 0.4090909), wk = 0.0026042 k( 359) = ( 0.0000000 0.5000000 0.4545454), wk = 0.0026042 k( 360) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026042 k( 361) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0026042 k( 362) = ( 0.5000000 0.0000000 0.4545454), wk = 0.0026042 k( 363) = ( 0.5000000 0.0000000 0.4090909), wk = 0.0026042 k( 364) = ( 0.5000000 0.0000000 0.3636364), wk = 0.0026042 k( 365) = ( 0.5000000 0.0000000 0.3181818), wk = 0.0026042 k( 366) = ( 0.5000000 0.0000000 0.2727273), wk = 0.0026042 k( 367) = ( 0.5000000 0.0000000 0.2272727), wk = 0.0026042 k( 368) = ( 0.5000000 0.0000000 0.1818182), wk = 0.0026042 k( 369) = ( 0.5000000 0.0000000 0.1363636), wk = 0.0026042 k( 370) = ( 0.5000000 0.0000000 0.0909091), wk = 0.0026042 k( 371) = ( 0.5000000 0.0000000 0.0454545), wk = 0.0026042 k( 372) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0026042 k( 373) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026042 k( 374) = ( 0.5000000 0.5000000 0.0454545), wk = 0.0026042 k( 375) = ( 0.5000000 0.5000000 0.0909091), wk = 0.0026042 k( 376) = ( 0.5000000 0.5000000 0.1363636), wk = 0.0026042 k( 377) = ( 0.5000000 0.5000000 0.1818182), wk = 0.0026042 k( 378) = ( 0.5000000 0.5000000 0.2272727), wk = 0.0026042 k( 379) = ( 0.5000000 0.5000000 0.2727273), wk = 0.0026042 k( 380) = ( 0.5000000 0.5000000 0.3181818), wk = 0.0026042 k( 381) = ( 0.5000000 0.5000000 0.3636364), wk = 0.0026042 k( 382) = ( 0.5000000 0.5000000 0.4090909), wk = 0.0026042 k( 383) = ( 0.5000000 0.5000000 0.4545454), wk = 0.0026042 k( 384) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026042 Dense grid: 263925 G-vectors FFT dimensions: ( 40, 72, 200) Smooth grid: 100939 G-vectors FFT dimensions: ( 30, 48, 144) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.83 Mb ( 380, 144) NL pseudopotentials 1.58 Mb ( 190, 544) Each V/rho on FFT grid 0.13 Mb ( 8640) Each G-vector array 0.03 Mb ( 3665) G-vector shells 0.01 Mb ( 1847) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 3.34 Mb ( 380, 576) Each subspace H/S matrix 0.14 Mb ( 96, 96) Each matrix 2.39 Mb ( 544, 2, 144) The potential is recalculated from file : ./TcP3.save/charge-density.dat negative rho (up, down): 1.406E+02 0.000E+00 Starting wfc are 200 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 12.4 secs Computing kpt #: 2 total cpu time spent up to now is 21.4 secs Computing kpt #: 3 total cpu time spent up to now is 30.1 secs Computing kpt #: 4 total cpu time spent up to now is 38.5 secs Computing kpt #: 5 total cpu time spent up to now is 48.5 secs Computing kpt #: 6 total cpu time spent up to now is 57.7 secs Computing kpt #: 7 total cpu time spent up to now is 68.7 secs Computing kpt #: 8 total cpu time spent up to now is 79.4 secs Computing kpt #: 9 total cpu time spent up to now is 89.1 secs Computing kpt #: 10 total cpu time spent up to now is 99.3 secs Computing kpt #: 11 total cpu time spent up to now is 112.6 secs Computing kpt #: 12 total cpu time spent up to now is 126.9 secs Computing kpt #: 13 total cpu time spent up to now is 137.3 secs Computing kpt #: 14 total cpu time spent up to now is 148.2 secs Computing kpt #: 15 total cpu time spent up to now is 159.6 secs Computing kpt #: 16 total cpu time spent up to now is 169.8 secs Computing kpt #: 17 total cpu time spent up to now is 181.5 secs Computing kpt #: 18 total cpu time spent up to now is 192.3 secs Computing kpt #: 19 total cpu time spent up to now is 202.7 secs Computing kpt #: 20 total cpu time spent up to now is 210.8 secs Computing kpt #: 21 total cpu time spent up to now is 218.2 secs Computing kpt #: 22 total cpu time spent up to now is 225.3 secs Computing kpt #: 23 total cpu time spent up to now is 232.6 secs Computing kpt #: 24 total cpu time spent up to now is 240.6 secs Computing kpt #: 25 total cpu time spent up to now is 247.9 secs Computing kpt #: 26 total cpu time spent up to now is 255.4 secs Computing kpt #: 27 total cpu time spent up to now is 263.3 secs Computing kpt #: 28 total cpu time spent up to now is 271.4 secs Computing kpt #: 29 total cpu time spent up to now is 279.7 secs Computing kpt #: 30 total cpu time spent up to now is 287.3 secs Computing kpt #: 31 total cpu time spent up to now is 295.4 secs Computing kpt #: 32 total cpu time spent up to now is 303.2 secs Computing kpt #: 33 total cpu time spent up to now is 311.4 secs Computing kpt #: 34 total cpu time spent up to now is 319.2 secs Computing kpt #: 35 total cpu time spent up to now is 327.9 secs Computing kpt #: 36 total cpu time spent up to now is 336.9 secs Computing kpt #: 37 total cpu time spent up to now is 345.7 secs Computing kpt #: 38 total cpu time spent up to now is 354.0 secs Computing kpt #: 39 total cpu time spent up to now is 362.3 secs Computing kpt #: 40 total cpu time spent up to now is 370.3 secs Computing kpt #: 41 total cpu time spent up to now is 377.4 secs Computing kpt #: 42 total cpu time spent up to now is 384.6 secs Computing kpt #: 43 total cpu time spent up to now is 393.7 secs Computing kpt #: 44 total cpu time spent up to now is 402.3 secs Computing kpt #: 45 total cpu time spent up to now is 410.2 secs Computing kpt #: 46 total cpu time spent up to now is 417.8 secs Computing kpt #: 47 total cpu time spent up to now is 425.8 secs Computing kpt #: 48 total cpu time spent up to now is 434.1 secs Computing kpt #: 49 total cpu time spent up to now is 442.8 secs Computing kpt #: 50 total cpu time spent up to now is 452.0 secs Computing kpt #: 51 total cpu time spent up to now is 460.7 secs Computing kpt #: 52 total cpu time spent up to now is 468.4 secs Computing kpt #: 53 total cpu time spent up to now is 476.2 secs Computing kpt #: 54 total cpu time spent up to now is 484.1 secs Computing kpt #: 55 total cpu time spent up to now is 492.1 secs Computing kpt #: 56 total cpu time spent up to now is 499.8 secs Computing kpt #: 57 total cpu time spent up to now is 508.0 secs Computing kpt #: 58 total cpu time spent up to now is 516.5 secs Computing kpt #: 59 total cpu time spent up to now is 524.1 secs Computing kpt #: 60 total cpu time spent up to now is 531.6 secs Computing kpt #: 61 total cpu time spent up to now is 539.0 secs Computing kpt #: 62 total cpu time spent up to now is 546.9 secs Computing kpt #: 63 total cpu time spent up to now is 555.0 secs Computing kpt #: 64 total cpu time spent up to now is 562.6 secs Computing kpt #: 65 total cpu time spent up to now is 570.5 secs Computing kpt #: 66 total cpu time spent up to now is 578.4 secs Computing kpt #: 67 total cpu time spent up to now is 585.4 secs Computing kpt #: 68 total cpu time spent up to now is 592.7 secs Computing kpt #: 69 total cpu time spent up to now is 601.0 secs Computing kpt #: 70 total cpu time spent up to now is 608.9 secs Computing kpt #: 71 total cpu time spent up to now is 617.6 secs Computing kpt #: 72 total cpu time spent up to now is 625.9 secs Computing kpt #: 73 total cpu time spent up to now is 633.4 secs Computing kpt #: 74 total cpu time spent up to now is 641.7 secs Computing kpt #: 75 total cpu time spent up to now is 650.8 secs Computing kpt #: 76 total cpu time spent up to now is 658.8 secs Computing kpt #: 77 total cpu time spent up to now is 666.2 secs Computing kpt #: 78 total cpu time spent up to now is 675.9 secs Computing kpt #: 79 total cpu time spent up to now is 685.0 secs Computing kpt #: 80 total cpu time spent up to now is 693.8 secs Computing kpt #: 81 total cpu time spent up to now is 701.9 secs Computing kpt #: 82 total cpu time spent up to now is 710.2 secs Computing kpt #: 83 total cpu time spent up to now is 718.5 secs Computing kpt #: 84 total cpu time spent up to now is 726.9 secs Computing kpt #: 85 total cpu time spent up to now is 734.2 secs Computing kpt #: 86 total cpu time spent up to now is 742.0 secs Computing kpt #: 87 total cpu time spent up to now is 750.3 secs Computing kpt #: 88 total cpu time spent up to now is 758.6 secs Computing kpt #: 89 total cpu time spent up to now is 766.3 secs Computing kpt #: 90 total cpu time spent up to now is 774.2 secs Computing kpt #: 91 total cpu time spent up to now is 782.6 secs Computing kpt #: 92 total cpu time spent up to now is 790.8 secs Computing kpt #: 93 total cpu time spent up to now is 799.6 secs Computing kpt #: 94 total cpu time spent up to now is 808.0 secs Computing kpt #: 95 total cpu time spent up to now is 817.3 secs Computing kpt #: 96 total cpu time spent up to now is 827.1 secs Computing kpt #: 97 total cpu time spent up to now is 836.6 secs Computing kpt #: 98 total cpu time spent up to now is 846.0 secs Computing kpt #: 99 total cpu time spent up to now is 855.1 secs Computing kpt #: 100 total cpu time spent up to now is 864.5 secs Computing kpt #: 101 total cpu time spent up to now is 874.2 secs Computing kpt #: 102 total cpu time spent up to now is 885.8 secs Computing kpt #: 103 total cpu time spent up to now is 895.7 secs Computing kpt #: 104 total cpu time spent up to now is 905.0 secs Computing kpt #: 105 total cpu time spent up to now is 912.7 secs Computing kpt #: 106 total cpu time spent up to now is 921.3 secs Computing kpt #: 107 total cpu time spent up to now is 929.7 secs Computing kpt #: 108 total cpu time spent up to now is 937.9 secs Computing kpt #: 109 total cpu time spent up to now is 947.4 secs Computing kpt #: 110 total cpu time spent up to now is 956.0 secs Computing kpt #: 111 total cpu time spent up to now is 964.2 secs Computing kpt #: 112 total cpu time spent up to now is 972.6 secs Computing kpt #: 113 total cpu time spent up to now is 980.8 secs Computing kpt #: 114 total cpu time spent up to now is 988.8 secs Computing kpt #: 115 total cpu time spent up to now is 996.9 secs Computing kpt #: 116 total cpu time spent up to now is 1005.8 secs Computing kpt #: 117 total cpu time spent up to now is 1014.2 secs Computing kpt #: 118 total cpu time spent up to now is 1022.3 secs Computing kpt #: 119 total cpu time spent up to now is 1029.8 secs Computing kpt #: 120 total cpu time spent up to now is 1037.3 secs Computing kpt #: 121 total cpu time spent up to now is 1044.6 secs Computing kpt #: 122 total cpu time spent up to now is 1051.6 secs Computing kpt #: 123 total cpu time spent up to now is 1058.5 secs Computing kpt #: 124 total cpu time spent up to now is 1066.7 secs Computing kpt #: 125 total cpu time spent up to now is 1074.8 secs Computing kpt #: 126 total cpu time spent up to now is 1082.9 secs Computing kpt #: 127 total cpu time spent up to now is 1091.0 secs Computing kpt #: 128 total cpu time spent up to now is 1100.1 secs Computing kpt #: 129 total cpu time spent up to now is 1109.0 secs Computing kpt #: 130 total cpu time spent up to now is 1117.1 secs Computing kpt #: 131 total cpu time spent up to now is 1125.3 secs Computing kpt #: 132 total cpu time spent up to now is 1133.4 secs Computing kpt #: 133 total cpu time spent up to now is 1141.8 secs Computing kpt #: 134 total cpu time spent up to now is 1149.6 secs Computing kpt #: 135 total cpu time spent up to now is 1158.2 secs Computing kpt #: 136 total cpu time spent up to now is 1166.5 secs Computing kpt #: 137 total cpu time spent up to now is 1175.4 secs Computing kpt #: 138 total cpu time spent up to now is 1184.2 secs Computing kpt #: 139 total cpu time spent up to now is 1192.5 secs Computing kpt #: 140 total cpu time spent up to now is 1201.3 secs Computing kpt #: 141 total cpu time spent up to now is 1211.5 secs Computing kpt #: 142 total cpu time spent up to now is 1221.4 secs Computing kpt #: 143 total cpu time spent up to now is 1231.5 secs Computing kpt #: 144 total cpu time spent up to now is 1243.8 secs Computing kpt #: 145 total cpu time spent up to now is 1255.2 secs Computing kpt #: 146 total cpu time spent up to now is 1268.4 secs Computing kpt #: 147 total cpu time spent up to now is 1281.7 secs Computing kpt #: 148 total cpu time spent up to now is 1292.6 secs Computing kpt #: 149 total cpu time spent up to now is 1301.9 secs Computing kpt #: 150 total cpu time spent up to now is 1311.1 secs Computing kpt #: 151 total cpu time spent up to now is 1319.9 secs Computing kpt #: 152 total cpu time spent up to now is 1328.9 secs Computing kpt #: 153 total cpu time spent up to now is 1337.9 secs Computing kpt #: 154 total cpu time spent up to now is 1346.4 secs Computing kpt #: 155 total cpu time spent up to now is 1354.5 secs Computing kpt #: 156 total cpu time spent up to now is 1362.5 secs Computing kpt #: 157 total cpu time spent up to now is 1370.7 secs Computing kpt #: 158 total cpu time spent up to now is 1378.8 secs Computing kpt #: 159 total cpu time spent up to now is 1386.9 secs Computing kpt #: 160 total cpu time spent up to now is 1394.6 secs Computing kpt #: 161 total cpu time spent up to now is 1402.8 secs Computing kpt #: 162 total cpu time spent up to now is 1410.2 secs Computing kpt #: 163 total cpu time spent up to now is 1417.8 secs Computing kpt #: 164 total cpu time spent up to now is 1426.6 secs Computing kpt #: 165 total cpu time spent up to now is 1435.1 secs Computing kpt #: 166 total cpu time spent up to now is 1444.0 secs Computing kpt #: 167 total cpu time spent up to now is 1453.3 secs Computing kpt #: 168 total cpu time spent up to now is 1461.3 secs Computing kpt #: 169 total cpu time spent up to now is 1469.4 secs Computing kpt #: 170 total cpu time spent up to now is 1478.7 secs Computing kpt #: 171 total cpu time spent up to now is 1487.9 secs Computing kpt #: 172 total cpu time spent up to now is 1496.5 secs Computing kpt #: 173 total cpu time spent up to now is 1504.5 secs Computing kpt #: 174 total cpu time spent up to now is 1511.8 secs Computing kpt #: 175 total cpu time spent up to now is 1519.8 secs Computing kpt #: 176 total cpu time spent up to now is 1527.9 secs Computing kpt #: 177 total cpu time spent up to now is 1535.8 secs Computing kpt #: 178 total cpu time spent up to now is 1544.0 secs Computing kpt #: 179 total cpu time spent up to now is 1551.9 secs Computing kpt #: 180 total cpu time spent up to now is 1559.8 secs Computing kpt #: 181 total cpu time spent up to now is 1567.4 secs Computing kpt #: 182 total cpu time spent up to now is 1575.5 secs Computing kpt #: 183 total cpu time spent up to now is 1583.9 secs Computing kpt #: 184 total cpu time spent up to now is 1592.3 secs Computing kpt #: 185 total cpu time spent up to now is 1600.6 secs Computing kpt #: 186 total cpu time spent up to now is 1608.9 secs Computing kpt #: 187 total cpu time spent up to now is 1617.2 secs Computing kpt #: 188 total cpu time spent up to now is 1625.7 secs Computing kpt #: 189 total cpu time spent up to now is 1634.3 secs Computing kpt #: 190 total cpu time spent up to now is 1643.2 secs Computing kpt #: 191 total cpu time spent up to now is 1652.4 secs Computing kpt #: 192 total cpu time spent up to now is 1662.3 secs Computing kpt #: 193 total cpu time spent up to now is 1671.7 secs Computing kpt #: 194 total cpu time spent up to now is 1680.5 secs Computing kpt #: 195 total cpu time spent up to now is 1690.2 secs Computing kpt #: 196 total cpu time spent up to now is 1698.8 secs Computing kpt #: 197 total cpu time spent up to now is 1707.0 secs Computing kpt #: 198 total cpu time spent up to now is 1715.4 secs Computing kpt #: 199 total cpu time spent up to now is 1724.5 secs Computing kpt #: 200 total cpu time spent up to now is 1732.6 secs Computing kpt #: 201 total cpu time spent up to now is 1741.5 secs Computing kpt #: 202 total cpu time spent up to now is 1751.6 secs Computing kpt #: 203 total cpu time spent up to now is 1760.4 secs Computing kpt #: 204 total cpu time spent up to now is 1768.5 secs Computing kpt #: 205 total cpu time spent up to now is 1776.8 secs Computing kpt #: 206 total cpu time spent up to now is 1784.0 secs Computing kpt #: 207 total cpu time spent up to now is 1792.0 secs Computing kpt #: 208 total cpu time spent up to now is 1799.5 secs Computing kpt #: 209 total cpu time spent up to now is 1807.0 secs Computing kpt #: 210 total cpu time spent up to now is 1813.8 secs Computing kpt #: 211 total cpu time spent up to now is 1820.7 secs Computing kpt #: 212 total cpu time spent up to now is 1827.7 secs Computing kpt #: 213 total cpu time spent up to now is 1834.6 secs Computing kpt #: 214 total cpu time spent up to now is 1841.1 secs Computing kpt #: 215 total cpu time spent up to now is 1848.2 secs Computing kpt #: 216 total cpu time spent up to now is 1855.0 secs Computing kpt #: 217 total cpu time spent up to now is 1861.6 secs Computing kpt #: 218 total cpu time spent up to now is 1868.0 secs Computing kpt #: 219 total cpu time spent up to now is 1874.8 secs Computing kpt #: 220 total cpu time spent up to now is 1881.0 secs Computing kpt #: 221 total cpu time spent up to now is 1887.7 secs Computing kpt #: 222 total cpu time spent up to now is 1893.9 secs Computing kpt #: 223 total cpu time spent up to now is 1900.3 secs Computing kpt #: 224 total cpu time spent up to now is 1906.9 secs Computing kpt #: 225 total cpu time spent up to now is 1913.4 secs Computing kpt #: 226 total cpu time spent up to now is 1920.0 secs Computing kpt #: 227 total cpu time spent up to now is 1926.5 secs Computing kpt #: 228 total cpu time spent up to now is 1932.7 secs Computing kpt #: 229 total cpu time spent up to now is 1939.0 secs Computing kpt #: 230 total cpu time spent up to now is 1945.8 secs Computing kpt #: 231 total cpu time spent up to now is 1952.3 secs Computing kpt #: 232 total cpu time spent up to now is 1959.1 secs Computing kpt #: 233 total cpu time spent up to now is 1965.7 secs Computing kpt #: 234 total cpu time spent up to now is 1972.3 secs Computing kpt #: 235 total cpu time spent up to now is 1979.0 secs Computing kpt #: 236 total cpu time spent up to now is 1986.7 secs Computing kpt #: 237 total cpu time spent up to now is 1993.1 secs Computing kpt #: 238 total cpu time spent up to now is 1999.6 secs Computing kpt #: 239 total cpu time spent up to now is 2006.5 secs Computing kpt #: 240 total cpu time spent up to now is 2014.0 secs Computing kpt #: 241 total cpu time spent up to now is 2020.9 secs Computing kpt #: 242 total cpu time spent up to now is 2028.1 secs Computing kpt #: 243 total cpu time spent up to now is 2034.4 secs Computing kpt #: 244 total cpu time spent up to now is 2041.2 secs Computing kpt #: 245 total cpu time spent up to now is 2047.5 secs Computing kpt #: 246 total cpu time spent up to now is 2054.6 secs Computing kpt #: 247 total cpu time spent up to now is 2061.5 secs Computing kpt #: 248 total cpu time spent up to now is 2068.2 secs Computing kpt #: 249 total cpu time spent up to now is 2074.8 secs Computing kpt #: 250 total cpu time spent up to now is 2081.3 secs Computing kpt #: 251 total cpu time spent up to now is 2087.9 secs Computing kpt #: 252 total cpu time spent up to now is 2094.7 secs Computing kpt #: 253 total cpu time spent up to now is 2101.4 secs Computing kpt #: 254 total cpu time spent up to now is 2108.4 secs Computing kpt #: 255 total cpu time spent up to now is 2115.3 secs Computing kpt #: 256 total cpu time spent up to now is 2122.2 secs Computing kpt #: 257 total cpu time spent up to now is 2129.0 secs Computing kpt #: 258 total cpu time spent up to now is 2136.3 secs Computing kpt #: 259 total cpu time spent up to now is 2143.0 secs Computing kpt #: 260 total cpu time spent up to now is 2150.1 secs Computing kpt #: 261 total cpu time spent up to now is 2156.7 secs Computing kpt #: 262 total cpu time spent up to now is 2163.6 secs Computing kpt #: 263 total cpu time spent up to now is 2170.0 secs Computing kpt #: 264 total cpu time spent up to now is 2176.3 secs Computing kpt #: 265 total cpu time spent up to now is 2182.9 secs Computing kpt #: 266 total cpu time spent up to now is 2189.1 secs Computing kpt #: 267 total cpu time spent up to now is 2195.4 secs Computing kpt #: 268 total cpu time spent up to now is 2201.9 secs Computing kpt #: 269 total cpu time spent up to now is 2208.9 secs Computing kpt #: 270 total cpu time spent up to now is 2216.4 secs Computing kpt #: 271 total cpu time spent up to now is 2223.5 secs Computing kpt #: 272 total cpu time spent up to now is 2231.2 secs Computing kpt #: 273 total cpu time spent up to now is 2238.8 secs Computing kpt #: 274 total cpu time spent up to now is 2245.7 secs Computing kpt #: 275 total cpu time spent up to now is 2252.8 secs Computing kpt #: 276 total cpu time spent up to now is 2260.6 secs Computing kpt #: 277 total cpu time spent up to now is 2268.2 secs Computing kpt #: 278 total cpu time spent up to now is 2278.0 secs Computing kpt #: 279 total cpu time spent up to now is 2285.4 secs Computing kpt #: 280 total cpu time spent up to now is 2292.8 secs Computing kpt #: 281 total cpu time spent up to now is 2300.0 secs Computing kpt #: 282 total cpu time spent up to now is 2307.7 secs Computing kpt #: 283 total cpu time spent up to now is 2316.1 secs Computing kpt #: 284 total cpu time spent up to now is 2324.4 secs Computing kpt #: 285 total cpu time spent up to now is 2332.0 secs Computing kpt #: 286 total cpu time spent up to now is 2340.3 secs Computing kpt #: 287 total cpu time spent up to now is 2347.9 secs Computing kpt #: 288 total cpu time spent up to now is 2355.6 secs Computing kpt #: 289 total cpu time spent up to now is 2362.7 secs Computing kpt #: 290 total cpu time spent up to now is 2370.9 secs Computing kpt #: 291 total cpu time spent up to now is 2378.9 secs Computing kpt #: 292 total cpu time spent up to now is 2385.8 secs Computing kpt #: 293 total cpu time spent up to now is 2392.8 secs Computing kpt #: 294 total cpu time spent up to now is 2399.3 secs Computing kpt #: 295 total cpu time spent up to now is 2405.6 secs Computing kpt #: 296 total cpu time spent up to now is 2412.2 secs Computing kpt #: 297 total cpu time spent up to now is 2418.6 secs Computing kpt #: 298 total cpu time spent up to now is 2425.2 secs Computing kpt #: 299 total cpu time spent up to now is 2431.8 secs Computing kpt #: 300 total cpu time spent up to now is 2438.2 secs Computing kpt #: 301 total cpu time spent up to now is 2445.3 secs Computing kpt #: 302 total cpu time spent up to now is 2452.4 secs Computing kpt #: 303 total cpu time spent up to now is 2459.9 secs Computing kpt #: 304 total cpu time spent up to now is 2467.2 secs Computing kpt #: 305 total cpu time spent up to now is 2474.8 secs Computing kpt #: 306 total cpu time spent up to now is 2482.9 secs Computing kpt #: 307 total cpu time spent up to now is 2492.0 secs Computing kpt #: 308 total cpu time spent up to now is 2505.2 secs Computing kpt #: 309 total cpu time spent up to now is 2517.3 secs Computing kpt #: 310 total cpu time spent up to now is 2528.8 secs Computing kpt #: 311 total cpu time spent up to now is 2538.3 secs Computing kpt #: 312 total cpu time spent up to now is 2549.7 secs Computing kpt #: 313 total cpu time spent up to now is 2560.5 secs Computing kpt #: 314 total cpu time spent up to now is 2571.3 secs Computing kpt #: 315 total cpu time spent up to now is 2581.8 secs Computing kpt #: 316 total cpu time spent up to now is 2592.3 secs Computing kpt #: 317 total cpu time spent up to now is 2600.9 secs Computing kpt #: 318 total cpu time spent up to now is 2610.2 secs Computing kpt #: 319 total cpu time spent up to now is 2619.4 secs Computing kpt #: 320 total cpu time spent up to now is 2628.0 secs Computing kpt #: 321 total cpu time spent up to now is 2635.8 secs Computing kpt #: 322 total cpu time spent up to now is 2643.6 secs Computing kpt #: 323 total cpu time spent up to now is 2651.3 secs Computing kpt #: 324 total cpu time spent up to now is 2659.8 secs Computing kpt #: 325 total cpu time spent up to now is 2666.6 secs Computing kpt #: 326 total cpu time spent up to now is 2674.2 secs Computing kpt #: 327 total cpu time spent up to now is 2681.7 secs Computing kpt #: 328 total cpu time spent up to now is 2688.7 secs Computing kpt #: 329 total cpu time spent up to now is 2695.8 secs Computing kpt #: 330 total cpu time spent up to now is 2702.8 secs Computing kpt #: 331 total cpu time spent up to now is 2711.1 secs Computing kpt #: 332 total cpu time spent up to now is 2719.3 secs Computing kpt #: 333 total cpu time spent up to now is 2727.7 secs Computing kpt #: 334 total cpu time spent up to now is 2735.8 secs Computing kpt #: 335 total cpu time spent up to now is 2745.0 secs Computing kpt #: 336 total cpu time spent up to now is 2752.5 secs Computing kpt #: 337 total cpu time spent up to now is 2760.4 secs Computing kpt #: 338 total cpu time spent up to now is 2770.1 secs Computing kpt #: 339 total cpu time spent up to now is 2778.7 secs Computing kpt #: 340 total cpu time spent up to now is 2786.8 secs Computing kpt #: 341 total cpu time spent up to now is 2794.3 secs Computing kpt #: 342 total cpu time spent up to now is 2802.8 secs Computing kpt #: 343 total cpu time spent up to now is 2811.1 secs Computing kpt #: 344 total cpu time spent up to now is 2819.9 secs Computing kpt #: 345 total cpu time spent up to now is 2827.9 secs Computing kpt #: 346 total cpu time spent up to now is 2836.3 secs Computing kpt #: 347 total cpu time spent up to now is 2844.2 secs Computing kpt #: 348 total cpu time spent up to now is 2852.1 secs Computing kpt #: 349 total cpu time spent up to now is 2859.8 secs Computing kpt #: 350 total cpu time spent up to now is 2867.5 secs Computing kpt #: 351 total cpu time spent up to now is 2875.6 secs Computing kpt #: 352 total cpu time spent up to now is 2883.1 secs Computing kpt #: 353 total cpu time spent up to now is 2891.3 secs Computing kpt #: 354 total cpu time spent up to now is 2899.3 secs Computing kpt #: 355 total cpu time spent up to now is 2907.4 secs Computing kpt #: 356 total cpu time spent up to now is 2915.4 secs Computing kpt #: 357 total cpu time spent up to now is 2923.5 secs Computing kpt #: 358 total cpu time spent up to now is 2932.4 secs Computing kpt #: 359 total cpu time spent up to now is 2941.4 secs Computing kpt #: 360 total cpu time spent up to now is 2950.2 secs Computing kpt #: 361 total cpu time spent up to now is 2957.0 secs Computing kpt #: 362 total cpu time spent up to now is 2963.5 secs Computing kpt #: 363 total cpu time spent up to now is 2970.7 secs Computing kpt #: 364 total cpu time spent up to now is 2977.9 secs Computing kpt #: 365 total cpu time spent up to now is 2985.2 secs Computing kpt #: 366 total cpu time spent up to now is 2992.9 secs Computing kpt #: 367 total cpu time spent up to now is 3000.9 secs Computing kpt #: 368 total cpu time spent up to now is 3008.1 secs Computing kpt #: 369 total cpu time spent up to now is 3015.2 secs Computing kpt #: 370 total cpu time spent up to now is 3023.8 secs Computing kpt #: 371 total cpu time spent up to now is 3031.9 secs Computing kpt #: 372 total cpu time spent up to now is 3039.2 secs Computing kpt #: 373 total cpu time spent up to now is 3047.1 secs Computing kpt #: 374 total cpu time spent up to now is 3055.2 secs Computing kpt #: 375 total cpu time spent up to now is 3062.9 secs Computing kpt #: 376 total cpu time spent up to now is 3070.4 secs Computing kpt #: 377 total cpu time spent up to now is 3078.0 secs Computing kpt #: 378 total cpu time spent up to now is 3085.6 secs Computing kpt #: 379 total cpu time spent up to now is 3092.4 secs Computing kpt #: 380 total cpu time spent up to now is 3100.3 secs Computing kpt #: 381 total cpu time spent up to now is 3107.6 secs Computing kpt #: 382 total cpu time spent up to now is 3114.9 secs Computing kpt #: 383 total cpu time spent up to now is 3123.2 secs Computing kpt #: 384 total cpu time spent up to now is 3131.7 secs ethr = 8.33E-09, avg # of iterations = 35.1 total cpu time spent up to now is 3131.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 12591 PWs) bands (ev): ************************************************************************ -786.7415-786.7415-785.4461-785.4461-785.3301-785.3301-784.9283-784.9283 -101.9574-101.9574-101.9011-101.9011-101.8681-101.8681-101.8540-101.8540 -59.5526 -59.5526 -59.5037 -59.5037 -59.4791 -59.4791 -59.4734 -59.4734 -56.6503 -56.6503 -56.6492 -56.6492 -56.6484 -56.6484 -56.6472 -56.6472 -24.4226 -24.4226 -24.4224 -24.4224 -24.4179 -24.4179 -24.4166 -24.4166 -11.8029 -11.8029 -11.7577 -11.7577 -10.1636 -10.1636 -10.0356 -10.0356 -7.5850 -7.5850 -7.4032 -7.4032 -6.9895 -6.9895 -6.8801 -6.8801 -4.7036 -4.7036 -4.6528 -4.6528 -4.4067 -4.4067 -4.2560 -4.2560 -3.7999 -3.7999 -3.6392 -3.6392 -2.1056 -2.1056 -1.2343 -1.2343 -1.1754 -1.1754 -0.7490 -0.7490 -0.3371 -0.3371 -0.2171 -0.2171 -0.0117 -0.0117 0.1818 0.1818 0.2292 0.2292 0.4770 0.4770 0.7199 0.7199 1.0422 1.0422 1.2078 1.2078 1.4587 1.4587 1.6357 1.6357 1.8008 1.8008 2.4054 2.4054 3.0282 3.0282 3.3015 3.3015 4.2385 4.2385 4.8122 4.8122 5.2427 5.2427 5.7337 5.7337 5.7454 5.7454 5.7878 5.7878 5.8738 5.8738 5.9020 5.9020 6.3526 6.3526 6.4201 6.4201 6.6469 6.6469 6.7352 6.7352 7.0198 7.0198 7.2051 7.2051 7.2826 7.2826 k = 0.0098-0.0000-0.0000 ( 12581 PWs) bands (ev): ************************************************************************ -786.5655-786.5655-785.4003-785.4003-785.1428-785.1428-784.7495-784.7495 -101.9430-101.9430-101.8824-101.8824-101.8628-101.8628-101.8042-101.8042 -59.5423 -59.5423 -59.5027 -59.5027 -59.4714 -59.4714 -59.4678 -59.4678 -56.6501 -56.6501 -56.6493 -56.6493 -56.6478 -56.6478 -56.6471 -56.6471 -24.4230 -24.4230 -24.4221 -24.4221 -24.4179 -24.4179 -24.4159 -24.4159 -11.8016 -11.8016 -11.7563 -11.7563 -10.1624 -10.1624 -10.0344 -10.0344 -7.5842 -7.5842 -7.4023 -7.4023 -6.9888 -6.9888 -6.8792 -6.8792 -4.7023 -4.7023 -4.6516 -4.6516 -4.4057 -4.4057 -4.2551 -4.2551 -3.7989 -3.7989 -3.6385 -3.6385 -2.1049 -2.1049 -1.2344 -1.2344 -1.1745 -1.1745 -0.7490 -0.7490 -0.3449 -0.3449 -0.2178 -0.2178 -0.0124 -0.0124 0.1803 0.1803 0.2269 0.2269 0.4753 0.4753 0.7196 0.7196 1.0418 1.0418 1.2009 1.2009 1.4596 1.4596 1.6280 1.6280 1.8015 1.8015 2.4070 2.4070 3.0293 3.0293 3.3028 3.3028 4.2376 4.2376 4.8026 4.8026 5.2335 5.2335 5.7402 5.7402 5.7488 5.7488 5.8013 5.8013 5.8648 5.8648 5.8904 5.8904 6.3471 6.3471 6.4041 6.4041 6.6594 6.6594 6.7393 6.7393 7.0131 7.0131 7.2107 7.2107 7.2879 7.2879 k = 0.0196-0.0000-0.0000 ( 12577 PWs) bands (ev): ************************************************************************ -786.4257-786.4257-785.4261-785.4261-785.1652-785.1652-784.5269-784.5269 -101.9391-101.9391-101.8717-101.8717-101.8551-101.8551-101.7687-101.7687 -59.5395 -59.5395 -59.5014 -59.5014 -59.4790 -59.4790 -59.4706 -59.4706 -56.6499 -56.6499 -56.6496 -56.6496 -56.6477 -56.6477 -56.6466 -56.6466 -24.4233 -24.4233 -24.4224 -24.4224 -24.4188 -24.4188 -24.4164 -24.4164 -11.7976 -11.7976 -11.7523 -11.7523 -10.1588 -10.1588 -10.0309 -10.0309 -7.5820 -7.5820 -7.3998 -7.3998 -6.9864 -6.9864 -6.8765 -6.8765 -4.6988 -4.6988 -4.6483 -4.6483 -4.4026 -4.4026 -4.2528 -4.2528 -3.7957 -3.7957 -3.6360 -3.6360 -2.1030 -2.1030 -1.2352 -1.2352 -1.1721 -1.1721 -0.7491 -0.7491 -0.3670 -0.3670 -0.2227 -0.2227 -0.0153 -0.0153 0.1750 0.1750 0.2207 0.2207 0.4692 0.4692 0.7184 0.7184 1.0401 1.0401 1.1813 1.1813 1.4619 1.4619 1.6057 1.6057 1.8038 1.8038 2.4118 2.4118 3.0324 3.0324 3.3067 3.3067 4.2340 4.2340 4.7745 4.7745 5.2077 5.2077 5.7289 5.7289 5.7676 5.7676 5.8283 5.8283 5.8593 5.8593 5.8697 5.8697 6.3292 6.3292 6.3636 6.3636 6.6874 6.6874 6.7521 6.7521 6.9971 6.9971 7.2271 7.2271 7.3033 7.3033 k = 0.0294-0.0000-0.0000 ( 12569 PWs) bands (ev): ************************************************************************ -786.3218-786.3218-785.3277-785.3277-785.1632-785.1632-784.3934-784.3934 -101.9330-101.9330-101.8552-101.8552-101.8155-101.8155-101.7626-101.7626 -59.5327 -59.5327 -59.4890 -59.4890 -59.4705 -59.4705 -59.4692 -59.4692 -56.6496 -56.6496 -56.6488 -56.6488 -56.6474 -56.6474 -56.6461 -56.6461 -24.4237 -24.4237 -24.4227 -24.4227 -24.4194 -24.4194 -24.4170 -24.4170 -11.7909 -11.7909 -11.7456 -11.7456 -10.1529 -10.1529 -10.0249 -10.0249 -7.5782 -7.5782 -7.3958 -7.3958 -6.9826 -6.9826 -6.8718 -6.8718 -4.6929 -4.6929 -4.6427 -4.6427 -4.3974 -4.3974 -4.2487 -4.2487 -3.7904 -3.7904 -3.6320 -3.6320 -2.0998 -2.0998 -1.2364 -1.2364 -1.1682 -1.1682 -0.7497 -0.7497 -0.3991 -0.3991 -0.2350 -0.2350 -0.0231 -0.0231 0.1658 0.1658 0.2130 0.2130 0.4587 0.4587 0.7161 0.7161 1.0348 1.0348 1.1542 1.1542 1.4650 1.4650 1.5711 1.5711 1.8077 1.8077 2.4196 2.4196 3.0373 3.0373 3.3132 3.3132 4.2275 4.2275 4.7298 4.7298 5.1693 5.1693 5.6911 5.6911 5.7394 5.7394 5.8065 5.8065 5.9089 5.9089 5.9220 5.9220 6.2920 6.2920 6.3138 6.3138 6.7150 6.7150 6.7761 6.7761 6.9806 6.9806 7.2540 7.2540 7.3284 7.3284 k = 0.0392-0.0000-0.0000 ( 12563 PWs) bands (ev): ************************************************************************ -786.2654-786.2654-785.3114-785.3114-784.8396-784.8396-784.4666-784.4666 -101.9317-101.9317-101.8629-101.8629-101.7704-101.7704-101.7284-101.7284 -59.5369 -59.5369 -59.4920 -59.4920 -59.4667 -59.4667 -59.4625 -59.4625 -56.6495 -56.6495 -56.6488 -56.6488 -56.6471 -56.6471 -56.6455 -56.6455 -24.4249 -24.4249 -24.4237 -24.4237 -24.4201 -24.4201 -24.4184 -24.4184 -11.7815 -11.7815 -11.7362 -11.7362 -10.1446 -10.1446 -10.0167 -10.0167 -7.5729 -7.5729 -7.3901 -7.3901 -6.9772 -6.9772 -6.8654 -6.8654 -4.6846 -4.6846 -4.6350 -4.6350 -4.3902 -4.3902 -4.2431 -4.2431 -3.7831 -3.7831 -3.6263 -3.6263 -2.0955 -2.0955 -1.2381 -1.2381 -1.1629 -1.1629 -0.7514 -0.7514 -0.4383 -0.4383 -0.2571 -0.2571 -0.0399 -0.0399 0.1514 0.1514 0.2076 0.2076 0.4435 0.4435 0.7117 0.7117 1.0210 1.0210 1.1285 1.1285 1.4670 1.4670 1.5288 1.5288 1.8131 1.8131 2.4301 2.4301 3.0441 3.0441 3.3220 3.3220 4.2168 4.2168 4.6715 4.6715 5.1214 5.1214 5.6146 5.6146 5.6736 5.6736 5.7850 5.7850 5.9969 5.9969 6.0177 6.0177 6.2289 6.2289 6.2657 6.2657 6.7342 6.7342 6.8112 6.8112 6.9705 6.9705 7.2898 7.2898 7.3621 7.3621 k = 0.0490-0.0000-0.0000 ( 12567 PWs) bands (ev): ************************************************************************ -786.2810-786.2810-785.3594-785.3594-784.8932-784.8932-784.7108-784.7108 -101.9361-101.9361-101.8802-101.8802-101.7546-101.7546-101.7231-101.7231 -59.5448 -59.5448 -59.5063 -59.5063 -59.4759 -59.4759 -59.4594 -59.4594 -56.6495 -56.6495 -56.6490 -56.6490 -56.6467 -56.6467 -56.6457 -56.6457 -24.4268 -24.4268 -24.4255 -24.4255 -24.4220 -24.4220 -24.4196 -24.4196 -11.7695 -11.7695 -11.7242 -11.7242 -10.1341 -10.1341 -10.0062 -10.0062 -7.5662 -7.5662 -7.3831 -7.3831 -6.9704 -6.9704 -6.8573 -6.8573 -4.6743 -4.6743 -4.6251 -4.6251 -4.3810 -4.3810 -4.2360 -4.2360 -3.7738 -3.7738 -3.6192 -3.6192 -2.0900 -2.0900 -1.2405 -1.2405 -1.1563 -1.1563 -0.7554 -0.7554 -0.4820 -0.4820 -0.2898 -0.2898 -0.0711 -0.0711 0.1306 0.1306 0.2075 0.2075 0.4236 0.4236 0.7042 0.7042 0.9941 0.9941 1.1139 1.1139 1.4547 1.4547 1.4946 1.4946 1.8201 1.8201 2.4429 2.4429 3.0526 3.0526 3.3330 3.3330 4.2010 4.2010 4.6027 4.6027 5.0661 5.0661 5.5113 5.5113 5.5885 5.5885 5.7712 5.7712 6.0965 6.0965 6.1257 6.1257 6.1683 6.1683 6.2150 6.2150 6.7482 6.7482 6.8501 6.8501 6.9702 6.9702 7.3326 7.3326 7.4025 7.4025 k = 0.0588-0.0000-0.0000 ( 12571 PWs) bands (ev): ************************************************************************ -786.2186-786.2186-785.4209-785.4209-785.0010-785.0010-784.7371-784.7371 -101.9392-101.9392-101.9048-101.9048-101.7615-101.7615-101.7337-101.7337 -59.5415 -59.5415 -59.5092 -59.5092 -59.4809 -59.4809 -59.4636 -59.4636 -56.6495 -56.6495 -56.6490 -56.6490 -56.6464 -56.6464 -56.6457 -56.6457 -24.4295 -24.4295 -24.4275 -24.4275 -24.4236 -24.4236 -24.4209 -24.4209 -11.7548 -11.7548 -11.7095 -11.7095 -10.1211 -10.1211 -9.9933 -9.9933 -7.5581 -7.5581 -7.3744 -7.3744 -6.9621 -6.9621 -6.8473 -6.8473 -4.6616 -4.6616 -4.6131 -4.6131 -4.3698 -4.3698 -4.2272 -4.2272 -3.7624 -3.7624 -3.6105 -3.6105 -2.0834 -2.0834 -1.2436 -1.2436 -1.1482 -1.1482 -0.7636 -0.7636 -0.5278 -0.5278 -0.3328 -0.3328 -0.1183 -0.1183 0.1017 0.1017 0.2138 0.2138 0.3998 0.3998 0.6926 0.6926 0.9589 0.9589 1.1109 1.1109 1.4096 1.4096 1.4917 1.4917 1.8285 1.8285 2.4580 2.4580 3.0627 3.0627 3.3462 3.3462 4.1789 4.1789 4.5263 4.5263 5.0045 5.0045 5.3918 5.3918 5.4934 5.4934 5.7552 5.7552 6.0535 6.0535 6.1274 6.1274 6.2544 6.2544 6.2852 6.2852 6.7620 6.7620 6.8867 6.8867 6.9801 6.9801 7.3795 7.3795 7.4477 7.4477 k = 0.0686-0.0000-0.0000 ( 12591 PWs) bands (ev): ************************************************************************ -786.4752-786.4752-785.6963-785.6963-785.4350-785.4350-784.9574-784.9574 -102.0060-102.0060-101.9537-101.9537-101.7971-101.7971-101.7540-101.7540 -59.5499 -59.5499 -59.5216 -59.5216 -59.5013 -59.5013 -59.4771 -59.4771 -56.6504 -56.6504 -56.6495 -56.6495 -56.6470 -56.6470 -56.6464 -56.6464 -24.4330 -24.4330 -24.4309 -24.4309 -24.4265 -24.4265 -24.4246 -24.4246 -11.7375 -11.7375 -11.6922 -11.6922 -10.1060 -10.1060 -9.9782 -9.9782 -7.5487 -7.5487 -7.3642 -7.3642 -6.9524 -6.9524 -6.8356 -6.8356 -4.6468 -4.6468 -4.5990 -4.5990 -4.3566 -4.3566 -4.2169 -4.2169 -3.7491 -3.7491 -3.6004 -3.6004 -2.0758 -2.0758 -1.2479 -1.2479 -1.1392 -1.1392 -0.7793 -0.7793 -0.5729 -0.5729 -0.3860 -0.3860 -0.1810 -0.1810 0.0621 0.0621 0.2253 0.2253 0.3722 0.3722 0.6767 0.6767 0.9242 0.9242 1.1146 1.1146 1.3574 1.3574 1.4978 1.4978 1.8381 1.8381 2.4750 2.4750 3.0742 3.0742 3.3612 3.3612 4.1488 4.1488 4.4445 4.4445 4.9369 4.9369 5.2613 5.2613 5.3941 5.3941 5.7289 5.7289 5.9597 5.9597 6.0654 6.0654 6.3878 6.3878 6.4400 6.4400 6.7792 6.7792 6.9171 6.9171 7.0006 7.0006 7.4258 7.4258 7.4964 7.4964 k = 0.0784-0.0000-0.0000 ( 12583 PWs) bands (ev): ************************************************************************ 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6.6089 6.6089 6.8048 6.8048 6.9445 6.9445 7.0305 7.0305 7.4648 7.4648 7.5485 7.5485 k = 0.0882-0.0000-0.0000 ( 12577 PWs) bands (ev): ************************************************************************ -786.3156-786.3156-785.3756-785.3756-785.2453-785.2453-784.6844-784.6844 -101.9822-101.9822-101.9439-101.9439-101.7606-101.7606-101.7147-101.7147 -59.5385 -59.5385 -59.5139 -59.5139 -59.4956 -59.4956 -59.4658 -59.4658 -56.6494 -56.6494 -56.6485 -56.6485 -56.6457 -56.6457 -56.6445 -56.6445 -24.4387 -24.4387 -24.4353 -24.4353 -24.4300 -24.4300 -24.4287 -24.4287 -11.6948 -11.6948 -11.6494 -11.6494 -10.0682 -10.0682 -9.9407 -9.9407 -7.5256 -7.5256 -7.3394 -7.3394 -6.9291 -6.9291 -6.8071 -6.8071 -4.6105 -4.6105 -4.5634 -4.5634 -4.3242 -4.3242 -4.1913 -4.1913 -3.7167 -3.7167 -3.5760 -3.5760 -2.0568 -2.0568 -1.2595 -1.2595 -1.1184 -1.1184 -0.8469 -0.8469 -0.6488 -0.6488 -0.5199 -0.5199 -0.3421 -0.3421 -0.0561 -0.0561 0.2562 0.2562 0.3145 0.3145 0.6390 0.6390 0.8706 0.8706 1.1320 1.1320 1.2684 1.2684 1.5177 1.5177 1.8605 1.8605 2.5142 2.5142 3.1007 3.1007 3.3950 3.3950 4.0624 4.0624 4.2719 4.2719 4.7819 4.7819 4.9819 4.9819 5.2046 5.2046 5.6167 5.6167 5.7478 5.7478 5.9718 5.9718 6.6334 6.6334 6.7825 6.7825 6.8485 6.8485 6.9845 6.9845 7.0669 7.0669 7.4876 7.4876 7.6043 7.6043 k = 0.0980-0.0000-0.0000 ( 12591 PWs) bands (ev): ************************************************************************ -786.5892-786.5892-785.8476-785.8476-785.2814-785.2814-784.9258-784.9258 -102.0233-102.0233-101.9721-101.9721-101.7610-101.7610-101.7251-101.7251 -59.5564 -59.5564 -59.5221 -59.5221 -59.5124 -59.5124 -59.4721 -59.4721 -56.6503 -56.6503 -56.6490 -56.6490 -56.6457 -56.6457 -56.6447 -56.6447 -24.4426 -24.4426 -24.4384 -24.4384 -24.4341 -24.4341 -24.4325 -24.4325 -11.6695 -11.6695 -11.6241 -11.6241 -10.0460 -10.0460 -9.9186 -9.9186 -7.5124 -7.5124 -7.3250 -7.3250 -6.9156 -6.9156 -6.7905 -6.7905 -4.5894 -4.5894 -4.5425 -4.5425 -4.3052 -4.3052 -4.1763 -4.1763 -3.6980 -3.6980 -3.5621 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************************************************************************ -786.5920-786.5920-786.0247-786.0247-784.9833-784.9833-784.8377-784.8377 -102.0732-102.0732-102.0145-102.0145-101.7082-101.7082-101.6666-101.6666 -59.5573 -59.5573 -59.5199 -59.5199 -59.4995 -59.4995 -59.4730 -59.4730 -56.6495 -56.6495 -56.6478 -56.6478 -56.6438 -56.6438 -56.6422 -56.6422 -24.4527 -24.4527 -24.4493 -24.4493 -24.4443 -24.4443 -24.4416 -24.4416 -11.5777 -11.5777 -11.5321 -11.5321 -9.9655 -9.9655 -9.8382 -9.8382 -7.4657 -7.4657 -7.2739 -7.2739 -6.8687 -6.8687 -6.7319 -6.7319 -4.5153 -4.5153 -4.4653 -4.4653 -4.2371 -4.2371 -4.1220 -4.1220 -3.6327 -3.6327 -3.5144 -3.5144 -2.0076 -2.0076 -1.3245 -1.3245 -1.1222 -1.1222 -1.0925 -1.0925 -0.9367 -0.9367 -0.7926 -0.7926 -0.6473 -0.6473 -0.4118 -0.4118 0.2185 0.2185 0.3099 0.3099 0.5719 0.5719 0.8026 0.8026 1.1653 1.1653 1.2333 1.2333 1.5812 1.5812 1.9107 1.9107 2.6064 2.6064 3.1505 3.1505 3.4476 3.4476 3.8185 3.8185 3.8860 3.8860 4.3449 4.3449 4.4383 4.4383 4.9587 4.9587 5.2107 5.2107 5.2687 5.2687 5.9443 5.9443 6.7362 6.7362 6.8675 6.8675 7.1284 7.1284 7.2742 7.2742 7.4651 7.4651 7.5213 7.5213 7.6635 7.6635 k = 0.1373-0.0000-0.0000 ( 12573 PWs) bands (ev): ************************************************************************ -786.5035-786.5035-785.9075-785.9075-784.7924-784.7924-784.6464-784.6464 -102.0350-102.0350-102.0115-102.0115-101.6640-101.6640-101.6314-101.6314 -59.5521 -59.5521 -59.5081 -59.5081 -59.4902 -59.4902 -59.4592 -59.4592 -56.6481 -56.6481 -56.6471 -56.6471 -56.6423 -56.6423 -56.6403 -56.6403 -24.4565 -24.4565 -24.4521 -24.4521 -24.4471 -24.4471 -24.4450 -24.4450 -11.5418 -11.5418 -11.4962 -11.4962 -9.9341 -9.9341 -9.8067 -9.8067 -7.4483 -7.4483 -7.2545 -7.2545 -6.8514 -6.8514 -6.7096 -6.7096 -4.4872 -4.4872 -4.4348 -4.4348 -4.2108 -4.2108 -4.1009 -4.1009 -3.6084 -3.6084 -3.4973 -3.4973 -1.9935 -1.9935 -1.3645 -1.3645 -1.2018 -1.2018 -1.1299 -1.1299 -1.0277 -1.0277 -0.8611 -0.8611 -0.6850 -0.6850 -0.5050 -0.5050 0.2012 0.2012 0.3186 0.3186 0.5507 0.5507 0.7973 0.7973 1.1751 1.1751 1.2494 1.2494 1.6024 1.6024 1.9235 1.9235 2.6312 2.6312 3.1538 3.1538 3.4446 3.4446 3.7436 3.7436 3.7984 3.7984 4.2177 4.2177 4.3206 4.3206 4.9134 4.9134 5.1023 5.1023 5.1533 5.1533 5.9501 5.9501 6.7317 6.7317 6.8460 6.8460 7.0734 7.0734 7.2434 7.2434 7.4042 7.4042 7.5429 7.5429 7.7713 7.7713 k = 0.1471-0.0000-0.0000 ( 12576 PWs) bands (ev): ************************************************************************ -786.6173-786.6173-786.0046-786.0046-784.8020-784.8020-784.6724-784.6724 -102.0393-102.0393-102.0091-102.0091-101.6762-101.6762-101.6370-101.6370 -59.5543 -59.5543 -59.5102 -59.5102 -59.4992 -59.4992 -59.4606 -59.4606 -56.6476 -56.6476 -56.6467 -56.6467 -56.6418 -56.6418 -56.6398 -56.6398 -24.4615 -24.4615 -24.4566 -24.4566 -24.4516 -24.4516 -24.4492 -24.4492 -11.5033 -11.5033 -11.4577 -11.4577 -9.9005 -9.9005 -9.7732 -9.7732 -7.4301 -7.4301 -7.2342 -7.2342 -6.8335 -6.8335 -6.6864 -6.6864 -4.4578 -4.4578 -4.4021 -4.4021 -4.1830 -4.1830 -4.0785 -4.0785 -3.5835 -3.5835 -3.4801 -3.4801 -1.9791 -1.9791 -1.4266 -1.4266 -1.2809 -1.2809 -1.2289 -1.2289 -1.0782 -1.0782 -0.9111 -0.9111 -0.7224 -0.7224 -0.5912 -0.5912 0.1857 0.1857 0.3252 0.3252 0.5252 0.5252 0.7988 0.7988 1.1879 1.1879 1.2687 1.2687 1.6258 1.6258 1.9359 1.9359 2.6561 2.6561 3.1454 3.1454 3.4287 3.4287 3.6371 3.6371 3.7500 3.7500 4.0979 4.0979 4.2086 4.2086 4.8531 4.8531 4.9941 4.9941 5.0598 5.0598 5.9575 5.9575 6.7194 6.7194 6.8164 6.8164 6.9688 6.9688 7.2243 7.2243 7.3041 7.3041 7.5675 7.5675 7.8217 7.8217 k = 0.1569-0.0000-0.0000 ( 12562 PWs) bands (ev): ************************************************************************ -786.4339-786.4339-785.7936-785.7936-784.6772-784.6772-784.4503-784.4503 -102.0161-102.0161-101.9484-101.9484-101.6781-101.6781-101.6031-101.6031 -59.5454 -59.5454 -59.4956 -59.4956 -59.4903 -59.4903 -59.4552 -59.4552 -56.6463 -56.6463 -56.6453 -56.6453 -56.6407 -56.6407 -56.6382 -56.6382 -24.4663 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7.8036 7.8036 k = 0.1765-0.0000-0.0000 ( 12582 PWs) bands (ev): ************************************************************************ -786.5789-786.5789-786.1910-786.1910-784.9590-784.9590-784.7705-784.7705 -102.0359-102.0359-101.9377-101.9377-101.7561-101.7561-101.6875-101.6875 -59.5513 -59.5513 -59.5111 -59.5111 -59.5010 -59.5010 -59.4815 -59.4815 -56.6467 -56.6467 -56.6445 -56.6445 -56.6398 -56.6398 -56.6378 -56.6378 -24.4756 -24.4756 -24.4703 -24.4703 -24.4655 -24.4655 -24.4632 -24.4632 -11.3724 -11.3724 -11.3264 -11.3264 -9.7868 -9.7868 -9.6589 -9.6589 -7.3727 -7.3727 -7.1684 -7.1684 -6.7782 -6.7782 -6.6116 -6.6116 -4.3627 -4.3627 -4.2909 -4.2909 -4.0905 -4.0905 -4.0035 -4.0035 -3.5082 -3.5082 -3.4316 -3.4316 -1.9394 -1.9394 -1.7312 -1.7312 -1.6352 -1.6352 -1.4983 -1.4983 -1.2097 -1.2097 -1.0083 -1.0083 -0.8470 -0.8470 -0.7548 -0.7548 0.1490 0.1490 0.3338 0.3338 0.4369 0.4369 0.8314 0.8314 1.2388 1.2388 1.3350 1.3350 1.7094 1.7094 1.9705 1.9705 2.7276 2.7276 2.9932 2.9932 3.1949 3.1949 3.4227 3.4227 3.6496 3.6496 3.8831 3.8831 3.9088 3.9088 4.5418 4.5418 4.6735 4.6735 4.9516 4.9516 5.9823 5.9823 6.5230 6.5230 6.6617 6.6617 6.7126 6.7126 6.9175 6.9175 7.2880 7.2880 7.5322 7.5322 7.6947 7.6947 k = 0.1863-0.0000-0.0000 ( 12584 PWs) bands (ev): ************************************************************************ -786.6667-786.6667-786.2526-786.2526-785.0935-785.0935-784.9157-784.9157 -102.0379-102.0379-101.9072-101.9072-101.7528-101.7528-101.6905-101.6905 -59.5561 -59.5561 -59.5206 -59.5206 -59.5034 -59.5034 -59.4827 -59.4827 -56.6461 -56.6461 -56.6438 -56.6438 -56.6392 -56.6392 -56.6374 -56.6374 -24.4810 -24.4810 -24.4758 -24.4758 -24.4702 -24.4702 -24.4678 -24.4678 -11.3236 -11.3236 -11.2774 -11.2774 -9.7446 -9.7446 -9.6166 -9.6166 -7.3531 -7.3531 -7.1452 -7.1452 -6.7600 -6.7600 -6.5856 -6.5856 -4.3289 -4.3289 -4.2498 -4.2498 -4.0571 -4.0571 -3.9763 -3.9763 -3.4851 -3.4851 -3.4181 -3.4181 -1.9380 -1.9380 -1.8455 -1.8455 -1.7619 -1.7619 -1.5810 -1.5810 -1.2526 -1.2526 -1.0709 -1.0709 -0.8689 -0.8689 -0.7782 -0.7782 0.1385 0.1385 0.3298 0.3298 0.4119 0.4119 0.8457 0.8457 1.2569 1.2569 1.3575 1.3575 1.7415 1.7415 1.9808 1.9808 2.7433 2.7433 2.9044 2.9044 3.0539 3.0539 3.4035 3.4035 3.6119 3.6119 3.8120 3.8120 3.8798 3.8798 4.4219 4.4219 4.5814 4.5814 4.9347 4.9347 5.9889 5.9889 6.3856 6.3856 6.5928 6.5928 6.6807 6.6807 6.8196 6.8196 7.2893 7.2893 7.5052 7.5052 7.5743 7.5743 k = 0.1961-0.0000-0.0000 ( 12592 PWs) bands (ev): ************************************************************************ -786.6972-786.6972-786.3355-786.3355-785.1651-785.1651-785.0915-785.0915 -102.0757-102.0757-101.9270-101.9270-101.7731-101.7731-101.7153-101.7153 -59.5605 -59.5605 -59.5160 -59.5160 -59.5067 -59.5067 -59.4950 -59.4950 -56.6461 -56.6461 -56.6431 -56.6431 -56.6391 -56.6391 -56.6368 -56.6368 -24.4862 -24.4862 -24.4815 -24.4815 -24.4753 -24.4753 -24.4735 -24.4735 -11.2722 -11.2722 -11.2259 -11.2259 -9.7004 -9.7004 -9.5719 -9.5719 -7.3335 -7.3335 -7.1217 -7.1217 -6.7425 -6.7425 -6.5595 -6.5595 -4.2943 -4.2943 -4.2069 -4.2069 -4.0226 -4.0226 -3.9481 -3.9481 -3.4649 -3.4649 -3.4068 -3.4068 -1.9931 -1.9931 -1.9390 -1.9390 -1.8515 -1.8515 -1.6638 -1.6638 -1.3014 -1.3014 -1.1367 -1.1367 -0.8979 -0.8979 -0.7824 -0.7824 0.1280 0.1280 0.3170 0.3170 0.3956 0.3956 0.8592 0.8592 1.2743 1.2743 1.3791 1.3791 1.7753 1.7753 1.9901 1.9901 2.7233 2.7233 2.8353 2.8353 2.9075 2.9075 3.3793 3.3793 3.5876 3.5876 3.7292 3.7292 3.8808 3.8808 4.3023 4.3023 4.5014 4.5014 4.9173 4.9173 5.9931 5.9931 6.2427 6.2427 6.5186 6.5186 6.6434 6.6434 6.7394 6.7394 7.2798 7.2798 7.4491 7.4491 7.4794 7.4794 k = 0.2059-0.0000-0.0000 ( 12584 PWs) bands (ev): ************************************************************************ -786.5301-786.5301-786.1857-786.1857-785.2078-785.2078-785.1318-785.1318 -102.0722-102.0722-101.8655-101.8655-101.7654-101.7654-101.7022-101.7022 -59.5512 -59.5512 -59.5091 -59.5091 -59.5009 -59.5009 -59.4912 -59.4912 -56.6447 -56.6447 -56.6414 -56.6414 -56.6378 -56.6378 -56.6355 -56.6355 -24.4911 -24.4911 -24.4864 -24.4864 -24.4795 -24.4795 -24.4776 -24.4776 -11.2183 -11.2183 -11.1718 -11.1718 -9.6540 -9.6540 -9.5252 -9.5252 -7.3142 -7.3142 -7.0980 -7.0980 -6.7260 -6.7260 -6.5336 -6.5336 -4.2590 -4.2590 -4.1624 -4.1624 -3.9872 -3.9872 -3.9192 -3.9192 -3.4492 -3.4492 -3.3982 -3.3982 -2.1022 -2.1022 -2.0444 -2.0444 -1.8707 -1.8707 -1.7416 -1.7416 -1.3602 -1.3602 -1.1958 -1.1958 -0.9362 -0.9362 -0.7721 -0.7721 0.1172 0.1172 0.2947 0.2947 0.3898 0.3898 0.8707 0.8707 1.2907 1.2907 1.3994 1.3994 1.8102 1.8102 1.9986 1.9986 2.6293 2.6293 2.7560 2.7560 2.8333 2.8333 3.3482 3.3482 3.5752 3.5752 3.6566 3.6566 3.8835 3.8835 4.1857 4.1857 4.4367 4.4367 4.8971 4.8971 5.9923 5.9923 6.1003 6.1003 6.4399 6.4399 6.5983 6.5983 6.6802 6.6802 7.2434 7.2434 7.3402 7.3402 7.4532 7.4532 k = 0.2157-0.0000-0.0000 ( 12602 PWs) bands (ev): ************************************************************************ -786.6873-786.6873-786.2969-786.2969-785.4469-785.4469-785.3936-785.3936 -102.1076-102.1076-101.9018-101.9018-101.7981-101.7981-101.7798-101.7798 -59.5631 -59.5631 -59.5201 -59.5201 -59.5162 -59.5162 -59.5041 -59.5041 -56.6448 -56.6448 -56.6423 -56.6423 -56.6378 -56.6378 -56.6363 -56.6363 -24.4974 -24.4974 -24.4928 -24.4928 -24.4851 -24.4851 -24.4837 -24.4837 -11.1618 -11.1618 -11.1152 -11.1152 -9.6057 -9.6057 -9.4764 -9.4764 -7.2957 -7.2957 -7.0744 -7.0744 -6.7109 -6.7109 -6.5081 -6.5081 -4.2236 -4.2236 -4.1166 -4.1166 -3.9512 -3.9512 -3.8899 -3.8899 -3.4406 -3.4406 -3.3926 -3.3926 -2.2132 -2.2132 -2.1552 -2.1552 -1.8882 -1.8882 -1.7997 -1.7997 -1.4292 -1.4292 -1.2464 -1.2464 -0.9799 -0.9799 -0.7549 -0.7549 0.1051 0.1051 0.2664 0.2664 0.3903 0.3903 0.8790 0.8790 1.3049 1.3049 1.4174 1.4174 1.8446 1.8446 2.0061 2.0061 2.5082 2.5082 2.6076 2.6076 2.8494 2.8494 3.3138 3.3138 3.5447 3.5447 3.6180 3.6180 3.8804 3.8804 4.0748 4.0748 4.3907 4.3907 4.8721 4.8721 5.9442 5.9442 6.0006 6.0006 6.3599 6.3599 6.5505 6.5505 6.6359 6.6359 7.1511 7.1511 7.2696 7.2696 7.4347 7.4347 k = 0.2255-0.0000-0.0000 ( 12590 PWs) bands (ev): ************************************************************************ -786.5471-786.5471-786.1312-786.1312-785.3355-785.3355-785.1465-785.1465 -102.0970-102.0970-101.8653-101.8653-101.7663-101.7663-101.7458-101.7458 -59.5546 -59.5546 -59.5146 -59.5146 -59.5061 -59.5061 -59.5034 -59.5034 -56.6432 -56.6432 -56.6415 -56.6415 -56.6366 -56.6366 -56.6350 -56.6350 -24.5026 -24.5026 -24.4979 -24.4979 -24.4906 -24.4906 -24.4880 -24.4880 -11.1029 -11.1029 -11.0560 -11.0560 -9.5552 -9.5552 -9.4255 -9.4255 -7.2780 -7.2780 -7.0509 -7.0509 -6.6976 -6.6976 -6.4834 -6.4834 -4.1874 -4.1874 -4.0696 -4.0696 -3.9149 -3.9149 -3.8604 -3.8604 -3.4412 -3.4412 -3.3902 -3.3902 -2.3172 -2.3172 -2.2574 -2.2574 -1.9426 -1.9426 -1.8142 -1.8142 -1.5034 -1.5034 -1.2917 -1.2917 -1.0255 -1.0255 -0.7343 -0.7343 0.0923 0.0923 0.2355 0.2355 0.3940 0.3940 0.8838 0.8838 1.3161 1.3161 1.4326 1.4326 1.8762 1.8762 2.0130 2.0130 2.3825 2.3825 2.4613 2.4613 2.8696 2.8696 3.2799 3.2799 3.4848 3.4848 3.6183 3.6183 3.8664 3.8664 3.9752 3.9752 4.3658 4.3658 4.8417 4.8417 5.8084 5.8084 5.9837 5.9837 6.2849 6.2849 6.5081 6.5081 6.5978 6.5978 7.0306 7.0306 7.2138 7.2138 7.4222 7.4222 k = 0.2353-0.0000-0.0000 ( 12596 PWs) bands (ev): ************************************************************************ -786.5608-786.5608-786.2492-786.2492-785.4083-785.4083-785.0452-785.0452 -102.1216-102.1216-101.9056-101.9056-101.8021-101.8021-101.7591-101.7591 -59.5604 -59.5604 -59.5195 -59.5195 -59.5095 -59.5095 -59.4931 -59.4931 -56.6424 -56.6424 -56.6411 -56.6411 -56.6363 -56.6363 -56.6341 -56.6341 -24.5082 -24.5082 -24.5035 -24.5035 -24.4954 -24.4954 -24.4937 -24.4937 -11.0414 -11.0414 -10.9943 -10.9943 -9.5029 -9.5029 -9.3726 -9.3726 -7.2614 -7.2614 -7.0279 -7.0279 -6.6867 -6.6867 -6.4601 -6.4601 -4.1515 -4.1515 -4.0221 -4.0221 -3.8790 -3.8790 -3.8314 -3.8314 -3.4523 -3.4523 -3.3926 -3.3926 -2.4113 -2.4113 -2.3461 -2.3461 -2.0139 -2.0139 -1.8091 -1.8091 -1.5789 -1.5789 -1.3356 -1.3356 -1.0720 -1.0720 -0.7122 -0.7122 0.0782 0.0782 0.2031 0.2031 0.3989 0.3989 0.8842 0.8842 1.3225 1.3225 1.4438 1.4438 1.8983 1.8983 2.0200 2.0200 2.2617 2.2617 2.3207 2.3207 2.8902 2.8902 3.2467 3.2467 3.4216 3.4216 3.6223 3.6223 3.8368 3.8368 3.8983 3.8983 4.3612 4.3612 4.8053 4.8053 5.6703 5.6703 5.9614 5.9614 6.2183 6.2183 6.4745 6.4745 6.5613 6.5613 6.9068 6.9068 7.1537 7.1537 7.4106 7.4106 k = 0.2451-0.0000-0.0000 ( 12594 PWs) bands (ev): ************************************************************************ -786.5399-786.5399-786.2015-786.2015-785.4863-785.4863-784.9098-784.9098 -102.1634-102.1634-101.8863-101.8863-101.8065-101.8065-101.7364-101.7364 -59.5681 -59.5681 -59.5111 -59.5111 -59.5027 -59.5027 -59.4889 -59.4889 -56.6415 -56.6415 -56.6401 -56.6401 -56.6356 -56.6356 -56.6327 -56.6327 -24.5126 -24.5126 -24.5089 -24.5089 -24.5001 -24.5001 -24.4989 -24.4989 -10.9775 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-59.5202 -59.5202 -59.5034 -59.5034 -59.4903 -59.4903 -56.6406 -56.6406 -56.6397 -56.6397 -56.6352 -56.6352 -56.6323 -56.6323 -24.5184 -24.5184 -24.5148 -24.5148 -24.5054 -24.5054 -24.5038 -24.5038 -10.9111 -10.9111 -10.8634 -10.8634 -9.3925 -9.3925 -9.2607 -9.2607 -7.2336 -7.2336 -6.9844 -6.9844 -6.6743 -6.6743 -6.4194 -6.4194 -4.0811 -4.0811 -3.9294 -3.9294 -3.8124 -3.8124 -3.7781 -3.7781 -3.5003 -3.5003 -3.4165 -3.4165 -2.5641 -2.5641 -2.4720 -2.4720 -2.1532 -2.1532 -1.7938 -1.7938 -1.7193 -1.7193 -1.4271 -1.4271 -1.1615 -1.1615 -0.6680 -0.6680 0.0466 0.0466 0.1358 0.1358 0.4082 0.4082 0.8715 0.8715 1.3111 1.3111 1.4467 1.4467 1.8438 1.8438 2.0168 2.0168 2.0840 2.0840 2.1207 2.1207 2.9283 2.9283 3.1759 3.1759 3.3049 3.3049 3.5745 3.5745 3.7803 3.7803 3.8300 3.8300 4.3976 4.3976 4.7175 4.7175 5.4047 5.4047 5.8815 5.8815 6.1210 6.1210 6.4345 6.4345 6.4841 6.4841 6.6771 6.6771 7.0218 7.0218 7.3679 7.3679 k = 0.2647-0.0000-0.0000 ( 12592 PWs) bands (ev): ************************************************************************ -786.3794-786.3794-786.0190-786.0190-785.5684-785.5684-785.0521-785.0521 -102.1557-102.1557-101.9035-101.9035-101.8178-101.8178-101.7202-101.7202 -59.5624 -59.5624 -59.5076 -59.5076 -59.4987 -59.4987 -59.4890 -59.4890 -56.6397 -56.6397 -56.6386 -56.6386 -56.6347 -56.6347 -56.6307 -56.6307 -24.5233 -24.5233 -24.5198 -24.5198 -24.5103 -24.5103 -24.5086 -24.5086 -10.8423 -10.8423 -10.7942 -10.7942 -9.3346 -9.3346 -9.2017 -9.2017 -7.2230 -7.2230 -6.9646 -6.9646 -6.6742 -6.6742 -6.4031 -6.4031 -4.0475 -4.0475 -3.8893 -3.8893 -3.7845 -3.7845 -3.7566 -3.7566 -3.5299 -3.5299 -3.4350 -3.4350 -2.6232 -2.6232 -2.5070 -2.5070 -2.2160 -2.2160 -1.8001 -1.8001 -1.7690 -1.7690 -1.4759 -1.4759 -1.2028 -1.2028 -0.6475 -0.6475 0.0292 0.0292 0.1015 0.1015 0.4112 0.4112 0.8586 0.8586 1.2848 1.2848 1.4302 1.4302 1.7544 1.7544 1.9496 1.9496 2.0449 2.0449 2.1315 2.1315 2.9442 2.9442 3.1325 3.1325 3.2516 3.2516 3.5280 3.5280 3.7727 3.7727 3.8254 3.8254 4.4299 4.4299 4.6693 4.6693 5.2794 5.2794 5.8272 5.8272 6.0857 6.0857 6.4230 6.4230 6.4344 6.4344 6.5888 6.5888 6.9543 6.9543 7.3292 7.3292 k = 0.2745-0.0000-0.0000 ( 12596 PWs) bands (ev): ************************************************************************ -786.4162-786.4162-786.0755-786.0755-785.6544-785.6544-785.1520-785.1520 -102.1404-102.1404-101.9517-101.9517-101.8095-101.8095-101.7208-101.7208 -59.5666 -59.5666 -59.5144 -59.5144 -59.5070 -59.5070 -59.4816 -59.4816 -56.6391 -56.6391 -56.6383 -56.6383 -56.6343 -56.6343 -56.6302 -56.6302 -24.5289 -24.5289 -24.5254 -24.5254 -24.5156 -24.5156 -24.5139 -24.5139 -10.7711 -10.7711 -10.7226 -10.7226 -9.2749 -9.2749 -9.1410 -9.1410 -7.2154 -7.2154 -6.9463 -6.9463 -6.6790 -6.6790 -6.3904 -6.3904 -4.0161 -4.0161 -3.8625 -3.8625 -3.7611 -3.7611 -3.7416 -3.7416 -3.5531 -3.5531 -3.4508 -3.4508 -2.6729 -2.6729 -2.5248 -2.5248 -2.2731 -2.2731 -1.8446 -1.8446 -1.7771 -1.7771 -1.5254 -1.5254 -1.2410 -1.2410 -0.6292 -0.6292 0.0102 0.0102 0.0675 0.0675 0.4122 0.4122 0.8412 0.8412 1.2385 1.2385 1.3889 1.3889 1.6645 1.6645 1.8760 1.8760 2.0342 2.0342 2.1622 2.1622 2.9567 2.9567 3.0800 3.0800 3.2026 3.2026 3.4871 3.4871 3.7625 3.7625 3.8418 3.8418 4.4659 4.4659 4.6220 4.6220 5.1601 5.1601 5.7687 5.7687 6.0528 6.0528 6.3545 6.3545 6.4244 6.4244 6.5340 6.5340 6.8885 6.8885 7.2797 7.2797 k = 0.2843-0.0000-0.0000 ( 12596 PWs) bands (ev): ************************************************************************ -786.5200-786.5200-786.0837-786.0837-785.4911-785.4911-785.2999-785.2999 -102.1388-102.1388-101.9542-101.9542-101.8072-101.8072-101.7193-101.7193 -59.5618 -59.5618 -59.5139 -59.5139 -59.5124 -59.5124 -59.4834 -59.4834 -56.6383 -56.6383 -56.6376 -56.6376 -56.6333 -56.6333 -56.6298 -56.6298 -24.5345 -24.5345 -24.5305 -24.5305 -24.5210 -24.5210 -24.5193 -24.5193 -10.6975 -10.6975 -10.6486 -10.6486 -9.2135 -9.2135 -9.0784 -9.0784 -7.2111 -7.2111 -6.9301 -6.9301 -6.6894 -6.6894 -6.3818 -6.3818 -3.9876 -3.9876 -3.8597 -3.8597 -3.7542 -3.7542 -3.7208 -3.7208 -3.5602 -3.5602 -3.4570 -3.4570 -2.7150 -2.7150 -2.5280 -2.5280 -2.3235 -2.3235 -1.8897 -1.8897 -1.7820 -1.7820 -1.5733 -1.5733 -1.2753 -1.2753 -0.6139 -0.6139 -0.0105 -0.0105 0.0345 0.0345 0.4107 0.4107 0.8197 0.8197 1.1700 1.1700 1.3114 1.3114 1.6005 1.6005 1.8222 1.8222 2.0281 2.0281 2.1981 2.1981 2.9617 2.9617 3.0205 3.0205 3.1599 3.1599 3.4564 3.4564 3.7552 3.7552 3.8685 3.8685 4.4978 4.4978 4.5832 4.5832 5.0482 5.0482 5.7085 5.7085 6.0187 6.0187 6.2646 6.2646 6.4254 6.4254 6.5060 6.5060 6.8264 6.8264 7.2243 7.2243 k = 0.2941-0.0000-0.0000 ( 12604 PWs) bands (ev): ************************************************************************ -786.5797-786.5797-786.1412-786.1412-785.6527-785.6527-785.4481-785.4481 -102.1602-102.1602-101.9547-101.9547-101.8390-101.8390-101.7556-101.7556 -59.5595 -59.5595 -59.5233 -59.5233 -59.5152 -59.5152 -59.4876 -59.4876 -56.6375 -56.6375 -56.6372 -56.6372 -56.6331 -56.6331 -56.6293 -56.6293 -24.5396 -24.5396 -24.5358 -24.5358 -24.5266 -24.5266 -24.5247 -24.5247 -10.6216 -10.6216 -10.5722 -10.5722 -9.1506 -9.1506 -9.0140 -9.0140 -7.2108 -7.2108 -6.9164 -6.9164 -6.7062 -6.7062 -6.3781 -6.3781 -3.9638 -3.9638 -3.8809 -3.8809 -3.7720 -3.7720 -3.6852 -3.6852 -3.5495 -3.5495 -3.4499 -3.4499 -2.7508 -2.7508 -2.5201 -2.5201 -2.3672 -2.3672 -1.9273 -1.9273 -1.7951 -1.7951 -1.6157 -1.6157 -1.3056 -1.3056 -0.6029 -0.6029 -0.0329 -0.0329 0.0028 0.0028 0.4061 0.4061 0.7944 0.7944 1.0824 1.0824 1.2027 1.2027 1.5639 1.5639 1.7869 1.7869 2.0234 2.0234 2.2349 2.2349 2.9297 2.9297 2.9852 2.9852 3.1237 3.1237 3.4343 3.4343 3.7541 3.7541 3.9001 3.9001 4.4985 4.4985 4.5801 4.5801 4.9454 4.9454 5.6478 5.6478 5.9811 5.9811 6.1734 6.1734 6.4275 6.4275 6.4930 6.4930 6.7704 6.7704 7.1676 7.1676 k = 0.3039-0.0000-0.0000 ( 12614 PWs) bands (ev): ************************************************************************ -786.7559-786.7559-786.1892-786.1892-785.9150-785.9150-785.6771-785.6771 -102.1564-102.1564-101.9525-101.9525-101.8811-101.8811-101.7833-101.7833 -59.5653 -59.5653 -59.5342 -59.5342 -59.5250 -59.5250 -59.4907 -59.4907 -56.6377 -56.6377 -56.6362 -56.6362 -56.6331 -56.6331 -56.6291 -56.6291 -24.5450 -24.5450 -24.5414 -24.5414 -24.5326 -24.5326 -24.5303 -24.5303 -10.5434 -10.5434 -10.4934 -10.4934 -9.0860 -9.0860 -8.9481 -8.9481 -7.2150 -7.2150 -6.9054 -6.9054 -6.7301 -6.7301 -6.3798 -6.3798 -3.9482 -3.9482 -3.9151 -3.9151 -3.7975 -3.7975 -3.6464 -3.6464 -3.5276 -3.5276 -3.4304 -3.4304 -2.7809 -2.7809 -2.5041 -2.5041 -2.4042 -2.4042 -1.9576 -1.9576 -1.8199 -1.8199 -1.6477 -1.6477 -1.3316 -1.3316 -0.5972 -0.5972 -0.0564 -0.0564 -0.0275 -0.0275 0.3983 0.3983 0.7647 0.7647 0.9818 0.9818 1.0780 1.0780 1.5424 1.5424 1.7645 1.7645 2.0198 2.0198 2.2708 2.2708 2.8583 2.8583 2.9804 2.9804 3.0929 3.0929 3.4173 3.4173 3.7604 3.7604 3.9349 3.9349 4.4687 4.4687 4.6101 4.6101 4.8552 4.8552 5.5868 5.5868 5.9394 5.9394 6.0880 6.0880 6.4248 6.4248 6.4916 6.4916 6.7228 6.7228 7.1131 7.1131 k = 0.3137-0.0000-0.0000 ( 12618 PWs) bands (ev): ************************************************************************ -786.7550-786.7550-786.1433-786.1433-785.9440-785.9440-785.7218-785.7218 -102.1766-102.1766-101.9822-101.9822-101.9035-101.9035-101.7868-101.7868 -59.5762 -59.5762 -59.5351 -59.5351 -59.5223 -59.5223 -59.4895 -59.4895 -56.6377 -56.6377 -56.6359 -56.6359 -56.6329 -56.6329 -56.6285 -56.6285 -24.5504 -24.5504 -24.5461 -24.5461 -24.5375 -24.5375 -24.5360 -24.5360 -10.4629 -10.4629 -10.4123 -10.4123 -9.0198 -9.0198 -8.8804 -8.8804 -7.2242 -7.2242 -6.8975 -6.8975 -6.7614 -6.7614 -6.3875 -6.3875 -3.9594 -3.9594 -3.9397 -3.9397 -3.8172 -3.8172 -3.6091 -3.6091 -3.5010 -3.5010 -3.4018 -3.4018 -2.8047 -2.8047 -2.4834 -2.4834 -2.4341 -2.4341 -1.9838 -1.9838 -1.8540 -1.8540 -1.6679 -1.6679 -1.3528 -1.3528 -0.5976 -0.5976 -0.0799 -0.0799 -0.0568 -0.0568 0.3864 0.3864 0.7301 0.7301 0.8752 0.8752 0.9480 0.9480 1.5276 1.5276 1.7494 1.7494 2.0173 2.0173 2.3049 2.3049 2.7816 2.7816 2.9752 2.9752 3.0664 3.0664 3.4023 3.4023 3.7738 3.7738 3.9723 3.9723 4.4367 4.4367 4.6369 4.6369 4.7874 4.7874 5.5256 5.5256 5.8935 5.8935 6.0122 6.0122 6.4113 6.4113 6.5013 6.5013 6.6857 6.6857 7.0642 7.0642 k = 0.3235-0.0000-0.0000 ( 12622 PWs) bands (ev): ************************************************************************ -786.8168-786.8168-786.2795-786.2795-785.9571-785.9571-785.7788-785.7788 -102.1673-102.1673-102.0142-102.0142-101.9164-101.9164-101.8183-101.8183 -59.5715 -59.5715 -59.5362 -59.5362 -59.5235 -59.5235 -59.4845 -59.4845 -56.6362 -56.6362 -56.6360 -56.6360 -56.6315 -56.6315 -56.6285 -56.6285 -24.5548 -24.5548 -24.5507 -24.5507 -24.5427 -24.5427 -24.5401 -24.5401 -10.3802 -10.3802 -10.3288 -10.3288 -8.9522 -8.9522 -8.8110 -8.8110 -7.2391 -7.2391 -6.8933 -6.8933 -6.8006 -6.8006 -6.4013 -6.4013 -3.9956 -3.9956 -3.9534 -3.9534 -3.8232 -3.8232 -3.5759 -3.5759 -3.4730 -3.4730 -3.3670 -3.3670 -2.8213 -2.8213 -2.4663 -2.4663 -2.4512 -2.4512 -2.0132 -2.0132 -1.8872 -1.8872 -1.6786 -1.6786 -1.3690 -1.3690 -0.6050 -0.6050 -0.1045 -0.1045 -0.0841 -0.0841 0.3694 0.3694 0.6867 0.6867 0.7711 0.7711 0.8184 0.8184 1.5157 1.5157 1.7376 1.7376 2.0162 2.0162 2.3367 2.3367 2.7055 2.7055 2.9663 2.9663 3.0426 3.0426 3.3868 3.3868 3.7936 3.7936 4.0121 4.0121 4.4073 4.4073 4.6319 4.6319 4.7666 4.7666 5.4640 5.4640 5.8438 5.8438 5.9485 5.9485 6.3871 6.3871 6.5178 6.5178 6.6597 6.6597 7.0234 7.0234 k = 0.3333-0.0000-0.0000 ( 12622 PWs) bands (ev): ************************************************************************ -786.9993-786.9993-786.1698-786.1698-785.9052-785.9052-785.8457-785.8457 -102.1270-102.1270-102.0304-102.0304-101.8947-101.8947-101.8499-101.8499 -59.5744 -59.5744 -59.5346 -59.5346 -59.5267 -59.5267 -59.4822 -59.4822 -56.6358 -56.6358 -56.6353 -56.6353 -56.6305 -56.6305 -56.6283 -56.6283 -24.5594 -24.5594 -24.5553 -24.5553 -24.5473 -24.5473 -24.5449 -24.5449 -10.2952 -10.2952 -10.2431 -10.2431 -8.8833 -8.8833 -8.7400 -8.7400 -7.2603 -7.2603 -6.8933 -6.8933 -6.8476 -6.8476 -6.4216 -6.4216 -4.0281 -4.0281 -3.9749 -3.9749 -3.8185 -3.8185 -3.5483 -3.5483 -3.4454 -3.4454 -3.3285 -3.3285 -2.8293 -2.8293 -2.4782 -2.4782 -2.4325 -2.4325 -2.0542 -2.0542 -1.9078 -1.9078 -1.6820 -1.6820 -1.3809 -1.3809 -0.6195 -0.6195 -0.1352 -0.1352 -0.1045 -0.1045 0.3453 0.3453 0.6187 0.6187 0.6827 0.6827 0.7001 0.7001 1.5050 1.5050 1.7266 1.7266 2.0167 2.0167 2.3656 2.3656 2.6323 2.6323 2.9531 2.9531 3.0207 3.0207 3.3695 3.3695 3.8190 3.8190 4.0542 4.0542 4.3796 4.3796 4.5996 4.5996 4.7894 4.7894 5.4019 5.4019 5.7913 5.7913 5.8976 5.8976 6.3554 6.3554 6.5345 6.5345 6.6446 6.6446 6.9931 6.9931 k = 0.3431-0.0000-0.0000 ( 12640 PWs) bands (ev): ************************************************************************ -787.0520-787.0520-786.1640-786.1640-786.1535-786.1535-786.0308-786.0308 -102.1357-102.1357-102.0697-102.0697-101.9851-101.9851-101.9392-101.9392 -59.5807 -59.5807 -59.5512 -59.5512 -59.5396 -59.5396 -59.4956 -59.4956 -56.6361 -56.6361 -56.6356 -56.6356 -56.6306 -56.6306 -56.6292 -56.6292 -24.5649 -24.5649 -24.5604 -24.5604 -24.5534 -24.5534 -24.5505 -24.5505 -10.2081 -10.2081 -10.1552 -10.1552 -8.8131 -8.8131 -8.6676 -8.6676 -7.2883 -7.2883 -6.9080 -6.9080 -6.8927 -6.8927 -6.4482 -6.4482 -4.0533 -4.0533 -3.9969 -3.9969 -3.8101 -3.8101 -3.5272 -3.5272 -3.4191 -3.4191 -3.2885 -3.2885 -2.8276 -2.8276 -2.4898 -2.4898 -2.4100 -2.4100 -2.1077 -2.1077 -1.9134 -1.9134 -1.6786 -1.6786 -1.3891 -1.3891 -0.6407 -0.6407 -0.1736 -0.1736 -0.1181 -0.1181 0.3086 0.3086 0.5258 0.5258 0.5716 0.5716 0.6399 0.6399 1.4948 1.4948 1.7150 1.7150 2.0187 2.0187 2.3915 2.3915 2.5633 2.5633 2.9339 2.9339 3.0009 3.0009 3.3495 3.3495 3.8491 3.8491 4.0980 4.0980 4.3512 4.3512 4.5728 4.5728 4.8242 4.8242 5.3397 5.3397 5.7377 5.7377 5.8581 5.8581 6.3197 6.3197 6.5425 6.5425 6.6429 6.6429 6.9741 6.9741 k = 0.3529-0.0000-0.0000 ( 12632 PWs) bands (ev): ************************************************************************ -786.8154-786.8154-786.2941-786.2941-785.9475-785.9475-785.8167-785.8167 -102.1311-102.1311-102.0562-102.0562-101.9574-101.9574-101.9440-101.9440 -59.5800 -59.5800 -59.5445 -59.5445 -59.5264 -59.5264 -59.4912 -59.4912 -56.6353 -56.6353 -56.6346 -56.6346 -56.6298 -56.6298 -56.6290 -56.6290 -24.5681 -24.5681 -24.5636 -24.5636 -24.5575 -24.5575 -24.5548 -24.5548 -10.1189 -10.1189 -10.0650 -10.0650 -8.7416 -8.7416 -8.5936 -8.5936 -7.3235 -7.3235 -6.9687 -6.9687 -6.9042 -6.9042 -6.4806 -6.4806 -4.0699 -4.0699 -4.0149 -4.0149 -3.8009 -3.8009 -3.5118 -3.5118 -3.3950 -3.3950 -3.2485 -3.2485 -2.8156 -2.8156 -2.4974 -2.4974 -2.3896 -2.3896 -2.1672 -2.1672 -1.9077 -1.9077 -1.6680 -1.6680 -1.3941 -1.3941 -0.6673 -0.6673 -0.2179 -0.2179 -0.1278 -0.1278 0.2501 0.2501 0.4345 0.4345 0.4702 0.4702 0.5929 0.5929 1.4851 1.4851 1.7020 1.7020 2.0228 2.0228 2.4136 2.4136 2.5006 2.5006 2.9081 2.9081 2.9850 2.9850 3.3269 3.3269 3.8834 3.8834 4.1426 4.1426 4.3224 4.3224 4.5623 4.5623 4.8593 4.8593 5.2803 5.2803 5.6849 5.6849 5.8284 5.8284 6.2833 6.2833 6.5369 6.5369 6.6559 6.6559 6.9645 6.9645 k = 0.3627-0.0000-0.0000 ( 12642 PWs) bands (ev): ************************************************************************ -786.7778-786.7778-786.3354-786.3354-786.0671-786.0671-785.8614-785.8614 -102.1594-102.1594-102.0756-102.0756-102.0278-102.0278-101.9655-101.9655 -59.5793 -59.5793 -59.5513 -59.5513 -59.5329 -59.5329 -59.4993 -59.4993 -56.6352 -56.6352 -56.6340 -56.6340 -56.6299 -56.6299 -56.6290 -56.6290 -24.5720 -24.5720 -24.5683 -24.5683 -24.5618 -24.5618 -24.5597 -24.5597 -10.0277 -10.0277 -9.9727 -9.9727 -8.6691 -8.6691 -8.5186 -8.5186 -7.3662 -7.3662 -7.0398 -7.0398 -6.9179 -6.9179 -6.5188 -6.5188 -4.0776 -4.0776 -4.0268 -4.0268 -3.7928 -3.7928 -3.5015 -3.5015 -3.3740 -3.3740 -3.2099 -3.2099 -2.7939 -2.7939 -2.5041 -2.5041 -2.3727 -2.3727 -2.2272 -2.2272 -1.8938 -1.8938 -1.6501 -1.6501 -1.3969 -1.3969 -0.6982 -0.6982 -0.2682 -0.2682 -0.1360 -0.1360 0.1640 0.1640 0.3441 0.3441 0.3999 0.3999 0.5462 0.5462 1.4759 1.4759 1.6874 1.6874 2.0286 2.0286 2.4213 2.4213 2.4553 2.4553 2.8759 2.8759 2.9710 2.9710 3.3019 3.3019 3.9210 3.9210 4.1852 4.1852 4.2972 4.2972 4.5673 4.5673 4.8891 4.8891 5.2264 5.2264 5.6334 5.6334 5.8061 5.8061 6.2482 6.2482 6.5219 6.5219 6.6775 6.6775 6.9303 6.9303 k = 0.3725-0.0000-0.0000 ( 12644 PWs) bands (ev): ************************************************************************ -786.8116-786.8116-786.4150-786.4150-786.2106-786.2106-785.7296-785.7296 -102.1495-102.1495-102.0754-102.0754-102.0458-102.0458-101.9680-101.9680 -59.5834 -59.5834 -59.5602 -59.5602 -59.5392 -59.5392 -59.4977 -59.4977 -56.6349 -56.6349 -56.6335 -56.6335 -56.6297 -56.6297 -56.6290 -56.6290 -24.5757 -24.5757 -24.5725 -24.5725 -24.5661 -24.5661 -24.5646 -24.5646 -9.9345 -9.9345 -9.8783 -9.8783 -8.5956 -8.5956 -8.4423 -8.4423 -7.4165 -7.4165 -7.1182 -7.1182 -6.9366 -6.9366 -6.5620 -6.5620 -4.0761 -4.0761 -4.0322 -4.0322 -3.7853 -3.7853 -3.4944 -3.4944 -3.3566 -3.3566 -3.1736 -3.1736 -2.7637 -2.7637 -2.5142 -2.5142 -2.3630 -2.3630 -2.2773 -2.2773 -1.8732 -1.8732 -1.6249 -1.6249 -1.3984 -1.3984 -0.7322 -0.7322 -0.3240 -0.3240 -0.1458 -0.1458 0.0612 0.0612 0.2561 0.2561 0.3541 0.3541 0.4985 0.4985 1.4672 1.4672 1.6711 1.6711 2.0361 2.0361 2.3825 2.3825 2.4603 2.4603 2.8387 2.8387 2.9579 2.9579 3.2752 3.2752 3.9612 3.9612 4.2170 4.2170 4.2865 4.2865 4.5841 4.5841 4.9086 4.9086 5.1830 5.1830 5.5842 5.5842 5.7891 5.7891 6.2165 6.2165 6.5041 6.5041 6.6992 6.6992 6.8701 6.8701 k = 0.3824-0.0000-0.0000 ( 12652 PWs) bands (ev): ************************************************************************ -786.9990-786.9990-786.5845-786.5845-786.4181-786.4181-785.7594-785.7594 -102.1415-102.1415-102.1380-102.1380-102.0562-102.0562-101.9626-101.9626 -59.5943 -59.5943 -59.5637 -59.5637 -59.5427 -59.5427 -59.5059 -59.5059 -56.6343 -56.6343 -56.6332 -56.6332 -56.6299 -56.6299 -56.6287 -56.6287 -24.5794 -24.5794 -24.5765 -24.5765 -24.5702 -24.5702 -24.5688 -24.5688 -9.8394 -9.8394 -9.7818 -9.7818 -8.5213 -8.5213 -8.3650 -8.3650 -7.4745 -7.4745 -7.2032 -7.2032 -6.9606 -6.9606 -6.6095 -6.6095 -4.0662 -4.0662 -4.0309 -4.0309 -3.7786 -3.7786 -3.4894 -3.4894 -3.3433 -3.3433 -3.1403 -3.1403 -2.7283 -2.7283 -2.5323 -2.5323 -2.3804 -2.3804 -2.2907 -2.2907 -1.8467 -1.8467 -1.5933 -1.5933 -1.3993 -1.3993 -0.7685 -0.7685 -0.3844 -0.3844 -0.1662 -0.1662 -0.0393 -0.0393 0.1758 0.1758 0.3174 0.3174 0.4497 0.4497 1.4593 1.4593 1.6534 1.6534 2.0449 2.0449 2.3392 2.3392 2.4742 2.4742 2.7979 2.7979 2.9446 2.9446 3.2476 3.2476 4.0035 4.0035 4.2234 4.2234 4.3061 4.3061 4.6094 4.6094 4.9124 4.9124 5.1561 5.1561 5.5374 5.5374 5.7744 5.7744 6.1896 6.1896 6.4878 6.4878 6.7103 6.7103 6.8219 6.8219 k = 0.3922-0.0000-0.0000 ( 12662 PWs) bands (ev): ************************************************************************ -787.1458-787.1458-786.8844-786.8844-786.5128-786.5128-785.7618-785.7618 -102.2060-102.2060-102.1499-102.1499-102.0875-102.0875-101.9721-101.9721 -59.6048 -59.6048 -59.5658 -59.5658 -59.5446 -59.5446 -59.5071 -59.5071 -56.6343 -56.6343 -56.6331 -56.6331 -56.6300 -56.6300 -56.6287 -56.6287 -24.5829 -24.5829 -24.5800 -24.5800 -24.5746 -24.5746 -24.5726 -24.5726 -9.7425 -9.7425 -9.6834 -9.6834 -8.4464 -8.4464 -8.2866 -8.2866 -7.5398 -7.5398 -7.2940 -7.2940 -6.9899 -6.9899 -6.6609 -6.6609 -4.0484 -4.0484 -4.0231 -4.0231 -3.7721 -3.7721 -3.4850 -3.4850 -3.3343 -3.3343 -3.1101 -3.1101 -2.6958 -2.6958 -2.5572 -2.5572 -2.4179 -2.4179 -2.2674 -2.2674 -1.8152 -1.8152 -1.5563 -1.5563 -1.4005 -1.4005 -0.8063 -0.8063 -0.4477 -0.4477 -0.2260 -0.2260 -0.1036 -0.1036 0.1046 0.1046 0.2832 0.2832 0.4002 0.4002 1.4523 1.4523 1.6346 1.6346 2.0548 2.0548 2.3022 2.3022 2.4863 2.4863 2.7543 2.7543 2.9311 2.9311 3.2195 3.2195 4.0470 4.0470 4.2185 4.2185 4.3411 4.3411 4.6395 4.6395 4.8991 4.8991 5.1479 5.1479 5.4940 5.4940 5.7594 5.7594 6.1689 6.1689 6.4756 6.4756 6.6910 6.6910 6.8067 6.8067 k = 0.4020-0.0000-0.0000 ( 12652 PWs) bands (ev): ************************************************************************ -787.1024-787.1024-786.6909-786.6909-786.3579-786.3579-785.7563-785.7563 -102.1708-102.1708-102.1352-102.1352-102.0566-102.0566-101.9405-101.9405 -59.5934 -59.5934 -59.5623 -59.5623 -59.5398 -59.5398 -59.5045 -59.5045 -56.6332 -56.6332 -56.6318 -56.6318 -56.6289 -56.6289 -56.6279 -56.6279 -24.5851 -24.5851 -24.5826 -24.5826 -24.5772 -24.5772 -24.5755 -24.5755 -9.6438 -9.6438 -9.5830 -9.5830 -8.3710 -8.3710 -8.2075 -8.2075 -7.6119 -7.6119 -7.3897 -7.3897 -7.0242 -7.0242 -6.7157 -6.7157 -4.0244 -4.0244 -4.0086 -4.0086 -3.7652 -3.7652 -3.4803 -3.4803 -3.3298 -3.3298 -3.0832 -3.0832 -2.6894 -2.6894 -2.5702 -2.5702 -2.4497 -2.4497 -2.2286 -2.2286 -1.7797 -1.7797 -1.5149 -1.5149 -1.4031 -1.4031 -0.8457 -0.8457 -0.5116 -0.5116 -0.3269 -0.3269 -0.1280 -0.1280 0.0434 0.0434 0.2489 0.2489 0.3505 0.3505 1.4467 1.4467 1.6154 1.6154 2.0655 2.0655 2.2732 2.2732 2.4955 2.4955 2.7091 2.7091 2.9177 2.9177 3.1916 3.1916 4.0916 4.0916 4.2165 4.2165 4.3766 4.3766 4.6709 4.6709 4.8761 4.8761 5.1531 5.1531 5.4551 5.4551 5.7420 5.7420 6.1556 6.1556 6.4690 6.4690 6.6484 6.6484 6.8188 6.8188 k = 0.4118-0.0000-0.0000 ( 12656 PWs) bands (ev): ************************************************************************ -787.0768-787.0768-786.7672-786.7672-786.3940-786.3940-785.8702-785.8702 -102.1495-102.1495-102.1211-102.1211-102.0830-102.0830-101.9892-101.9892 -59.5800 -59.5800 -59.5618 -59.5618 -59.5501 -59.5501 -59.5172 -59.5172 -56.6327 -56.6327 -56.6309 -56.6309 -56.6288 -56.6288 -56.6273 -56.6273 -24.5876 -24.5876 -24.5852 -24.5852 -24.5810 -24.5810 -24.5791 -24.5791 -9.5435 -9.5435 -9.4808 -9.4808 -8.2957 -8.2957 -8.1277 -8.1277 -7.6903 -7.6903 -7.4898 -7.4898 -7.0637 -7.0637 -6.7736 -6.7736 -3.9986 -3.9986 -3.9846 -3.9846 -3.7580 -3.7580 -3.4746 -3.4746 -3.3298 -3.3298 -3.0593 -3.0593 -2.7271 -2.7271 -2.5661 -2.5661 -2.4583 -2.4583 -2.1801 -2.1801 -1.7417 -1.7417 -1.4705 -1.4705 -1.4082 -1.4082 -0.8870 -0.8870 -0.5741 -0.5741 -0.4378 -0.4378 -0.1424 -0.1424 -0.0078 -0.0078 0.2130 0.2130 0.3012 0.3012 1.4423 1.4423 1.5961 1.5961 2.0765 2.0765 2.2522 2.2522 2.5009 2.5009 2.6627 2.6627 2.9052 2.9052 3.1640 3.1640 4.1359 4.1359 4.2201 4.2201 4.4080 4.4080 4.6969 4.6969 4.8551 4.8551 5.1631 5.1631 5.4218 5.4218 5.7204 5.7204 6.1496 6.1496 6.4672 6.4672 6.6037 6.6037 6.8386 6.8386 k = 0.4216-0.0000-0.0000 ( 12656 PWs) bands (ev): ************************************************************************ -787.1170-787.1170-786.7475-786.7475-786.2961-786.2961-785.8853-785.8853 -102.1478-102.1478-102.1234-102.1234-102.0856-102.0856-101.9960-101.9960 -59.5828 -59.5828 -59.5613 -59.5613 -59.5459 -59.5459 -59.5186 -59.5186 -56.6323 -56.6323 -56.6302 -56.6302 -56.6286 -56.6286 -56.6270 -56.6270 -24.5895 -24.5895 -24.5880 -24.5880 -24.5834 -24.5834 -24.5818 -24.5818 -9.4417 -9.4417 -9.3768 -9.3768 -8.2208 -8.2208 -8.0475 -8.0475 -7.7737 -7.7737 -7.5931 -7.5931 -7.1080 -7.1080 -6.8343 -6.8343 -3.9745 -3.9745 -3.9498 -3.9498 -3.7501 -3.7501 -3.4672 -3.4672 -3.3343 -3.3343 -3.0382 -3.0382 -2.7863 -2.7863 -2.5814 -2.5814 -2.4266 -2.4266 -2.1241 -2.1241 -1.7027 -1.7027 -1.4266 -1.4266 -1.4143 -1.4143 -0.9300 -0.9300 -0.6342 -0.6342 -0.5476 -0.5476 -0.1562 -0.1562 -0.0482 -0.0482 0.1748 0.1748 0.2532 0.2532 1.4395 1.4395 1.5772 1.5772 2.0877 2.0877 2.2395 2.2395 2.5018 2.5018 2.6161 2.6161 2.8948 2.8948 3.1373 3.1373 4.1792 4.1792 4.2298 4.2298 4.4335 4.4335 4.7079 4.7079 4.8503 4.8503 5.1718 5.1718 5.3960 5.3960 5.6948 5.6948 6.1506 6.1506 6.4652 6.4652 6.5693 6.5693 6.8604 6.8604 k = 0.4314-0.0000-0.0000 ( 12656 PWs) bands (ev): ************************************************************************ -787.0845-787.0845-786.6968-786.6968-786.2779-786.2779-785.8757-785.8757 -102.1512-102.1512-102.1388-102.1388-102.0735-102.0735-102.0107-102.0107 -59.5826 -59.5826 -59.5597 -59.5597 -59.5395 -59.5395 -59.5261 -59.5261 -56.6320 -56.6320 -56.6298 -56.6298 -56.6287 -56.6287 -56.6272 -56.6272 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-102.1663-102.1663-102.1371-102.1371-102.0805-102.0805-102.0234-102.0234 -59.5894 -59.5894 -59.5624 -59.5624 -59.5378 -59.5378 -59.5297 -59.5297 -56.6319 -56.6319 -56.6298 -56.6298 -56.6285 -56.6285 -56.6272 -56.6272 -24.5935 -24.5935 -24.5924 -24.5924 -24.5884 -24.5884 -24.5868 -24.5868 -9.2340 -9.2340 -9.1640 -9.1640 -8.0868 -8.0868 -7.9421 -7.9421 -7.8884 -7.8884 -7.8028 -7.8028 -7.2099 -7.2099 -6.9634 -6.9634 -3.9223 -3.9223 -3.8659 -3.8659 -3.7311 -3.7311 -3.4463 -3.4463 -3.3565 -3.3565 -3.0033 -3.0033 -2.9201 -2.9201 -2.6500 -2.6500 -2.3052 -2.3052 -1.9952 -1.9952 -1.6305 -1.6305 -1.4481 -1.4481 -1.3294 -1.3294 -1.0156 -1.0156 -0.7885 -0.7885 -0.7098 -0.7098 -0.1870 -0.1870 -0.0951 -0.0951 0.0913 0.0913 0.1636 0.1636 1.4381 1.4381 1.5421 1.5421 2.1114 2.1114 2.2370 2.2370 2.4865 2.4865 2.5264 2.5264 2.8849 2.8849 3.0858 3.0858 4.2452 4.2452 4.2790 4.2790 4.4629 4.4629 4.6807 4.6807 4.8972 4.8972 5.1722 5.1722 5.3732 5.3732 5.6345 5.6345 6.1667 6.1667 6.4223 6.4223 6.5772 6.5772 6.9071 6.9071 k = 0.4510-0.0000-0.0000 ( 12660 PWs) bands (ev): ************************************************************************ -787.2667-787.2667-786.6106-786.6106-786.2313-786.2313-786.0276-786.0276 -102.1487-102.1487-102.1457-102.1457-102.0662-102.0662-102.0498-102.0498 -59.5913 -59.5913 -59.5603 -59.5603 -59.5449 -59.5449 -59.5262 -59.5262 -56.6317 -56.6317 -56.6298 -56.6298 -56.6281 -56.6281 -56.6264 -56.6264 -24.5950 -24.5950 -24.5934 -24.5934 -24.5910 -24.5910 -24.5885 -24.5885 -9.1285 -9.1285 -9.0553 -9.0553 -8.0923 -8.0923 -7.9765 -7.9765 -7.9018 -7.9018 -7.8012 -7.8012 -7.2669 -7.2669 -7.0314 -7.0314 -3.8945 -3.8945 -3.8236 -3.8236 -3.7178 -3.7178 -3.4320 -3.4320 -3.3739 -3.3739 -3.0067 -3.0067 -2.9684 -2.9684 -2.6886 -2.6886 -2.2351 -2.2351 -1.9255 -1.9255 -1.6074 -1.6074 -1.4638 -1.4638 -1.2873 -1.2873 -1.0513 -1.0513 -0.8883 -0.8883 -0.7559 -0.7559 -0.1996 -0.1996 -0.1041 -0.1041 0.0476 0.0476 0.1225 0.1225 1.4396 1.4396 1.5263 1.5263 2.1253 2.1253 2.2442 2.2442 2.4650 2.4650 2.4903 2.4903 2.8868 2.8868 3.0612 3.0612 4.2665 4.2665 4.3165 4.3165 4.4668 4.4668 4.6590 4.6590 4.9312 4.9312 5.1630 5.1630 5.3757 5.3757 5.6024 5.6024 6.1786 6.1786 6.3890 6.3890 6.6126 6.6126 6.9326 6.9326 k = 0.4608-0.0000-0.0000 ( 12660 PWs) bands (ev): ************************************************************************ -787.2381-787.2381-786.5841-786.5841-786.2046-786.2046-786.0583-786.0583 -102.1700-102.1700-102.1261-102.1261-102.0677-102.0677-102.0496-102.0496 -59.5926 -59.5926 -59.5629 -59.5629 -59.5451 -59.5451 -59.5227 -59.5227 -56.6310 -56.6310 -56.6296 -56.6296 -56.6281 -56.6281 -56.6264 -56.6264 -24.5957 -24.5957 -24.5947 -24.5947 -24.5929 -24.5929 -24.5902 -24.5902 -9.0220 -9.0220 -8.9453 -8.9453 -8.1763 -8.1763 -8.0472 -8.0472 -7.8826 -7.8826 -7.7221 -7.7221 -7.3271 -7.3271 -7.1016 -7.1016 -3.8669 -3.8669 -3.7889 -3.7889 -3.6969 -3.6969 -3.4154 -3.4154 -3.3947 -3.3947 -3.0655 -3.0655 -2.9594 -2.9594 -2.7272 -2.7272 -2.1624 -2.1624 -1.8558 -1.8558 -1.6060 -1.6060 -1.4673 -1.4673 -1.2560 -1.2560 -1.0733 -1.0733 -0.9852 -0.9852 -0.7972 -0.7972 -0.2065 -0.2065 -0.1067 -0.1067 0.0048 0.0048 0.0838 0.0838 1.4426 1.4426 1.5118 1.5118 2.1417 2.1417 2.2546 2.2546 2.4314 2.4314 2.4659 2.4659 2.8930 2.8930 3.0373 3.0373 4.2871 4.2871 4.3517 4.3517 4.4664 4.4664 4.6369 4.6369 4.9652 4.9652 5.1498 5.1498 5.3849 5.3849 5.5703 5.5703 6.1918 6.1918 6.3566 6.3566 6.6598 6.6598 6.9599 6.9599 k = 0.4706-0.0000-0.0000 ( 12672 PWs) bands (ev): ************************************************************************ -787.3251-787.3251-786.8417-786.8417-786.4031-786.4031-786.1622-786.1622 -102.1907-102.1907-102.1640-102.1640-102.0920-102.0920-102.0708-102.0708 -59.5907 -59.5907 -59.5727 -59.5727 -59.5521 -59.5521 -59.5439 -59.5439 -56.6317 -56.6317 -56.6298 -56.6298 -56.6288 -56.6288 -56.6279 -56.6279 -24.5971 -24.5971 -24.5959 -24.5959 -24.5948 -24.5948 -24.5937 -24.5937 -8.9148 -8.9148 -8.8342 -8.8342 -8.2756 -8.2756 -8.1558 -8.1558 -7.8157 -7.8157 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-56.6302 -56.6286 -56.6286 -56.6276 -56.6276 -56.6269 -56.6269 -24.5965 -24.5965 -24.5958 -24.5958 -24.5946 -24.5946 -24.5937 -24.5937 -8.8072 -8.8072 -8.7221 -8.7221 -8.3791 -8.3791 -8.2683 -8.2683 -7.7437 -7.7437 -7.5657 -7.5657 -7.4530 -7.4530 -7.2476 -7.2476 -3.8162 -3.8162 -3.7639 -3.7639 -3.6193 -3.6193 -3.4529 -3.4529 -3.3656 -3.3656 -3.1902 -3.1902 -2.9188 -2.9188 -2.8009 -2.8009 -2.0137 -2.0137 -1.7742 -1.7742 -1.6180 -1.6180 -1.4494 -1.4494 -1.2518 -1.2518 -1.1504 -1.1504 -1.0447 -1.0447 -0.8786 -0.8786 -0.1968 -0.1968 -0.1086 -0.1086 -0.0599 -0.0599 0.0143 0.0143 1.4525 1.4525 1.4870 1.4870 2.1837 2.1837 2.2674 2.2674 2.3762 2.3762 2.4221 2.4221 2.9168 2.9168 2.9921 2.9921 4.3289 4.3289 4.3883 4.3883 4.4810 4.4810 4.5894 4.5894 5.0271 5.0271 5.1173 5.1173 5.4158 5.4158 5.5102 5.5102 6.2209 6.2209 6.3001 6.3001 6.7802 6.7802 7.0178 7.0178 k = 0.4902-0.0000-0.0000 ( 12638 PWs) bands (ev): ************************************************************************ -786.8059-786.8059-786.4806-786.4806-785.9929-785.9929-785.7792-785.7792 -102.1184-102.1184-102.0715-102.0715-102.0301-102.0301-101.9616-101.9616 -59.5651 -59.5651 -59.5573 -59.5573 -59.5296 -59.5296 -59.5250 -59.5250 -56.6293 -56.6293 -56.6279 -56.6279 -56.6270 -56.6270 -56.6264 -56.6264 -24.5962 -24.5962 -24.5956 -24.5956 -24.5947 -24.5947 -24.5938 -24.5938 -8.6995 -8.6995 -8.6093 -8.6093 -8.4846 -8.4846 -8.3817 -8.3817 -7.6716 -7.6716 -7.5383 -7.5383 -7.4696 -7.4696 -7.3228 -7.3228 -3.7953 -3.7953 -3.7679 -3.7679 -3.5730 -3.5730 -3.4882 -3.4882 -3.3329 -3.3329 -3.2451 -3.2451 -2.8938 -2.8938 -2.8347 -2.8347 -1.9404 -1.9404 -1.8099 -1.8099 -1.5692 -1.5692 -1.4645 -1.4645 -1.2562 -1.2562 -1.2060 -1.2060 -1.0067 -1.0067 -0.9210 -0.9210 -0.1801 -0.1801 -0.1299 -0.1299 -0.0581 -0.0581 -0.0154 -0.0154 1.4593 1.4593 1.4766 1.4766 2.2087 2.2087 2.2565 2.2565 2.3719 2.3719 2.4009 2.4009 2.9330 2.9330 2.9710 2.9710 4.3489 4.3489 4.3819 4.3819 4.5057 4.5057 4.5628 4.5628 5.0538 5.0538 5.0985 5.0985 5.4358 5.4358 5.4831 5.4831 6.2374 6.2374 6.2765 6.2765 6.8502 6.8502 6.9993 6.9993 k = 0.5000-0.0000-0.0000 ( 12654 PWs) bands (ev): ************************************************************************ -786.8549-786.8549-786.8549-786.8549-786.0223-786.0223-786.0223-786.0223 -102.1297-102.1297-102.1297-102.1297-102.0474-102.0474-102.0474-102.0474 -59.5735 -59.5735 -59.5735 -59.5735 -59.5390 -59.5390 -59.5390 -59.5390 -56.6294 -56.6294 -56.6294 -56.6294 -56.6277 -56.6277 -56.6277 -56.6277 -24.5970 -24.5970 -24.5970 -24.5970 -24.5952 -24.5952 -24.5952 -24.5952 -8.5922 -8.5922 -8.5922 -8.5922 -8.4952 -8.4952 -8.4952 -8.4952 -7.6013 -7.6013 -7.6013 -7.6013 -7.3988 -7.3988 -7.3988 -7.3988 -3.7789 -3.7789 -3.7789 -3.7789 -3.5286 -3.5286 -3.5286 -3.5286 -3.2930 -3.2930 -3.2930 -3.2930 -2.8658 -2.8658 -2.8658 -2.8658 -1.8708 -1.8708 -1.8708 -1.8708 -1.5096 -1.5096 -1.5096 -1.5096 -1.2414 -1.2414 -1.2414 -1.2414 -0.9643 -0.9643 -0.9643 -0.9643 -0.1569 -0.1569 -0.1569 -0.1569 -0.0403 -0.0403 -0.0403 -0.0403 1.4671 1.4671 1.4671 1.4671 2.2342 2.2342 2.2342 2.2342 2.3824 2.3824 2.3824 2.3824 2.9511 2.9511 2.9511 2.9511 4.3671 4.3671 4.3671 4.3671 4.5342 4.5342 4.5342 4.5342 5.0774 5.0774 5.0774 5.0774 5.4581 5.4581 5.4581 5.4581 6.2556 6.2556 6.2556 6.2556 6.9243 6.9243 6.9243 6.9243 k = 0.5000-0.0000-0.0000 ( 12654 PWs) bands (ev): ************************************************************************ -786.8549-786.8549-786.8549-786.8549-786.0223-786.0223-786.0223-786.0223 -102.1297-102.1297-102.1297-102.1297-102.0474-102.0474-102.0474-102.0474 -59.5735 -59.5735 -59.5735 -59.5735 -59.5390 -59.5390 -59.5390 -59.5390 -56.6294 -56.6294 -56.6294 -56.6294 -56.6277 -56.6277 -56.6277 -56.6277 -24.5970 -24.5970 -24.5970 -24.5970 -24.5952 -24.5952 -24.5952 -24.5952 -8.5922 -8.5922 -8.5922 -8.5922 -8.4952 -8.4952 -8.4952 -8.4952 -7.6013 -7.6013 -7.6013 -7.6013 -7.3988 -7.3988 -7.3988 -7.3988 -3.7789 -3.7789 -3.7789 -3.7789 -3.5286 -3.5286 -3.5286 -3.5286 -3.2930 -3.2930 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-24.5939 -8.5918 -8.5918 -8.5917 -8.5917 -8.4948 -8.4948 -8.4946 -8.4946 -7.6025 -7.6025 -7.5989 -7.5989 -7.4006 -7.4006 -7.3957 -7.3957 -3.7834 -3.7834 -3.7803 -3.7803 -3.5321 -3.5321 -3.5305 -3.5305 -3.2967 -3.2967 -3.2955 -3.2955 -2.8720 -2.8720 -2.8704 -2.8704 -1.8737 -1.8737 -1.8650 -1.8650 -1.5086 -1.5086 -1.5056 -1.5056 -1.2494 -1.2494 -1.2311 -1.2311 -0.9687 -0.9687 -0.9547 -0.9547 -0.1671 -0.1671 -0.1403 -0.1403 -0.0357 -0.0357 -0.0340 -0.0340 1.4627 1.4627 1.4749 1.4749 2.2313 2.2313 2.2387 2.2387 2.3771 2.3771 2.3906 2.3906 2.9514 2.9514 2.9529 2.9529 4.3358 4.3358 4.3962 4.3962 4.5077 4.5077 4.5602 4.5602 5.0717 5.0717 5.0867 5.0867 5.4270 5.4270 5.4906 5.4906 6.2459 6.2459 6.2653 6.2653 6.9141 6.9141 6.9375 6.9375 k = 0.5000 0.0194-0.0000 ( 12638 PWs) bands (ev): ************************************************************************ -786.6972-786.6972-786.6388-786.6388-785.9315-785.9315-785.8855-785.8855 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6.9076 6.9515 6.9515 k = 0.5000 0.0291-0.0000 ( 12634 PWs) bands (ev): ************************************************************************ -786.6071-786.6071-786.5984-786.5984-785.8840-785.8840-785.8765-785.8765 -102.0874-102.0874-102.0761-102.0761-102.0020-102.0020-101.9791-101.9791 -59.5557 -59.5557 -59.5523 -59.5523 -59.5240 -59.5240 -59.5193 -59.5193 -56.6285 -56.6285 -56.6271 -56.6271 -56.6259 -56.6259 -56.6250 -56.6250 -24.5952 -24.5952 -24.5948 -24.5948 -24.5939 -24.5939 -24.5933 -24.5933 -8.5886 -8.5886 -8.5884 -8.5884 -8.4916 -8.4916 -8.4908 -8.4908 -7.6030 -7.6030 -7.5919 -7.5919 -7.4011 -7.4011 -7.3865 -7.3865 -3.8098 -3.8098 -3.8010 -3.8010 -3.5554 -3.5554 -3.5505 -3.5505 -3.3236 -3.3236 -3.3208 -3.3208 -2.9149 -2.9149 -2.9106 -2.9106 -1.8734 -1.8734 -1.8464 -1.8464 -1.4968 -1.4968 -1.4806 -1.4806 -1.2571 -1.2571 -1.2035 -1.2035 -0.9606 -0.9606 -0.9242 -0.9242 -0.1676 -0.1676 -0.0928 -0.0928 0.0026 0.0026 0.0131 0.0131 1.4624 1.4624 1.4983 1.4983 2.2284 2.2284 2.2520 2.2520 2.3747 2.3747 2.4132 2.4132 2.9574 2.9574 2.9618 2.9618 4.2684 4.2684 4.4354 4.4354 4.4637 4.4637 4.6062 4.6062 5.0688 5.0688 5.1143 5.1143 5.3712 5.3712 5.5565 5.5565 6.2258 6.2258 6.2818 6.2818 6.9052 6.9052 6.9640 6.9640 k = 0.5000 0.0388-0.0000 ( 12622 PWs) bands (ev): ************************************************************************ -786.3967-786.3967-786.3747-786.3747-785.6825-785.6825-785.6408-785.6408 -102.0638-102.0638-102.0439-102.0439-102.0070-102.0070-101.9723-101.9723 -59.5436 -59.5436 -59.5428 -59.5428 -59.5121 -59.5121 -59.5105 -59.5105 -56.6280 -56.6280 -56.6262 -56.6262 -56.6259 -56.6259 -56.6244 -56.6244 -24.5949 -24.5949 -24.5939 -24.5939 -24.5927 -24.5927 -24.5923 -24.5923 -8.5857 -8.5857 -8.5855 -8.5855 -8.4886 -8.4886 -8.4877 -8.4877 -7.6019 -7.6019 -7.5873 -7.5873 -7.3996 -7.3996 -7.3803 -7.3803 -3.8308 -3.8308 -3.8199 -3.8199 -3.5748 -3.5748 -3.5682 -3.5682 -3.3459 -3.3459 -3.3429 -3.3429 -2.9491 -2.9491 -2.9439 -2.9439 -1.8721 -1.8721 -1.8356 -1.8356 -1.4872 -1.4872 -1.4588 -1.4588 -1.2556 -1.2556 -1.1842 -1.1842 -0.9478 -0.9478 -0.9048 -0.9048 -0.1584 -0.1584 -0.0640 -0.0640 0.0350 0.0350 0.0538 0.0538 1.4668 1.4668 1.5142 1.5142 2.2283 2.2283 2.2617 2.2617 2.3786 2.3786 2.4275 2.4275 2.9635 2.9635 2.9691 2.9691 4.2338 4.2338 4.4174 4.4174 4.4759 4.4759 4.6261 4.6261 5.0699 5.0699 5.1312 5.1312 5.3492 5.3492 5.5898 5.5898 6.2155 6.2155 6.2887 6.2887 6.9066 6.9066 6.9728 6.9728 k = 0.5000 0.0485-0.0000 ( 12640 PWs) bands (ev): ************************************************************************ -786.5822-786.5822-786.5500-786.5500-785.8789-785.8789-785.8752-785.8752 -102.1218-102.1218-102.1065-102.1065-102.0234-102.0234-101.9922-101.9922 -59.5605 -59.5605 -59.5565 -59.5565 -59.5290 -59.5290 -59.5230 -59.5230 -56.6292 -56.6292 -56.6280 -56.6280 -56.6268 -56.6268 -56.6252 -56.6252 -24.5966 -24.5966 -24.5950 -24.5950 -24.5941 -24.5941 -24.5938 -24.5938 -8.5821 -8.5821 -8.5818 -8.5818 -8.4849 -8.4849 -8.4837 -8.4837 -7.6001 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0.9862 0.9862 1.8271 1.8271 1.9144 1.9144 2.6896 2.6896 2.7517 2.7517 3.3620 3.3620 3.4680 3.4680 3.5376 3.5376 3.6423 3.6423 4.2147 4.2147 4.3642 4.3642 4.6005 4.6005 4.6215 4.6215 4.9919 4.9919 5.4408 5.4408 5.5780 5.5780 5.8118 5.8118 6.0375 6.0375 6.2525 6.2525 6.5970 6.5970 6.8258 6.8258 k = 0.5000 0.2231-0.0000 ( 12608 PWs) bands (ev): ************************************************************************ -786.2594-786.2594-786.2003-786.2003-786.0164-786.0164-785.7025-785.7025 -102.0138-102.0138-101.9898-101.9898-101.9372-101.9372-101.8705-101.8705 -59.5388 -59.5388 -59.5366 -59.5366 -59.5166 -59.5166 -59.4919 -59.4919 -56.6310 -56.6310 -56.6278 -56.6278 -56.6261 -56.6261 -56.6260 -56.6260 -24.5949 -24.5949 -24.5943 -24.5943 -24.5917 -24.5917 -24.5914 -24.5914 -8.4441 -8.4441 -8.4439 -8.4439 -8.3388 -8.3388 -8.3364 -8.3364 -7.4740 -7.4740 -7.4466 -7.4466 -7.2070 -7.2070 -7.1680 -7.1680 -4.5523 -4.5523 -4.5506 -4.5506 -4.3612 -4.3612 -4.3428 -4.3428 -4.1479 -4.1479 -4.1337 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5.4210 5.4210 5.5405 5.5405 5.9231 5.9231 6.0996 6.0996 6.5068 6.5068 6.5522 6.5522 k = 0.4608 0.3007-0.0000 ( 12636 PWs) bands (ev): ************************************************************************ -786.7097-786.7097-786.4092-786.4092-786.2054-786.2054-785.9854-785.9854 -102.0682-102.0682-102.0589-102.0589-101.9937-101.9937-101.9885-101.9885 -59.5712 -59.5712 -59.5572 -59.5572 -59.5317 -59.5317 -59.5198 -59.5198 -56.6342 -56.6342 -56.6338 -56.6338 -56.6295 -56.6295 -56.6284 -56.6284 -24.5939 -24.5939 -24.5934 -24.5934 -24.5905 -24.5905 -24.5902 -24.5902 -8.7501 -8.7501 -8.7444 -8.7444 -8.0336 -8.0336 -8.0253 -8.0253 -7.4965 -7.4965 -7.4490 -7.4490 -7.2034 -7.2034 -7.1460 -7.1460 -4.7943 -4.7943 -4.7449 -4.7449 -4.4504 -4.4504 -4.3095 -4.3095 -4.2087 -4.2087 -4.1369 -4.1369 -3.9492 -3.9492 -3.9364 -3.9364 -1.8568 -1.8568 -1.8181 -1.8181 -1.1365 -1.1365 -1.0579 -1.0579 -0.5901 -0.5901 -0.4223 -0.4223 -0.2761 -0.2761 -0.1141 -0.1141 0.2890 0.2890 0.4082 0.4082 0.9063 0.9063 1.0080 1.0080 1.8840 1.8840 1.9556 1.9556 2.8235 2.8235 2.8463 2.8463 3.7450 3.7450 3.8145 3.8145 4.3018 4.3018 4.3140 4.3140 4.4159 4.4159 4.5094 4.5094 4.5697 4.5697 4.7853 4.7853 5.2255 5.2255 5.2469 5.2469 5.4311 5.4311 5.5547 5.5547 5.9174 5.9174 6.1428 6.1428 6.5138 6.5138 6.5760 6.5760 k = 0.4510 0.3007-0.0000 ( 12638 PWs) bands (ev): ************************************************************************ -786.7482-786.7482-786.4625-786.4625-786.3246-786.3246-785.9787-785.9787 -102.0851-102.0851-102.0492-102.0492-102.0044-102.0044-101.9902-101.9902 -59.5771 -59.5771 -59.5522 -59.5522 -59.5297 -59.5297 -59.5188 -59.5188 -56.6348 -56.6348 -56.6347 -56.6347 -56.6293 -56.6293 -56.6288 -56.6288 -24.5927 -24.5927 -24.5919 -24.5919 -24.5888 -24.5888 -24.5886 -24.5886 -8.8479 -8.8479 -8.8427 -8.8427 -7.9706 -7.9706 -7.9638 -7.9638 -7.5241 -7.5241 -7.4638 -7.4638 -7.2269 -7.2269 -7.1562 -7.1562 -4.8189 -4.8189 -4.7764 -4.7764 -4.4059 -4.4059 -4.2824 -4.2824 -4.1476 -4.1476 -4.0939 -4.0939 -3.8953 -3.8953 -3.8765 -3.8765 -1.8806 -1.8806 -1.8345 -1.8345 -1.1655 -1.1655 -1.0734 -1.0734 -0.6146 -0.6146 -0.4408 -0.4408 -0.2574 -0.2574 -0.0963 -0.0963 0.2878 0.2878 0.4303 0.4303 0.9171 0.9171 1.0330 1.0330 1.8723 1.8723 1.9581 1.9581 2.8139 2.8139 2.8427 2.8427 3.6923 3.6923 3.7694 3.7694 4.2921 4.2921 4.3067 4.3067 4.4276 4.4276 4.5218 4.5218 4.6138 4.6138 4.8412 4.8412 5.1798 5.1798 5.2376 5.2376 5.4496 5.4496 5.5651 5.5651 5.9199 5.9199 6.1876 6.1876 6.5258 6.5258 6.6059 6.6059 k = 0.4412 0.3007-0.0000 ( 12634 PWs) bands (ev): ************************************************************************ -786.5380-786.5380-786.5347-786.5347-786.2860-786.2860-785.8222-785.8222 -102.0574-102.0574-102.0394-102.0394-102.0058-102.0058-101.9959-101.9959 -59.5727 -59.5727 -59.5494 -59.5494 -59.5242 -59.5242 -59.5225 -59.5225 -56.6349 -56.6349 -56.6345 -56.6345 -56.6301 -56.6301 -56.6288 -56.6288 -24.5908 -24.5908 -24.5902 -24.5902 -24.5867 -24.5867 -24.5866 -24.5866 -8.9462 -8.9462 -8.9415 -8.9415 -7.9175 -7.9175 -7.9139 -7.9139 -7.5554 -7.5554 -7.4817 -7.4817 -7.2509 -7.2509 -7.1682 -7.1682 -4.8363 -4.8363 -4.7999 -4.7999 -4.3574 -4.3574 -4.2534 -4.2534 -4.0797 -4.0797 -4.0460 -4.0460 -3.8327 -3.8327 -3.8085 -3.8085 -1.9077 -1.9077 -1.8555 -1.8555 -1.1961 -1.1961 -1.0936 -1.0936 -0.6386 -0.6386 -0.4687 -0.4687 -0.2310 -0.2310 -0.0834 -0.0834 0.2914 0.2914 0.4541 0.4541 0.9350 0.9350 1.0589 1.0589 1.8607 1.8607 1.9584 1.9584 2.8026 2.8026 2.8376 2.8376 3.6396 3.6396 3.7225 3.7225 4.2787 4.2787 4.2942 4.2942 4.4408 4.4408 4.5346 4.5346 4.6636 4.6636 4.8893 4.8893 5.1315 5.1315 5.2348 5.2348 5.4741 5.4741 5.5746 5.5746 5.9307 5.9307 6.2337 6.2337 6.5437 6.5437 6.6421 6.6421 k = 0.4314 0.3007-0.0000 ( 12614 PWs) bands (ev): ************************************************************************ -786.3459-786.3459-786.2806-786.2806-786.0148-786.0148-785.5114-785.5114 -102.0175-102.0175-102.0151-102.0151-101.9543-101.9543-101.9249-101.9249 -59.5625 -59.5625 -59.5356 -59.5356 -59.5122 -59.5122 -59.5064 -59.5064 -56.6347 -56.6347 -56.6340 -56.6340 -56.6288 -56.6288 -56.6279 -56.6279 -24.5882 -24.5882 -24.5873 -24.5873 -24.5838 -24.5838 -24.5835 -24.5835 -9.0444 -9.0444 -9.0401 -9.0401 -7.8778 -7.8778 -7.8764 -7.8764 -7.5894 -7.5894 -7.5028 -7.5028 -7.2733 -7.2733 -7.1811 -7.1811 -4.8447 -4.8447 -4.8135 -4.8135 -4.3053 -4.3053 -4.2193 -4.2193 -4.0085 -4.0085 -3.9932 -3.9932 -3.7626 -3.7626 -3.7342 -3.7342 -1.9376 -1.9376 -1.8807 -1.8807 -1.2275 -1.2275 -1.1177 -1.1177 -0.6622 -0.6622 -0.5012 -0.5012 -0.2027 -0.2027 -0.0764 -0.0764 0.3009 0.3009 0.4804 0.4804 0.9600 0.9600 1.0857 1.0857 1.8492 1.8492 1.9565 1.9565 2.7893 2.7893 2.8309 2.8309 3.5884 3.5884 3.6758 3.6758 4.2634 4.2634 4.2789 4.2789 4.4528 4.4528 4.5467 4.5467 4.7136 4.7136 4.9224 4.9224 5.0842 5.0842 5.2429 5.2429 5.5037 5.5037 5.5863 5.5863 5.9501 5.9501 6.2810 6.2810 6.5678 6.5678 6.6847 6.6847 k = 0.4216 0.3007-0.0000 ( 12626 PWs) bands (ev): ************************************************************************ -786.5927-786.5927-786.4213-786.4213-786.0191-786.0191-785.6813-785.6813 -102.0483-102.0483-102.0308-102.0308-101.9729-101.9729-101.9585-101.9585 -59.5721 -59.5721 -59.5431 -59.5431 -59.5281 -59.5281 -59.5161 -59.5161 -56.6359 -56.6359 -56.6346 -56.6346 -56.6297 -56.6297 -56.6295 -56.6295 -24.5867 -24.5867 -24.5863 -24.5863 -24.5823 -24.5823 -24.5819 -24.5819 -9.1423 -9.1423 -9.1384 -9.1384 -7.8572 -7.8572 -7.8492 -7.8492 -7.6258 -7.6258 -7.5279 -7.5279 -7.2922 -7.2922 -7.1942 -7.1942 -4.8429 -4.8429 -4.8161 -4.8161 -4.2503 -4.2503 -4.1805 -4.1805 -3.9360 -3.9360 -3.9352 -3.9352 -3.6869 -3.6869 -3.6557 -3.6557 -1.9700 -1.9700 -1.9098 -1.9098 -1.2594 -1.2594 -1.1452 -1.1452 -0.6856 -0.6856 -0.5366 -0.5366 -0.1761 -0.1761 -0.0759 -0.0759 0.3163 0.3163 0.5092 0.5092 0.9910 0.9910 1.1130 1.1130 1.8377 1.8377 1.9519 1.9519 2.7739 2.7739 2.8224 2.8224 3.5393 3.5393 3.6303 3.6303 4.2465 4.2465 4.2613 4.2613 4.4616 4.4616 4.5558 4.5558 4.7589 4.7589 4.9361 4.9361 5.0421 5.0421 5.2630 5.2630 5.5381 5.5381 5.6034 5.6034 5.9785 5.9785 6.3297 6.3297 6.5970 6.5970 6.7329 6.7329 k = 0.4118 0.3007-0.0000 ( 12610 PWs) bands (ev): ************************************************************************ -786.3834-786.3834-786.3199-786.3199-785.7443-785.7443-785.4797-785.4797 -102.0038-102.0038-101.9882-101.9882-101.9361-101.9361-101.9152-101.9152 -59.5583 -59.5583 -59.5367 -59.5367 -59.5170 -59.5170 -59.5098 -59.5098 -56.6353 -56.6353 -56.6345 -56.6345 -56.6291 -56.6291 -56.6290 -56.6290 -24.5836 -24.5836 -24.5832 -24.5832 -24.5786 -24.5786 -24.5778 -24.5778 -9.2394 -9.2394 -9.2359 -9.2359 -7.8522 -7.8522 -7.8371 -7.8371 -7.6629 -7.6629 -7.5577 -7.5577 -7.3060 -7.3060 -7.2068 -7.2068 -4.8296 -4.8296 -4.8065 -4.8065 -4.1917 -4.1917 -4.1368 -4.1368 -3.8749 -3.8749 -3.8598 -3.8598 -3.6068 -3.6068 -3.5740 -3.5740 -2.0043 -2.0043 -1.9421 -1.9421 -1.2911 -1.2911 -1.1753 -1.1753 -0.7082 -0.7082 -0.5732 -0.5732 -0.1525 -0.1525 -0.0812 -0.0812 0.3384 0.3384 0.5414 0.5414 1.0283 1.0283 1.1409 1.1409 1.8264 1.8264 1.9450 1.9450 2.7566 2.7566 2.8124 2.8124 3.4933 3.4933 3.5873 3.5873 4.2288 4.2288 4.2427 4.2427 4.4661 4.4661 4.5606 4.5606 4.7919 4.7919 4.9326 4.9326 5.0131 5.0131 5.2910 5.2910 5.5777 5.5777 5.6296 5.6296 6.0174 6.0174 6.3807 6.3807 6.6312 6.6312 6.7861 6.7861 k = 0.4020 0.3007-0.0000 ( 12614 PWs) bands (ev): ************************************************************************ -786.5434-786.5434-786.1592-786.1592-785.8646-785.8646-785.4680-785.4680 -102.0188-102.0188-101.9935-101.9935-101.9615-101.9615-101.9389-101.9389 -59.5601 -59.5601 -59.5365 -59.5365 -59.5145 -59.5145 -59.5085 -59.5085 -56.6364 -56.6364 -56.6345 -56.6345 -56.6297 -56.6297 -56.6295 -56.6295 -24.5808 -24.5808 -24.5805 -24.5805 -24.5756 -24.5756 -24.5749 -24.5749 -9.3357 -9.3357 -9.3324 -9.3324 -7.8613 -7.8613 -7.8409 -7.8409 -7.6999 -7.6999 -7.5933 -7.5933 -7.3152 -7.3152 -7.2192 -7.2192 -4.8041 -4.8041 -4.7840 -4.7840 -4.1303 -4.1303 -4.0892 -4.0892 -3.8104 -3.8104 -3.7827 -3.7827 -3.5236 -3.5236 -3.4905 -3.4905 -2.0402 -2.0402 -1.9771 -1.9771 -1.3226 -1.3226 -1.2076 -1.2076 -0.7305 -0.7305 -0.6109 -0.6109 -0.1331 -0.1331 -0.0922 -0.0922 0.3666 0.3666 0.5767 0.5767 1.0705 1.0705 1.1692 1.1692 1.8149 1.8149 1.9355 1.9355 2.7373 2.7373 2.8008 2.8008 3.4505 3.4505 3.5470 3.5470 4.2098 4.2098 4.2224 4.2224 4.4650 4.4650 4.5586 4.5586 4.8025 4.8025 4.9167 4.9167 5.0085 5.0085 5.3205 5.3205 5.6228 5.6228 5.6666 5.6666 6.0675 6.0675 6.4337 6.4337 6.6688 6.6688 6.8418 6.8418 k = 0.3922 0.3007-0.0000 ( 12606 PWs) bands (ev): ************************************************************************ -786.3889-786.3889-786.1163-786.1163-785.6267-785.6267-785.4699-785.4699 -102.0003-102.0003-101.9623-101.9623-101.9295-101.9295-101.9183-101.9183 -59.5530 -59.5530 -59.5342 -59.5342 -59.5165 -59.5165 -59.5014 -59.5014 -56.6367 -56.6367 -56.6337 -56.6337 -56.6292 -56.6292 -56.6290 -56.6290 -24.5777 -24.5777 -24.5774 -24.5774 -24.5717 -24.5717 -24.5716 -24.5716 -9.4308 -9.4308 -9.4278 -9.4278 -7.8819 -7.8819 -7.8598 -7.8598 -7.7362 -7.7362 -7.6343 -7.6343 -7.3218 -7.3218 -7.2320 -7.2320 -4.7659 -4.7659 -4.7484 -4.7484 -4.0664 -4.0664 -4.0380 -4.0380 -3.7433 -3.7433 -3.7043 -3.7043 -3.4382 -3.4382 -3.4060 -3.4060 -2.0770 -2.0770 -2.0140 -2.0140 -1.3536 -1.3536 -1.2415 -1.2415 -0.7518 -0.7518 -0.6489 -0.6489 -0.1181 -0.1181 -0.1079 -0.1079 0.4012 0.4012 0.6149 0.6149 1.1172 1.1172 1.1981 1.1981 1.8034 1.8034 1.9236 1.9236 2.7160 2.7160 2.7877 2.7877 3.4117 3.4117 3.5101 3.5101 4.1899 4.1899 4.2011 4.2011 4.4576 4.4576 4.5481 4.5481 4.7892 4.7892 4.8934 4.8934 5.0313 5.0313 5.3485 5.3485 5.6736 5.6736 5.7140 5.7140 6.1299 6.1299 6.4879 6.4879 6.7095 6.7095 6.8923 6.8923 k = 0.3824 0.3007-0.0000 ( 12620 PWs) bands (ev): ************************************************************************ -786.6198-786.6198-786.4191-786.4191-785.7470-785.7470-785.7155-785.7155 -102.0258-102.0258-102.0114-102.0114-101.9482-101.9482-101.9308-101.9308 -59.5666 -59.5666 -59.5514 -59.5514 -59.5225 -59.5225 -59.5042 -59.5042 -56.6377 -56.6377 -56.6355 -56.6355 -56.6302 -56.6302 -56.6297 -56.6297 -24.5752 -24.5752 -24.5747 -24.5747 -24.5691 -24.5691 -24.5684 -24.5684 -9.5246 -9.5246 -9.5219 -9.5219 -7.9115 -7.9115 -7.8910 -7.8910 -7.7728 -7.7728 -7.6803 -7.6803 -7.3284 -7.3284 -7.2462 -7.2462 -4.7149 -4.7149 -4.6995 -4.6995 -4.0007 -4.0007 -3.9843 -3.9843 -3.6744 -3.6744 -3.6250 -3.6250 -3.3517 -3.3517 -3.3215 -3.3215 -2.1142 -2.1142 -2.0519 -2.0519 -1.3841 -1.3841 -1.2767 -1.2767 -0.7723 -0.7723 -0.6873 -0.6873 -0.1276 -0.1276 -0.1072 -0.1072 0.4409 0.4409 0.6554 0.6554 1.1679 1.1679 1.2275 1.2275 1.7918 1.7918 1.9093 1.9093 2.6928 2.6928 2.7733 2.7733 3.3768 3.3768 3.4766 3.4766 4.1686 4.1686 4.1781 4.1781 4.4433 4.4433 4.5275 4.5275 4.7632 4.7632 4.8651 4.8651 5.0714 5.0714 5.3755 5.3755 5.7301 5.7301 5.7694 5.7694 6.2043 6.2043 6.5403 6.5403 6.7541 6.7541 6.9061 6.9061 k = 0.3725 0.3007-0.0000 ( 12620 PWs) bands (ev): ************************************************************************ -786.5175-786.5175-786.3727-786.3727-785.8642-785.8642-785.6641-785.6641 -102.0341-102.0341-102.0328-102.0328-101.9525-101.9525-101.8979-101.8979 -59.5641 -59.5641 -59.5513 -59.5513 -59.5230 -59.5230 -59.5067 -59.5067 -56.6387 -56.6387 -56.6364 -56.6364 -56.6304 -56.6304 -56.6299 -56.6299 -24.5719 -24.5719 -24.5708 -24.5708 -24.5652 -24.5652 -24.5646 -24.5646 -9.6169 -9.6169 -9.6144 -9.6144 -7.9477 -7.9477 -7.9307 -7.9307 -7.8110 -7.8110 -7.7299 -7.7299 -7.3374 -7.3374 -7.2629 -7.2629 -4.6511 -4.6511 -4.6377 -4.6377 -3.9332 -3.9332 -3.9285 -3.9285 -3.6043 -3.6043 -3.5453 -3.5453 -3.2648 -3.2648 -3.2380 -3.2380 -2.1511 -2.1511 -2.0899 -2.0899 -1.4138 -1.4138 -1.3126 -1.3126 -0.7914 -0.7914 -0.7254 -0.7254 -0.1499 -0.1499 -0.0998 -0.0998 0.4853 0.4853 0.6981 0.6981 1.2220 1.2220 1.2573 1.2573 1.7801 1.7801 1.8930 1.8930 2.6677 2.6677 2.7575 2.7575 3.3467 3.3467 3.4472 3.4472 4.1462 4.1462 4.1538 4.1538 4.4227 4.4227 4.4976 4.4976 4.7332 4.7332 4.8333 4.8333 5.1209 5.1209 5.4043 5.4043 5.7924 5.7924 5.8304 5.8304 6.2902 6.2902 6.5855 6.5855 6.8059 6.8059 6.8862 6.8862 k = 0.3627 0.3007-0.0000 ( 12620 PWs) bands (ev): ************************************************************************ -786.4917-786.4917-786.3370-786.3370-786.0197-786.0197-785.7081-785.7081 -102.0272-102.0272-102.0241-102.0241-101.9517-101.9517-101.8858-101.8858 -59.5617 -59.5617 -59.5504 -59.5504 -59.5274 -59.5274 -59.5123 -59.5123 -56.6391 -56.6391 -56.6368 -56.6368 -56.6310 -56.6310 -56.6303 -56.6303 -24.5685 -24.5685 -24.5672 -24.5672 -24.5613 -24.5613 -24.5604 -24.5604 -9.7076 -9.7076 -9.7054 -9.7054 -7.9885 -7.9885 -7.9758 -7.9758 -7.8520 -7.8520 -7.7825 -7.7825 -7.3500 -7.3500 -7.2827 -7.2827 -4.5753 -4.5753 -4.5637 -4.5637 -3.8715 -3.8715 -3.8644 -3.8644 -3.5340 -3.5340 -3.4656 -3.4656 -3.1781 -3.1781 -3.1564 -3.1564 -2.1868 -2.1868 -2.1267 -2.1267 -1.4426 -1.4426 -1.3491 -1.3491 -0.8092 -0.8092 -0.7631 -0.7631 -0.1743 -0.1743 -0.0951 -0.0951 0.5330 0.5330 0.7424 0.7424 1.2789 1.2789 1.2876 1.2876 1.7685 1.7685 1.8752 1.8752 2.6408 2.6408 2.7406 2.7406 3.3214 3.3214 3.4218 3.4218 4.1225 4.1225 4.1281 4.1281 4.3967 4.3967 4.4599 4.4599 4.7018 4.7018 4.7983 4.7983 5.1761 5.1761 5.4373 5.4373 5.8602 5.8602 5.8949 5.8949 6.3861 6.3861 6.6181 6.6181 6.8568 6.8568 6.8678 6.8678 k = 0.3529 0.3007-0.0000 ( 12632 PWs) bands (ev): ************************************************************************ -786.6327-786.6327-786.5111-786.5111-786.1793-786.1793-785.8512-785.8512 -102.0557-102.0557-102.0479-102.0479-101.9519-101.9519-101.9371-101.9371 -59.5728 -59.5728 -59.5554 -59.5554 -59.5310 -59.5310 -59.5261 -59.5261 -56.6406 -56.6406 -56.6380 -56.6380 -56.6321 -56.6321 -56.6311 -56.6311 -24.5648 -24.5648 -24.5640 -24.5640 -24.5576 -24.5576 -24.5567 -24.5567 -9.7967 -9.7967 -9.7946 -9.7946 -8.0328 -8.0328 -8.0243 -8.0243 -7.8959 -7.8959 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-56.6379 -56.6379 -56.6318 -56.6318 -56.6312 -56.6312 -24.5596 -24.5596 -24.5589 -24.5589 -24.5527 -24.5527 -24.5513 -24.5513 -9.8839 -9.8839 -9.8820 -9.8820 -8.0792 -8.0792 -8.0746 -8.0746 -7.9424 -7.9424 -7.8929 -7.8929 -7.3885 -7.3885 -7.3334 -7.3334 -4.3904 -4.3904 -4.3825 -4.3825 -3.7574 -3.7574 -3.7252 -3.7252 -3.3959 -3.3959 -3.3102 -3.3102 -3.0084 -3.0084 -3.0045 -3.0045 -2.2506 -2.2506 -2.1911 -2.1911 -1.4973 -1.4973 -1.4224 -1.4224 -0.8394 -0.8394 -0.8358 -0.8358 -0.2255 -0.2255 -0.0910 -0.0910 0.6354 0.6354 0.8347 0.8347 1.3483 1.3483 1.3983 1.3983 1.7467 1.7467 1.8371 1.8371 2.5819 2.5819 2.7034 2.7034 3.2865 3.2865 3.3834 3.3834 4.0703 4.0703 4.0739 4.0739 4.3345 4.3345 4.3699 4.3699 4.6356 4.6356 4.7198 4.7198 5.2991 5.2991 5.5208 5.5208 6.0104 6.0104 6.0300 6.0300 6.6006 6.6006 6.6400 6.6400 6.7882 6.7882 7.0093 7.0093 k = 0.3333 0.3007-0.0000 ( 12614 PWs) bands (ev): ************************************************************************ -786.4816-786.4816-786.4255-786.4255-785.7029-785.7029-785.6061-785.6061 -102.0235-102.0235-102.0054-102.0054-101.9078-101.9078-101.8982-101.8982 -59.5547 -59.5547 -59.5392 -59.5392 -59.5212 -59.5212 -59.5165 -59.5165 -56.6404 -56.6404 -56.6385 -56.6385 -56.6324 -56.6324 -56.6320 -56.6320 -24.5551 -24.5551 -24.5544 -24.5544 -24.5481 -24.5481 -24.5465 -24.5465 -9.9692 -9.9692 -9.9674 -9.9674 -8.1273 -8.1273 -8.1261 -8.1261 -7.9912 -7.9912 -7.9498 -7.9498 -7.4143 -7.4143 -7.3641 -7.3641 -4.2834 -4.2834 -4.2777 -4.2777 -3.7016 -3.7016 -3.6559 -3.6559 -3.3299 -3.3299 -3.2363 -3.2363 -2.9374 -2.9374 -2.9273 -2.9273 -2.2756 -2.2756 -2.2147 -2.2147 -1.5229 -1.5229 -1.4586 -1.4586 -0.8705 -0.8705 -0.8516 -0.8516 -0.2508 -0.2508 -0.0904 -0.0904 0.6884 0.6884 0.8820 0.8820 1.3778 1.3778 1.4585 1.4585 1.7379 1.7379 1.8192 1.8192 2.5498 2.5498 2.6834 2.6834 3.2772 3.2772 3.3703 3.3703 4.0417 4.0417 4.0462 4.0462 4.3017 4.3017 4.3215 4.3215 4.6004 4.6004 4.6769 4.6769 5.3654 5.3654 5.5718 5.5718 6.0914 6.0914 6.0989 6.0989 6.6337 6.6337 6.7132 6.7132 6.7545 6.7545 7.0642 7.0642 k = 0.3235 0.3007-0.0000 ( 12620 PWs) bands (ev): ************************************************************************ -786.5642-786.5642-786.5603-786.5603-785.7634-785.7634-785.6426-785.6426 -102.0453-102.0453-102.0303-102.0303-101.9106-101.9106-101.9022-101.9022 -59.5560 -59.5560 -59.5447 -59.5447 -59.5266 -59.5266 -59.5138 -59.5138 -56.6413 -56.6413 -56.6397 -56.6397 -56.6333 -56.6333 -56.6330 -56.6330 -24.5512 -24.5512 -24.5495 -24.5495 -24.5437 -24.5437 -24.5420 -24.5420 -10.0525 -10.0525 -10.0509 -10.0509 -8.1782 -8.1782 -8.1764 -8.1764 -8.0416 -8.0416 -8.0072 -8.0072 -7.4439 -7.4439 -7.3980 -7.3980 -4.1682 -4.1682 -4.1652 -4.1652 -3.6478 -3.6478 -3.5874 -3.5874 -3.2673 -3.2673 -3.1668 -3.1668 -2.8789 -2.8789 -2.8502 -2.8502 -2.2935 -2.2935 -2.2295 -2.2295 -1.5470 -1.5470 -1.4941 -1.4941 -0.9036 -0.9036 -0.8619 -0.8619 -0.2751 -0.2751 -0.0900 -0.0900 0.7414 0.7414 0.9298 0.9298 1.4059 1.4059 1.5159 1.5159 1.7315 1.7315 1.8049 1.8049 2.5162 2.5162 2.6625 2.6625 3.2730 3.2730 3.3608 3.3608 4.0112 4.0112 4.0191 4.0191 4.2700 4.2700 4.2724 4.2724 4.5641 4.5641 4.6320 4.6320 5.4340 5.4340 5.6286 5.6286 6.1671 6.1671 6.1749 6.1749 6.6197 6.6197 6.7147 6.7147 6.8351 6.8351 7.0959 7.0959 k = 0.3137 0.3007-0.0000 ( 12632 PWs) bands (ev): ************************************************************************ -786.7000-786.7000-786.6850-786.6850-785.8249-785.8249-785.7919-785.7919 -102.0887-102.0887-102.0472-102.0472-101.9408-101.9408-101.9201-101.9201 -59.5693 -59.5693 -59.5549 -59.5549 -59.5276 -59.5276 -59.5257 -59.5257 -56.6427 -56.6427 -56.6413 -56.6413 -56.6350 -56.6350 -56.6343 -56.6343 -24.5477 -24.5477 -24.5455 -24.5455 -24.5396 -24.5396 -24.5375 -24.5375 -10.1338 -10.1338 -10.1323 -10.1323 -8.2305 -8.2305 -8.2261 -8.2261 -8.0932 -8.0932 -8.0647 -8.0647 -7.4769 -7.4769 -7.4347 -7.4347 -4.0463 -4.0463 -4.0461 -4.0461 -3.5968 -3.5968 -3.5201 -3.5201 -3.2091 -3.2091 -3.1032 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************************************************************************ -786.8071-786.8071-786.6984-786.6984-785.8275-785.8275-785.7958-785.7958 -102.1156-102.1156-102.0844-102.0844-102.0047-102.0047-101.9823-101.9823 -59.5687 -59.5687 -59.5573 -59.5573 -59.5444 -59.5444 -59.5372 -59.5372 -56.6452 -56.6452 -56.6452 -56.6452 -56.6382 -56.6382 -56.6374 -56.6374 -24.5338 -24.5338 -24.5332 -24.5332 -24.5241 -24.5241 -24.5236 -24.5236 -10.3648 -10.3648 -10.3637 -10.3637 -8.3854 -8.3854 -8.3755 -8.3755 -8.2504 -8.2504 -8.2352 -8.2352 -7.5897 -7.5897 -7.5562 -7.5562 -3.6737 -3.6737 -3.6542 -3.6542 -3.4621 -3.4621 -3.3253 -3.3253 -3.0706 -3.0706 -2.9622 -2.9622 -2.7490 -2.7490 -2.6042 -2.6042 -2.2452 -2.2452 -2.1649 -2.1649 -1.6236 -1.6236 -1.6196 -1.6196 -1.0157 -1.0157 -0.8774 -0.8774 -0.3479 -0.3479 -0.0801 -0.0801 0.9366 0.9366 1.1177 1.1177 1.4916 1.4916 1.6112 1.6112 1.7511 1.7511 1.8936 1.8936 2.3734 2.3734 2.5801 2.5801 3.3025 3.3025 3.3461 3.3461 3.8779 3.8779 3.9317 3.9317 4.0889 4.0889 4.1788 4.1788 4.4241 4.4241 4.4508 4.4508 5.7178 5.7178 5.8903 5.8903 6.3645 6.3645 6.4109 6.4109 6.6317 6.6317 6.6387 6.6387 7.1420 7.1420 7.2103 7.2103 k = 0.2745 0.3007-0.0000 ( 12638 PWs) bands (ev): ************************************************************************ -786.8060-786.8060-786.6124-786.6124-785.6716-785.6716-785.5662-785.5662 -102.0942-102.0942-102.0737-102.0737-101.9976-101.9976-101.9660-101.9660 -59.5646 -59.5646 -59.5429 -59.5429 -59.5370 -59.5370 -59.5329 -59.5329 -56.6456 -56.6456 -56.6453 -56.6453 -56.6385 -56.6385 -56.6375 -56.6375 -24.5278 -24.5278 -24.5274 -24.5274 -24.5184 -24.5184 -24.5178 -24.5178 -10.4374 -10.4374 -10.4363 -10.4363 -8.4355 -8.4355 -8.4243 -8.4243 -8.3026 -8.3026 -8.2907 -8.2907 -7.6302 -7.6302 -7.5990 -7.5990 -3.5569 -3.5569 -3.5299 -3.5299 -3.4168 -3.4168 -3.2610 -3.2610 -3.0363 -3.0363 -2.9327 -2.9327 -2.7320 -2.7320 -2.5559 -2.5559 -2.2026 -2.2026 -2.1230 -2.1230 -1.6427 -1.6427 -1.6360 -1.6360 -1.0371 -1.0371 -0.8738 -0.8738 -0.3568 -0.3568 -0.0734 -0.0734 0.9748 0.9748 1.1594 1.1594 1.5086 1.5086 1.6046 1.6046 1.7680 1.7680 1.9485 1.9485 2.3406 2.3406 2.5631 2.5631 3.3178 3.3178 3.3446 3.3446 3.8457 3.8457 3.9150 3.9150 4.0527 4.0527 4.1657 4.1657 4.3963 4.3963 4.4124 4.4124 5.7862 5.7862 5.9573 5.9573 6.3689 6.3689 6.3949 6.3949 6.6566 6.6566 6.7021 6.7021 7.1565 7.1565 7.2376 7.2376 k = 0.2647 0.3007-0.0000 ( 12642 PWs) bands (ev): ************************************************************************ -786.8220-786.8220-786.6569-786.6569-785.6516-785.6516-785.5331-785.5331 -102.1008-102.1008-102.0856-102.0856-102.0170-102.0170-101.9802-101.9802 -59.5645 -59.5645 -59.5478 -59.5478 -59.5385 -59.5385 -59.5362 -59.5362 -56.6466 -56.6466 -56.6463 -56.6463 -56.6391 -56.6391 -56.6388 -56.6388 -24.5225 -24.5225 -24.5219 -24.5219 -24.5136 -24.5136 -24.5130 -24.5130 -10.5076 -10.5076 -10.5067 -10.5067 -8.4847 -8.4847 -8.4724 -8.4724 -8.3543 -8.3543 -8.3454 -8.3454 -7.6714 -7.6714 -7.6423 -7.6423 -3.4554 -3.4554 -3.4464 -3.4464 -3.3403 -3.3403 -3.1976 -3.1976 -3.0004 -3.0004 -2.9068 -2.9068 -2.7132 -2.7132 -2.5089 -2.5089 -2.1561 -2.1561 -2.0775 -2.0775 -1.6596 -1.6596 -1.6448 -1.6448 -1.0552 -1.0552 -0.8670 -0.8670 -0.3611 -0.3611 -0.0644 -0.0644 1.0054 1.0054 1.1953 1.1953 1.5270 1.5270 1.5992 1.5992 1.7872 1.7872 2.0008 2.0008 2.3138 2.3138 2.5493 2.5493 3.3336 3.3336 3.3432 3.3432 3.8166 3.8166 3.8963 3.8963 4.0251 4.0251 4.1529 4.1529 4.3748 4.3748 4.3823 4.3823 5.8506 5.8506 6.0203 6.0203 6.3576 6.3576 6.3659 6.3659 6.6837 6.6837 6.7786 6.7786 7.1791 7.1791 7.2587 7.2587 k = 0.2549 0.3007-0.0000 ( 12642 PWs) bands (ev): ************************************************************************ -786.8350-786.8350-786.7956-786.7956-785.7404-785.7404-785.4821-785.4821 -102.0790-102.0790-102.0758-102.0758-101.9997-101.9997-101.9914-101.9914 -59.5651 -59.5651 -59.5525 -59.5525 -59.5369 -59.5369 -59.5345 -59.5345 -56.6470 -56.6470 -56.6462 -56.6462 -56.6395 -56.6395 -56.6390 -56.6390 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7.3285 7.3285 k = 0.2353 0.3007-0.0000 ( 12650 PWs) bands (ev): ************************************************************************ -787.0397-787.0397-786.7330-786.7330-785.6716-785.6716-785.4352-785.4352 -102.1564-102.1564-102.0869-102.0869-101.9982-101.9982-101.9946-101.9946 -59.5755 -59.5755 -59.5521 -59.5521 -59.5458 -59.5458 -59.5410 -59.5410 -56.6490 -56.6490 -56.6482 -56.6482 -56.6419 -56.6419 -56.6408 -56.6408 -24.5076 -24.5076 -24.5065 -24.5065 -24.4989 -24.4989 -24.4980 -24.4980 -10.7043 -10.7043 -10.7035 -10.7035 -8.6255 -8.6255 -8.6105 -8.6105 -8.5041 -8.5041 -8.5021 -8.5021 -7.7960 -7.7960 -7.7721 -7.7721 -3.3875 -3.3875 -3.2978 -3.2978 -3.0929 -3.0929 -3.0788 -3.0788 -2.7825 -2.7825 -2.7399 -2.7399 -2.5983 -2.5983 -2.3635 -2.3635 -2.0529 -2.0529 -1.9552 -1.9552 -1.6445 -1.6445 -1.6401 -1.6401 -1.0839 -1.0839 -0.8240 -0.8240 -0.3411 -0.3411 -0.0202 -0.0202 1.0455 1.0455 1.2438 1.2438 1.5995 1.5995 1.6263 1.6263 1.8440 1.8440 2.0641 2.0641 2.3269 2.3269 2.5366 2.5366 3.3486 3.3486 3.3712 3.3712 3.7671 3.7671 3.8149 3.8149 3.9938 3.9938 4.0852 4.0852 4.3731 4.3731 4.3845 4.3845 5.9978 5.9978 6.1312 6.1312 6.2779 6.2779 6.3335 6.3335 6.7430 6.7430 6.9402 6.9402 7.3371 7.3371 7.3824 7.3824 k = 0.2255 0.3007-0.0000 ( 12658 PWs) bands (ev): ************************************************************************ -786.9570-786.9570-786.8711-786.8711-785.6818-785.6818-785.6616-785.6616 -102.1955-102.1955-102.1079-102.1079-102.0136-102.0136-101.9894-101.9894 -59.5785 -59.5785 -59.5694 -59.5694 -59.5486 -59.5486 -59.5421 -59.5421 -56.6500 -56.6500 -56.6493 -56.6493 -56.6435 -56.6435 -56.6418 -56.6418 -24.5029 -24.5029 -24.5022 -24.5022 -24.4943 -24.4943 -24.4930 -24.4930 -10.7650 -10.7650 -10.7643 -10.7643 -8.6697 -8.6697 -8.6542 -8.6542 -8.5518 -8.5518 -8.5517 -8.5517 -7.8368 -7.8368 -7.8144 -7.8144 -3.3877 -3.3877 -3.2898 -3.2898 -3.0798 -3.0798 -3.0492 -3.0492 -2.7199 -2.7199 -2.6330 -2.6330 -2.5037 -2.5037 -2.3093 -2.3093 -2.0413 -2.0413 -1.9271 -1.9271 -1.6253 -1.6253 -1.6141 -1.6141 -1.0819 -1.0819 -0.8009 -0.8009 -0.3224 -0.3224 0.0010 0.0010 1.0432 1.0432 1.2386 1.2386 1.6250 1.6250 1.6480 1.6480 1.8603 1.8603 2.0539 2.0539 2.3604 2.3604 2.5444 2.5444 3.3583 3.3583 3.3769 3.3769 3.7676 3.7676 3.7862 3.7862 3.9895 3.9895 4.0536 4.0536 4.4004 4.4004 4.4186 4.4186 6.0177 6.0177 6.1234 6.1234 6.2652 6.2652 6.3510 6.3510 6.7515 6.7515 6.9643 6.9643 7.4135 7.4135 7.4460 7.4460 k = 0.2157 0.3007-0.0000 ( 12642 PWs) bands (ev): ************************************************************************ -786.8328-786.8328-786.7604-786.7604-785.4314-785.4314-785.4142-785.4142 -102.1510-102.1510-102.0752-102.0752-101.9761-101.9761-101.9455-101.9455 -59.5664 -59.5664 -59.5559 -59.5559 -59.5349 -59.5349 -59.5264 -59.5264 -56.6488 -56.6488 -56.6482 -56.6482 -56.6425 -56.6425 -56.6407 -56.6407 -24.4966 -24.4966 -24.4959 -24.4959 -24.4883 -24.4883 -24.4866 -24.4866 -10.8233 -10.8233 -10.8227 -10.8227 -8.7124 -8.7124 -8.6962 -8.6962 -8.5996 -8.5996 -8.5980 -8.5980 -7.8769 -7.8769 -7.8558 -7.8558 -3.3937 -3.3937 -3.2962 -3.2962 -3.0678 -3.0678 -3.0359 -3.0359 -2.6811 -2.6811 -2.5245 -2.5245 -2.3807 -2.3807 -2.2468 -2.2468 -2.0359 -2.0359 -1.9047 -1.9047 -1.6042 -1.6042 -1.5765 -1.5765 -1.0714 -1.0714 -0.7726 -0.7726 -0.2974 -0.2974 0.0259 0.0259 1.0363 1.0363 1.2261 1.2261 1.6464 1.6464 1.6683 1.6683 1.8761 1.8761 2.0439 2.0439 2.3948 2.3948 2.5584 2.5584 3.3738 3.3738 3.3797 3.3797 3.7615 3.7615 3.7757 3.7757 3.9850 3.9850 4.0240 4.0240 4.4422 4.4422 4.4661 4.4661 6.0166 6.0166 6.1005 6.1005 6.2677 6.2677 6.3729 6.3729 6.7593 6.7593 6.9798 6.9798 7.4830 7.4830 7.5143 7.5143 k = 0.2059 0.3007-0.0000 ( 12624 PWs) bands (ev): ************************************************************************ -786.6968-786.6968-786.4713-786.4713-785.2162-785.2162-785.1688-785.1688 -102.1326-102.1326-102.0230-102.0230-101.9120-101.9120-101.9056-101.9056 -59.5523 -59.5523 -59.5484 -59.5484 -59.5240 -59.5240 -59.5037 -59.5037 -56.6483 -56.6483 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6.3007 6.3007 6.3996 6.3996 6.7825 6.7825 6.9977 6.9977 7.5475 7.5475 7.6347 7.6347 k = 0.1863 0.3007-0.0000 ( 12616 PWs) bands (ev): ************************************************************************ -786.5948-786.5948-786.3197-786.3197-785.2121-785.2121-785.1346-785.1346 -102.1219-102.1219-101.9914-101.9914-101.8947-101.8947-101.8439-101.8439 -59.5461 -59.5461 -59.5461 -59.5461 -59.5103 -59.5103 -59.5085 -59.5085 -56.6494 -56.6494 -56.6482 -56.6482 -56.6430 -56.6430 -56.6418 -56.6418 -24.4801 -24.4801 -24.4793 -24.4793 -24.4716 -24.4716 -24.4687 -24.4687 -10.9833 -10.9833 -10.9828 -10.9828 -8.8308 -8.8308 -8.8133 -8.8133 -8.7335 -8.7335 -8.7279 -8.7279 -7.9908 -7.9908 -7.9734 -7.9734 -3.4377 -3.4377 -3.3603 -3.3603 -3.0423 -3.0423 -3.0305 -3.0305 -2.6134 -2.6134 -2.3266 -2.3266 -2.1304 -2.1304 -2.0637 -2.0637 -1.8475 -1.8475 -1.7683 -1.7683 -1.5253 -1.5253 -1.4678 -1.4678 -0.9777 -0.9777 -0.6555 -0.6555 -0.1884 -0.1884 0.1229 0.1229 0.9967 0.9967 1.1670 1.1670 1.6621 1.6621 1.6656 1.6656 1.9273 1.9273 2.0718 2.0718 2.4616 2.4616 2.6234 2.6234 3.3927 3.3927 3.4340 3.4340 3.7481 3.7481 3.7877 3.7877 3.9843 3.9843 4.0126 4.0126 4.6354 4.6354 4.6707 4.6707 5.9333 5.9333 6.0007 6.0007 6.3198 6.3198 6.4000 6.4000 6.7993 6.7993 7.0032 7.0032 7.5486 7.5486 7.6695 7.6695 k = 0.1765 0.3007-0.0000 ( 12620 PWs) bands (ev): ************************************************************************ -786.6426-786.6426-786.4144-786.4144-785.3486-785.3486-785.1101-785.1101 -102.1005-102.1005-102.0092-102.0092-101.8841-101.8841-101.8576-101.8576 -59.5539 -59.5539 -59.5469 -59.5469 -59.5201 -59.5201 -59.5183 -59.5183 -56.6501 -56.6501 -56.6493 -56.6493 -56.6441 -56.6441 -56.6428 -56.6428 -24.4759 -24.4759 -24.4745 -24.4745 -24.4672 -24.4672 -24.4644 -24.4644 -11.0316 -11.0316 -11.0312 -11.0312 -8.8670 -8.8670 -8.8491 -8.8491 -8.7748 -8.7748 -8.7680 -8.7680 -8.0262 -8.0262 -8.0100 -8.0100 -3.4576 -3.4576 -3.3879 -3.3879 -3.0390 -3.0390 -3.0333 -3.0333 -2.5969 -2.5969 -2.2982 -2.2982 -2.1395 -2.1395 -2.0351 -2.0351 -1.7170 -1.7170 -1.6561 -1.6561 -1.4955 -1.4955 -1.4361 -1.4361 -0.9257 -0.9257 -0.6061 -0.6061 -0.1419 -0.1419 0.1627 0.1627 0.9812 0.9812 1.1451 1.1451 1.6410 1.6410 1.6503 1.6503 1.9446 1.9446 2.0991 2.0991 2.4698 2.4698 2.6450 2.6450 3.4059 3.4059 3.4420 3.4420 3.7745 3.7745 3.7795 3.7795 3.9950 3.9950 4.0494 4.0494 4.7160 4.7160 4.7551 4.7551 5.8953 5.8953 5.9647 5.9647 6.3367 6.3367 6.3927 6.3927 6.8180 6.8180 7.0076 7.0076 7.5408 7.5408 7.6823 7.6823 k = 0.1667 0.3007-0.0000 ( 12610 PWs) bands (ev): ************************************************************************ -786.4673-786.4673-786.2095-786.2095-785.1460-785.1460-784.8490-784.8490 -102.0942-102.0942-102.0008-102.0008-101.8691-101.8691-101.8433-101.8433 -59.5458 -59.5458 -59.5290 -59.5290 -59.5135 -59.5135 -59.5084 -59.5084 -56.6502 -56.6502 -56.6497 -56.6497 -56.6440 -56.6440 -56.6434 -56.6434 -24.4705 -24.4705 -24.4688 -24.4688 -24.4615 -24.4615 -24.4595 -24.4595 -11.0774 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-59.5184 -59.5184 -59.5055 -59.5055 -59.5004 -59.5004 -56.6499 -56.6499 -56.6499 -56.6499 -56.6443 -56.6443 -56.6435 -56.6435 -24.4649 -24.4649 -24.4633 -24.4633 -24.4566 -24.4566 -24.4546 -24.4546 -11.1206 -11.1206 -11.1203 -11.1203 -8.9334 -8.9334 -8.9151 -8.9151 -8.8515 -8.8515 -8.8426 -8.8426 -8.0925 -8.0925 -8.0784 -8.0784 -3.5004 -3.5004 -3.4442 -3.4442 -3.0422 -3.0422 -3.0391 -3.0391 -2.5675 -2.5675 -2.2728 -2.2728 -2.1607 -2.1607 -2.0374 -2.0374 -1.5181 -1.5181 -1.5023 -1.5023 -1.3256 -1.3256 -1.3097 -1.3097 -0.7987 -0.7987 -0.4946 -0.4946 -0.0354 -0.0354 0.2545 0.2545 0.9512 0.9512 1.1034 1.1034 1.5737 1.5737 1.6091 1.6091 1.9743 1.9743 2.1557 2.1557 2.4741 2.4741 2.6740 2.6740 3.4277 3.4277 3.4422 3.4422 3.7579 3.7579 3.8958 3.8958 4.0464 4.0464 4.1627 4.1627 4.8928 4.8928 4.9419 4.9419 5.8163 5.8163 5.8934 5.8934 6.3617 6.3617 6.3626 6.3626 6.8548 6.8548 7.0129 7.0129 7.5146 7.5146 7.6654 7.6654 k = 0.1471 0.3007-0.0000 ( 12590 PWs) bands (ev): ************************************************************************ -786.2234-786.2234-785.4925-785.4925-784.9696-784.9696-784.7136-784.7136 -101.9914-101.9914-101.9861-101.9861-101.8581-101.8581-101.8014-101.8014 -59.5218 -59.5218 -59.5198 -59.5198 -59.5030 -59.5030 -59.4952 -59.4952 -56.6505 -56.6505 -56.6495 -56.6495 -56.6454 -56.6454 -56.6433 -56.6433 -24.4597 -24.4597 -24.4586 -24.4586 -24.4520 -24.4520 -24.4499 -24.4499 -11.1613 -11.1613 -11.1610 -11.1610 -8.9638 -8.9638 -8.9454 -8.9454 -8.8869 -8.8869 -8.8772 -8.8772 -8.1233 -8.1233 -8.1101 -8.1101 -3.5223 -3.5223 -3.4720 -3.4720 -3.0478 -3.0478 -3.0421 -3.0421 -2.5544 -2.5544 -2.2735 -2.2735 -2.1672 -2.1672 -2.0496 -2.0496 -1.4850 -1.4850 -1.4829 -1.4829 -1.1866 -1.1866 -1.1842 -1.1842 -0.7287 -0.7287 -0.4342 -0.4342 0.0241 0.0241 0.3062 0.3062 0.9380 0.9380 1.0846 1.0846 1.5357 1.5357 1.5822 1.5822 1.9856 1.9856 2.1772 2.1772 2.4742 2.4742 2.6791 2.6791 3.4109 3.4109 3.4540 3.4540 3.7728 3.7728 3.9667 3.9667 4.0933 4.0933 4.2311 4.2311 4.9863 4.9863 5.0421 5.0421 5.7768 5.7768 5.8589 5.8589 6.3426 6.3426 6.3699 6.3699 6.8701 6.8701 7.0137 7.0137 7.4989 7.4989 7.6469 7.6469 k = 0.1373 0.3007-0.0000 ( 12582 PWs) bands (ev): ************************************************************************ -786.1612-786.1612-785.5881-785.5881-784.7906-784.7906-784.5195-784.5195 -101.9802-101.9802-101.9623-101.9623-101.8324-101.8324-101.7772-101.7772 -59.5211 -59.5211 -59.5125 -59.5125 -59.4989 -59.4989 -59.4852 -59.4852 -56.6504 -56.6504 -56.6498 -56.6498 -56.6456 -56.6456 -56.6433 -56.6433 -24.4545 -24.4545 -24.4533 -24.4533 -24.4477 -24.4477 -24.4460 -24.4460 -11.1994 -11.1994 -11.1991 -11.1991 -8.9922 -8.9922 -8.9738 -8.9738 -8.9204 -8.9204 -8.9099 -8.9099 -8.1523 -8.1523 -8.1401 -8.1401 -3.5438 -3.5438 -3.4988 -3.4988 -3.0539 -3.0539 -3.0466 -3.0466 -2.5424 -2.5424 -2.2810 -2.2810 -2.1705 -2.1705 -2.0646 -2.0646 -1.4718 -1.4718 -1.4718 -1.4718 -1.0495 -1.0495 -1.0407 -1.0407 -0.6570 -0.6570 -0.3718 -0.3718 0.0877 0.0877 0.3617 0.3617 0.9270 0.9270 1.0679 1.0679 1.4966 1.4966 1.5525 1.5525 1.9946 1.9946 2.1913 2.1913 2.4753 2.4753 2.6781 2.6781 3.3909 3.3909 3.4536 3.4536 3.8117 3.8117 4.0364 4.0364 4.1590 4.1590 4.3045 4.3045 5.0814 5.0814 5.1452 5.1452 5.7380 5.7380 5.8257 5.8257 6.3208 6.3208 6.3757 6.3757 6.8820 6.8820 7.0128 7.0128 7.4820 7.4820 7.6261 7.6261 k = 0.1275 0.3007-0.0000 ( 12600 PWs) bands (ev): ************************************************************************ -786.4934-786.4934-785.9555-785.9555-785.0473-785.0473-784.7847-784.7847 -102.0048-102.0048-102.0016-102.0016-101.8589-101.8589-101.8223-101.8223 -59.5353 -59.5353 -59.5273 -59.5273 -59.5093 -59.5093 -59.4945 -59.4945 -56.6516 -56.6516 -56.6511 -56.6511 -56.6466 -56.6466 -56.6448 -56.6448 -24.4508 -24.4508 -24.4499 -24.4499 -24.4449 -24.4449 -24.4434 -24.4434 -11.2349 -11.2349 -11.2346 -11.2346 -9.0189 -9.0189 -9.0005 -9.0005 -8.9519 -8.9519 -8.9408 -8.9408 -8.1795 -8.1795 -8.1683 -8.1683 -3.5649 -3.5649 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-102.0286-102.0286-101.9787-101.9787-101.8346-101.8346-101.8233-101.8233 -59.5296 -59.5296 -59.5182 -59.5182 -59.5101 -59.5101 -59.4819 -59.4819 -56.6516 -56.6516 -56.6516 -56.6516 -56.6470 -56.6470 -56.6458 -56.6458 -24.4431 -24.4431 -24.4422 -24.4422 -24.4370 -24.4370 -24.4365 -24.4365 -11.2981 -11.2981 -11.2979 -11.2979 -9.0658 -9.0658 -9.0475 -9.0475 -9.0085 -9.0085 -8.9963 -8.9963 -8.2283 -8.2283 -8.2190 -8.2190 -3.6039 -3.6039 -3.5723 -3.5723 -3.0737 -3.0737 -3.0654 -3.0654 -2.5104 -2.5104 -2.3205 -2.3205 -2.1766 -2.1766 -2.1159 -2.1159 -1.4654 -1.4654 -1.4594 -1.4594 -0.6539 -0.6539 -0.6475 -0.6475 -0.4443 -0.4443 -0.1846 -0.1846 0.3012 0.3012 0.5463 0.5463 0.9169 0.9169 1.0346 1.0346 1.3838 1.3838 1.4521 1.4521 2.0092 2.0092 2.1876 2.1876 2.4878 2.4878 2.6489 2.6489 3.3246 3.3246 3.3967 3.3967 4.0391 4.0391 4.2390 4.2390 4.4348 4.4348 4.5390 4.5390 5.3571 5.3571 5.4510 5.4510 5.6335 5.6335 5.7461 5.7461 6.2486 6.2486 6.3846 6.3846 6.8908 6.8908 6.9938 6.9938 7.4081 7.4081 7.5206 7.5206 k = 0.0980 0.3007-0.0000 ( 12592 PWs) bands (ev): ************************************************************************ -786.1634-786.1634-785.9005-785.9005-784.9232-784.9232-784.9152-784.9152 -101.9869-101.9869-101.9857-101.9857-101.8188-101.8188-101.8146-101.8146 -59.5297 -59.5297 -59.5224 -59.5224 -59.5054 -59.5054 -59.4870 -59.4870 -56.6530 -56.6530 -56.6525 -56.6525 -56.6473 -56.6473 -56.6464 -56.6464 -24.4392 -24.4392 -24.4390 -24.4390 -24.4339 -24.4339 -24.4337 -24.4337 -11.3258 -11.3258 -11.3256 -11.3256 -9.0864 -9.0864 -9.0681 -9.0681 -9.0336 -9.0336 -9.0209 -9.0209 -8.2498 -8.2498 -8.2414 -8.2414 -3.6216 -3.6216 -3.5937 -3.5937 -3.0802 -3.0802 -3.0724 -3.0724 -2.5008 -2.5008 -2.3346 -2.3346 -2.1798 -2.1798 -2.1328 -2.1328 -1.4669 -1.4669 -1.4591 -1.4591 -0.5387 -0.5387 -0.5367 -0.5367 -0.3764 -0.3764 -0.1255 -0.1255 0.3783 0.3783 0.6084 0.6084 0.9282 0.9282 1.0308 1.0308 1.3513 1.3513 1.4165 1.4165 2.0112 2.0112 2.1752 2.1752 2.4932 2.4932 2.6339 2.6339 3.3026 3.3026 3.3706 3.3706 4.1344 4.1344 4.3114 4.3114 4.5358 4.5358 4.6175 4.6175 5.4301 5.4301 5.5305 5.5305 5.6143 5.6143 5.7441 5.7441 6.2232 6.2232 6.3868 6.3868 6.8805 6.8805 6.9760 6.9760 7.3216 7.3216 7.3632 7.3632 k = 0.0882 0.3007-0.0000 ( 12584 PWs) bands (ev): ************************************************************************ -786.0639-786.0639-785.5477-785.5477-785.0318-785.0318-784.8629-784.8629 -101.9609-101.9609-101.9256-101.9256-101.8234-101.8234-101.8094-101.8094 -59.5230 -59.5230 -59.5205 -59.5205 -59.5009 -59.5009 -59.4819 -59.4819 -56.6527 -56.6527 -56.6518 -56.6518 -56.6477 -56.6477 -56.6468 -56.6468 -24.4363 -24.4363 -24.4355 -24.4355 -24.4308 -24.4308 -24.4303 -24.4303 -11.3509 -11.3509 -11.3507 -11.3507 -9.1047 -9.1047 -9.0867 -9.0867 -9.0565 -9.0565 -9.0434 -9.0434 -8.2693 -8.2693 -8.2618 -8.2618 -3.6378 -3.6378 -3.6134 -3.6134 -3.0866 -3.0866 -3.0793 -3.0793 -2.4915 -2.4915 -2.3480 -2.3480 -2.1839 -2.1839 -2.1488 -2.1488 -1.4689 -1.4689 -1.4599 -1.4599 -0.4384 -0.4384 -0.4348 -0.4348 -0.3111 -0.3111 -0.0698 -0.0698 0.4554 0.4554 0.6638 0.6638 0.9531 0.9531 1.0316 1.0316 1.3236 1.3236 1.3804 1.3804 2.0120 2.0120 2.1598 2.1598 2.4980 2.4980 2.6179 2.6179 3.2814 3.2814 3.3442 3.3442 4.2329 4.2329 4.3861 4.3861 4.6361 4.6361 4.6939 4.6939 5.4671 5.4671 5.5693 5.5693 5.6273 5.6273 5.7823 5.7823 6.1973 6.1973 6.3894 6.3894 6.8567 6.8567 6.9406 6.9406 7.1932 7.1932 7.2091 7.2091 k = 0.0784 0.3007-0.0000 ( 12598 PWs) bands (ev): ************************************************************************ -786.2818-786.2818-785.7999-785.7999-785.2435-785.2435-784.9930-784.9930 -101.9977-101.9977-101.9404-101.9404-101.8615-101.8615-101.8439-101.8439 -59.5340 -59.5340 -59.5286 -59.5286 -59.5040 -59.5040 -59.4902 -59.4902 -56.6535 -56.6535 -56.6528 -56.6528 -56.6489 -56.6489 -56.6481 -56.6481 -24.4338 -24.4338 -24.4328 -24.4328 -24.4292 -24.4292 -24.4289 -24.4289 -11.3734 -11.3734 -11.3732 -11.3732 -9.1209 -9.1209 -9.1035 -9.1035 -9.0772 -9.0772 -9.0640 -9.0640 -8.2869 -8.2869 -8.2802 -8.2802 -3.6526 -3.6526 -3.6315 -3.6315 -3.0926 -3.0926 -3.0860 -3.0860 -2.4829 -2.4829 -2.3606 -2.3606 -2.1887 -2.1887 -2.1641 -2.1641 -1.4713 -1.4713 -1.4617 -1.4617 -0.3534 -0.3534 -0.3442 -0.3442 -0.2483 -0.2483 -0.0186 -0.0186 0.5289 0.5289 0.7066 0.7066 0.9960 0.9960 1.0369 1.0369 1.3029 1.3029 1.3440 1.3440 2.0117 2.0117 2.1422 2.1422 2.5018 2.5018 2.6013 2.6013 3.2613 3.2613 3.3183 3.3183 4.3318 4.3318 4.4614 4.4614 4.7331 4.7331 4.7666 4.7666 5.4617 5.4617 5.5689 5.5689 5.6769 5.6769 5.8572 5.8572 6.1709 6.1709 6.3926 6.3926 6.8073 6.8073 6.8672 6.8672 7.0878 7.0878 7.0961 7.0961 k = 0.0686 0.3007-0.0000 ( 12606 PWs) bands (ev): ************************************************************************ -786.4651-786.4651-786.0066-786.0066-785.3244-785.3244-785.1567-785.1567 -101.9905-101.9905-101.9610-101.9610-101.8781-101.8781-101.8523-101.8523 -59.5412 -59.5412 -59.5393 -59.5393 -59.5121 -59.5121 -59.4892 -59.4892 -56.6539 -56.6539 -56.6533 -56.6533 -56.6497 -56.6497 -56.6491 -56.6491 -24.4317 -24.4317 -24.4307 -24.4307 -24.4275 -24.4275 -24.4273 -24.4273 -11.3932 -11.3932 -11.3931 -11.3931 -9.1350 -9.1350 -9.1183 -9.1183 -9.0955 -9.0955 -9.0824 -9.0824 -8.3024 -8.3024 -8.2966 -8.2966 -3.6657 -3.6657 -3.6476 -3.6476 -3.0981 -3.0981 -3.0923 -3.0923 -2.4748 -2.4748 -2.3722 -2.3722 -2.1940 -2.1940 -2.1779 -2.1779 -1.4735 -1.4735 -1.4640 -1.4640 -0.2811 -0.2811 -0.2687 -0.2687 -0.1862 -0.1862 0.0278 0.0278 0.5949 0.5949 0.7354 0.7354 1.0455 1.0455 1.0565 1.0565 1.2928 1.2928 1.3079 1.3079 2.0108 2.0108 2.1235 2.1235 2.5045 2.5045 2.5849 2.5849 3.2427 3.2427 3.2936 3.2936 4.4286 4.4286 4.5355 4.5355 4.8247 4.8247 4.8338 4.8338 5.4397 5.4397 5.5530 5.5530 5.7370 5.7370 5.9436 5.9436 6.1449 6.1449 6.3961 6.3961 6.7228 6.7228 6.7567 6.7567 7.0140 7.0140 7.0457 7.0457 k = 0.0588 0.3007-0.0000 ( 12618 PWs) bands (ev): ************************************************************************ -786.4573-786.4573-786.2512-786.2512-785.6561-785.6561-785.4407-785.4407 -102.0091-102.0091-101.9825-101.9825-101.9113-101.9113-101.8647-101.8647 -59.5501 -59.5501 -59.5485 -59.5485 -59.5113 -59.5113 -59.5008 -59.5008 -56.6549 -56.6549 -56.6535 -56.6535 -56.6505 -56.6505 -56.6502 -56.6502 -24.4303 -24.4303 -24.4293 -24.4293 -24.4266 -24.4266 -24.4253 -24.4253 -11.4104 -11.4104 -11.4103 -11.4103 -9.1471 -9.1471 -9.1312 -9.1312 -9.1114 -9.1114 -9.0987 -9.0987 -8.3158 -8.3158 -8.3109 -8.3109 -3.6770 -3.6770 -3.6618 -3.6618 -3.1031 -3.1031 -3.0981 -3.0981 -2.4670 -2.4670 -2.3827 -2.3827 -2.1996 -2.1996 -2.1901 -2.1901 -1.4756 -1.4756 -1.4666 -1.4666 -0.2215 -0.2215 -0.2092 -0.2092 -0.1242 -0.1242 0.0685 0.0685 0.6495 0.6495 0.7532 0.7532 1.0549 1.0549 1.1284 1.1284 1.2725 1.2725 1.2972 1.2972 2.0092 2.0092 2.1043 2.1043 2.5060 2.5060 2.5689 2.5689 3.2260 3.2260 3.2706 3.2706 4.5207 4.5207 4.6063 4.6063 4.8940 4.8940 4.9080 4.9080 5.4157 5.4157 5.5334 5.5334 5.7926 5.7926 6.0234 6.0234 6.1243 6.1243 6.3973 6.3973 6.6189 6.6189 6.6407 6.6407 6.9761 6.9761 7.0177 7.0177 k = 0.0490 0.3007-0.0000 ( 12610 PWs) bands (ev): ************************************************************************ -786.4703-786.4703-786.1516-786.1516-785.4470-785.4470-785.2916-785.2916 -102.0003-102.0003-101.9595-101.9595-101.8757-101.8757-101.8514-101.8514 -59.5477 -59.5477 -59.5403 -59.5403 -59.5085 -59.5085 -59.4977 -59.4977 -56.6541 -56.6541 -56.6534 -56.6534 -56.6507 -56.6507 -56.6502 -56.6502 -24.4275 -24.4275 -24.4267 -24.4267 -24.4250 -24.4250 -24.4234 -24.4234 -11.4249 -11.4249 -11.4248 -11.4248 -9.1568 -9.1568 -9.1423 -9.1423 -9.1245 -9.1245 -9.1127 -9.1127 -8.3271 -8.3271 -8.3230 -8.3230 -3.6865 -3.6865 -3.6740 -3.6740 -3.1073 -3.1073 -3.1032 -3.1032 -2.4596 -2.4596 -2.3921 -2.3921 -2.2051 -2.2051 -2.2005 -2.2005 -1.4773 -1.4773 -1.4692 -1.4692 -0.1728 -0.1728 -0.1631 -0.1631 -0.0641 -0.0641 0.1024 0.1024 0.6918 0.6918 0.7641 0.7641 1.0620 1.0620 1.2027 1.2027 1.2401 1.2401 1.3176 1.3176 2.0072 2.0072 2.0852 2.0852 2.5066 2.5066 2.5540 2.5540 3.2116 3.2116 3.2496 3.2496 4.6059 4.6059 4.6715 4.6715 4.9456 4.9456 4.9795 4.9795 5.3967 5.3967 5.5153 5.5153 5.8389 5.8389 6.0564 6.0564 6.1421 6.1421 6.3875 6.3875 6.5188 6.5188 6.5457 6.5457 6.9554 6.9554 6.9978 6.9978 k = 0.0392 0.3007-0.0000 ( 12614 PWs) bands (ev): ************************************************************************ -786.5111-786.5111-786.1519-786.1519-785.5283-785.5283-785.3029-785.3029 -101.9823-101.9823-101.9487-101.9487-101.8933-101.8933-101.8664-101.8664 -59.5552 -59.5552 -59.5509 -59.5509 -59.5072 -59.5072 -59.5034 -59.5034 -56.6542 -56.6542 -56.6540 -56.6540 -56.6517 -56.6517 -56.6512 -56.6512 -24.4262 -24.4262 -24.4260 -24.4260 -24.4240 -24.4240 -24.4227 -24.4227 -11.4368 -11.4368 -11.4368 -11.4368 -9.1646 -9.1646 -9.1519 -9.1519 -9.1350 -9.1350 -9.1245 -9.1245 -8.3364 -8.3364 -8.3331 -8.3331 -3.6941 -3.6941 -3.6843 -3.6843 -3.1108 -3.1108 -3.1076 -3.1076 -2.4527 -2.4527 -2.4006 -2.4006 -2.2104 -2.2104 -2.2090 -2.2090 -1.4786 -1.4786 -1.4718 -1.4718 -0.1348 -0.1348 -0.1281 -0.1281 -0.0089 -0.0089 0.1285 0.1285 0.7222 0.7222 0.7706 0.7706 1.0666 1.0666 1.2030 1.2030 1.2806 1.2806 1.3504 1.3504 2.0050 2.0050 2.0665 2.0665 2.5064 2.5064 2.5405 2.5405 3.1999 3.1999 3.2311 3.2311 4.6812 4.6812 4.7287 4.7287 4.9872 4.9872 5.0342 5.0342 5.3882 5.3882 5.5005 5.5005 5.8740 5.8740 6.0365 6.0365 6.1970 6.1970 6.3487 6.3487 6.4384 6.4384 6.4956 6.4956 6.9430 6.9430 6.9811 6.9811 k = 0.0294 0.3007-0.0000 ( 12614 PWs) bands (ev): ************************************************************************ -786.4660-786.4660-786.1822-786.1822-785.4772-785.4772-785.3788-785.3788 -101.9813-101.9813-101.9532-101.9532-101.9008-101.9008-101.8482-101.8482 -59.5538 -59.5538 -59.5517 -59.5517 -59.5085 -59.5085 -59.5033 -59.5033 -56.6543 -56.6543 -56.6541 -56.6541 -56.6519 -56.6519 -56.6517 -56.6517 -24.4247 -24.4247 -24.4244 -24.4244 -24.4234 -24.4234 -24.4219 -24.4219 -11.4461 -11.4461 -11.4460 -11.4460 -9.1701 -9.1701 -9.1600 -9.1600 -9.1426 -9.1426 -9.1341 -9.1341 -8.3435 -8.3435 -8.3410 -8.3410 -3.6999 -3.6999 -3.6926 -3.6926 -3.1135 -3.1135 -3.1111 -3.1111 -2.4461 -2.4461 -2.4083 -2.4083 -2.2155 -2.2155 -2.2150 -2.2150 -1.4794 -1.4794 -1.4740 -1.4740 -0.1065 -0.1065 -0.1021 -0.1021 0.0399 0.0399 0.1457 0.1457 0.7432 0.7432 0.7744 0.7744 1.0707 1.0707 1.1730 1.1730 1.3453 1.3453 1.3878 1.3878 2.0032 2.0032 2.0488 2.0488 2.5059 2.5059 2.5289 2.5289 3.1913 3.1913 3.2151 3.2151 4.7439 4.7439 4.7756 4.7756 5.0192 5.0192 5.0682 5.0682 5.3938 5.3938 5.4898 5.4898 5.8981 5.8981 6.0072 6.0072 6.2318 6.2318 6.2912 6.2912 6.3953 6.3953 6.4819 6.4819 6.9357 6.9357 6.9665 6.9665 k = 0.0196 0.3007-0.0000 ( 12596 PWs) bands (ev): ************************************************************************ -786.3317-786.3317-786.1379-786.1379-785.3083-785.3083-785.1978-785.1978 -101.9092-101.9092-101.8977-101.8977-101.8260-101.8260-101.8008-101.8008 -59.5530 -59.5530 -59.5481 -59.5481 -59.5005 -59.5005 -59.4949 -59.4949 -56.6531 -56.6531 -56.6530 -56.6530 -56.6518 -56.6518 -56.6514 -56.6514 -24.4234 -24.4234 -24.4230 -24.4230 -24.4216 -24.4216 -24.4209 -24.4209 -11.4527 -11.4527 -11.4527 -11.4527 -9.1735 -9.1735 -9.1664 -9.1664 -9.1474 -9.1474 -9.1414 -9.1414 -8.3484 -8.3484 -8.3468 -8.3468 -3.7036 -3.7036 -3.6988 -3.6988 -3.1153 -3.1153 -3.1138 -3.1138 -2.4396 -2.4396 -2.4150 -2.4150 -2.2197 -2.2197 -2.2189 -2.2189 -1.4797 -1.4797 -1.4760 -1.4760 -0.0861 -0.0861 -0.0838 -0.0838 0.0814 0.0814 0.1533 0.1533 0.7574 0.7574 0.7759 0.7759 1.0769 1.0769 1.1454 1.1454 1.3973 1.3973 1.4212 1.4212 2.0030 2.0030 2.0330 2.0330 2.5057 2.5057 2.5196 2.5196 3.1861 3.1861 3.2023 3.2023 4.7914 4.7914 4.8100 4.8100 5.0430 5.0430 5.0825 5.0825 5.4121 5.4121 5.4815 5.4815 5.9134 5.9134 5.9781 5.9781 6.2280 6.2280 6.2426 6.2426 6.4009 6.4009 6.4770 6.4770 6.9325 6.9325 6.9541 6.9541 k = 0.0098 0.3007-0.0000 ( 12596 PWs) bands (ev): ************************************************************************ -786.3661-786.3661-786.3382-786.3382-785.3235-785.3235-785.2311-785.2311 -101.8834-101.8834-101.8787-101.8787-101.8145-101.8145-101.7997-101.7997 -59.5556 -59.5556 -59.5520 -59.5520 -59.5016 -59.5016 -59.5009 -59.5009 -56.6534 -56.6534 -56.6533 -56.6533 -56.6521 -56.6521 -56.6517 -56.6517 -24.4229 -24.4229 -24.4227 -24.4227 -24.4214 -24.4214 -24.4206 -24.4206 -11.4567 -11.4567 -11.4567 -11.4567 -9.1748 -9.1748 -9.1711 -9.1711 -9.1496 -9.1496 -9.1464 -9.1464 -8.3513 -8.3513 -8.3505 -8.3505 -3.7054 -3.7054 -3.7030 -3.7030 -3.1164 -3.1164 -3.1156 -3.1156 -2.4336 -2.4336 -2.4215 -2.4215 -2.2222 -2.2222 -2.2215 -2.2215 -1.4795 -1.4795 -1.4776 -1.4776 -0.0744 -0.0744 -0.0733 -0.0733 0.1139 0.1139 0.1504 0.1504 0.7666 0.7666 0.7753 0.7753 1.0871 1.0871 1.1215 1.1215 1.4322 1.4322 1.4428 1.4428 2.0049 2.0049 2.0199 2.0199 2.5063 2.5063 2.5128 2.5128 3.1845 3.1845 3.1927 3.1927 4.8218 4.8218 4.8302 4.8302 5.0607 5.0607 5.0825 5.0825 5.4356 5.4356 5.4716 5.4716 5.9239 5.9239 5.9533 5.9533 6.2110 6.2110 6.2130 6.2130 6.4277 6.4277 6.4686 6.4686 6.9330 6.9330 6.9441 6.9441 k = 0.0000 0.3007-0.0000 ( 12596 PWs) bands (ev): ************************************************************************ -786.2776-786.2776-786.2776-786.2776-785.2856-785.2856-785.2856-785.2856 -101.8972-101.8972-101.8972-101.8972-101.7960-101.7960-101.7960-101.7960 -59.5552 -59.5552 -59.5552 -59.5552 -59.5003 -59.5003 -59.5003 -59.5003 -56.6535 -56.6535 -56.6535 -56.6535 -56.6519 -56.6519 -56.6519 -56.6519 -24.4225 -24.4225 -24.4225 -24.4225 -24.4206 -24.4206 -24.4206 -24.4206 -11.4580 -11.4580 -11.4580 -11.4580 -9.1739 -9.1739 -9.1739 -9.1739 -9.1493 -9.1493 -9.1493 -9.1493 -8.3520 -8.3520 -8.3520 -8.3520 -3.7052 -3.7052 -3.7052 -3.7052 -3.1164 -3.1164 -3.1164 -3.1164 -2.4276 -2.4276 -2.4276 -2.4276 -2.2226 -2.2226 -2.2226 -2.2226 -1.4787 -1.4787 -1.4787 -1.4787 -0.0703 -0.0703 -0.0703 -0.0703 0.1371 0.1371 0.1371 0.1371 0.7723 0.7723 0.7723 0.7723 1.1019 1.1019 1.1019 1.1019 1.4474 1.4474 1.4474 1.4474 2.0104 2.0104 2.0104 2.0104 2.5084 2.5084 2.5084 2.5084 3.1867 3.1867 3.1867 3.1867 4.8346 4.8346 4.8346 4.8346 5.0741 5.0741 5.0741 5.0741 5.4566 5.4566 5.4566 5.4566 5.9356 5.9356 5.9356 5.9356 6.2035 6.2035 6.2035 6.2035 6.4523 6.4523 6.4523 6.4523 6.9370 6.9370 6.9370 6.9370 k = 0.0000 0.3007-0.0000 ( 12596 PWs) bands (ev): ************************************************************************ -786.2776-786.2776-786.2776-786.2776-785.2856-785.2856-785.2856-785.2856 -101.8972-101.8972-101.8972-101.8972-101.7960-101.7960-101.7960-101.7960 -59.5552 -59.5552 -59.5552 -59.5552 -59.5003 -59.5003 -59.5003 -59.5003 -56.6535 -56.6535 -56.6535 -56.6535 -56.6519 -56.6519 -56.6519 -56.6519 -24.4225 -24.4225 -24.4225 -24.4225 -24.4206 -24.4206 -24.4206 -24.4206 -11.4580 -11.4580 -11.4580 -11.4580 -9.1739 -9.1739 -9.1739 -9.1739 -9.1493 -9.1493 -9.1493 -9.1493 -8.3520 -8.3520 -8.3520 -8.3520 -3.7052 -3.7052 -3.7052 -3.7052 -3.1164 -3.1164 -3.1164 -3.1164 -2.4276 -2.4276 -2.4276 -2.4276 -2.2226 -2.2226 -2.2226 -2.2226 -1.4787 -1.4787 -1.4787 -1.4787 -0.0703 -0.0703 -0.0703 -0.0703 0.1371 0.1371 0.1371 0.1371 0.7723 0.7723 0.7723 0.7723 1.1019 1.1019 1.1019 1.1019 1.4474 1.4474 1.4474 1.4474 2.0104 2.0104 2.0104 2.0104 2.5084 2.5084 2.5084 2.5084 3.1867 3.1867 3.1867 3.1867 4.8346 4.8346 4.8346 4.8346 5.0741 5.0741 5.0741 5.0741 5.4566 5.4566 5.4566 5.4566 5.9356 5.9356 5.9356 5.9356 6.2035 6.2035 6.2035 6.2035 6.4523 6.4523 6.4523 6.4523 6.9370 6.9370 6.9370 6.9370 k = 0.0000 0.2910-0.0000 ( 12594 PWs) bands (ev): ************************************************************************ -786.3710-786.3710-786.2155-786.2155-785.3098-785.3098-785.1864-785.1864 -101.9106-101.9106-101.8549-101.8549-101.8086-101.8086-101.7810-101.7810 -59.5590 -59.5590 -59.5522 -59.5522 -59.5033 -59.5033 -59.4972 -59.4972 -56.6545 -56.6545 -56.6533 -56.6533 -56.6520 -56.6520 -56.6515 -56.6515 -24.4230 -24.4230 -24.4220 -24.4220 -24.4212 -24.4212 -24.4204 -24.4204 -11.4605 -11.4605 -11.4575 -11.4575 -9.2333 -9.2333 -9.1994 -9.1994 -9.1135 -9.1135 -9.0978 -9.0978 -8.3570 -8.3570 -8.3404 -8.3404 -3.7646 -3.7646 -3.6470 -3.6470 -3.1327 -3.1327 -3.1091 -3.1091 -2.4563 -2.4563 -2.3970 -2.3970 -2.2602 -2.2602 -2.1815 -2.1815 -1.4931 -1.4931 -1.4703 -1.4703 -0.0793 -0.0793 -0.0613 -0.0613 0.1226 0.1226 0.1513 0.1513 0.7545 0.7545 0.7863 0.7863 1.0498 1.0498 1.1473 1.1473 1.4397 1.4397 1.4555 1.4555 1.9155 1.9155 2.1030 2.1030 2.4609 2.4609 2.5595 2.5595 3.1610 3.1610 3.2343 3.2343 4.8223 4.8223 4.8476 4.8476 5.0660 5.0660 5.0811 5.0811 5.4405 5.4405 5.4719 5.4719 5.8984 5.8984 5.9690 5.9690 6.1940 6.1940 6.2106 6.2106 6.4410 6.4410 6.4641 6.4641 6.8847 6.8847 6.9871 6.9871 k = 0.0000 0.2813-0.0000 ( 12596 PWs) bands (ev): ************************************************************************ -786.4048-786.4048-786.1731-786.1731-785.3339-785.3339-785.0634-785.0634 -101.9287-101.9287-101.8749-101.8749-101.8261-101.8261-101.7822-101.7822 -59.5644 -59.5644 -59.5466 -59.5466 -59.5099 -59.5099 -59.4842 -59.4842 -56.6533 -56.6533 -56.6530 -56.6530 -56.6522 -56.6522 -56.6506 -56.6506 -24.4232 -24.4232 -24.4217 -24.4217 -24.4208 -24.4208 -24.4202 -24.4202 -11.4650 -11.4650 -11.4591 -11.4591 -9.2913 -9.2913 -9.2485 -9.2485 -9.0539 -9.0539 -9.0435 -9.0435 -8.3555 -8.3555 -8.3225 -8.3225 -3.8244 -3.8244 -3.5910 -3.5910 -3.1557 -3.1557 -3.1119 -3.1119 -2.4836 -2.4836 -2.3678 -2.3678 -2.2897 -2.2897 -2.1385 -2.1385 -1.5134 -1.5134 -1.4674 -1.4674 -0.0885 -0.0885 -0.0533 -0.0533 0.1081 0.1081 0.1647 0.1647 0.7333 0.7333 0.7963 0.7963 0.9926 0.9926 1.1850 1.1850 1.4328 1.4328 1.4638 1.4638 1.8202 1.8202 2.1885 2.1885 2.4182 2.4182 2.6155 2.6155 3.1606 3.1606 3.2994 3.2994 4.8110 4.8110 4.8610 4.8610 5.0556 5.0556 5.0880 5.0880 5.4238 5.4238 5.4857 5.4857 5.8598 5.8598 5.9958 5.9958 6.1832 6.1832 6.2151 6.2151 6.4311 6.4311 6.4755 6.4755 6.8310 6.8310 7.0349 7.0349 k = 0.0000 0.2716-0.0000 ( 12596 PWs) bands (ev): ************************************************************************ -786.3321-786.3321-786.1498-786.1498-785.2636-785.2636-785.0390-785.0390 -101.9208-101.9208-101.8819-101.8819-101.8417-101.8417-101.8013-101.8013 -59.5536 -59.5536 -59.5437 -59.5437 -59.5179 -59.5179 -59.4859 -59.4859 -56.6550 -56.6550 -56.6529 -56.6529 -56.6522 -56.6522 -56.6499 -56.6499 -24.4232 -24.4232 -24.4216 -24.4216 -24.4205 -24.4205 -24.4197 -24.4197 -11.4715 -11.4715 -11.4627 -11.4627 -9.3478 -9.3478 -9.2967 -9.2967 -8.9978 -8.9978 -8.9831 -8.9831 -8.3475 -8.3475 -8.2984 -8.2984 -3.8843 -3.8843 -3.5385 -3.5385 -3.1832 -3.1832 -3.1253 -3.1253 -2.5119 -2.5119 -2.3536 -2.3536 -2.2961 -2.2961 -2.0939 -2.0939 -1.5394 -1.5394 -1.4695 -1.4695 -0.0974 -0.0974 -0.0467 -0.0467 0.0940 0.0940 0.1775 0.1775 0.7092 0.7092 0.8019 0.8019 0.9326 0.9326 1.2146 1.2146 1.4269 1.4269 1.4722 1.4722 1.7263 1.7263 2.2462 2.2462 2.3992 2.3992 2.6773 2.6773 3.1866 3.1866 3.3777 3.3777 4.8009 4.8009 4.8741 4.8741 5.0412 5.0412 5.0954 5.0954 5.4073 5.4073 5.4979 5.4979 5.8226 5.8226 6.0129 6.0129 6.1731 6.1731 6.2171 6.2171 6.4234 6.4234 6.4860 6.4860 6.7772 6.7772 7.0805 7.0805 k = 0.0000 0.2619-0.0000 ( 12602 PWs) bands (ev): ************************************************************************ -786.3896-786.3896-786.0905-786.0905-785.3690-785.3690-785.0689-785.0689 -101.9412-101.9412-101.9147-101.9147-101.8567-101.8567-101.8167-101.8167 -59.5586 -59.5586 -59.5497 -59.5497 -59.5197 -59.5197 -59.4846 -59.4846 -56.6548 -56.6548 -56.6536 -56.6536 -56.6526 -56.6526 -56.6506 -56.6506 -24.4236 -24.4236 -24.4222 -24.4222 -24.4212 -24.4212 -24.4193 -24.4193 -11.4798 -11.4798 -11.4681 -11.4681 -9.4029 -9.4029 -9.3439 -9.3439 -8.9435 -8.9435 -8.9191 -8.9191 -8.3333 -8.3333 -8.2684 -8.2684 -3.9437 -3.9437 -3.4920 -3.4920 -3.2123 -3.2123 -3.1488 -3.1488 -2.5450 -2.5450 -2.3603 -2.3603 -2.2727 -2.2727 -2.0481 -2.0481 -1.5708 -1.5708 -1.4754 -1.4754 -0.1062 -0.1062 -0.0423 -0.0423 0.0812 0.0812 0.1894 0.1894 0.6832 0.6832 0.8018 0.8018 0.8730 0.8730 1.2364 1.2364 1.4207 1.4207 1.4803 1.4803 1.6370 1.6370 2.2350 2.2350 2.4441 2.4441 2.7442 2.7442 3.2375 3.2375 3.4659 3.4659 4.7918 4.7918 4.8862 4.8862 5.0210 5.0210 5.1037 5.1037 5.3920 5.3920 5.5077 5.5077 5.7896 5.7896 6.0165 6.0165 6.1671 6.1671 6.2166 6.2166 6.4185 6.4185 6.4953 6.4953 6.7248 6.7248 7.1240 7.1240 k = 0.0000 0.2522-0.0000 ( 12610 PWs) bands (ev): ************************************************************************ -786.4634-786.4634-786.0336-786.0336-785.5114-785.5114-785.2433-785.2433 -101.9735-101.9735-101.9410-101.9410-101.8737-101.8737-101.8238-101.8238 -59.5648 -59.5648 -59.5578 -59.5578 -59.5239 -59.5239 -59.4880 -59.4880 -56.6548 -56.6548 -56.6538 -56.6538 -56.6532 -56.6532 -56.6506 -56.6506 -24.4243 -24.4243 -24.4229 -24.4229 -24.4222 -24.4222 -24.4193 -24.4193 -11.4898 -11.4898 -11.4754 -11.4754 -9.4563 -9.4563 -9.3901 -9.3901 -8.8885 -8.8885 -8.8534 -8.8534 -8.3129 -8.3129 -8.2329 -8.2329 -4.0023 -4.0023 -3.4557 -3.4557 -3.2392 -3.2392 -3.1802 -3.1802 -2.5846 -2.5846 -2.3686 -2.3686 -2.2408 -2.2408 -2.0007 -2.0007 -1.6069 -1.6069 -1.4836 -1.4836 -0.1144 -0.1144 -0.0414 -0.0414 0.0709 0.0709 0.2003 0.2003 0.6564 0.6564 0.7862 0.7862 0.8255 0.8255 1.2508 1.2508 1.4093 1.4093 1.4870 1.4870 1.5604 1.5604 2.1837 2.1837 2.5245 2.5245 2.8149 2.8149 3.3099 3.3099 3.5616 3.5616 4.7837 4.7837 4.8955 4.8955 4.9938 4.9938 5.1132 5.1132 5.3795 5.3795 5.5145 5.5145 5.7632 5.7632 6.0044 6.0044 6.1670 6.1670 6.2146 6.2146 6.4167 6.4167 6.5035 6.5035 6.6759 6.6759 7.1656 7.1656 k = 0.0000 0.2425-0.0000 ( 12600 PWs) bands (ev): ************************************************************************ -786.3241-786.3241-785.8525-785.8525-785.3796-785.3796-785.1794-785.1794 -101.9664-101.9664-101.8889-101.8889-101.8678-101.8678-101.8108-101.8108 -59.5538 -59.5538 -59.5370 -59.5370 -59.5249 -59.5249 -59.4787 -59.4787 -56.6538 -56.6538 -56.6524 -56.6524 -56.6515 -56.6515 -56.6506 -56.6506 -24.4235 -24.4235 -24.4228 -24.4228 -24.4207 -24.4207 -24.4186 -24.4186 -11.5013 -11.5013 -11.4843 -11.4843 -9.5080 -9.5080 -9.4351 -9.4351 -8.8326 -8.8326 -8.7863 -8.7863 -8.2865 -8.2865 -8.1922 -8.1922 -4.0600 -4.0600 -3.4370 -3.4370 -3.2599 -3.2599 -3.2149 -3.2149 -2.6302 -2.6302 -2.3753 -2.3753 -2.2072 -2.2072 -1.9517 -1.9517 -1.6468 -1.6468 -1.4919 -1.4919 -0.1217 -0.1217 -0.0444 -0.0444 0.0645 0.0645 0.2105 0.2105 0.6301 0.6301 0.7390 0.7390 0.8078 0.8078 1.2577 1.2577 1.3789 1.3789 1.4847 1.4847 1.5210 1.5210 2.1218 2.1218 2.6113 2.6113 2.8877 2.8877 3.4003 3.4003 3.6633 3.6633 4.7762 4.7762 4.8988 4.8988 4.9609 4.9609 5.1242 5.1242 5.3715 5.3715 5.5179 5.5179 5.7449 5.7449 5.9795 5.9795 6.1702 6.1702 6.2129 6.2129 6.4179 6.4179 6.5111 6.5111 6.6323 6.6323 7.2060 7.2060 k = 0.0000 0.2328-0.0000 ( 12610 PWs) bands (ev): ************************************************************************ 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6.1707 6.2149 6.2149 6.4215 6.4215 6.5188 6.5188 6.5955 6.5955 7.2449 7.2449 k = 0.0000 0.2231-0.0000 ( 12618 PWs) bands (ev): ************************************************************************ -786.6250-786.6250-785.8288-785.8288-785.6399-785.6399-785.3097-785.3097 -102.0175-102.0175-101.9605-101.9605-101.9055-101.9055-101.8543-101.8543 -59.5700 -59.5700 -59.5481 -59.5481 -59.5386 -59.5386 -59.4947 -59.4947 -56.6559 -56.6559 -56.6540 -56.6540 -56.6534 -56.6534 -56.6527 -56.6527 -24.4252 -24.4252 -24.4236 -24.4236 -24.4224 -24.4224 -24.4191 -24.4191 -11.5284 -11.5284 -11.5064 -11.5064 -9.6062 -9.6062 -9.5219 -9.5219 -8.7173 -8.7173 -8.6495 -8.6495 -8.2170 -8.2170 -8.0971 -8.0971 -4.1717 -4.1717 -3.4674 -3.4674 -3.3264 -3.3264 -3.2324 -3.2324 -2.7339 -2.7339 -2.4023 -2.4023 -2.1366 -2.1366 -1.8519 -1.8519 -1.7331 -1.7331 -1.5011 -1.5011 -0.1371 -0.1371 -0.0638 -0.0638 0.0633 0.0633 0.2264 0.2264 0.5819 0.5819 0.6338 0.6338 0.7802 0.7802 1.2147 1.2147 1.2969 1.2969 1.4784 1.4784 1.5345 1.5345 1.9922 1.9922 2.7728 2.7728 3.0325 3.0325 3.6203 3.6203 3.8796 3.8796 4.7566 4.7566 4.8427 4.8427 4.9222 4.9222 5.1504 5.1504 5.3724 5.3724 5.5147 5.5147 5.7314 5.7314 5.9120 5.9120 6.1655 6.1655 6.2225 6.2225 6.4267 6.4267 6.5278 6.5278 6.5663 6.5663 7.2807 7.2807 k = 0.0000 0.2134-0.0000 ( 12630 PWs) bands (ev): ************************************************************************ -786.6820-786.6820-786.2374-786.2374-785.6998-785.6998-785.3697-785.3697 -102.0430-102.0430-101.9781-101.9781-101.9544-101.9544-101.8780-101.8780 -59.5758 -59.5758 -59.5536 -59.5536 -59.5393 -59.5393 -59.5146 -59.5146 -56.6569 -56.6569 -56.6556 -56.6556 -56.6535 -56.6535 -56.6530 -56.6530 -24.4262 -24.4262 -24.4249 -24.4249 -24.4220 -24.4220 -24.4200 -24.4200 -11.5435 -11.5435 -11.5193 -11.5193 -9.6526 -9.6526 -9.5633 -9.5633 -8.6578 -8.6578 -8.5801 -8.5801 -8.1746 -8.1746 -8.0435 -8.0435 -4.2255 -4.2255 -3.5049 -3.5049 -3.3755 -3.3755 -3.2238 -3.2238 -2.7892 -2.7892 -2.4302 -2.4302 -2.0981 -2.0981 -1.8128 -1.8128 -1.7651 -1.7651 -1.4985 -1.4985 -0.1453 -0.1453 -0.0769 -0.0769 0.0668 0.0668 0.2319 0.2319 0.5610 0.5610 0.5881 0.5881 0.7596 0.7596 1.1549 1.1549 1.2880 1.2880 1.4846 1.4846 1.5494 1.5494 1.9297 1.9297 2.8400 2.8400 3.1026 3.1026 3.7444 3.7444 3.9918 3.9918 4.7312 4.7312 4.8015 4.8015 4.9121 4.9121 5.1656 5.1656 5.3815 5.3815 5.5105 5.5105 5.7327 5.7327 5.8799 5.8799 6.1559 6.1559 6.2344 6.2344 6.4330 6.4330 6.5387 6.5387 6.5451 6.5451 7.2947 7.2947 k = 0.0000 0.2037-0.0000 ( 12630 PWs) bands (ev): ************************************************************************ -786.7153-786.7153-786.2706-786.2706-785.7722-785.7722-785.3919-785.3919 -102.0575-102.0575-101.9653-101.9653-101.9494-101.9494-101.8771-101.8771 -59.5801 -59.5801 -59.5503 -59.5503 -59.5298 -59.5298 -59.5157 -59.5157 -56.6571 -56.6571 -56.6557 -56.6557 -56.6529 -56.6529 -56.6520 -56.6520 -24.4260 -24.4260 -24.4245 -24.4245 -24.4224 -24.4224 -24.4201 -24.4201 -11.5594 -11.5594 -11.5331 -11.5331 -9.6971 -9.6971 -9.6034 -9.6034 -8.5969 -8.5969 -8.5100 -8.5100 -8.1275 -8.1275 -7.9864 -7.9864 -4.2776 -4.2776 -3.5493 -3.5493 -3.4261 -3.4261 -3.2209 -3.2209 -2.8453 -2.8453 -2.4699 -2.4699 -2.0576 -2.0576 -1.8323 -1.8323 -1.7361 -1.7361 -1.4894 -1.4894 -0.1545 -0.1545 -0.0899 -0.0899 0.0714 0.0714 0.2363 0.2363 0.5375 0.5375 0.5540 0.5540 0.7330 0.7330 1.0955 1.0955 1.2837 1.2837 1.4930 1.4930 1.5668 1.5668 1.8707 1.8707 2.8950 2.8950 3.1695 3.1695 3.8746 3.8746 4.1047 4.1047 4.6815 4.6815 4.7759 4.7759 4.9002 4.9002 5.1820 5.1820 5.3957 5.3957 5.5071 5.5071 5.7364 5.7364 5.8542 5.8542 6.1440 6.1440 6.2494 6.2494 6.4398 6.4398 6.5314 6.5314 6.5527 6.5527 7.2791 7.2791 k = 0.0000 0.1940-0.0000 ( 12626 PWs) bands (ev): ************************************************************************ -786.5660-786.5660-786.2091-786.2091-785.8208-785.8208-785.3992-785.3992 -102.0451-102.0451-101.9508-101.9508-101.9329-101.9329-101.8759-101.8759 -59.5817 -59.5817 -59.5501 -59.5501 -59.5286 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************************************************************************ -786.3561-786.3561-786.1067-786.1067-785.6366-785.6366-785.2594-785.2594 -102.0236-102.0236-101.9394-101.9394-101.9277-101.9277-101.8644-101.8644 -59.5674 -59.5674 -59.5397 -59.5397 -59.5181 -59.5181 -59.4926 -59.4926 -56.6555 -56.6555 -56.6546 -56.6546 -56.6521 -56.6521 -56.6502 -56.6502 -24.4255 -24.4255 -24.4224 -24.4224 -24.4214 -24.4214 -24.4189 -24.4189 -11.5928 -11.5928 -11.5627 -11.5627 -9.7803 -9.7803 -9.6788 -9.6788 -8.4716 -8.4716 -8.3687 -8.3687 -8.0208 -8.0208 -7.8638 -7.8638 -4.3765 -4.3765 -3.6511 -3.6511 -3.5263 -3.5263 -3.2491 -3.2491 -2.9587 -2.9587 -2.5824 -2.5824 -1.9916 -1.9916 -1.8771 -1.8771 -1.6382 -1.6382 -1.4525 -1.4525 -0.1778 -0.1778 -0.1109 -0.1109 0.0801 0.0801 0.2385 0.2385 0.4772 0.4772 0.5279 0.5279 0.6643 0.6643 0.9989 0.9989 1.2757 1.2757 1.5119 1.5119 1.6065 1.6065 1.7669 1.7669 2.9603 2.9603 3.2890 3.2890 4.1459 4.1459 4.3094 4.3094 4.5597 4.5597 4.7261 4.7261 4.8929 4.8929 5.2161 5.2161 5.4347 5.4347 5.5112 5.5112 5.7453 5.7453 5.8290 5.8290 6.1176 6.1176 6.2875 6.2875 6.4553 6.4553 6.5251 6.5251 6.5907 6.5907 7.2364 7.2364 k = 0.0000 0.1746-0.0000 ( 12604 PWs) bands (ev): ************************************************************************ -786.2809-786.2809-785.9368-785.9368-785.5499-785.5499-785.2342-785.2342 -101.9768-101.9768-101.9441-101.9441-101.8693-101.8693-101.8299-101.8299 -59.5616 -59.5616 -59.5267 -59.5267 -59.5055 -59.5055 -59.4860 -59.4860 -56.6548 -56.6548 -56.6539 -56.6539 -56.6511 -56.6511 -56.6497 -56.6497 -24.4244 -24.4244 -24.4208 -24.4208 -24.4203 -24.4203 -24.4186 -24.4186 -11.6099 -11.6099 -11.5781 -11.5781 -9.8190 -9.8190 -9.7142 -9.7142 -8.4075 -8.4075 -8.2979 -8.2979 -7.9619 -7.9619 -7.7992 -7.7992 -4.4231 -4.4231 -3.7066 -3.7066 -3.5746 -3.5746 -3.2826 -3.2826 -3.0167 -3.0167 -2.6517 -2.6517 -1.9946 -1.9946 -1.8518 -1.8518 -1.5912 -1.5912 -1.4260 -1.4260 -0.1922 -0.1922 -0.1180 -0.1180 0.0835 0.0835 0.2356 0.2356 0.4531 0.4531 0.5222 0.5222 0.6268 0.6268 0.9628 0.9628 1.2712 1.2712 1.5216 1.5216 1.6262 1.6262 1.7250 1.7250 2.9695 2.9695 3.3394 3.3394 4.2814 4.2814 4.3624 4.3624 4.5231 4.5231 4.6957 4.6957 4.9131 4.9131 5.2325 5.2325 5.4568 5.4568 5.5231 5.5231 5.7503 5.7503 5.8273 5.8273 6.1045 6.1045 6.3108 6.3108 6.4646 6.4646 6.5317 6.5317 6.6145 6.6145 7.2141 7.2141 k = 0.0000 0.1649-0.0000 ( 12616 PWs) bands (ev): ************************************************************************ -786.3944-786.3944-786.0527-786.0527-785.7080-785.7080-785.2831-785.2831 -102.0284-102.0284-101.9751-101.9751-101.8875-101.8875-101.8678-101.8678 -59.5729 -59.5729 -59.5417 -59.5417 -59.5102 -59.5102 -59.4861 -59.4861 -56.6556 -56.6556 -56.6537 -56.6537 -56.6531 -56.6531 -56.6504 -56.6504 -24.4246 -24.4246 -24.4212 -24.4212 -24.4209 -24.4209 -24.4199 -24.4199 -11.6271 -11.6271 -11.5936 -11.5936 -9.8557 -9.8557 -9.7481 -9.7481 -8.3429 -8.3429 -8.2273 -8.2273 -7.8999 -7.8999 -7.7329 -7.7329 -4.4679 -4.4679 -3.7644 -3.7644 -3.6217 -3.6217 -3.3277 -3.3277 -3.0774 -3.0774 -2.7271 -2.7271 -2.0134 -2.0134 -1.8017 -1.8017 -1.5475 -1.5475 -1.3954 -1.3954 -0.2085 -0.2085 -0.1244 -0.1244 0.0849 0.0849 0.2302 0.2302 0.4324 0.4324 0.5188 0.5188 0.5927 0.5927 0.9331 0.9331 1.2663 1.2663 1.5310 1.5310 1.6375 1.6375 1.6976 1.6976 2.9634 2.9634 3.3818 3.3818 4.3290 4.3290 4.4186 4.4186 4.5266 4.5266 4.6817 4.6817 4.9571 4.9571 5.2476 5.2476 5.4803 5.4803 5.5421 5.5421 5.7562 5.7562 5.8299 5.8299 6.0922 6.0922 6.3364 6.3364 6.4750 6.4750 6.5448 6.5448 6.6410 6.6410 7.1921 7.1921 k = 0.0000 0.1552-0.0000 ( 12616 PWs) bands (ev): ************************************************************************ -786.5278-786.5278-786.0396-786.0396-785.7225-785.7225-785.1965-785.1965 -102.0136-102.0136-101.9701-101.9701-101.9088-101.9088-101.8673-101.8673 -59.5676 -59.5676 -59.5395 -59.5395 -59.5166 -59.5166 -59.4819 -59.4819 -56.6548 -56.6548 -56.6541 -56.6541 -56.6534 -56.6534 -56.6499 -56.6499 -24.4250 -24.4250 -24.4215 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7.1522 k = 0.0000 0.1358-0.0000 ( 12610 PWs) bands (ev): ************************************************************************ -786.4084-786.4084-786.0691-786.0691-785.6483-785.6483-785.0959-785.0959 -102.0244-102.0244-101.9839-101.9839-101.8835-101.8835-101.8219-101.8219 -59.5603 -59.5603 -59.5359 -59.5359 -59.5165 -59.5165 -59.4675 -59.4675 -56.6534 -56.6534 -56.6511 -56.6511 -56.6501 -56.6501 -56.6482 -56.6482 -24.4249 -24.4249 -24.4222 -24.4222 -24.4205 -24.4205 -24.4186 -24.4186 -11.6772 -11.6772 -11.6397 -11.6397 -9.9540 -9.9540 -9.8390 -9.8390 -8.1486 -8.1486 -8.0184 -8.0184 -7.6999 -7.6999 -7.5282 -7.5282 -4.5884 -4.5884 -3.9440 -3.9440 -3.7606 -3.7606 -3.5076 -3.5076 -3.2813 -3.2813 -2.9699 -2.9699 -2.0639 -2.0639 -1.6079 -1.6079 -1.4341 -1.4341 -1.2908 -1.2908 -0.2563 -0.2563 -0.1385 -0.1385 0.0736 0.0736 0.2103 0.2103 0.3744 0.3744 0.4943 0.4943 0.5663 0.5663 0.8756 0.8756 1.2506 1.2506 1.5581 1.5581 1.5750 1.5750 1.7423 1.7423 2.8689 2.8689 3.4605 3.4605 4.0839 4.0839 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-101.9828-101.9828-101.8780-101.8780-101.7895-101.7895-101.7586-101.7586 -59.5308 -59.5308 -59.4959 -59.4959 -59.4805 -59.4805 -59.4784 -59.4784 -56.6382 -56.6382 -56.6360 -56.6360 -56.6309 -56.6309 -56.6303 -56.6303 -24.5268 -24.5268 -24.5235 -24.5235 -24.5136 -24.5136 -24.5134 -24.5134 -10.7505 -10.7505 -10.7447 -10.7447 -9.2354 -9.2354 -9.1804 -9.1804 -7.1532 -7.1532 -7.0747 -7.0747 -6.5052 -6.5052 -6.4910 -6.4910 -4.0477 -4.0477 -3.8682 -3.8682 -3.7652 -3.7652 -3.7427 -3.7427 -3.5031 -3.5031 -3.4685 -3.4685 -2.6183 -2.6183 -2.5898 -2.5898 -2.2603 -2.2603 -1.8837 -1.8837 -1.7286 -1.7286 -1.2586 -1.2586 -1.1874 -1.1874 -1.1666 -1.1666 0.0072 0.0072 0.2453 0.2453 0.5601 0.5601 0.8084 0.8084 1.3552 1.3552 1.4866 1.4866 1.6404 1.6404 1.6415 1.6415 1.9825 1.9825 2.0906 2.0906 3.0527 3.0527 3.0835 3.0835 3.3371 3.3371 3.4192 3.4192 3.6834 3.6834 3.7106 3.7106 4.5387 4.5387 4.6127 4.6127 5.4247 5.4247 5.5677 5.5677 5.9032 5.9032 6.3452 6.3452 6.4682 6.4682 6.7151 6.7151 6.9692 6.9692 7.3660 7.3660 k = 0.2843-0.0000 0.1007 ( 12578 PWs) bands (ev): ************************************************************************ -786.0831-786.0831-785.6567-785.6567-785.3514-785.3514-785.0781-785.0781 -102.0122-102.0122-101.9114-101.9114-101.7987-101.7987-101.7838-101.7838 -59.5299 -59.5299 -59.4987 -59.4987 -59.4831 -59.4831 -59.4829 -59.4829 -56.6377 -56.6377 -56.6358 -56.6358 -56.6307 -56.6307 -56.6303 -56.6303 -24.5325 -24.5325 -24.5292 -24.5292 -24.5191 -24.5191 -24.5187 -24.5187 -10.6768 -10.6768 -10.6708 -10.6708 -9.1748 -9.1748 -9.1170 -9.1170 -7.1485 -7.1485 -7.0665 -7.0665 -6.5027 -6.5027 -6.4886 -6.4886 -4.0185 -4.0185 -3.8490 -3.8490 -3.7698 -3.7698 -3.7274 -3.7274 -3.5090 -3.5090 -3.4773 -3.4773 -2.6523 -2.6523 -2.6145 -2.6145 -2.2937 -2.2937 -1.9329 -1.9329 -1.7526 -1.7526 -1.2951 -1.2951 -1.2097 -1.2097 -1.1648 -1.1648 -0.0125 -0.0125 0.2085 0.2085 0.5613 0.5613 0.7866 0.7866 1.2835 1.2835 1.3686 1.3686 1.6344 1.6344 1.6426 1.6426 1.9595 1.9595 2.0823 2.0823 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-1.7764 -1.7764 -1.3428 -1.3428 -1.2292 -1.2292 -1.1526 -1.1526 -0.0335 -0.0335 0.1702 0.1702 0.5591 0.5591 0.7569 0.7569 1.1949 1.1949 1.2334 1.2334 1.6371 1.6371 1.6567 1.6567 1.9474 1.9474 2.0754 2.0754 3.0074 3.0074 3.0664 3.0664 3.2034 3.2034 3.3332 3.3332 3.7211 3.7211 3.7468 3.7468 4.4893 4.4893 4.5593 4.5593 5.3276 5.3276 5.4907 5.4907 5.8083 5.8083 6.1626 6.1626 6.4397 6.4397 6.6731 6.6731 6.8075 6.8075 7.2510 7.2510 k = 0.3039-0.0000 0.1007 ( 12592 PWs) bands (ev): ************************************************************************ -786.2599-786.2599-785.9995-785.9995-785.4634-785.4634-785.2505-785.2505 -102.0744-102.0744-101.9320-101.9320-101.8305-101.8305-101.7947-101.7947 -59.5439 -59.5439 -59.5083 -59.5083 -59.4914 -59.4914 -59.4888 -59.4888 -56.6368 -56.6368 -56.6354 -56.6354 -56.6302 -56.6302 -56.6293 -56.6293 -24.5427 -24.5427 -24.5402 -24.5402 -24.5306 -24.5306 -24.5298 -24.5298 -10.5225 -10.5225 -10.5158 -10.5158 -9.0486 -9.0486 -8.9850 -8.9850 -7.1511 -7.1511 -7.0635 -7.0635 -6.5117 -6.5117 -6.4995 -6.4995 -3.9773 -3.9773 -3.8920 -3.8920 -3.8073 -3.8073 -3.6612 -3.6612 -3.4815 -3.4815 -3.4586 -3.4586 -2.7081 -2.7081 -2.6426 -2.6426 -2.3262 -2.3262 -2.0151 -2.0151 -1.7994 -1.7994 -1.3923 -1.3923 -1.2458 -1.2458 -1.1382 -1.1382 -0.0565 -0.0565 0.1308 0.1308 0.5528 0.5528 0.7174 0.7174 1.0942 1.0942 1.1012 1.1012 1.6458 1.6458 1.6727 1.6727 1.9411 1.9411 2.0677 2.0677 2.9671 2.9671 3.0681 3.0681 3.1433 3.1433 3.2919 3.2919 3.7541 3.7541 3.7682 3.7682 4.4711 4.4711 4.5243 4.5243 5.2963 5.2963 5.4643 5.4643 5.7697 5.7697 6.0717 6.0717 6.4223 6.4223 6.6567 6.6567 6.7401 6.7401 7.1946 7.1946 k = 0.3137-0.0000 0.1007 ( 12596 PWs) bands (ev): ************************************************************************ -786.3139-786.3139-785.9619-785.9619-785.5210-785.5210-785.1602-785.1602 -102.1029-102.1029-101.9713-101.9713-101.8559-101.8559-101.7904-101.7904 -59.5492 -59.5492 -59.5143 -59.5143 -59.4892 -59.4892 -59.4860 -59.4860 -56.6363 -56.6363 -56.6352 -56.6352 -56.6305 -56.6305 -56.6284 -56.6284 -24.5475 -24.5475 -24.5449 -24.5449 -24.5357 -24.5357 -24.5355 -24.5355 -10.4418 -10.4418 -10.4349 -10.4349 -8.9831 -8.9831 -8.9165 -8.9165 -7.1596 -7.1596 -7.0702 -7.0702 -6.5235 -6.5235 -6.5137 -6.5137 -3.9725 -3.9725 -3.9310 -3.9310 -3.8229 -3.8229 -3.6224 -3.6224 -3.4557 -3.4557 -3.4369 -3.4369 -2.7293 -2.7293 -2.6499 -2.6499 -2.3290 -2.3290 -2.0493 -2.0493 -1.8195 -1.8195 -1.4405 -1.4405 -1.2597 -1.2597 -1.1244 -1.1244 -0.0819 -0.0819 0.0906 0.0906 0.5417 0.5417 0.6657 0.6657 0.9549 0.9549 1.0116 1.0116 1.6578 1.6578 1.6889 1.6889 1.9376 1.9376 2.0580 2.0580 2.9239 2.9239 3.0498 3.0498 3.1025 3.1025 3.2566 3.2566 3.7902 3.7902 3.7912 3.7912 4.4603 4.4603 4.4874 4.4874 5.2732 5.2732 5.4429 5.4429 5.7365 5.7365 5.9844 5.9844 6.4012 6.4012 6.6420 6.6420 6.6843 6.6843 7.1404 7.1404 k = 0.3235-0.0000 0.1007 ( 12600 PWs) bands (ev): ************************************************************************ -786.4003-786.4003-786.0291-786.0291-785.5580-785.5580-785.1328-785.1328 -102.1262-102.1262-101.9689-101.9689-101.8707-101.8707-101.7996-101.7996 -59.5546 -59.5546 -59.5184 -59.5184 -59.4913 -59.4913 -59.4907 -59.4907 -56.6363 -56.6363 -56.6348 -56.6348 -56.6303 -56.6303 -56.6282 -56.6282 -24.5527 -24.5527 -24.5497 -24.5497 -24.5410 -24.5410 -24.5406 -24.5406 -10.3589 -10.3589 -10.3516 -10.3516 -8.9161 -8.9161 -8.8464 -8.8464 -7.1738 -7.1738 -7.0837 -7.0837 -6.5403 -6.5403 -6.5340 -6.5340 -3.9812 -3.9812 -3.9695 -3.9695 -3.8270 -3.8270 -3.5873 -3.5873 -3.4253 -3.4253 -3.4116 -3.4116 -2.7442 -2.7442 -2.6539 -2.6539 -2.3271 -2.3271 -2.0819 -2.0819 -1.8339 -1.8339 -1.4851 -1.4851 -1.2712 -1.2712 -1.1121 -1.1121 -0.1103 -0.1103 0.0501 0.0501 0.5248 0.5248 0.5999 0.5999 0.8177 0.8177 0.9318 0.9318 1.6716 1.6716 1.7048 1.7048 1.9358 1.9358 2.0465 2.0465 2.8776 2.8776 3.0024 3.0024 3.0893 3.0893 3.2270 3.2270 3.8131 3.8131 3.8308 3.8308 4.4519 4.4519 4.4585 4.4585 5.2560 5.2560 5.4245 5.4245 5.7085 5.7085 5.9029 5.9029 6.3761 6.3761 6.6286 6.6286 6.6418 6.6418 7.0890 7.0890 k = 0.3333-0.0000 0.1007 ( 12600 PWs) bands (ev): ************************************************************************ -786.2391-786.2391-785.9258-785.9258-785.6521-785.6521-785.1940-785.1940 -102.1220-102.1220-101.9513-101.9513-101.8823-101.8823-101.8247-101.8247 -59.5520 -59.5520 -59.5183 -59.5183 -59.4998 -59.4998 -59.4901 -59.4901 -56.6360 -56.6360 -56.6337 -56.6337 -56.6298 -56.6298 -56.6284 -56.6284 -24.5574 -24.5574 -24.5545 -24.5545 -24.5460 -24.5460 -24.5450 -24.5450 -10.2738 -10.2738 -10.2662 -10.2662 -8.8476 -8.8476 -8.7748 -8.7748 -7.1943 -7.1943 -7.1046 -7.1046 -6.5617 -6.5617 -6.5603 -6.5603 -4.0035 -4.0035 -3.9979 -3.9979 -3.8220 -3.8220 -3.5585 -3.5585 -3.3915 -3.3915 -3.3849 -3.3849 -2.7509 -2.7509 -2.6549 -2.6549 -2.3237 -2.3237 -2.1153 -2.1153 -1.8401 -1.8401 -1.5243 -1.5243 -1.2805 -1.2805 -1.1020 -1.1020 -0.1424 -0.1424 0.0097 0.0097 0.5004 0.5004 0.5216 0.5216 0.6853 0.6853 0.8632 0.8632 1.6865 1.6865 1.7204 1.7204 1.9351 1.9351 2.0334 2.0334 2.8287 2.8287 2.9484 2.9484 3.0799 3.0799 3.2018 3.2018 3.8376 3.8376 3.8722 3.8722 4.4205 4.4205 4.4660 4.4660 5.2424 5.2424 5.4066 5.4066 5.6842 5.6842 5.8290 5.8290 6.3482 6.3482 6.6130 6.6130 6.6166 6.6166 7.0408 7.0408 k = 0.3431-0.0000 0.1007 ( 12612 PWs) bands (ev): ************************************************************************ -786.3559-786.3559-786.0491-786.0491-785.8179-785.8179-785.3711-785.3711 -102.1167-102.1167-102.0177-102.0177-101.9181-101.9181-101.8699-101.8699 -59.5519 -59.5519 -59.5268 -59.5268 -59.5045 -59.5045 -59.4975 -59.4975 -56.6355 -56.6355 -56.6335 -56.6335 -56.6298 -56.6298 -56.6285 -56.6285 -24.5622 -24.5622 -24.5594 -24.5594 -24.5511 -24.5511 -24.5495 -24.5495 -10.1865 -10.1865 -10.1785 -10.1785 -8.7778 -8.7778 -8.7019 -8.7019 -7.2218 -7.2218 -7.1339 -7.1339 -6.5925 -6.5925 -6.5876 -6.5876 -4.0306 -4.0306 -4.0154 -4.0154 -3.8132 -3.8132 -3.5370 -3.5370 -3.3582 -3.3582 -3.3556 -3.3556 -2.7483 -2.7483 -2.6528 -2.6528 -2.3220 -2.3220 -2.1513 -2.1513 -1.8368 -1.8368 -1.5559 -1.5559 -1.2880 -1.2880 -1.0945 -1.0945 -0.1794 -0.1794 -0.0305 -0.0305 0.4352 0.4352 0.4610 0.4610 0.5657 0.5657 0.8035 0.8035 1.7019 1.7019 1.7356 1.7356 1.9354 1.9354 2.0192 2.0192 2.7781 2.7781 2.8947 2.8947 3.0659 3.0659 3.1786 3.1786 3.8647 3.8647 3.9145 3.9145 4.3956 4.3956 4.4822 4.4822 5.2307 5.2307 5.3865 5.3865 5.6620 5.6620 5.7646 5.7646 6.3198 6.3198 6.5965 6.5965 6.6058 6.6058 6.9958 6.9958 k = 0.3529-0.0000 0.1007 ( 12612 PWs) bands (ev): ************************************************************************ -786.2615-786.2615-786.2109-786.2109-785.8209-785.8209-785.2704-785.2704 -102.1232-102.1232-102.0054-102.0054-101.9197-101.9197-101.9001-101.9001 -59.5402 -59.5402 -59.5220 -59.5220 -59.5155 -59.5155 -59.4984 -59.4984 -56.6350 -56.6350 -56.6328 -56.6328 -56.6290 -56.6290 -56.6282 -56.6282 -24.5656 -24.5656 -24.5630 -24.5630 -24.5562 -24.5562 -24.5542 -24.5542 -10.0971 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************************************************************************ -786.5321-786.5321-786.4251-786.4251-786.0983-786.0983-785.5203-785.5203 -102.1316-102.1316-102.0564-102.0564-102.0278-102.0278-101.9475-101.9475 -59.5481 -59.5481 -59.5383 -59.5383 -59.5359 -59.5359 -59.5099 -59.5099 -56.6341 -56.6341 -56.6329 -56.6329 -56.6294 -56.6294 -56.6277 -56.6277 -24.5739 -24.5739 -24.5718 -24.5718 -24.5661 -24.5661 -24.5636 -24.5636 -9.9120 -9.9120 -9.9027 -9.9027 -8.5614 -8.5614 -8.4756 -8.4756 -7.3507 -7.3507 -7.2763 -7.2763 -6.7194 -6.7194 -6.6873 -6.6873 -4.0629 -4.0629 -4.0380 -4.0380 -3.7858 -3.7858 -3.5083 -3.5083 -3.2878 -3.2878 -3.2498 -3.2498 -2.6825 -2.6825 -2.6350 -2.6350 -2.3500 -2.3500 -2.2627 -2.2627 -1.7774 -1.7774 -1.5890 -1.5890 -1.2999 -1.2999 -1.0907 -1.0907 -0.3296 -0.3296 -0.1513 -0.1513 0.1564 0.1564 0.1822 0.1822 0.3931 0.3931 0.6461 0.6461 1.7492 1.7492 1.7783 1.7783 1.9456 1.9456 1.9777 1.9777 2.6280 2.6280 2.7426 2.7426 2.9926 2.9926 3.1022 3.1022 3.9682 3.9682 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-0.3957 -0.1959 -0.1959 0.0503 0.0503 0.1127 0.1127 0.3481 0.3481 0.5940 0.5940 1.7652 1.7652 1.7903 1.7903 1.9525 1.9525 1.9664 1.9664 2.5824 2.5824 2.6954 2.6954 2.9598 2.9598 3.0707 3.0707 4.0098 4.0098 4.0858 4.0858 4.3820 4.3820 4.5976 4.5976 5.1903 5.1903 5.2709 5.2709 5.5610 5.5610 5.6168 5.6168 6.2524 6.2524 6.5734 6.5734 6.6197 6.6197 6.8493 6.8493 k = 0.3922-0.0000 0.1007 ( 12626 PWs) bands (ev): ************************************************************************ -786.3335-786.3335-786.1328-786.1328-785.9691-785.9691-785.4954-785.4954 -102.1082-102.1082-102.0619-102.0619-102.0246-102.0246-101.9410-101.9410 -59.5450 -59.5450 -59.5288 -59.5288 -59.5253 -59.5253 -59.5056 -59.5056 -56.6322 -56.6322 -56.6305 -56.6305 -56.6278 -56.6278 -56.6265 -56.6265 -24.5800 -24.5800 -24.5786 -24.5786 -24.5728 -24.5728 -24.5708 -24.5708 -9.7192 -9.7192 -9.7089 -9.7089 -8.4122 -8.4122 -8.3196 -8.3196 -7.4768 -7.4768 -7.4158 -7.4158 -6.8228 -6.8228 -6.7695 -6.7695 -4.0439 -4.0439 -4.0202 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0.7631 0.7631 2.2371 2.2371 2.3152 2.3152 2.4001 2.4001 2.4092 2.4092 3.9159 3.9159 3.9553 3.9553 4.0471 4.0471 4.0984 4.0984 4.4665 4.4665 4.5289 4.5289 4.5358 4.5358 4.5546 4.5546 5.2267 5.2267 5.3265 5.3265 5.4742 5.4742 5.6190 5.6190 6.0762 6.0762 6.2080 6.2080 6.3201 6.3201 6.5178 6.5178 k = 0.5000 0.2813 0.1007 ( 12648 PWs) bands (ev): ************************************************************************ -786.6149-786.6149-786.5695-786.5695-786.4607-786.4607-786.3984-786.3984 -102.0851-102.0851-102.0834-102.0834-102.0284-102.0284-102.0107-102.0107 -59.5669 -59.5669 -59.5627 -59.5627 -59.5374 -59.5374 -59.5358 -59.5358 -56.6331 -56.6331 -56.6331 -56.6331 -56.6300 -56.6300 -56.6294 -56.6294 -24.5960 -24.5960 -24.5957 -24.5957 -24.5953 -24.5953 -24.5944 -24.5944 -8.3718 -8.3718 -8.3687 -8.3687 -8.3630 -8.3630 -8.3604 -8.3604 -7.3991 -7.3991 -7.3871 -7.3871 -7.1855 -7.1855 -7.1702 -7.1702 -4.6555 -4.6555 -4.6460 -4.6460 -4.5335 -4.5335 -4.5208 -4.5208 -4.2173 -4.2173 -4.2053 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6.4522 6.4522 k = 0.4510 0.3007 0.1007 ( 12616 PWs) bands (ev): ************************************************************************ -786.1921-786.1921-786.1921-786.1921-785.9513-785.9513-785.9513-785.9513 -102.0162-102.0162-102.0162-102.0162-101.9419-101.9419-101.9419-101.9419 -59.5415 -59.5415 -59.5415 -59.5415 -59.5146 -59.5146 -59.5146 -59.5146 -56.6324 -56.6324 -56.6324 -56.6324 -56.6285 -56.6285 -56.6285 -56.6285 -24.5914 -24.5914 -24.5914 -24.5914 -24.5879 -24.5879 -24.5879 -24.5879 -8.8443 -8.8443 -8.8443 -8.8443 -7.9828 -7.9828 -7.9828 -7.9828 -7.4462 -7.4462 -7.4462 -7.4462 -7.2260 -7.2260 -7.2260 -7.2260 -4.8003 -4.8003 -4.8003 -4.8003 -4.3706 -4.3706 -4.3706 -4.3706 -4.0864 -4.0864 -4.0864 -4.0864 -3.8835 -3.8835 -3.8835 -3.8835 -1.6831 -1.6831 -1.6831 -1.6831 -1.4623 -1.4623 -1.4623 -1.4623 -0.4340 -0.4340 -0.4340 -0.4340 -0.1274 -0.1274 -0.1274 -0.1274 0.4833 0.4833 0.4833 0.4833 0.8602 0.8602 0.8602 0.8602 2.2114 2.2114 2.2114 2.2114 2.4363 2.4363 2.4363 2.4363 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7.0492 7.0492 k = 0.3137 0.3007 0.1007 ( 12644 PWs) bands (ev): ************************************************************************ -786.7189-786.7189-786.7189-786.7189-785.9517-785.9517-785.9517-785.9517 -102.0828-102.0828-102.0828-102.0828-101.9889-101.9889-101.9889-101.9889 -59.5627 -59.5627 -59.5627 -59.5627 -59.5367 -59.5367 -59.5367 -59.5367 -56.6427 -56.6427 -56.6427 -56.6427 -56.6350 -56.6350 -56.6350 -56.6350 -24.5477 -24.5477 -24.5477 -24.5477 -24.5388 -24.5388 -24.5388 -24.5388 -10.1330 -10.1330 -10.1330 -10.1330 -8.2527 -8.2527 -8.2527 -8.2527 -8.0440 -8.0440 -8.0440 -8.0440 -7.4686 -7.4686 -7.4686 -7.4686 -4.0459 -4.0459 -4.0459 -4.0459 -3.5707 -3.5707 -3.5707 -3.5707 -3.1393 -3.1393 -3.1393 -3.1393 -2.7414 -2.7414 -2.7414 -2.7414 -2.2740 -2.2740 -2.2740 -2.2740 -1.7554 -1.7554 -1.7554 -1.7554 -0.7349 -0.7349 -0.7349 -0.7349 -0.2057 -0.2057 -0.2057 -0.2057 0.9244 0.9244 0.9244 0.9244 1.4941 1.4941 1.4941 1.4941 1.8698 1.8698 1.8698 1.8698 2.3246 2.3246 2.3246 2.3246 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-1.7655 -1.7655 -1.7655 -1.7655 -0.7502 -0.7502 -0.7502 -0.7502 -0.2131 -0.2131 -0.2131 -0.2131 0.9698 0.9698 0.9698 0.9698 1.5155 1.5155 1.5155 1.5155 1.8787 1.8787 1.8787 1.8787 2.3055 2.3055 2.3055 2.3055 3.3711 3.3711 3.3711 3.3711 3.8556 3.8556 3.8556 3.8556 4.2485 4.2485 4.2485 4.2485 4.5406 4.5406 4.5406 4.5406 5.6545 5.6545 5.6545 5.6545 6.4206 6.4206 6.4206 6.4206 6.7560 6.7560 6.7560 6.7560 7.1310 7.1310 7.1310 7.1310 k = 0.2941 0.3007 0.1007 ( 12624 PWs) bands (ev): ************************************************************************ -786.4209-786.4209-786.4209-786.4209-785.5743-785.5743-785.5743-785.5743 -102.0433-102.0433-102.0433-102.0433-101.9612-101.9612-101.9612-101.9612 -59.5470 -59.5470 -59.5470 -59.5470 -59.5200 -59.5200 -59.5200 -59.5200 -56.6430 -56.6430 -56.6430 -56.6430 -56.6354 -56.6354 -56.6354 -56.6354 -24.5368 -24.5368 -24.5368 -24.5368 -24.5274 -24.5274 -24.5274 -24.5274 -10.2893 -10.2893 -10.2893 -10.2893 -8.3535 -8.3535 -8.3535 -8.3535 -8.1552 -8.1552 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5.8680 6.4921 6.4921 6.4921 6.4921 6.8544 6.8544 6.8544 6.8544 7.2607 7.2607 7.2607 7.2607 k = 0.2647 0.3007 0.1007 ( 12608 PWs) bands (ev): ************************************************************************ -786.1782-786.1782-786.1782-786.1782-785.3199-785.3199-785.3199-785.3199 -102.0481-102.0481-102.0481-102.0481-101.9018-101.9018-101.9018-101.9018 -59.5340 -59.5340 -59.5340 -59.5340 -59.4999 -59.4999 -59.4999 -59.4999 -56.6438 -56.6438 -56.6438 -56.6438 -56.6363 -56.6363 -56.6363 -56.6363 -24.5205 -24.5205 -24.5205 -24.5205 -24.5102 -24.5102 -24.5102 -24.5102 -10.5070 -10.5070 -10.5070 -10.5070 -8.5019 -8.5019 -8.5019 -8.5019 -8.3175 -8.3175 -8.3175 -8.3175 -7.6673 -7.6673 -7.6673 -7.6673 -3.4523 -3.4523 -3.4523 -3.4523 -3.2765 -3.2765 -3.2765 -3.2765 -2.8971 -2.8971 -2.8971 -2.8971 -2.5287 -2.5287 -2.5287 -2.5287 -2.2934 -2.2934 -2.2934 -2.2934 -1.7356 -1.7356 -1.7356 -1.7356 -0.7985 -0.7985 -0.7985 -0.7985 -0.2131 -0.2131 -0.2131 -0.2131 1.1299 1.1299 1.1299 1.1299 1.5158 1.5158 1.5158 1.5158 1.9910 1.9910 1.9910 1.9910 2.2630 2.2630 2.2630 2.2630 3.4064 3.4064 3.4064 3.4064 3.6951 3.6951 3.6951 3.6951 4.1773 4.1773 4.1773 4.1773 4.3935 4.3935 4.3935 4.3935 5.9383 5.9383 5.9383 5.9383 6.4655 6.4655 6.4655 6.4655 6.9196 6.9196 6.9196 6.9196 7.3074 7.3074 7.3074 7.3074 k = 0.2549 0.3007 0.1007 ( 12628 PWs) bands (ev): ************************************************************************ -786.3953-786.3953-786.3953-786.3953-785.6644-785.6644-785.6644-785.6644 -102.0807-102.0807-102.0807-102.0807-101.9482-101.9482-101.9482-101.9482 -59.5508 -59.5508 -59.5508 -59.5508 -59.5107 -59.5107 -59.5107 -59.5107 -56.6455 -56.6455 -56.6455 -56.6455 -56.6381 -56.6381 -56.6381 -56.6381 -24.5165 -24.5165 -24.5165 -24.5165 -24.5054 -24.5054 -24.5054 -24.5054 -10.5750 -10.5750 -10.5750 -10.5750 -8.5499 -8.5499 -8.5499 -8.5499 -8.3698 -8.3698 -8.3698 -8.3698 -7.7096 -7.7096 -7.7096 -7.7096 -3.3882 -3.3882 -3.3882 -3.3882 -3.1942 -3.1942 -3.1942 -3.1942 -2.8520 -2.8520 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************************************************************************ -786.2383-786.2383-786.2383-786.2383-785.4022-785.4022-785.4022-785.4022 -102.0213-102.0213-102.0213-102.0213-101.9205-101.9205-101.9205-101.9205 -59.5358 -59.5358 -59.5358 -59.5358 -59.5056 -59.5056 -59.5056 -59.5056 -56.6465 -56.6465 -56.6465 -56.6465 -56.6391 -56.6391 -56.6391 -56.6391 -24.4991 -24.4991 -24.4991 -24.4991 -24.4890 -24.4890 -24.4890 -24.4890 -10.7646 -10.7646 -10.7646 -10.7646 -8.6867 -8.6867 -8.6867 -8.6867 -8.5187 -8.5187 -8.5187 -8.5187 -7.8351 -7.8351 -7.8351 -7.8351 -3.3049 -3.3049 -3.3049 -3.3049 -3.0648 -3.0648 -3.0648 -3.0648 -2.5874 -2.5874 -2.5874 -2.5874 -2.4898 -2.4898 -2.4898 -2.4898 -2.1548 -2.1548 -2.1548 -2.1548 -1.5843 -1.5843 -1.5843 -1.5843 -0.8141 -0.8141 -0.8141 -0.8141 -0.1475 -0.1475 -0.1475 -0.1475 1.1580 1.1580 1.1580 1.1580 1.5637 1.5637 1.5637 1.5637 1.9944 1.9944 1.9944 1.9944 2.3908 2.3908 2.3908 2.3908 3.4409 3.4409 3.4409 3.4409 3.5854 3.5854 3.5854 3.5854 4.1450 4.1450 4.1450 4.1450 4.3942 4.3942 4.3942 4.3942 6.1762 6.1762 6.1762 6.1762 6.3141 6.3141 6.3141 6.3141 7.1118 7.1118 7.1118 7.1118 7.4755 7.4755 7.4755 7.4755 k = 0.2157 0.3007 0.1007 ( 12616 PWs) bands (ev): ************************************************************************ -786.3318-786.3318-786.3318-786.3318-785.3230-785.3230-785.3230-785.3230 -102.0397-102.0397-102.0397-102.0397-101.9282-101.9282-101.9282-101.9282 -59.5418 -59.5418 -59.5418 -59.5418 -59.5053 -59.5053 -59.5053 -59.5053 -56.6480 -56.6480 -56.6480 -56.6480 -56.6405 -56.6405 -56.6405 -56.6405 -24.4937 -24.4937 -24.4937 -24.4937 -24.4844 -24.4844 -24.4844 -24.4844 -10.8229 -10.8229 -10.8229 -10.8229 -8.7297 -8.7297 -8.7297 -8.7297 -8.5655 -8.5655 -8.5655 -8.5655 -7.8758 -7.8758 -7.8758 -7.8758 -3.2951 -3.2951 -3.2951 -3.2951 -3.0681 -3.0681 -3.0681 -3.0681 -2.5214 -2.5214 -2.5214 -2.5214 -2.4233 -2.4233 -2.4233 -2.4233 -2.1131 -2.1131 -2.1131 -2.1131 -1.5372 -1.5372 -1.5372 -1.5372 -0.8083 -0.8083 -0.8083 -0.8083 -0.1192 -0.1192 -0.1192 -0.1192 1.1415 1.1415 1.1415 1.1415 1.5846 1.5846 1.5846 1.5846 1.9864 1.9864 1.9864 1.9864 2.4332 2.4332 2.4332 2.4332 3.4496 3.4496 3.4496 3.4496 3.5707 3.5707 3.5707 3.5707 4.1323 4.1323 4.1323 4.1323 4.4374 4.4374 4.4374 4.4374 6.1918 6.1918 6.1918 6.1918 6.3054 6.3054 6.3054 6.3054 7.1340 7.1340 7.1340 7.1340 7.4858 7.4858 7.4858 7.4858 k = 0.2059 0.3007 0.1007 ( 12616 PWs) bands (ev): ************************************************************************ -786.3847-786.3847-786.3847-786.3847-785.3196-785.3196-785.3196-785.3196 -102.0356-102.0356-102.0356-102.0356-101.9125-101.9125-101.9125-101.9125 -59.5450 -59.5450 -59.5450 -59.5450 -59.5065 -59.5065 -59.5065 -59.5065 -56.6485 -56.6485 -56.6485 -56.6485 -56.6408 -56.6408 -56.6408 -56.6408 -24.4887 -24.4887 -24.4887 -24.4887 -24.4795 -24.4795 -24.4795 -24.4795 -10.8788 -10.8788 -10.8788 -10.8788 -8.7712 -8.7712 -8.7712 -8.7712 -8.6106 -8.6106 -8.6106 -8.6106 -7.9155 -7.9155 -7.9155 -7.9155 -3.2910 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7.4594 7.4594 k = 0.1765 0.3007 0.1007 ( 12608 PWs) bands (ev): ************************************************************************ -786.1284-786.1284-786.1284-786.1284-785.0835-785.0835-785.0835-785.0835 -102.0237-102.0237-102.0237-102.0237-101.8888-101.8888-101.8888-101.8888 -59.5415 -59.5415 -59.5415 -59.5415 -59.5074 -59.5074 -59.5074 -59.5074 -56.6506 -56.6506 -56.6506 -56.6506 -56.6432 -56.6432 -56.6432 -56.6432 -24.4739 -24.4739 -24.4739 -24.4739 -24.4650 -24.4650 -24.4650 -24.4650 -11.0314 -11.0314 -11.0314 -11.0314 -8.8864 -8.8864 -8.8864 -8.8864 -8.7354 -8.7354 -8.7354 -8.7354 -8.0274 -8.0274 -8.0274 -8.0274 -3.3032 -3.3032 -3.3032 -3.3032 -3.1464 -3.1464 -3.1464 -3.1464 -2.4734 -2.4734 -2.4734 -2.4734 -2.1783 -2.1783 -2.1783 -2.1783 -1.6974 -1.6974 -1.6974 -1.6974 -1.3722 -1.3722 -1.3722 -1.3722 -0.7160 -0.7160 -0.7160 -0.7160 0.0403 0.0403 0.0403 0.0403 1.0455 1.0455 1.0455 1.0455 1.5929 1.5929 1.5929 1.5929 2.0153 2.0153 2.0153 2.0153 2.5451 2.5451 2.5451 2.5451 3.5113 3.5113 3.5113 3.5113 3.5676 3.5676 3.5676 3.5676 4.1440 4.1440 4.1440 4.1440 4.7246 4.7246 4.7246 4.7246 6.0386 6.0386 6.0386 6.0386 6.4332 6.4332 6.4332 6.4332 7.1585 7.1585 7.1585 7.1585 7.4426 7.4426 7.4426 7.4426 k = 0.1667 0.3007 0.1007 ( 12600 PWs) bands (ev): ************************************************************************ -786.0712-786.0712-786.0712-786.0712-785.0336-785.0336-785.0336-785.0336 -101.9922-101.9922-101.9922-101.9922-101.8685-101.8685-101.8685-101.8685 -59.5349 -59.5349 -59.5349 -59.5349 -59.5069 -59.5069 -59.5069 -59.5069 -56.6507 -56.6507 -56.6507 -56.6507 -56.6434 -56.6434 -56.6434 -56.6434 -24.4685 -24.4685 -24.4685 -24.4685 -24.4604 -24.4604 -24.4604 -24.4604 -11.0772 -11.0772 -11.0772 -11.0772 -8.9214 -8.9214 -8.9214 -8.9214 -8.7733 -8.7733 -8.7733 -8.7733 -8.0618 -8.0618 -8.0618 -8.0618 -3.3129 -3.3129 -3.3129 -3.3129 -3.1711 -3.1711 -3.1711 -3.1711 -2.4655 -2.4655 -2.4655 -2.4655 -2.1652 -2.1652 -2.1652 -2.1652 -1.5594 -1.5594 -1.5594 -1.5594 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6.5068 6.5068 6.5068 6.5068 7.1219 7.1219 7.1219 7.1219 7.3654 7.3654 7.3654 7.3654 k = 0.1275 0.3007 0.1007 ( 12624 PWs) bands (ev): ************************************************************************ -786.4988-786.4988-786.4988-786.4988-785.2949-785.2949-785.2949-785.2949 -102.0404-102.0404-102.0404-102.0404-101.8994-101.8994-101.8994-101.8994 -59.5541 -59.5541 -59.5541 -59.5541 -59.5229 -59.5229 -59.5229 -59.5229 -56.6540 -56.6540 -56.6540 -56.6540 -56.6473 -56.6473 -56.6473 -56.6473 -24.4525 -24.4525 -24.4525 -24.4525 -24.4455 -24.4455 -24.4455 -24.4455 -11.2348 -11.2348 -11.2348 -11.2348 -9.0435 -9.0435 -9.0435 -9.0435 -8.9055 -8.9055 -8.9055 -8.9055 -8.1831 -8.1831 -8.1831 -8.1831 -3.3644 -3.3644 -3.3644 -3.3644 -3.2676 -3.2676 -3.2676 -3.2676 -2.4370 -2.4370 -2.4370 -2.4370 -2.1637 -2.1637 -2.1637 -2.1637 -1.3541 -1.3541 -1.3541 -1.3541 -0.9011 -0.9011 -0.9011 -0.9011 -0.4514 -0.4514 -0.4514 -0.4514 0.3331 0.3331 0.3331 0.3331 0.9348 0.9348 0.9348 0.9348 1.4583 1.4583 1.4583 1.4583 2.1025 2.1025 2.1025 2.1025 2.5296 2.5296 2.5296 2.5296 3.4284 3.4284 3.4284 3.4284 3.8946 3.8946 3.8946 3.8946 4.3964 4.3964 4.3964 4.3964 5.2208 5.2208 5.2208 5.2208 5.8221 5.8221 5.8221 5.8221 6.5135 6.5135 6.5135 6.5135 7.1042 7.1042 7.1042 7.1042 7.3462 7.3462 7.3462 7.3462 k = 0.1176 0.3007 0.1007 ( 12628 PWs) bands (ev): ************************************************************************ -786.4455-786.4455-786.4455-786.4455-785.3877-785.3877-785.3877-785.3877 -102.0401-102.0401-102.0401-102.0401-101.9113-101.9113-101.9113-101.9113 -59.5538 -59.5538 -59.5538 -59.5538 -59.5322 -59.5322 -59.5322 -59.5322 -56.6545 -56.6545 -56.6545 -56.6545 -56.6485 -56.6485 -56.6485 -56.6485 -24.4491 -24.4491 -24.4491 -24.4491 -24.4421 -24.4421 -24.4421 -24.4421 -11.2677 -11.2677 -11.2677 -11.2677 -9.0693 -9.0693 -9.0693 -9.0693 -8.9334 -8.9334 -8.9334 -8.9334 -8.2090 -8.2090 -8.2090 -8.2090 -3.3781 -3.3781 -3.3781 -3.3781 -3.2896 -3.2896 -3.2896 -3.2896 -2.4301 -2.4301 -2.4301 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************************************************************************ -786.1968-786.1968-786.1968-786.1968-785.0642-785.0642-785.0642-785.0642 -102.0086-102.0086-102.0086-102.0086-101.8531-101.8531-101.8531-101.8531 -59.5438 -59.5438 -59.5438 -59.5438 -59.5096 -59.5096 -59.5096 -59.5096 -56.6543 -56.6543 -56.6543 -56.6543 -56.6495 -56.6495 -56.6495 -56.6495 -24.4374 -24.4374 -24.4374 -24.4374 -24.4326 -24.4326 -24.4326 -24.4326 -11.3508 -11.3508 -11.3508 -11.3508 -9.1345 -9.1345 -9.1345 -9.1345 -9.0039 -9.0039 -9.0039 -9.0039 -8.2748 -8.2748 -8.2748 -8.2748 -3.4159 -3.4159 -3.4159 -3.4159 -3.3479 -3.3479 -3.3479 -3.3479 -2.4084 -2.4084 -2.4084 -2.4084 -2.2007 -2.2007 -2.2007 -2.2007 -1.3518 -1.3518 -1.3518 -1.3518 -0.4228 -0.4228 -0.4228 -0.4228 -0.2129 -0.2129 -0.2129 -0.2129 0.6090 0.6090 0.6090 0.6090 0.9210 0.9210 0.9210 0.9210 1.3296 1.3296 1.3296 1.3296 2.1319 2.1319 2.1319 2.1319 2.4622 2.4622 2.4622 2.4622 3.3325 3.3325 3.3325 3.3325 4.2683 4.2683 4.2683 4.2683 4.7130 4.7130 4.7130 4.7130 5.5468 5.5468 5.5468 5.5468 5.7592 5.7592 5.7592 5.7592 6.5014 6.5014 6.5014 6.5014 6.9211 6.9211 6.9211 6.9211 7.2711 7.2711 7.2711 7.2711 k = 0.0784 0.3007 0.1007 ( 12636 PWs) bands (ev): ************************************************************************ -786.4791-786.4791-786.4791-786.4791-785.5066-785.5066-785.5066-785.5066 -102.0594-102.0594-102.0594-102.0594-101.9369-101.9369-101.9369-101.9369 -59.5612 -59.5612 -59.5612 -59.5612 -59.5247 -59.5247 -59.5247 -59.5247 -56.6554 -56.6554 -56.6554 -56.6554 -56.6515 -56.6515 -56.6515 -56.6515 -24.4366 -24.4366 -24.4366 -24.4366 -24.4314 -24.4314 -24.4314 -24.4314 -11.3733 -11.3733 -11.3733 -11.3733 -9.1524 -9.1524 -9.1524 -9.1524 -9.0233 -9.0233 -9.0233 -9.0233 -8.2928 -8.2928 -8.2928 -8.2928 -3.4269 -3.4269 -3.4269 -3.4269 -3.3645 -3.3645 -3.3645 -3.3645 -2.4009 -2.4009 -2.4009 -2.4009 -2.2132 -2.2132 -2.2132 -2.2132 -1.3548 -1.3548 -1.3548 -1.3548 -0.3307 -0.3307 -0.3307 -0.3307 -0.1601 -0.1601 -0.1601 -0.1601 0.6622 0.6622 0.6622 0.6622 0.9462 0.9462 0.9462 0.9462 1.3010 1.3010 1.3010 1.3010 2.1347 2.1347 2.1347 2.1347 2.4435 2.4435 2.4435 2.4435 3.3098 3.3098 3.3098 3.3098 4.3627 4.3627 4.3627 4.3627 4.7941 4.7941 4.7941 4.7941 5.5402 5.5402 5.5402 5.5402 5.8271 5.8271 5.8271 5.8271 6.4901 6.4901 6.4901 6.4901 6.8171 6.8171 6.8171 6.8171 7.2434 7.2434 7.2434 7.2434 k = 0.0686 0.3007 0.1007 ( 12628 PWs) bands (ev): ************************************************************************ -786.3200-786.3200-786.3200-786.3200-785.3463-785.3463-785.3463-785.3463 -102.0173-102.0173-102.0173-102.0173-101.9375-101.9375-101.9375-101.9375 -59.5579 -59.5579 -59.5579 -59.5579 -59.5241 -59.5241 -59.5241 -59.5241 -56.6552 -56.6552 -56.6552 -56.6552 -56.6521 -56.6521 -56.6521 -56.6521 -24.4340 -24.4340 -24.4340 -24.4340 -24.4289 -24.4289 -24.4289 -24.4289 -11.3931 -11.3931 -11.3931 -11.3931 -9.1681 -9.1681 -9.1681 -9.1681 -9.0402 -9.0402 -9.0402 -9.0402 -8.3087 -8.3087 -8.3087 -8.3087 -3.4367 -3.4367 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6.5584 6.5584 6.5584 6.5584 6.7096 6.7096 6.7096 6.7096 7.0370 7.0370 7.0370 7.0370 k = 0.0000 0.0291 0.1007 ( 12592 PWs) bands (ev): ************************************************************************ -786.0190-786.0190-786.0190-786.0190-785.3654-785.3654-785.3654-785.3654 -101.9254-101.9254-101.9254-101.9254-101.8400-101.8400-101.8400-101.8400 -59.5374 -59.5374 -59.5374 -59.5374 -59.4804 -59.4804 -59.4804 -59.4804 -56.6497 -56.6497 -56.6497 -56.6497 -56.6485 -56.6485 -56.6485 -56.6485 -24.4229 -24.4229 -24.4229 -24.4229 -24.4175 -24.4175 -24.4175 -24.4175 -11.7747 -11.7747 -11.7747 -11.7747 -10.0907 -10.0907 -10.0907 -10.0907 -7.5415 -7.5415 -7.5415 -7.5415 -6.9612 -6.9612 -6.9612 -6.9612 -4.7010 -4.7010 -4.7010 -4.7010 -4.2520 -4.2520 -4.2520 -4.2520 -3.6770 -3.6770 -3.6770 -3.6770 -1.8160 -1.8160 -1.8160 -1.8160 -0.8601 -0.8601 -0.8601 -0.8601 -0.2832 -0.2832 -0.2832 -0.2832 0.0734 0.0734 0.0734 0.0734 0.4216 0.4216 0.4216 0.4216 0.8825 0.8825 0.8825 0.8825 1.3575 1.3575 1.3575 1.3575 1.5617 1.5617 1.5617 1.5617 2.7122 2.7122 2.7122 2.7122 3.9382 3.9382 3.9382 3.9382 4.9929 4.9929 4.9929 4.9929 5.7188 5.7188 5.7188 5.7188 5.8771 5.8771 5.8771 5.8771 6.0997 6.0997 6.0997 6.0997 6.5714 6.5714 6.5714 6.5714 6.7180 6.7180 6.7180 6.7180 7.0659 7.0659 7.0659 7.0659 k = 0.0000 0.0194 0.1007 ( 12596 PWs) bands (ev): ************************************************************************ -786.0363-786.0363-786.0363-786.0363-785.4196-785.4196-785.4196-785.4196 -101.9390-101.9390-101.9390-101.9390-101.8454-101.8454-101.8454-101.8454 -59.5460 -59.5460 -59.5460 -59.5460 -59.4817 -59.4817 -59.4817 -59.4817 -56.6505 -56.6505 -56.6505 -56.6505 -56.6488 -56.6488 -56.6488 -56.6488 -24.4240 -24.4240 -24.4240 -24.4240 -24.4175 -24.4175 -24.4175 -24.4175 -11.7781 -11.7781 -11.7781 -11.7781 -10.0959 -10.0959 -10.0959 -10.0959 -7.5227 -7.5227 -7.5227 -7.5227 -6.9360 -6.9360 -6.9360 -6.9360 -4.7126 -4.7126 -4.7126 -4.7126 -4.2820 -4.2820 -4.2820 -4.2820 -3.6926 -3.6926 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0.7724 0.7724 0.7724 1.1012 1.1012 1.1012 1.1012 1.4466 1.4466 1.4466 1.4466 2.0125 2.0125 2.0125 2.0125 2.5056 2.5056 2.5056 2.5056 3.1872 3.1872 3.1872 3.1872 4.8339 4.8339 4.8339 4.8339 5.0768 5.0768 5.0768 5.0768 5.4542 5.4542 5.4542 5.4542 5.9408 5.9408 5.9408 5.9408 6.2040 6.2040 6.2040 6.2040 6.4523 6.4523 6.4523 6.4523 6.9375 6.9375 6.9375 6.9375 k = 0.0000 0.3007 0.0183 ( 12572 PWs) bands (ev): ************************************************************************ -785.8801-785.8801-785.8801-785.8801-784.9903-784.9903-784.9903-784.9903 -101.8362-101.8362-101.8362-101.8362-101.7609-101.7609-101.7609-101.7609 -59.5364 -59.5364 -59.5364 -59.5364 -59.4820 -59.4820 -59.4820 -59.4820 -56.6526 -56.6526 -56.6526 -56.6526 -56.6503 -56.6503 -56.6503 -56.6503 -24.4210 -24.4210 -24.4210 -24.4210 -24.4197 -24.4197 -24.4197 -24.4197 -11.4580 -11.4580 -11.4580 -11.4580 -9.1821 -9.1821 -9.1821 -9.1821 -9.1402 -9.1402 -9.1402 -9.1402 -8.3526 -8.3526 -8.3526 -8.3526 -3.6957 -3.6957 -3.6957 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-786.6309-786.6309-786.6309-786.6309-786.1164-786.1164-786.1164-786.1164 -102.0893-102.0893-102.0893-102.0893-101.9886-101.9886-101.9886-101.9886 -59.5641 -59.5641 -59.5641 -59.5641 -59.5256 -59.5256 -59.5256 -59.5256 -56.6332 -56.6332 -56.6332 -56.6332 -56.6287 -56.6287 -56.6287 -56.6287 -24.5953 -24.5953 -24.5953 -24.5953 -24.5937 -24.5937 -24.5937 -24.5937 -8.4096 -8.4096 -8.4096 -8.4096 -8.3111 -8.3111 -8.3111 -8.3111 -7.4261 -7.4261 -7.4261 -7.4261 -7.1455 -7.1455 -7.1455 -7.1455 -4.6651 -4.6651 -4.6651 -4.6651 -4.5043 -4.5043 -4.5043 -4.5043 -4.2519 -4.2519 -4.2519 -4.2519 -4.0524 -4.0524 -4.0524 -4.0524 -1.7803 -1.7803 -1.7803 -1.7803 -1.1140 -1.1140 -1.1140 -1.1140 -0.4576 -0.4576 -0.4576 -0.4576 -0.2036 -0.2036 -0.2036 -0.2036 0.3472 0.3472 0.3472 0.3472 0.9053 0.9053 0.9053 0.9053 1.9638 1.9638 1.9638 1.9638 2.7943 2.7943 2.7943 2.7943 3.9184 3.9184 3.9184 3.9184 4.2785 4.2785 4.2785 4.2785 4.4381 4.4381 4.4381 4.4381 4.5870 4.5870 4.5870 4.5870 5.2979 5.2979 5.2979 5.2979 5.4631 5.4631 5.4631 5.4631 6.0022 6.0022 6.0022 6.0022 6.4977 6.4977 6.4977 6.4977 k = 0.5000 0.3007 0.0366 ( 12648 PWs) bands (ev): ************************************************************************ -786.6427-786.6427-786.6427-786.6427-786.2802-786.2802-786.2802-786.2802 -102.1013-102.1013-102.1013-102.1013-102.0152-102.0152-102.0152-102.0152 -59.5677 -59.5677 -59.5677 -59.5677 -59.5364 -59.5364 -59.5364 -59.5364 -56.6337 -56.6337 -56.6337 -56.6337 -56.6302 -56.6302 -56.6302 -56.6302 -24.5954 -24.5954 -24.5954 -24.5954 -24.5945 -24.5945 -24.5945 -24.5945 -8.4064 -8.4064 -8.4064 -8.4064 -8.3154 -8.3154 -8.3154 -8.3154 -7.4215 -7.4215 -7.4215 -7.4215 -7.1493 -7.1493 -7.1493 -7.1493 -4.6645 -4.6645 -4.6645 -4.6645 -4.5089 -4.5089 -4.5089 -4.5089 -4.2470 -4.2470 -4.2470 -4.2470 -4.0527 -4.0527 -4.0527 -4.0527 -1.7647 -1.7647 -1.7647 -1.7647 -1.1544 -1.1544 -1.1544 -1.1544 -0.4407 -0.4407 -0.4407 -0.4407 -0.1967 -0.1967 -0.1967 -0.1967 0.3600 0.3600 0.3600 0.3600 0.8897 0.8897 0.8897 0.8897 1.9910 1.9910 1.9910 1.9910 2.7566 2.7566 2.7566 2.7566 3.9310 3.9310 3.9310 3.9310 4.2679 4.2679 4.2679 4.2679 4.4431 4.4431 4.4431 4.4431 4.5878 4.5878 4.5878 4.5878 5.3010 5.3010 5.3010 5.3010 5.4589 5.4589 5.4589 5.4589 6.0137 6.0137 6.0137 6.0137 6.4872 6.4872 6.4872 6.4872 k = 0.5000 0.3007 0.0458 ( 12632 PWs) bands (ev): ************************************************************************ -786.3933-786.3933-786.3933-786.3933-786.0207-786.0207-786.0207-786.0207 -102.0762-102.0762-102.0762-102.0762-101.9887-101.9887-101.9887-101.9887 -59.5545 -59.5545 -59.5545 -59.5545 -59.5219 -59.5219 -59.5219 -59.5219 -56.6333 -56.6333 -56.6333 -56.6333 -56.6292 -56.6292 -56.6292 -56.6292 -24.5948 -24.5948 -24.5948 -24.5948 -24.5934 -24.5934 -24.5934 -24.5934 -8.4023 -8.4023 -8.4023 -8.4023 -8.3206 -8.3206 -8.3206 -8.3206 -7.4160 -7.4160 -7.4160 -7.4160 -7.1536 -7.1536 -7.1536 -7.1536 -4.6634 -4.6634 -4.6634 -4.6634 -4.5140 -4.5140 -4.5140 -4.5140 -4.2415 -4.2415 -4.2415 -4.2415 -4.0529 -4.0529 -4.0529 -4.0529 -1.7448 -1.7448 -1.7448 -1.7448 -1.2003 -1.2003 -1.2003 -1.2003 -0.4228 -0.4228 -0.4228 -0.4228 -0.1902 -0.1902 -0.1902 -0.1902 0.3774 0.3774 0.3774 0.3774 0.8707 0.8707 0.8707 0.8707 2.0251 2.0251 2.0251 2.0251 2.7113 2.7113 2.7113 2.7113 3.9457 3.9457 3.9457 3.9457 4.2553 4.2553 4.2553 4.2553 4.4509 4.4509 4.4509 4.4509 4.5870 4.5870 4.5870 4.5870 5.3046 5.3046 5.3046 5.3046 5.4543 5.4543 5.4543 5.4543 6.0280 6.0280 6.0280 6.0280 6.4741 6.4741 6.4741 6.4741 k = 0.5000 0.3007 0.0549 ( 12636 PWs) bands (ev): ************************************************************************ -786.5034-786.5034-786.5034-786.5034-786.1124-786.1124-786.1124-786.1124 -102.0712-102.0712-102.0712-102.0712-101.9949-101.9949-101.9949-101.9949 -59.5580 -59.5580 -59.5580 -59.5580 -59.5272 -59.5272 -59.5272 -59.5272 -56.6334 -56.6334 -56.6334 -56.6334 -56.6297 -56.6297 -56.6297 -56.6297 -24.5953 -24.5953 -24.5953 -24.5953 -24.5938 -24.5938 -24.5938 -24.5938 -8.3975 -8.3975 -8.3975 -8.3975 -8.3267 -8.3267 -8.3267 -8.3267 -7.4103 -7.4103 -7.4103 -7.4103 -7.1584 -7.1584 -7.1584 -7.1584 -4.6625 -4.6625 -4.6625 -4.6625 -4.5193 -4.5193 -4.5193 -4.5193 -4.2361 -4.2361 -4.2361 -4.2361 -4.0532 -4.0532 -4.0532 -4.0532 -1.7211 -1.7211 -1.7211 -1.7211 -1.2491 -1.2491 -1.2491 -1.2491 -0.4055 -0.4055 -0.4055 -0.4055 -0.1856 -0.1856 -0.1856 -0.1856 0.3986 0.3986 0.3986 0.3986 0.8488 0.8488 0.8488 0.8488 2.0650 2.0650 2.0650 2.0650 2.6598 2.6598 2.6598 2.6598 3.9609 3.9609 3.9609 3.9609 4.2413 4.2413 4.2413 4.2413 4.4611 4.4611 4.4611 4.4611 4.5839 4.5839 4.5839 4.5839 5.3082 5.3082 5.3082 5.3082 5.4494 5.4494 5.4494 5.4494 6.0442 6.0442 6.0442 6.0442 6.4587 6.4587 6.4587 6.4587 k = 0.5000 0.3007 0.0641 ( 12632 PWs) bands (ev): ************************************************************************ -786.4754-786.4754-786.4754-786.4754-786.0662-786.0662-786.0662-786.0662 -102.0540-102.0540-102.0540-102.0540-101.9938-101.9938-101.9938-101.9938 -59.5523 -59.5523 -59.5523 -59.5523 -59.5241 -59.5241 -59.5241 -59.5241 -56.6331 -56.6331 -56.6331 -56.6331 -56.6294 -56.6294 -56.6294 -56.6294 -24.5948 -24.5948 -24.5948 -24.5948 -24.5932 -24.5932 -24.5932 -24.5932 -8.3920 -8.3920 -8.3920 -8.3920 -8.3334 -8.3334 -8.3334 -8.3334 -7.4045 -7.4045 -7.4045 -7.4045 -7.1633 -7.1633 -7.1633 -7.1633 -4.6615 -4.6615 -4.6615 -4.6615 -4.5242 -4.5242 -4.5242 -4.5242 -4.2309 -4.2309 -4.2309 -4.2309 -4.0535 -4.0535 -4.0535 -4.0535 -1.6939 -1.6939 -1.6939 -1.6939 -1.2987 -1.2987 -1.2987 -1.2987 -0.3893 -0.3893 -0.3893 -0.3893 -0.1833 -0.1833 -0.1833 -0.1833 0.4229 0.4229 0.4229 0.4229 0.8250 0.8250 0.8250 0.8250 2.1102 2.1102 2.1102 2.1102 2.6040 2.6040 2.6040 2.6040 3.9758 3.9758 3.9758 3.9758 4.2272 4.2272 4.2272 4.2272 4.4735 4.4735 4.4735 4.4735 4.5782 4.5782 4.5782 4.5782 5.3117 5.3117 5.3117 5.3117 5.4449 5.4449 5.4449 5.4449 6.0614 6.0614 6.0614 6.0614 6.4423 6.4423 6.4423 6.4423 k = 0.5000 0.3007 0.0732 ( 12644 PWs) bands (ev): ************************************************************************ -786.5923-786.5923-786.5923-786.5923-786.2035-786.2035-786.2035-786.2035 -102.0751-102.0751-102.0751-102.0751-102.0278-102.0278-102.0278-102.0278 -59.5620 -59.5620 -59.5620 -59.5620 -59.5327 -59.5327 -59.5327 -59.5327 -56.6337 -56.6337 -56.6337 -56.6337 -56.6299 -56.6299 -56.6299 -56.6299 -24.5957 -24.5957 -24.5957 -24.5957 -24.5943 -24.5943 -24.5943 -24.5943 -8.3858 -8.3858 -8.3858 -8.3858 -8.3405 -8.3405 -8.3405 -8.3405 -7.3993 -7.3993 -7.3993 -7.3993 -7.1677 -7.1677 -7.1677 -7.1677 -4.6607 -4.6607 -4.6607 -4.6607 -4.5285 -4.5285 -4.5285 -4.5285 -4.2266 -4.2266 -4.2266 -4.2266 -4.0539 -4.0539 -4.0539 -4.0539 -1.6643 -1.6643 -1.6643 -1.6643 -1.3470 -1.3470 -1.3470 -1.3470 -0.3752 -0.3752 -0.3752 -0.3752 -0.1832 -0.1832 -0.1832 -0.1832 0.4479 0.4479 0.4479 0.4479 0.8010 0.8010 0.8010 0.8010 2.1593 2.1593 2.1593 2.1593 2.5458 2.5458 2.5458 2.5458 3.9894 3.9894 3.9894 3.9894 4.2139 4.2139 4.2139 4.2139 4.4873 4.4873 4.4873 4.4873 4.5699 4.5699 4.5699 4.5699 5.3148 5.3148 5.3148 5.3148 5.4408 5.4408 5.4408 5.4408 6.0780 6.0780 6.0780 6.0780 6.4259 6.4259 6.4259 6.4259 k = 0.5000 0.3007 0.0824 ( 12632 PWs) bands (ev): ************************************************************************ -786.3620-786.3620-786.3620-786.3620-786.1033-786.1033-786.1033-786.1033 -102.0538-102.0538-102.0538-102.0538-102.0031-102.0031-102.0031-102.0031 -59.5512 -59.5512 -59.5512 -59.5512 -59.5212 -59.5212 -59.5212 -59.5212 -56.6327 -56.6327 -56.6327 -56.6327 -56.6292 -56.6292 -56.6292 -56.6292 -24.5949 -24.5949 -24.5949 -24.5949 -24.5934 -24.5934 -24.5934 -24.5934 -8.3792 -8.3792 -8.3792 -8.3792 -8.3479 -8.3479 -8.3479 -8.3479 -7.3949 -7.3949 -7.3949 -7.3949 -7.1712 -7.1712 -7.1712 -7.1712 -4.6599 -4.6599 -4.6599 -4.6599 -4.5318 -4.5318 -4.5318 -4.5318 -4.2231 -4.2231 -4.2231 -4.2231 -4.0541 -4.0541 -4.0541 -4.0541 -1.6340 -1.6340 -1.6340 -1.6340 -1.3910 -1.3910 -1.3910 -1.3910 -0.3639 -0.3639 -0.3639 -0.3639 -0.1841 -0.1841 -0.1841 -0.1841 0.4711 0.4711 0.4711 0.4711 0.7795 0.7795 0.7795 0.7795 2.2105 2.2105 2.2105 2.2105 2.4879 2.4879 2.4879 2.4879 4.0007 4.0007 4.0007 4.0007 4.2031 4.2031 4.2031 4.2031 4.5022 4.5022 4.5022 4.5022 4.5594 4.5594 4.5594 4.5594 5.3172 5.3172 5.3172 5.3172 5.4378 5.4378 5.4378 5.4378 6.0925 6.0925 6.0925 6.0925 6.4118 6.4118 6.4118 6.4118 k = 0.5000 0.3007 0.0915 ( 12652 PWs) bands (ev): ************************************************************************ -786.6904-786.6904-786.6904-786.6904-786.3909-786.3909-786.3909-786.3909 -102.0850-102.0850-102.0850-102.0850-102.0445-102.0445-102.0445-102.0445 -59.5686 -59.5686 -59.5686 -59.5686 -59.5348 -59.5348 -59.5348 -59.5348 -56.6339 -56.6339 -56.6339 -56.6339 -56.6302 -56.6302 -56.6302 -56.6302 -24.5958 -24.5958 -24.5958 -24.5958 -24.5945 -24.5945 -24.5945 -24.5945 -8.3726 -8.3726 -8.3726 -8.3726 -8.3551 -8.3551 -8.3551 -8.3551 -7.3924 -7.3924 -7.3924 -7.3924 -7.1737 -7.1737 -7.1737 -7.1737 -4.6596 -4.6596 -4.6596 -4.6596 -4.5339 -4.5339 -4.5339 -4.5339 -4.2212 -4.2212 -4.2212 -4.2212 -4.0544 -4.0544 -4.0544 -4.0544 -1.6081 -1.6081 -1.6081 -1.6081 -1.4256 -1.4256 -1.4256 -1.4256 -0.3568 -0.3568 -0.3568 -0.3568 -0.1856 -0.1856 -0.1856 -0.1856 0.4878 0.4878 0.4878 0.4878 0.7636 0.7636 0.7636 0.7636 2.2580 2.2580 2.2580 2.2580 2.4358 2.4358 2.4358 2.4358 4.0079 4.0079 4.0079 4.0079 4.1957 4.1957 4.1957 4.1957 4.5172 4.5172 4.5172 4.5172 4.5470 4.5470 4.5470 4.5470 5.3186 5.3186 5.3186 5.3186 5.4357 5.4357 5.4357 5.4357 6.1023 6.1023 6.1023 6.1023 6.4018 6.4018 6.4018 6.4018 k = 0.5000 0.3007 0.1007 ( 12656 PWs) bands (ev): ************************************************************************ -786.6873-786.6873-786.6873-786.6873-786.5041-786.5041-786.5041-786.5041 -102.0931-102.0931-102.0931-102.0931-102.0533-102.0533-102.0533-102.0533 -59.5701 -59.5701 -59.5701 -59.5701 -59.5423 -59.5423 -59.5423 -59.5423 -56.6343 -56.6343 -56.6343 -56.6343 -56.6310 -56.6310 -56.6310 -56.6310 -24.5956 -24.5956 -24.5956 -24.5956 -24.5950 -24.5950 -24.5950 -24.5950 -8.3682 -8.3682 -8.3682 -8.3682 -8.3597 -8.3597 -8.3597 -8.3597 -7.3915 -7.3915 -7.3915 -7.3915 -7.1745 -7.1745 -7.1745 -7.1745 -4.6594 -4.6594 -4.6594 -4.6594 -4.5346 -4.5346 -4.5346 -4.5346 -4.2204 -4.2204 -4.2204 -4.2204 -4.0545 -4.0545 -4.0545 -4.0545 -1.5968 -1.5968 -1.5968 -1.5968 -1.4398 -1.4398 -1.4398 -1.4398 -0.3544 -0.3544 -0.3544 -0.3544 -0.1863 -0.1863 -0.1863 -0.1863 0.4940 0.4940 0.4940 0.4940 0.7577 0.7577 0.7577 0.7577 2.2826 2.2826 2.2826 2.2826 2.4097 2.4097 2.4097 2.4097 4.0106 4.0106 4.0106 4.0106 4.1930 4.1930 4.1930 4.1930 4.5291 4.5291 4.5291 4.5291 4.5359 4.5359 4.5359 4.5359 5.3191 5.3191 5.3191 5.3191 5.4350 5.4350 5.4350 5.4350 6.1059 6.1059 6.1059 6.1059 6.3983 6.3983 6.3983 6.3983 Writing output data file TcP3.save init_run : 2.27s CPU 1.38s WALL ( 1 calls) electrons : 3301.30s CPU 3127.92s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.44s CPU 0.32s WALL ( 1 calls) Called by electrons: c_bands : 3301.27s CPU 3127.88s WALL ( 1 calls) v_of_rho : 0.14s CPU 0.07s WALL ( 1 calls) v_h : 0.08s CPU 0.04s WALL ( 1 calls) v_xc : 0.06s CPU 0.03s WALL ( 1 calls) newd : 0.85s CPU 0.47s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.82s CPU 0.77s WALL ( 384 calls) cegterg : 2988.93s CPU 2911.24s WALL ( 857 calls) Called by sum_band: Called by *egterg: h_psi : 1596.46s CPU 1415.57s WALL ( 14710 calls) s_psi : 184.08s CPU 183.37s WALL ( 14710 calls) g_psi : 1.65s CPU 1.82s WALL ( 13469 calls) cdiaghg : 1129.00s CPU 1133.00s WALL ( 13853 calls) cegterg:over : 149.54s CPU 149.06s WALL ( 13469 calls) cegterg:upda : 92.29s CPU 92.28s WALL ( 13469 calls) cegterg:last : 61.66s CPU 61.87s WALL ( 2273 calls) cdiaghg:chol : 41.00s CPU 41.58s WALL ( 13853 calls) cdiaghg:inve : 32.84s CPU 33.39s WALL ( 13853 calls) cdiaghg:para : 79.29s CPU 80.55s WALL ( 27706 calls) Called by h_psi: h_psi:vloc : 1295.72s CPU 1121.82s WALL ( 14710 calls) h_psi:vnl : 298.68s CPU 291.59s WALL ( 14710 calls) add_vuspsi : 149.28s CPU 147.20s WALL ( 14710 calls) General routines calbec : 149.22s CPU 144.32s WALL ( 14710 calls) fft : 0.18s CPU 0.10s WALL ( 19 calls) ffts : 0.03s CPU 0.02s WALL ( 4 calls) fftw : 1264.31s CPU 1092.41s WALL ( 3864732 calls) interpolate : 0.06s CPU 0.03s WALL ( 4 calls) davcio : 0.78s CPU 17.85s WALL ( 768 calls) Parallel routines fft_scatter : 946.39s CPU 905.51s WALL ( 3864755 calls) PWSCF : 1h 1m CPU 1h 1m WALL This run was terminated on: 20:56:34 28Mar2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=