Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 18:21:42 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./KAgSe.save/ file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 44 30 8 2272 1206 190 Max 45 31 9 2281 1234 199 Sum 1609 1085 305 81965 44049 6929 bravais-lattice index = 14 lattice parameter (alat) = 8.5416 a.u. unit-cell volume = 1046.4420 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 278.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.541561 celldm(2)= 1.000000 celldm(3)= 1.679204 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 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.679204 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.595520 ) PseudoPot. # 1 for Se read from file: /users/gautes/Pseudo/Se.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 38611c150961c07dbd63be353364166d Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1211 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for K read from file: /users/gautes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 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. # 3 for Ag read from file: /users/gautes/Pseudo/Ag.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 30ab375624a706b88a092e30a79375fd Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1237 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 Se 6.00 78.96000 Se( 1.00) K 9.00 39.09830 K( 1.00) Ag 11.00 107.86820 Ag( 1.00) 4 Sym. Ops., with inversion, found (note: 12 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) 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 [1,1,0] cryst. s( 2) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 2) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s( 4) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 4) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [1,1,0] -C2 -2 180 deg rotation - cart. axis [1,1,0] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [1,1,0] -s_h -4 inv. 180 deg rotation - cart. axis [1,1,0] E Cartesian axes number of k points= 312 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 2) = ( 0.0000000 0.0142857 -0.0000000), wk = 0.0032051 k( 3) = ( 0.0000000 0.0285714 -0.0000000), wk = 0.0032051 k( 4) = ( 0.0000000 0.0428571 -0.0000000), wk = 0.0032051 k( 5) = ( 0.0000000 0.0571429 -0.0000000), wk = 0.0032051 k( 6) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0032051 k( 7) = ( 0.0000000 0.0857143 -0.0000000), wk = 0.0032051 k( 8) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0032051 k( 9) = ( 0.0000000 0.1142857 -0.0000000), wk = 0.0032051 k( 10) = ( 0.0000000 0.1285714 -0.0000000), wk = 0.0032051 k( 11) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0032051 k( 12) = ( 0.0000000 0.1571429 -0.0000000), wk = 0.0032051 k( 13) = ( 0.0000000 0.1714286 -0.0000000), wk = 0.0032051 k( 14) = ( 0.0000000 0.1857143 -0.0000000), wk = 0.0032051 k( 15) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0032051 k( 16) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0032051 k( 17) = ( 0.0000000 0.2285714 -0.0000000), wk = 0.0032051 k( 18) = ( 0.0000000 0.2428571 -0.0000000), wk = 0.0032051 k( 19) = ( 0.0000000 0.2571429 -0.0000000), wk = 0.0032051 k( 20) = ( 0.0000000 0.2714286 -0.0000000), wk = 0.0032051 k( 21) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0032051 k( 22) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0032051 k( 23) = ( 0.0000000 0.3142857 -0.0000000), wk = 0.0032051 k( 24) = ( 0.0000000 0.3285714 -0.0000000), wk = 0.0032051 k( 25) = ( 0.0000000 0.3428571 -0.0000000), wk = 0.0032051 k( 26) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0032051 k( 27) = ( 0.0000000 0.3714286 -0.0000000), wk = 0.0032051 k( 28) = ( 0.0000000 0.3857143 -0.0000000), wk = 0.0032051 k( 29) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0032051 k( 30) = ( 0.0000000 0.4142857 -0.0000000), wk = 0.0032051 k( 31) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0032051 k( 32) = ( 0.0000000 0.4428571 -0.0000000), wk = 0.0032051 k( 33) = ( 0.0000000 0.4571429 -0.0000000), wk = 0.0032051 k( 34) = ( 0.0000000 0.4714286 -0.0000000), wk = 0.0032051 k( 35) = ( 0.0000000 0.4857143 -0.0000000), wk = 0.0032051 k( 36) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032051 k( 37) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032051 k( 38) = ( 0.0142857 0.5000000 -0.0000000), wk = 0.0032051 k( 39) = ( 0.0285714 0.5000000 -0.0000000), wk = 0.0032051 k( 40) = ( 0.0428571 0.5000000 -0.0000000), wk = 0.0032051 k( 41) = ( 0.0571429 0.5000000 -0.0000000), wk = 0.0032051 k( 42) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0032051 k( 43) = ( 0.0857143 0.5000000 -0.0000000), wk = 0.0032051 k( 44) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0032051 k( 45) = ( 0.1142857 0.5000000 -0.0000000), wk = 0.0032051 k( 46) = ( 0.1285714 0.5000000 -0.0000000), wk = 0.0032051 k( 47) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0032051 k( 48) = ( 0.1571429 0.5000000 -0.0000000), wk = 0.0032051 k( 49) = ( 0.1714286 0.5000000 -0.0000000), wk = 0.0032051 k( 50) = ( 0.1857143 0.5000000 -0.0000000), wk = 0.0032051 k( 51) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0032051 k( 52) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0032051 k( 53) = ( 0.2285714 0.5000000 -0.0000000), wk = 0.0032051 k( 54) = ( 0.2428571 0.5000000 -0.0000000), wk = 0.0032051 k( 55) = ( 0.2571429 0.5000000 -0.0000000), wk = 0.0032051 k( 56) = ( 0.2714286 0.5000000 -0.0000000), wk = 0.0032051 k( 57) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0032051 k( 58) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0032051 k( 59) = ( 0.3142857 0.5000000 -0.0000000), wk = 0.0032051 k( 60) = ( 0.3285714 0.5000000 -0.0000000), wk = 0.0032051 k( 61) = ( 0.3428571 0.5000000 -0.0000000), wk = 0.0032051 k( 62) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0032051 k( 63) = ( 0.3714286 0.5000000 -0.0000000), wk = 0.0032051 k( 64) = ( 0.3857143 0.5000000 -0.0000000), wk = 0.0032051 k( 65) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0032051 k( 66) = ( 0.4142857 0.5000000 -0.0000000), wk = 0.0032051 k( 67) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0032051 k( 68) = ( 0.4428571 0.5000000 -0.0000000), wk = 0.0032051 k( 69) = ( 0.4571429 0.5000000 -0.0000000), wk = 0.0032051 k( 70) = ( 0.4714286 0.5000000 -0.0000000), wk = 0.0032051 k( 71) = ( 0.4857143 0.5000000 -0.0000000), wk = 0.0032051 k( 72) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032051 k( 73) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032051 k( 74) = ( 0.4900000 0.4900000 -0.0000000), wk = 0.0032051 k( 75) = ( 0.4800000 0.4800000 -0.0000000), wk = 0.0032051 k( 76) = ( 0.4700000 0.4700000 -0.0000000), wk = 0.0032051 k( 77) = ( 0.4600000 0.4600000 -0.0000000), wk = 0.0032051 k( 78) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0032051 k( 79) = ( 0.4400000 0.4400000 -0.0000000), wk = 0.0032051 k( 80) = ( 0.4300000 0.4300000 -0.0000000), wk = 0.0032051 k( 81) = ( 0.4200000 0.4200000 -0.0000000), wk = 0.0032051 k( 82) = ( 0.4100000 0.4100000 -0.0000000), wk = 0.0032051 k( 83) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0032051 k( 84) = ( 0.3900000 0.3900000 -0.0000000), wk = 0.0032051 k( 85) = ( 0.3800000 0.3800000 -0.0000000), wk = 0.0032051 k( 86) = ( 0.3700000 0.3700000 -0.0000000), wk = 0.0032051 k( 87) = ( 0.3600000 0.3600000 -0.0000000), wk = 0.0032051 k( 88) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0032051 k( 89) = ( 0.3400000 0.3400000 -0.0000000), wk = 0.0032051 k( 90) = ( 0.3300000 0.3300000 -0.0000000), wk = 0.0032051 k( 91) = ( 0.3200000 0.3200000 -0.0000000), wk = 0.0032051 k( 92) = ( 0.3100000 0.3100000 -0.0000000), wk = 0.0032051 k( 93) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0032051 k( 94) = ( 0.2900000 0.2900000 -0.0000000), wk = 0.0032051 k( 95) = ( 0.2800000 0.2800000 -0.0000000), wk = 0.0032051 k( 96) = ( 0.2700000 0.2700000 -0.0000000), wk = 0.0032051 k( 97) = ( 0.2600000 0.2600000 -0.0000000), wk = 0.0032051 k( 98) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0032051 k( 99) = ( 0.2400000 0.2400000 -0.0000000), wk = 0.0032051 k( 100) = ( 0.2300000 0.2300000 -0.0000000), wk = 0.0032051 k( 101) = ( 0.2200000 0.2200000 -0.0000000), wk = 0.0032051 k( 102) = ( 0.2100000 0.2100000 -0.0000000), wk = 0.0032051 k( 103) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0032051 k( 104) = ( 0.1900000 0.1900000 -0.0000000), wk = 0.0032051 k( 105) = ( 0.1800000 0.1800000 -0.0000000), wk = 0.0032051 k( 106) = ( 0.1700000 0.1700000 -0.0000000), wk = 0.0032051 k( 107) = ( 0.1600000 0.1600000 -0.0000000), wk = 0.0032051 k( 108) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0032051 k( 109) = ( 0.1400000 0.1400000 -0.0000000), wk = 0.0032051 k( 110) = ( 0.1300000 0.1300000 -0.0000000), wk = 0.0032051 k( 111) = ( 0.1200000 0.1200000 -0.0000000), wk = 0.0032051 k( 112) = ( 0.1100000 0.1100000 -0.0000000), wk = 0.0032051 k( 113) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0032051 k( 114) = ( 0.0900000 0.0900000 -0.0000000), wk = 0.0032051 k( 115) = ( 0.0800000 0.0800000 -0.0000000), wk = 0.0032051 k( 116) = ( 0.0700000 0.0700000 -0.0000000), wk = 0.0032051 k( 117) = ( 0.0600000 0.0600000 -0.0000000), wk = 0.0032051 k( 118) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0032051 k( 119) = ( 0.0400000 0.0400000 -0.0000000), wk = 0.0032051 k( 120) = ( 0.0300000 0.0300000 -0.0000000), wk = 0.0032051 k( 121) = ( 0.0200000 0.0200000 -0.0000000), wk = 0.0032051 k( 122) = ( 0.0100000 0.0100000 -0.0000000), wk = 0.0032051 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 125) = ( 0.0000000 0.0000000 0.0141791), wk = 0.0032051 k( 126) = ( 0.0000000 0.0000000 0.0283581), wk = 0.0032051 k( 127) = ( 0.0000000 0.0000000 0.0425372), wk = 0.0032051 k( 128) = ( 0.0000000 0.0000000 0.0567162), wk = 0.0032051 k( 129) = ( 0.0000000 0.0000000 0.0708953), wk = 0.0032051 k( 130) = ( 0.0000000 0.0000000 0.0850743), wk = 0.0032051 k( 131) = ( 0.0000000 0.0000000 0.0992534), wk = 0.0032051 k( 132) = ( 0.0000000 0.0000000 0.1134325), wk = 0.0032051 k( 133) = ( 0.0000000 0.0000000 0.1276115), wk = 0.0032051 k( 134) = ( 0.0000000 0.0000000 0.1417906), wk = 0.0032051 k( 135) = ( 0.0000000 0.0000000 0.1559696), wk = 0.0032051 k( 136) = ( 0.0000000 0.0000000 0.1701487), wk = 0.0032051 k( 137) = ( 0.0000000 0.0000000 0.1843277), wk = 0.0032051 k( 138) = ( 0.0000000 0.0000000 0.1985068), wk = 0.0032051 k( 139) = ( 0.0000000 0.0000000 0.2126859), wk = 0.0032051 k( 140) = ( 0.0000000 0.0000000 0.2268649), wk = 0.0032051 k( 141) = ( 0.0000000 0.0000000 0.2410440), wk = 0.0032051 k( 142) = ( 0.0000000 0.0000000 0.2552230), wk = 0.0032051 k( 143) = ( 0.0000000 0.0000000 0.2694021), wk = 0.0032051 k( 144) = ( 0.0000000 0.0000000 0.2835812), wk = 0.0032051 k( 145) = ( 0.0000000 0.0000000 0.2977602), wk = 0.0032051 k( 146) = ( 0.0000000 0.0000000 0.2977602), wk = 0.0032051 k( 147) = ( 0.0000000 0.0142857 0.2977602), wk = 0.0032051 k( 148) = ( 0.0000000 0.0285714 0.2977602), wk = 0.0032051 k( 149) = ( 0.0000000 0.0428571 0.2977602), wk = 0.0032051 k( 150) = ( 0.0000000 0.0571429 0.2977602), wk = 0.0032051 k( 151) = ( 0.0000000 0.0714286 0.2977602), wk = 0.0032051 k( 152) = ( 0.0000000 0.0857143 0.2977602), wk = 0.0032051 k( 153) = ( 0.0000000 0.1000000 0.2977602), wk = 0.0032051 k( 154) = ( 0.0000000 0.1142857 0.2977602), wk = 0.0032051 k( 155) = ( 0.0000000 0.1285714 0.2977602), wk = 0.0032051 k( 156) = ( 0.0000000 0.1428571 0.2977602), wk = 0.0032051 k( 157) = ( 0.0000000 0.1571429 0.2977602), wk = 0.0032051 k( 158) = ( 0.0000000 0.1714286 0.2977602), wk = 0.0032051 k( 159) = ( 0.0000000 0.1857143 0.2977602), wk = 0.0032051 k( 160) = ( 0.0000000 0.2000000 0.2977602), wk = 0.0032051 k( 161) = ( 0.0000000 0.2142857 0.2977602), wk = 0.0032051 k( 162) = ( 0.0000000 0.2285714 0.2977602), wk = 0.0032051 k( 163) = ( 0.0000000 0.2428571 0.2977602), wk = 0.0032051 k( 164) = ( 0.0000000 0.2571429 0.2977602), wk = 0.0032051 k( 165) = ( 0.0000000 0.2714286 0.2977602), wk = 0.0032051 k( 166) = ( 0.0000000 0.2857143 0.2977602), wk = 0.0032051 k( 167) = ( 0.0000000 0.3000000 0.2977602), wk = 0.0032051 k( 168) = ( 0.0000000 0.3142857 0.2977602), wk = 0.0032051 k( 169) = ( 0.0000000 0.3285714 0.2977602), wk = 0.0032051 k( 170) = ( 0.0000000 0.3428571 0.2977602), wk = 0.0032051 k( 171) = ( 0.0000000 0.3571429 0.2977602), wk = 0.0032051 k( 172) = ( 0.0000000 0.3714286 0.2977602), wk = 0.0032051 k( 173) = ( 0.0000000 0.3857143 0.2977602), wk = 0.0032051 k( 174) = ( 0.0000000 0.4000000 0.2977602), wk = 0.0032051 k( 175) = ( 0.0000000 0.4142857 0.2977602), wk = 0.0032051 k( 176) = ( 0.0000000 0.4285714 0.2977602), wk = 0.0032051 k( 177) = ( 0.0000000 0.4428571 0.2977602), wk = 0.0032051 k( 178) = ( 0.0000000 0.4571429 0.2977602), wk = 0.0032051 k( 179) = ( 0.0000000 0.4714286 0.2977602), wk = 0.0032051 k( 180) = ( 0.0000000 0.4857143 0.2977602), wk = 0.0032051 k( 181) = ( 0.0000000 0.5000000 0.2977602), wk = 0.0032051 k( 182) = ( 0.0000000 0.5000000 0.2977602), wk = 0.0032051 k( 183) = ( 0.0142857 0.5000000 0.2977602), wk = 0.0032051 k( 184) = ( 0.0285714 0.5000000 0.2977602), wk = 0.0032051 k( 185) = ( 0.0428571 0.5000000 0.2977602), wk = 0.0032051 k( 186) = ( 0.0571429 0.5000000 0.2977602), wk = 0.0032051 k( 187) = ( 0.0714286 0.5000000 0.2977602), wk = 0.0032051 k( 188) = ( 0.0857143 0.5000000 0.2977602), wk = 0.0032051 k( 189) = ( 0.1000000 0.5000000 0.2977602), wk = 0.0032051 k( 190) = ( 0.1142857 0.5000000 0.2977602), wk = 0.0032051 k( 191) = ( 0.1285714 0.5000000 0.2977602), wk = 0.0032051 k( 192) = ( 0.1428571 0.5000000 0.2977602), wk = 0.0032051 k( 193) = ( 0.1571429 0.5000000 0.2977602), wk = 0.0032051 k( 194) = ( 0.1714286 0.5000000 0.2977602), wk = 0.0032051 k( 195) = ( 0.1857143 0.5000000 0.2977602), wk = 0.0032051 k( 196) = ( 0.2000000 0.5000000 0.2977602), wk = 0.0032051 k( 197) = ( 0.2142857 0.5000000 0.2977602), wk = 0.0032051 k( 198) = ( 0.2285714 0.5000000 0.2977602), wk = 0.0032051 k( 199) = ( 0.2428571 0.5000000 0.2977602), wk = 0.0032051 k( 200) = ( 0.2571429 0.5000000 0.2977602), wk = 0.0032051 k( 201) = ( 0.2714286 0.5000000 0.2977602), wk = 0.0032051 k( 202) = ( 0.2857143 0.5000000 0.2977602), wk = 0.0032051 k( 203) = ( 0.3000000 0.5000000 0.2977602), wk = 0.0032051 k( 204) = ( 0.3142857 0.5000000 0.2977602), wk = 0.0032051 k( 205) = ( 0.3285714 0.5000000 0.2977602), wk = 0.0032051 k( 206) = ( 0.3428571 0.5000000 0.2977602), wk = 0.0032051 k( 207) = ( 0.3571429 0.5000000 0.2977602), wk = 0.0032051 k( 208) = ( 0.3714286 0.5000000 0.2977602), wk = 0.0032051 k( 209) = ( 0.3857143 0.5000000 0.2977602), wk = 0.0032051 k( 210) = ( 0.4000000 0.5000000 0.2977602), wk = 0.0032051 k( 211) = ( 0.4142857 0.5000000 0.2977602), wk = 0.0032051 k( 212) = ( 0.4285714 0.5000000 0.2977602), wk = 0.0032051 k( 213) = ( 0.4428571 0.5000000 0.2977602), wk = 0.0032051 k( 214) = ( 0.4571429 0.5000000 0.2977602), wk = 0.0032051 k( 215) = ( 0.4714286 0.5000000 0.2977602), wk = 0.0032051 k( 216) = ( 0.4857143 0.5000000 0.2977602), wk = 0.0032051 k( 217) = ( 0.5000000 0.5000000 0.2977602), wk = 0.0032051 k( 218) = ( 0.5000000 0.5000000 0.2977602), wk = 0.0032051 k( 219) = ( 0.4900000 0.4900000 0.2977602), wk = 0.0032051 k( 220) = ( 0.4800000 0.4800000 0.2977602), wk = 0.0032051 k( 221) = ( 0.4700000 0.4700000 0.2977602), wk = 0.0032051 k( 222) = ( 0.4600000 0.4600000 0.2977602), wk = 0.0032051 k( 223) = ( 0.4500000 0.4500000 0.2977602), wk = 0.0032051 k( 224) = ( 0.4400000 0.4400000 0.2977602), wk = 0.0032051 k( 225) = ( 0.4300000 0.4300000 0.2977602), wk = 0.0032051 k( 226) = ( 0.4200000 0.4200000 0.2977602), wk = 0.0032051 k( 227) = ( 0.4100000 0.4100000 0.2977602), wk = 0.0032051 k( 228) = ( 0.4000000 0.4000000 0.2977602), wk = 0.0032051 k( 229) = ( 0.3900000 0.3900000 0.2977602), wk = 0.0032051 k( 230) = ( 0.3800000 0.3800000 0.2977602), wk = 0.0032051 k( 231) = ( 0.3700000 0.3700000 0.2977602), wk = 0.0032051 k( 232) = ( 0.3600000 0.3600000 0.2977602), wk = 0.0032051 k( 233) = ( 0.3500000 0.3500000 0.2977602), wk = 0.0032051 k( 234) = ( 0.3400000 0.3400000 0.2977602), wk = 0.0032051 k( 235) = ( 0.3300000 0.3300000 0.2977602), wk = 0.0032051 k( 236) = ( 0.3200000 0.3200000 0.2977602), wk = 0.0032051 k( 237) = ( 0.3100000 0.3100000 0.2977602), wk = 0.0032051 k( 238) = ( 0.3000000 0.3000000 0.2977602), wk = 0.0032051 k( 239) = ( 0.2900000 0.2900000 0.2977602), wk = 0.0032051 k( 240) = ( 0.2800000 0.2800000 0.2977602), wk = 0.0032051 k( 241) = ( 0.2700000 0.2700000 0.2977602), wk = 0.0032051 k( 242) = ( 0.2600000 0.2600000 0.2977602), wk = 0.0032051 k( 243) = ( 0.2500000 0.2500000 0.2977602), wk = 0.0032051 k( 244) = ( 0.2400000 0.2400000 0.2977602), wk = 0.0032051 k( 245) = ( 0.2300000 0.2300000 0.2977602), wk = 0.0032051 k( 246) = ( 0.2200000 0.2200000 0.2977602), wk = 0.0032051 k( 247) = ( 0.2100000 0.2100000 0.2977602), wk = 0.0032051 k( 248) = ( 0.2000000 0.2000000 0.2977602), wk = 0.0032051 k( 249) = ( 0.1900000 0.1900000 0.2977602), wk = 0.0032051 k( 250) = ( 0.1800000 0.1800000 0.2977602), wk = 0.0032051 k( 251) = ( 0.1700000 0.1700000 0.2977602), wk = 0.0032051 k( 252) = ( 0.1600000 0.1600000 0.2977602), wk = 0.0032051 k( 253) = ( 0.1500000 0.1500000 0.2977602), wk = 0.0032051 k( 254) = ( 0.1400000 0.1400000 0.2977602), wk = 0.0032051 k( 255) = ( 0.1300000 0.1300000 0.2977602), wk = 0.0032051 k( 256) = ( 0.1200000 0.1200000 0.2977602), wk = 0.0032051 k( 257) = ( 0.1100000 0.1100000 0.2977602), wk = 0.0032051 k( 258) = ( 0.1000000 0.1000000 0.2977602), wk = 0.0032051 k( 259) = ( 0.0900000 0.0900000 0.2977602), wk = 0.0032051 k( 260) = ( 0.0800000 0.0800000 0.2977602), wk = 0.0032051 k( 261) = ( 0.0700000 0.0700000 0.2977602), wk = 0.0032051 k( 262) = ( 0.0600000 0.0600000 0.2977602), wk = 0.0032051 k( 263) = ( 0.0500000 0.0500000 0.2977602), wk = 0.0032051 k( 264) = ( 0.0400000 0.0400000 0.2977602), wk = 0.0032051 k( 265) = ( 0.0300000 0.0300000 0.2977602), wk = 0.0032051 k( 266) = ( 0.0200000 0.0200000 0.2977602), wk = 0.0032051 k( 267) = ( 0.0100000 0.0100000 0.2977602), wk = 0.0032051 k( 268) = ( 0.0000000 0.0000000 0.2977602), wk = 0.0032051 k( 269) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032051 k( 270) = ( 0.0000000 0.5000000 0.0141791), wk = 0.0032051 k( 271) = ( 0.0000000 0.5000000 0.0283581), wk = 0.0032051 k( 272) = ( 0.0000000 0.5000000 0.0425372), wk = 0.0032051 k( 273) = ( 0.0000000 0.5000000 0.0567162), wk = 0.0032051 k( 274) = ( 0.0000000 0.5000000 0.0708953), wk = 0.0032051 k( 275) = ( 0.0000000 0.5000000 0.0850743), wk = 0.0032051 k( 276) = ( 0.0000000 0.5000000 0.0992534), wk = 0.0032051 k( 277) = ( 0.0000000 0.5000000 0.1134325), wk = 0.0032051 k( 278) = ( 0.0000000 0.5000000 0.1276115), wk = 0.0032051 k( 279) = ( 0.0000000 0.5000000 0.1417906), wk = 0.0032051 k( 280) = ( 0.0000000 0.5000000 0.1559696), wk = 0.0032051 k( 281) = ( 0.0000000 0.5000000 0.1701487), wk = 0.0032051 k( 282) = ( 0.0000000 0.5000000 0.1843277), wk = 0.0032051 k( 283) = ( 0.0000000 0.5000000 0.1985068), wk = 0.0032051 k( 284) = ( 0.0000000 0.5000000 0.2126859), wk = 0.0032051 k( 285) = ( 0.0000000 0.5000000 0.2268649), wk = 0.0032051 k( 286) = ( 0.0000000 0.5000000 0.2410440), wk = 0.0032051 k( 287) = ( 0.0000000 0.5000000 0.2552230), wk = 0.0032051 k( 288) = ( 0.0000000 0.5000000 0.2694021), wk = 0.0032051 k( 289) = ( 0.0000000 0.5000000 0.2835812), wk = 0.0032051 k( 290) = ( 0.0000000 0.5000000 0.2977602), wk = 0.0032051 k( 291) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032051 k( 292) = ( 0.5000000 0.5000000 0.0141791), wk = 0.0032051 k( 293) = ( 0.5000000 0.5000000 0.0283581), wk = 0.0032051 k( 294) = ( 0.5000000 0.5000000 0.0425372), wk = 0.0032051 k( 295) = ( 0.5000000 0.5000000 0.0567162), wk = 0.0032051 k( 296) = ( 0.5000000 0.5000000 0.0708953), wk = 0.0032051 k( 297) = ( 0.5000000 0.5000000 0.0850743), wk = 0.0032051 k( 298) = ( 0.5000000 0.5000000 0.0992534), wk = 0.0032051 k( 299) = ( 0.5000000 0.5000000 0.1134325), wk = 0.0032051 k( 300) = ( 0.5000000 0.5000000 0.1276115), wk = 0.0032051 k( 301) = ( 0.5000000 0.5000000 0.1417906), wk = 0.0032051 k( 302) = ( 0.5000000 0.5000000 0.1559696), wk = 0.0032051 k( 303) = ( 0.5000000 0.5000000 0.1701487), wk = 0.0032051 k( 304) = ( 0.5000000 0.5000000 0.1843277), wk = 0.0032051 k( 305) = ( 0.5000000 0.5000000 0.1985068), wk = 0.0032051 k( 306) = ( 0.5000000 0.5000000 0.2126859), wk = 0.0032051 k( 307) = ( 0.5000000 0.5000000 0.2268649), wk = 0.0032051 k( 308) = ( 0.5000000 0.5000000 0.2410440), wk = 0.0032051 k( 309) = ( 0.5000000 0.5000000 0.2552230), wk = 0.0032051 k( 310) = ( 0.5000000 0.5000000 0.2694021), wk = 0.0032051 k( 311) = ( 0.5000000 0.5000000 0.2835812), wk = 0.0032051 k( 312) = ( 0.5000000 0.5000000 0.2977602), wk = 0.0032051 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 2) = ( 0.0000000 0.0142857 -0.0000000), wk = 0.0032051 k( 3) = ( 0.0000000 0.0285714 -0.0000000), wk = 0.0032051 k( 4) = ( 0.0000000 0.0428571 -0.0000000), wk = 0.0032051 k( 5) = ( 0.0000000 0.0571429 -0.0000000), wk = 0.0032051 k( 6) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0032051 k( 7) = ( 0.0000000 0.0857143 0.0000000), wk = 0.0032051 k( 8) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0032051 k( 9) = ( 0.0000000 0.1142857 -0.0000000), wk = 0.0032051 k( 10) = ( 0.0000000 0.1285714 -0.0000000), wk = 0.0032051 k( 11) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0032051 k( 12) = ( 0.0000000 0.1571429 0.0000000), wk = 0.0032051 k( 13) = ( 0.0000000 0.1714286 -0.0000000), wk = 0.0032051 k( 14) = ( 0.0000000 0.1857143 -0.0000000), wk = 0.0032051 k( 15) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0032051 k( 16) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0032051 k( 17) = ( 0.0000000 0.2285714 0.0000000), wk = 0.0032051 k( 18) = ( 0.0000000 0.2428571 -0.0000000), wk = 0.0032051 k( 19) = ( 0.0000000 0.2571429 -0.0000000), wk = 0.0032051 k( 20) = ( 0.0000000 0.2714286 -0.0000000), wk = 0.0032051 k( 21) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0032051 k( 22) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0032051 k( 23) = ( 0.0000000 0.3142857 -0.0000000), wk = 0.0032051 k( 24) = ( 0.0000000 0.3285714 -0.0000000), wk = 0.0032051 k( 25) = ( 0.0000000 0.3428571 -0.0000000), wk = 0.0032051 k( 26) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0032051 k( 27) = ( 0.0000000 0.3714286 -0.0000000), wk = 0.0032051 k( 28) = ( 0.0000000 0.3857143 -0.0000000), wk = 0.0032051 k( 29) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0032051 k( 30) = ( 0.0000000 0.4142857 -0.0000000), wk = 0.0032051 k( 31) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0032051 k( 32) = ( 0.0000000 0.4428571 -0.0000000), wk = 0.0032051 k( 33) = ( 0.0000000 0.4571429 0.0000000), wk = 0.0032051 k( 34) = ( 0.0000000 0.4714286 -0.0000000), wk = 0.0032051 k( 35) = ( 0.0000000 0.4857143 -0.0000000), wk = 0.0032051 k( 36) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032051 k( 37) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032051 k( 38) = ( 0.0142857 0.5000000 0.0000000), wk = 0.0032051 k( 39) = ( 0.0285714 0.5000000 0.0000000), wk = 0.0032051 k( 40) = ( 0.0428571 0.5000000 0.0000000), wk = 0.0032051 k( 41) = ( 0.0571429 0.5000000 -0.0000000), wk = 0.0032051 k( 42) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0032051 k( 43) = ( 0.0857143 0.5000000 0.0000000), wk = 0.0032051 k( 44) = ( 0.1000000 0.5000000 0.0000000), wk = 0.0032051 k( 45) = ( 0.1142857 0.5000000 0.0000000), wk = 0.0032051 k( 46) = ( 0.1285714 0.5000000 -0.0000000), wk = 0.0032051 k( 47) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0032051 k( 48) = ( 0.1571429 0.5000000 0.0000000), wk = 0.0032051 k( 49) = ( 0.1714286 0.5000000 -0.0000000), wk = 0.0032051 k( 50) = ( 0.1857143 0.5000000 -0.0000000), wk = 0.0032051 k( 51) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0032051 k( 52) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0032051 k( 53) = ( 0.2285714 0.5000000 -0.0000000), wk = 0.0032051 k( 54) = ( 0.2428571 0.5000000 -0.0000000), wk = 0.0032051 k( 55) = ( 0.2571429 0.5000000 0.0000000), wk = 0.0032051 k( 56) = ( 0.2714286 0.5000000 0.0000000), wk = 0.0032051 k( 57) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0032051 k( 58) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0032051 k( 59) = ( 0.3142857 0.5000000 -0.0000000), wk = 0.0032051 k( 60) = ( 0.3285714 0.5000000 -0.0000000), wk = 0.0032051 k( 61) = ( 0.3428571 0.5000000 -0.0000000), wk = 0.0032051 k( 62) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0032051 k( 63) = ( 0.3714286 0.5000000 -0.0000000), wk = 0.0032051 k( 64) = ( 0.3857143 0.5000000 -0.0000000), wk = 0.0032051 k( 65) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0032051 k( 66) = ( 0.4142857 0.5000000 -0.0000000), wk = 0.0032051 k( 67) = ( 0.4285714 0.5000000 0.0000000), wk = 0.0032051 k( 68) = ( 0.4428571 0.5000000 0.0000000), wk = 0.0032051 k( 69) = ( 0.4571429 0.5000000 -0.0000000), wk = 0.0032051 k( 70) = ( 0.4714286 0.5000000 0.0000000), wk = 0.0032051 k( 71) = ( 0.4857143 0.5000000 0.0000000), wk = 0.0032051 k( 72) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032051 k( 73) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032051 k( 74) = ( 0.4900000 0.4900000 -0.0000000), wk = 0.0032051 k( 75) = ( 0.4800000 0.4800000 0.0000000), wk = 0.0032051 k( 76) = ( 0.4700000 0.4700000 -0.0000000), wk = 0.0032051 k( 77) = ( 0.4600000 0.4600000 -0.0000000), wk = 0.0032051 k( 78) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0032051 k( 79) = ( 0.4400000 0.4400000 0.0000000), wk = 0.0032051 k( 80) = ( 0.4300000 0.4300000 -0.0000000), wk = 0.0032051 k( 81) = ( 0.4200000 0.4200000 0.0000000), wk = 0.0032051 k( 82) = ( 0.4100000 0.4100000 -0.0000000), wk = 0.0032051 k( 83) = ( 0.4000000 0.4000000 0.0000000), wk = 0.0032051 k( 84) = ( 0.3900000 0.3900000 -0.0000000), wk = 0.0032051 k( 85) = ( 0.3800000 0.3800000 0.0000000), wk = 0.0032051 k( 86) = ( 0.3700000 0.3700000 -0.0000000), wk = 0.0032051 k( 87) = ( 0.3600000 0.3600000 -0.0000000), wk = 0.0032051 k( 88) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0032051 k( 89) = ( 0.3400000 0.3400000 -0.0000000), wk = 0.0032051 k( 90) = ( 0.3300000 0.3300000 -0.0000000), wk = 0.0032051 k( 91) = ( 0.3200000 0.3200000 -0.0000000), wk = 0.0032051 k( 92) = ( 0.3100000 0.3100000 -0.0000000), wk = 0.0032051 k( 93) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0032051 k( 94) = ( 0.2900000 0.2900000 -0.0000000), wk = 0.0032051 k( 95) = ( 0.2800000 0.2800000 -0.0000000), wk = 0.0032051 k( 96) = ( 0.2700000 0.2700000 0.0000000), wk = 0.0032051 k( 97) = ( 0.2600000 0.2600000 0.0000000), wk = 0.0032051 k( 98) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0032051 k( 99) = ( 0.2400000 0.2400000 0.0000000), wk = 0.0032051 k( 100) = ( 0.2300000 0.2300000 -0.0000000), wk = 0.0032051 k( 101) = ( 0.2200000 0.2200000 0.0000000), wk = 0.0032051 k( 102) = ( 0.2100000 0.2100000 0.0000000), wk = 0.0032051 k( 103) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0032051 k( 104) = ( 0.1900000 0.1900000 0.0000000), wk = 0.0032051 k( 105) = ( 0.1800000 0.1800000 -0.0000000), wk = 0.0032051 k( 106) = ( 0.1700000 0.1700000 -0.0000000), wk = 0.0032051 k( 107) = ( 0.1600000 0.1600000 -0.0000000), wk = 0.0032051 k( 108) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0032051 k( 109) = ( 0.1400000 0.1400000 -0.0000000), wk = 0.0032051 k( 110) = ( 0.1300000 0.1300000 0.0000000), wk = 0.0032051 k( 111) = ( 0.1200000 0.1200000 0.0000000), wk = 0.0032051 k( 112) = ( 0.1100000 0.1100000 0.0000000), wk = 0.0032051 k( 113) = ( 0.1000000 0.1000000 0.0000000), wk = 0.0032051 k( 114) = ( 0.0900000 0.0900000 -0.0000000), wk = 0.0032051 k( 115) = ( 0.0800000 0.0800000 -0.0000000), wk = 0.0032051 k( 116) = ( 0.0700000 0.0700000 -0.0000000), wk = 0.0032051 k( 117) = ( 0.0600000 0.0600000 0.0000000), wk = 0.0032051 k( 118) = ( 0.0500000 0.0500000 0.0000000), wk = 0.0032051 k( 119) = ( 0.0400000 0.0400000 -0.0000000), wk = 0.0032051 k( 120) = ( 0.0300000 0.0300000 0.0000000), wk = 0.0032051 k( 121) = ( 0.0200000 0.0200000 -0.0000000), wk = 0.0032051 k( 122) = ( 0.0100000 0.0100000 -0.0000000), wk = 0.0032051 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 125) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0032051 k( 126) = ( 0.0000000 0.0000000 0.0476190), wk = 0.0032051 k( 127) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0032051 k( 128) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0032051 k( 129) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0032051 k( 130) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0032051 k( 131) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0032051 k( 132) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0032051 k( 133) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0032051 k( 134) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0032051 k( 135) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0032051 k( 136) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0032051 k( 137) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0032051 k( 138) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0032051 k( 139) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0032051 k( 140) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0032051 k( 141) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0032051 k( 142) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0032051 k( 143) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0032051 k( 144) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0032051 k( 145) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032051 k( 146) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032051 k( 147) = ( 0.0000000 0.0142857 0.5000000), wk = 0.0032051 k( 148) = ( 0.0000000 0.0285714 0.5000000), wk = 0.0032051 k( 149) = ( 0.0000000 0.0428571 0.5000000), wk = 0.0032051 k( 150) = ( 0.0000000 0.0571429 0.5000000), wk = 0.0032051 k( 151) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0032051 k( 152) = ( 0.0000000 0.0857143 0.5000000), wk = 0.0032051 k( 153) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0032051 k( 154) = ( 0.0000000 0.1142857 0.5000000), wk = 0.0032051 k( 155) = ( 0.0000000 0.1285714 0.5000000), wk = 0.0032051 k( 156) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0032051 k( 157) = ( 0.0000000 0.1571429 0.5000000), wk = 0.0032051 k( 158) = ( 0.0000000 0.1714286 0.5000000), wk = 0.0032051 k( 159) = ( 0.0000000 0.1857143 0.5000000), wk = 0.0032051 k( 160) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0032051 k( 161) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0032051 k( 162) = ( 0.0000000 0.2285714 0.5000000), wk = 0.0032051 k( 163) = ( 0.0000000 0.2428571 0.5000000), wk = 0.0032051 k( 164) = ( 0.0000000 0.2571429 0.5000000), wk = 0.0032051 k( 165) = ( 0.0000000 0.2714286 0.5000000), wk = 0.0032051 k( 166) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0032051 k( 167) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0032051 k( 168) = ( 0.0000000 0.3142857 0.5000000), wk = 0.0032051 k( 169) = ( 0.0000000 0.3285714 0.5000000), wk = 0.0032051 k( 170) = ( 0.0000000 0.3428571 0.5000000), wk = 0.0032051 k( 171) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0032051 k( 172) = ( 0.0000000 0.3714286 0.5000000), wk = 0.0032051 k( 173) = ( 0.0000000 0.3857143 0.5000000), wk = 0.0032051 k( 174) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0032051 k( 175) = ( 0.0000000 0.4142857 0.5000000), wk = 0.0032051 k( 176) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0032051 k( 177) = ( 0.0000000 0.4428571 0.5000000), wk = 0.0032051 k( 178) = ( 0.0000000 0.4571429 0.5000000), wk = 0.0032051 k( 179) = ( 0.0000000 0.4714286 0.5000000), wk = 0.0032051 k( 180) = ( 0.0000000 0.4857143 0.5000000), wk = 0.0032051 k( 181) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032051 k( 182) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032051 k( 183) = ( 0.0142857 0.5000000 0.5000000), wk = 0.0032051 k( 184) = ( 0.0285714 0.5000000 0.5000000), wk = 0.0032051 k( 185) = ( 0.0428571 0.5000000 0.5000000), wk = 0.0032051 k( 186) = ( 0.0571429 0.5000000 0.5000000), wk = 0.0032051 k( 187) = ( 0.0714286 0.5000000 0.5000000), wk = 0.0032051 k( 188) = ( 0.0857143 0.5000000 0.5000000), wk = 0.0032051 k( 189) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0032051 k( 190) = ( 0.1142857 0.5000000 0.5000000), wk = 0.0032051 k( 191) = ( 0.1285714 0.5000000 0.5000000), wk = 0.0032051 k( 192) = ( 0.1428571 0.5000000 0.5000000), wk = 0.0032051 k( 193) = ( 0.1571429 0.5000000 0.5000000), wk = 0.0032051 k( 194) = ( 0.1714286 0.5000000 0.5000000), wk = 0.0032051 k( 195) = ( 0.1857143 0.5000000 0.5000000), wk = 0.0032051 k( 196) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0032051 k( 197) = ( 0.2142857 0.5000000 0.5000000), wk = 0.0032051 k( 198) = ( 0.2285714 0.5000000 0.5000000), wk = 0.0032051 k( 199) = ( 0.2428571 0.5000000 0.5000000), wk = 0.0032051 k( 200) = ( 0.2571429 0.5000000 0.5000000), wk = 0.0032051 k( 201) = ( 0.2714286 0.5000000 0.5000000), wk = 0.0032051 k( 202) = ( 0.2857143 0.5000000 0.5000000), wk = 0.0032051 k( 203) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0032051 k( 204) = ( 0.3142857 0.5000000 0.5000000), wk = 0.0032051 k( 205) = ( 0.3285714 0.5000000 0.5000000), wk = 0.0032051 k( 206) = ( 0.3428571 0.5000000 0.5000000), wk = 0.0032051 k( 207) = ( 0.3571429 0.5000000 0.5000000), wk = 0.0032051 k( 208) = ( 0.3714286 0.5000000 0.5000000), wk = 0.0032051 k( 209) = ( 0.3857143 0.5000000 0.5000000), wk = 0.0032051 k( 210) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0032051 k( 211) = ( 0.4142857 0.5000000 0.5000000), wk = 0.0032051 k( 212) = ( 0.4285714 0.5000000 0.5000000), wk = 0.0032051 k( 213) = ( 0.4428571 0.5000000 0.5000000), wk = 0.0032051 k( 214) = ( 0.4571429 0.5000000 0.5000000), wk = 0.0032051 k( 215) = ( 0.4714286 0.5000000 0.5000000), wk = 0.0032051 k( 216) = ( 0.4857143 0.5000000 0.5000000), wk = 0.0032051 k( 217) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032051 k( 218) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032051 k( 219) = ( 0.4900000 0.4900000 0.5000000), wk = 0.0032051 k( 220) = ( 0.4800000 0.4800000 0.5000000), wk = 0.0032051 k( 221) = ( 0.4700000 0.4700000 0.5000000), wk = 0.0032051 k( 222) = ( 0.4600000 0.4600000 0.5000000), wk = 0.0032051 k( 223) = ( 0.4500000 0.4500000 0.5000000), wk = 0.0032051 k( 224) = ( 0.4400000 0.4400000 0.5000000), wk = 0.0032051 k( 225) = ( 0.4300000 0.4300000 0.5000000), wk = 0.0032051 k( 226) = ( 0.4200000 0.4200000 0.5000000), wk = 0.0032051 k( 227) = ( 0.4100000 0.4100000 0.5000000), wk = 0.0032051 k( 228) = ( 0.4000000 0.4000000 0.5000000), wk = 0.0032051 k( 229) = ( 0.3900000 0.3900000 0.5000000), wk = 0.0032051 k( 230) = ( 0.3800000 0.3800000 0.5000000), wk = 0.0032051 k( 231) = ( 0.3700000 0.3700000 0.5000000), wk = 0.0032051 k( 232) = ( 0.3600000 0.3600000 0.5000000), wk = 0.0032051 k( 233) = ( 0.3500000 0.3500000 0.5000000), wk = 0.0032051 k( 234) = ( 0.3400000 0.3400000 0.5000000), wk = 0.0032051 k( 235) = ( 0.3300000 0.3300000 0.5000000), wk = 0.0032051 k( 236) = ( 0.3200000 0.3200000 0.5000000), wk = 0.0032051 k( 237) = ( 0.3100000 0.3100000 0.5000000), wk = 0.0032051 k( 238) = ( 0.3000000 0.3000000 0.5000000), wk = 0.0032051 k( 239) = ( 0.2900000 0.2900000 0.5000000), wk = 0.0032051 k( 240) = ( 0.2800000 0.2800000 0.5000000), wk = 0.0032051 k( 241) = ( 0.2700000 0.2700000 0.5000000), wk = 0.0032051 k( 242) = ( 0.2600000 0.2600000 0.5000000), wk = 0.0032051 k( 243) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0032051 k( 244) = ( 0.2400000 0.2400000 0.5000000), wk = 0.0032051 k( 245) = ( 0.2300000 0.2300000 0.5000000), wk = 0.0032051 k( 246) = ( 0.2200000 0.2200000 0.5000000), wk = 0.0032051 k( 247) = ( 0.2100000 0.2100000 0.5000000), wk = 0.0032051 k( 248) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0032051 k( 249) = ( 0.1900000 0.1900000 0.5000000), wk = 0.0032051 k( 250) = ( 0.1800000 0.1800000 0.5000000), wk = 0.0032051 k( 251) = ( 0.1700000 0.1700000 0.5000000), wk = 0.0032051 k( 252) = ( 0.1600000 0.1600000 0.5000000), wk = 0.0032051 k( 253) = ( 0.1500000 0.1500000 0.5000000), wk = 0.0032051 k( 254) = ( 0.1400000 0.1400000 0.5000000), wk = 0.0032051 k( 255) = ( 0.1300000 0.1300000 0.5000000), wk = 0.0032051 k( 256) = ( 0.1200000 0.1200000 0.5000000), wk = 0.0032051 k( 257) = ( 0.1100000 0.1100000 0.5000000), wk = 0.0032051 k( 258) = ( 0.1000000 0.1000000 0.5000000), wk = 0.0032051 k( 259) = ( 0.0900000 0.0900000 0.5000000), wk = 0.0032051 k( 260) = ( 0.0800000 0.0800000 0.5000000), wk = 0.0032051 k( 261) = ( 0.0700000 0.0700000 0.5000000), wk = 0.0032051 k( 262) = ( 0.0600000 0.0600000 0.5000000), wk = 0.0032051 k( 263) = ( 0.0500000 0.0500000 0.5000000), wk = 0.0032051 k( 264) = ( 0.0400000 0.0400000 0.5000000), wk = 0.0032051 k( 265) = ( 0.0300000 0.0300000 0.5000000), wk = 0.0032051 k( 266) = ( 0.0200000 0.0200000 0.5000000), wk = 0.0032051 k( 267) = ( 0.0100000 0.0100000 0.5000000), wk = 0.0032051 k( 268) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032051 k( 269) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032051 k( 270) = ( 0.0000000 0.5000000 0.0238095), wk = 0.0032051 k( 271) = ( 0.0000000 0.5000000 0.0476191), wk = 0.0032051 k( 272) = ( 0.0000000 0.5000000 0.0714286), wk = 0.0032051 k( 273) = ( 0.0000000 0.5000000 0.0952381), wk = 0.0032051 k( 274) = ( 0.0000000 0.5000000 0.1190476), wk = 0.0032051 k( 275) = ( 0.0000000 0.5000000 0.1428571), wk = 0.0032051 k( 276) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0032051 k( 277) = ( 0.0000000 0.5000000 0.1904762), wk = 0.0032051 k( 278) = ( 0.0000000 0.5000000 0.2142857), wk = 0.0032051 k( 279) = ( 0.0000000 0.5000000 0.2380952), wk = 0.0032051 k( 280) = ( 0.0000000 0.5000000 0.2619048), wk = 0.0032051 k( 281) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0032051 k( 282) = ( 0.0000000 0.5000000 0.3095238), wk = 0.0032051 k( 283) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0032051 k( 284) = ( 0.0000000 0.5000000 0.3571429), wk = 0.0032051 k( 285) = ( 0.0000000 0.5000000 0.3809524), wk = 0.0032051 k( 286) = ( 0.0000000 0.5000000 0.4047619), wk = 0.0032051 k( 287) = ( 0.0000000 0.5000000 0.4285714), wk = 0.0032051 k( 288) = ( 0.0000000 0.5000000 0.4523810), wk = 0.0032051 k( 289) = ( 0.0000000 0.5000000 0.4761905), wk = 0.0032051 k( 290) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032051 k( 291) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032051 k( 292) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0032051 k( 293) = ( 0.5000000 0.5000000 0.0476190), wk = 0.0032051 k( 294) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0032051 k( 295) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0032051 k( 296) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0032051 k( 297) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0032051 k( 298) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0032051 k( 299) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0032051 k( 300) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0032051 k( 301) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0032051 k( 302) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0032051 k( 303) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0032051 k( 304) = ( 0.5000000 0.5000000 0.3095238), wk = 0.0032051 k( 305) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0032051 k( 306) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0032051 k( 307) = ( 0.5000000 0.5000000 0.3809524), wk = 0.0032051 k( 308) = ( 0.5000000 0.5000000 0.4047619), wk = 0.0032051 k( 309) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0032051 k( 310) = ( 0.5000000 0.5000000 0.4523810), wk = 0.0032051 k( 311) = ( 0.5000000 0.5000000 0.4761905), wk = 0.0032051 k( 312) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032051 Dense grid: 81965 G-vectors FFT dimensions: ( 45, 45, 80) Smooth grid: 44049 G-vectors FFT dimensions: ( 40, 40, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.29 Mb ( 310, 62) NL pseudopotentials 0.39 Mb ( 155, 164) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.02 Mb ( 2281) G-vector shells 0.01 Mb ( 1133) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.17 Mb ( 310, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.31 Mb ( 164, 2, 62) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./KAgSe.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.0 secs Computing kpt #: 2 total cpu time spent up to now is 3.7 secs Computing kpt #: 3 total cpu time spent up to now is 4.4 secs Computing kpt #: 4 total cpu time spent up to now is 5.1 secs Computing kpt #: 5 total cpu time spent up to now is 5.8 secs Computing kpt #: 6 total cpu time spent up to now is 6.6 secs Computing kpt #: 7 total cpu time spent up to now is 7.3 secs Computing kpt #: 8 total cpu time spent up to now is 7.9 secs Computing kpt #: 9 total cpu time spent up to now is 8.6 secs Computing kpt #: 10 total cpu time spent up to now is 9.2 secs Computing kpt #: 11 total cpu time spent up to now is 9.9 secs Computing kpt #: 12 total cpu time spent up to now is 10.5 secs Computing kpt #: 13 total cpu time spent up to now is 11.1 secs Computing kpt #: 14 total cpu time spent up to now is 11.8 secs Computing kpt #: 15 total cpu time spent up to now is 12.4 secs Computing kpt #: 16 total cpu time spent up to now is 13.1 secs Computing kpt #: 17 total cpu time spent up to now is 13.7 secs Computing kpt #: 18 total cpu time spent up to now is 14.3 secs Computing kpt #: 19 total cpu time spent up to now is 14.9 secs Computing kpt #: 20 total cpu time spent up to now is 15.5 secs Computing kpt #: 21 total cpu time spent up to now is 16.1 secs Computing kpt #: 22 total cpu time spent up to now is 16.8 secs Computing kpt #: 23 total cpu time spent up to now is 17.4 secs Computing kpt #: 24 total cpu time spent up to now is 18.0 secs Computing kpt #: 25 total cpu time spent up to now is 18.7 secs Computing kpt #: 26 total cpu time spent up to now is 19.3 secs Computing kpt #: 27 total cpu time spent up to now is 19.9 secs Computing kpt #: 28 total cpu time spent up to now is 20.6 secs Computing kpt #: 29 total cpu time spent up to now is 21.2 secs Computing kpt #: 30 total cpu time spent up to now is 21.8 secs Computing kpt #: 31 total cpu time spent up to now is 22.3 secs Computing kpt #: 32 total cpu time spent up to now is 22.9 secs Computing kpt #: 33 total cpu time spent up to now is 23.5 secs Computing kpt #: 34 total cpu time spent up to now is 24.1 secs Computing kpt #: 35 total cpu time spent up to now is 24.7 secs Computing kpt #: 36 total cpu time spent up to now is 25.3 secs Computing kpt #: 37 total cpu time spent up to now is 26.0 secs Computing kpt #: 38 total cpu time spent up to now is 27.0 secs Computing kpt #: 39 total cpu time spent up to now is 27.8 secs Computing kpt #: 40 total cpu time spent up to now is 28.5 secs Computing kpt #: 41 total cpu time spent up to now is 29.1 secs Computing kpt #: 42 total cpu time spent up to now is 29.8 secs Computing kpt #: 43 total cpu time spent up to now is 30.5 secs Computing kpt #: 44 total cpu time spent up to now is 31.2 secs Computing kpt #: 45 total cpu time spent up to now is 31.9 secs Computing kpt #: 46 total cpu time spent up to now is 32.7 secs Computing kpt #: 47 total cpu time spent up to now is 33.4 secs Computing kpt #: 48 total cpu time spent up to now is 34.1 secs Computing kpt #: 49 total cpu time spent up to now is 34.8 secs Computing kpt #: 50 total cpu time spent up to now is 35.5 secs Computing kpt #: 51 total cpu time spent up to now is 36.3 secs Computing kpt #: 52 total cpu time spent up to now is 37.0 secs Computing kpt #: 53 total cpu time spent up to now is 37.7 secs Computing kpt #: 54 total cpu time spent up to now is 38.4 secs Computing kpt #: 55 total cpu time spent up to now is 39.1 secs Computing kpt #: 56 total cpu time spent up to now is 39.8 secs Computing kpt #: 57 total cpu time spent up to now is 40.5 secs Computing kpt #: 58 total cpu time spent up to now is 41.2 secs Computing kpt #: 59 total cpu time spent up to now is 41.9 secs Computing kpt #: 60 total cpu time spent up to now is 42.6 secs Computing kpt #: 61 total cpu time spent up to now is 43.3 secs Computing kpt #: 62 total cpu time spent up to now is 44.0 secs Computing kpt #: 63 total cpu time spent up to now is 44.7 secs Computing kpt #: 64 total cpu time spent up to now is 45.4 secs Computing kpt #: 65 total cpu time spent up to now is 46.1 secs Computing kpt #: 66 total cpu time spent up to now is 46.7 secs Computing kpt #: 67 total cpu time spent up to now is 47.4 secs Computing kpt #: 68 total cpu time spent up to now is 48.1 secs Computing kpt #: 69 total cpu time spent up to now is 48.8 secs Computing kpt #: 70 total cpu time spent up to now is 49.5 secs Computing kpt #: 71 total cpu time spent up to now is 50.2 secs Computing kpt #: 72 total cpu time spent up to now is 50.8 secs Computing kpt #: 73 total cpu time spent up to now is 51.3 secs Computing kpt #: 74 total cpu time spent up to now is 52.0 secs Computing kpt #: 75 total cpu time spent up to now is 52.7 secs Computing kpt #: 76 total cpu time spent up to now is 53.4 secs Computing kpt #: 77 total cpu time spent up to now is 54.1 secs Computing kpt #: 78 total cpu time spent up to now is 54.8 secs Computing kpt #: 79 total cpu time spent up to now is 55.5 secs Computing kpt #: 80 total cpu time spent up to now is 56.2 secs Computing kpt #: 81 total cpu time spent up to now is 56.9 secs Computing kpt #: 82 total cpu time spent up to now is 57.6 secs Computing kpt #: 83 total cpu time spent up to now is 58.3 secs Computing kpt #: 84 total cpu time spent up to now is 59.0 secs Computing kpt #: 85 total cpu time spent up to now is 59.6 secs Computing kpt #: 86 total cpu time spent up to now is 60.2 secs Computing kpt #: 87 total cpu time spent up to now is 60.8 secs Computing kpt #: 88 total cpu time spent up to now is 61.4 secs Computing kpt #: 89 total cpu time spent up to now is 62.0 secs Computing kpt #: 90 total cpu time spent up to now is 62.7 secs Computing kpt #: 91 total cpu time spent up to now is 63.4 secs Computing kpt #: 92 total cpu time spent up to now is 64.1 secs Computing kpt #: 93 total cpu time spent up to now is 64.7 secs Computing kpt #: 94 total cpu time spent up to now is 65.4 secs Computing kpt #: 95 total cpu time spent up to now is 66.0 secs Computing kpt #: 96 total cpu time spent up to now is 66.6 secs Computing kpt #: 97 total cpu time spent up to now is 67.3 secs Computing kpt #: 98 total cpu time spent up to now is 67.9 secs Computing kpt #: 99 total cpu time spent up to now is 68.5 secs Computing kpt #: 100 total cpu time spent up to now is 69.2 secs Computing kpt #: 101 total cpu time spent up to now is 69.8 secs Computing kpt #: 102 total cpu time spent up to now is 70.4 secs Computing kpt #: 103 total cpu time spent up to now is 71.1 secs Computing kpt #: 104 total cpu time spent up to now is 71.7 secs Computing kpt #: 105 total cpu time spent up to now is 72.4 secs Computing kpt #: 106 total cpu time spent up to now is 73.0 secs Computing kpt #: 107 total cpu time spent up to now is 73.7 secs Computing kpt #: 108 total cpu time spent up to now is 74.3 secs Computing kpt #: 109 total cpu time spent up to now is 74.9 secs Computing kpt #: 110 total cpu time spent up to now is 75.5 secs Computing kpt #: 111 total cpu time spent up to now is 76.2 secs Computing kpt #: 112 total cpu time spent up to now is 76.8 secs Computing kpt #: 113 total cpu time spent up to now is 77.4 secs Computing kpt #: 114 total cpu time spent up to now is 78.1 secs Computing kpt #: 115 total cpu time spent up to now is 78.7 secs Computing kpt #: 116 total cpu time spent up to now is 79.4 secs Computing kpt #: 117 total cpu time spent up to now is 80.0 secs Computing kpt #: 118 total cpu time spent up to now is 80.8 secs Computing kpt #: 119 total cpu time spent up to now is 81.5 secs Computing kpt #: 120 total cpu time spent up to now is 82.2 secs Computing kpt #: 121 total cpu time spent up to now is 82.9 secs Computing kpt #: 122 total cpu time spent up to now is 83.6 secs Computing kpt #: 123 total cpu time spent up to now is 84.4 secs Computing kpt #: 124 total cpu time spent up to now is 85.1 secs Computing kpt #: 125 total cpu time spent up to now is 85.8 secs Computing kpt #: 126 total cpu time spent up to now is 86.5 secs Computing kpt #: 127 total cpu time spent up to now is 87.2 secs Computing kpt #: 128 total cpu time spent up to now is 88.0 secs Computing kpt #: 129 total cpu time spent up to now is 88.7 secs Computing kpt #: 130 total cpu time spent up to now is 89.5 secs Computing kpt #: 131 total cpu time spent up to now is 90.2 secs Computing kpt #: 132 total cpu time spent up to now is 91.0 secs Computing kpt #: 133 total cpu time spent up to now is 91.8 secs Computing kpt #: 134 total cpu time spent up to now is 92.5 secs Computing kpt #: 135 total cpu time spent up to now is 93.2 secs Computing kpt #: 136 total cpu time spent up to now is 93.8 secs Computing kpt #: 137 total cpu time spent up to now is 94.5 secs Computing kpt #: 138 total cpu time spent up to now is 95.0 secs Computing kpt #: 139 total cpu time spent up to now is 95.6 secs Computing kpt #: 140 total cpu time spent up to now is 96.2 secs Computing kpt #: 141 total cpu time spent up to now is 96.8 secs Computing kpt #: 142 total cpu time spent up to now is 97.4 secs Computing kpt #: 143 total cpu time spent up to now is 97.9 secs Computing kpt #: 144 total cpu time spent up to now is 98.5 secs Computing kpt #: 145 total cpu time spent up to now is 99.0 secs Computing kpt #: 146 total cpu time spent up to now is 99.6 secs Computing kpt #: 147 total cpu time spent up to now is 100.2 secs Computing kpt #: 148 total cpu time spent up to now is 100.7 secs Computing kpt #: 149 total cpu time spent up to now is 101.3 secs Computing kpt #: 150 total cpu time spent up to now is 101.9 secs Computing kpt #: 151 total cpu time spent up to now is 102.4 secs Computing kpt #: 152 total cpu time spent up to now is 103.0 secs Computing kpt #: 153 total cpu time spent up to now is 103.6 secs Computing kpt #: 154 total cpu time spent up to now is 104.1 secs Computing kpt #: 155 total cpu time spent up to now is 104.7 secs Computing kpt #: 156 total cpu time spent up to now is 105.3 secs Computing kpt #: 157 total cpu time spent up to now is 105.9 secs Computing kpt #: 158 total cpu time spent up to now is 106.5 secs Computing kpt #: 159 total cpu time spent up to now is 107.0 secs Computing kpt #: 160 total cpu time spent up to now is 107.6 secs Computing kpt #: 161 total cpu time spent up to now is 108.2 secs Computing kpt #: 162 total cpu time spent up to now is 108.8 secs Computing kpt #: 163 total cpu time spent up to now is 109.3 secs Computing kpt #: 164 total cpu time spent up to now is 109.9 secs Computing kpt #: 165 total cpu time spent up to now is 110.7 secs Computing kpt #: 166 total cpu time spent up to now is 111.4 secs Computing kpt #: 167 total cpu time spent up to now is 112.1 secs Computing kpt #: 168 total cpu time spent up to now is 112.8 secs Computing kpt #: 169 total cpu time spent up to now is 113.5 secs Computing kpt #: 170 total cpu time spent up to now is 114.2 secs Computing kpt #: 171 total cpu time spent up to now is 114.9 secs Computing kpt #: 172 total cpu time spent up to now is 115.7 secs Computing kpt #: 173 total cpu time spent up to now is 116.4 secs Computing kpt #: 174 total cpu time spent up to now is 117.1 secs Computing kpt #: 175 total cpu time spent up to now is 117.9 secs Computing kpt #: 176 total cpu time spent up to now is 118.6 secs Computing kpt #: 177 total cpu time spent up to now is 119.3 secs Computing kpt #: 178 total cpu time spent up to now is 120.1 secs Computing kpt #: 179 total cpu time spent up to now is 120.8 secs Computing kpt #: 180 total cpu time spent up to now is 121.5 secs Computing kpt #: 181 total cpu time spent up to now is 122.2 secs Computing kpt #: 182 total cpu time spent up to now is 122.8 secs Computing kpt #: 183 total cpu time spent up to now is 123.5 secs Computing kpt #: 184 total cpu time spent up to now is 124.3 secs Computing kpt #: 185 total cpu time spent up to now is 125.0 secs Computing kpt #: 186 total cpu time spent up to now is 125.7 secs Computing kpt #: 187 total cpu time spent up to now is 126.5 secs Computing kpt #: 188 total cpu time spent up to now is 127.2 secs Computing kpt #: 189 total cpu time spent up to now is 127.9 secs Computing kpt #: 190 total cpu time spent up to now is 128.7 secs Computing kpt #: 191 total cpu time spent up to now is 129.5 secs Computing kpt #: 192 total cpu time spent up to now is 130.2 secs Computing kpt #: 193 total cpu time spent up to now is 130.9 secs Computing kpt #: 194 total cpu time spent up to now is 131.7 secs Computing kpt #: 195 total cpu time spent up to now is 132.4 secs Computing kpt #: 196 total cpu time spent up to now is 133.1 secs Computing kpt #: 197 total cpu time spent up to now is 133.8 secs Computing kpt #: 198 total cpu time spent up to now is 134.6 secs Computing kpt #: 199 total cpu time spent up to now is 135.3 secs Computing kpt #: 200 total cpu time spent up to now is 136.0 secs Computing kpt #: 201 total cpu time spent up to now is 136.8 secs Computing kpt #: 202 total cpu time spent up to now is 137.5 secs Computing kpt #: 203 total cpu time spent up to now is 138.2 secs Computing kpt #: 204 total cpu time spent up to now is 138.8 secs Computing kpt #: 205 total cpu time spent up to now is 139.5 secs Computing kpt #: 206 total cpu time spent up to now is 140.1 secs Computing kpt #: 207 total cpu time spent up to now is 140.8 secs Computing kpt #: 208 total cpu time spent up to now is 141.4 secs Computing kpt #: 209 total cpu time spent up to now is 142.1 secs Computing kpt #: 210 total cpu time spent up to now is 142.7 secs Computing kpt #: 211 total cpu time spent up to now is 143.4 secs Computing kpt #: 212 total cpu time spent up to now is 144.0 secs Computing kpt #: 213 total cpu time spent up to now is 144.7 secs Computing kpt #: 214 total cpu time spent up to now is 145.3 secs Computing kpt #: 215 total cpu time spent up to now is 145.9 secs Computing kpt #: 216 total cpu time spent up to now is 146.6 secs Computing kpt #: 217 total cpu time spent up to now is 147.3 secs Computing kpt #: 218 total cpu time spent up to now is 147.9 secs Computing kpt #: 219 total cpu time spent up to now is 148.6 secs Computing kpt #: 220 total cpu time spent up to now is 149.3 secs Computing kpt #: 221 total cpu time spent up to now is 149.9 secs Computing kpt #: 222 total cpu time spent up to now is 150.6 secs Computing kpt #: 223 total cpu time spent up to now is 151.2 secs Computing kpt #: 224 total cpu time spent up to now is 151.9 secs Computing kpt #: 225 total cpu time spent up to now is 152.5 secs Computing kpt #: 226 total cpu time spent up to now is 153.2 secs Computing kpt #: 227 total cpu time spent up to now is 153.9 secs Computing kpt #: 228 total cpu time spent up to now is 154.7 secs Computing kpt #: 229 total cpu time spent up to now is 155.4 secs Computing kpt #: 230 total cpu time spent up to now is 156.1 secs Computing kpt #: 231 total cpu time spent up to now is 156.8 secs Computing kpt #: 232 total cpu time spent up to now is 157.5 secs Computing kpt #: 233 total cpu time spent up to now is 158.1 secs Computing kpt #: 234 total cpu time spent up to now is 158.8 secs Computing kpt #: 235 total cpu time spent up to now is 159.4 secs Computing kpt #: 236 total cpu time spent up to now is 160.0 secs Computing kpt #: 237 total cpu time spent up to now is 160.6 secs Computing kpt #: 238 total cpu time spent up to now is 161.3 secs Computing kpt #: 239 total cpu time spent up to now is 162.0 secs Computing kpt #: 240 total cpu time spent up to now is 162.6 secs Computing kpt #: 241 total cpu time spent up to now is 163.3 secs Computing kpt #: 242 total cpu time spent up to now is 163.9 secs Computing kpt #: 243 total cpu time spent up to now is 164.6 secs Computing kpt #: 244 total cpu time spent up to now is 165.2 secs Computing kpt #: 245 total cpu time spent up to now is 165.8 secs Computing kpt #: 246 total cpu time spent up to now is 166.4 secs Computing kpt #: 247 total cpu time spent up to now is 167.0 secs Computing kpt #: 248 total cpu time spent up to now is 167.6 secs Computing kpt #: 249 total cpu time spent up to now is 168.2 secs Computing kpt #: 250 total cpu time spent up to now is 168.8 secs Computing kpt #: 251 total cpu time spent up to now is 169.3 secs Computing kpt #: 252 total cpu time spent up to now is 170.0 secs Computing kpt #: 253 total cpu time spent up to now is 170.6 secs Computing kpt #: 254 total cpu time spent up to now is 171.1 secs Computing kpt #: 255 total cpu time spent up to now is 171.7 secs Computing kpt #: 256 total cpu time spent up to now is 172.3 secs Computing kpt #: 257 total cpu time spent up to now is 172.8 secs Computing kpt #: 258 total cpu time spent up to now is 173.4 secs Computing kpt #: 259 total cpu time spent up to now is 174.0 secs Computing kpt #: 260 total cpu time spent up to now is 174.6 secs Computing kpt #: 261 total cpu time spent up to now is 175.1 secs Computing kpt #: 262 total cpu time spent up to now is 175.7 secs Computing kpt #: 263 total cpu time spent up to now is 176.3 secs Computing kpt #: 264 total cpu time spent up to now is 176.9 secs Computing kpt #: 265 total cpu time spent up to now is 177.5 secs Computing kpt #: 266 total cpu time spent up to now is 178.1 secs Computing kpt #: 267 total cpu time spent up to now is 178.7 secs Computing kpt #: 268 total cpu time spent up to now is 179.2 secs Computing kpt #: 269 total cpu time spent up to now is 179.8 secs Computing kpt #: 270 total cpu time spent up to now is 180.4 secs Computing kpt #: 271 total cpu time spent up to now is 181.0 secs Computing kpt #: 272 total cpu time spent up to now is 181.5 secs Computing kpt #: 273 total cpu time spent up to now is 182.1 secs Computing kpt #: 274 total cpu time spent up to now is 182.7 secs Computing kpt #: 275 total cpu time spent up to now is 183.3 secs Computing kpt #: 276 total cpu time spent up to now is 183.9 secs Computing kpt #: 277 total cpu time spent up to now is 184.5 secs Computing kpt #: 278 total cpu time spent up to now is 185.1 secs Computing kpt #: 279 total cpu time spent up to now is 185.7 secs Computing kpt #: 280 total cpu time spent up to now is 186.3 secs Computing kpt #: 281 total cpu time spent up to now is 186.9 secs Computing kpt #: 282 total cpu time spent up to now is 187.5 secs Computing kpt #: 283 total cpu time spent up to now is 188.2 secs Computing kpt #: 284 total cpu time spent up to now is 188.8 secs Computing kpt #: 285 total cpu time spent up to now is 189.4 secs Computing kpt #: 286 total cpu time spent up to now is 190.0 secs Computing kpt #: 287 total cpu time spent up to now is 190.6 secs Computing kpt #: 288 total cpu time spent up to now is 191.3 secs Computing kpt #: 289 total cpu time spent up to now is 191.9 secs Computing kpt #: 290 total cpu time spent up to now is 192.5 secs Computing kpt #: 291 total cpu time spent up to now is 193.1 secs Computing kpt #: 292 total cpu time spent up to now is 193.6 secs Computing kpt #: 293 total cpu time spent up to now is 194.1 secs Computing kpt #: 294 total cpu time spent up to now is 194.7 secs Computing kpt #: 295 total cpu time spent up to now is 195.2 secs Computing kpt #: 296 total cpu time spent up to now is 195.7 secs Computing kpt #: 297 total cpu time spent up to now is 196.3 secs Computing kpt #: 298 total cpu time spent up to now is 196.8 secs Computing kpt #: 299 total cpu time spent up to now is 197.3 secs Computing kpt #: 300 total cpu time spent up to now is 197.9 secs Computing kpt #: 301 total cpu time spent up to now is 198.4 secs Computing kpt #: 302 total cpu time spent up to now is 198.9 secs Computing kpt #: 303 total cpu time spent up to now is 199.5 secs Computing kpt #: 304 total cpu time spent up to now is 200.0 secs Computing kpt #: 305 total cpu time spent up to now is 200.6 secs Computing kpt #: 306 total cpu time spent up to now is 201.2 secs Computing kpt #: 307 total cpu time spent up to now is 201.8 secs Computing kpt #: 308 total cpu time spent up to now is 202.4 secs Computing kpt #: 309 total cpu time spent up to now is 203.0 secs Computing kpt #: 310 total cpu time spent up to now is 203.6 secs Computing kpt #: 311 total cpu time spent up to now is 204.2 secs Computing kpt #: 312 total cpu time spent up to now is 204.9 secs ethr = 1.92E-08, avg # of iterations = 19.7 total cpu time spent up to now is 204.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5475 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4937 -7.4937 -7.4223 -7.4223 -7.2481 -7.2481 -7.2093 -7.2093 -7.1785 -7.1785 -7.1195 -7.1195 -5.8581 -5.8581 -5.5137 -5.5137 1.7375 1.7375 1.9308 1.9308 1.9981 1.9981 2.1625 2.1625 2.2173 2.2173 2.8220 2.8220 3.0698 3.0698 3.3168 3.3168 3.6679 3.6679 3.8960 3.8960 4.0765 4.0765 4.8881 4.8881 5.0470 5.0470 5.8248 5.8248 6.3718 6.3718 6.4925 6.4925 6.9184 6.9184 9.0420 9.0420 9.7674 9.7674 10.3686 10.3686 11.1169 11.1169 k = 0.0000 0.0143-0.0000 ( 5469 PWs) bands (ev): -23.7504 -23.7504 -23.7265 -23.7265 -7.4938 -7.4938 -7.4224 -7.4224 -7.2481 -7.2481 -7.2098 -7.2098 -7.1782 -7.1782 -7.1198 -7.1198 -5.8574 -5.8574 -5.5134 -5.5134 1.7386 1.7386 1.9315 1.9315 1.9981 1.9981 2.1623 2.1623 2.2184 2.2184 2.8217 2.8217 3.0693 3.0693 3.3167 3.3167 3.6672 3.6672 3.8954 3.8954 4.0743 4.0743 4.8866 4.8866 5.0455 5.0455 5.8247 5.8247 6.3658 6.3658 6.4848 6.4848 6.9318 6.9318 9.0462 9.0462 9.7712 9.7712 10.3726 10.3726 11.1094 11.1094 k = 0.0000 0.0286-0.0000 ( 5477 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4940 -7.4940 -7.4229 -7.4229 -7.2481 -7.2481 -7.2111 -7.2111 -7.1772 -7.1772 -7.1206 -7.1206 -5.8552 -5.8552 -5.5127 -5.5127 1.7418 1.7418 1.9334 1.9334 1.9980 1.9980 2.1617 2.1617 2.2217 2.2217 2.8208 2.8208 3.0679 3.0679 3.3159 3.3159 3.6651 3.6651 3.8938 3.8938 4.0676 4.0676 4.8810 4.8810 5.0423 5.0423 5.8243 5.8243 6.3461 6.3461 6.4673 6.4673 6.9682 6.9682 9.0584 9.0584 9.7827 9.7827 10.3846 10.3846 11.0822 11.0822 k = 0.0000 0.0429-0.0000 ( 5487 PWs) bands (ev): -23.7503 -23.7503 -23.7266 -23.7266 -7.4945 -7.4945 -7.4236 -7.4236 -7.2481 -7.2481 -7.2130 -7.2130 -7.1758 -7.1758 -7.1219 -7.1219 -5.8517 -5.8517 -5.5114 -5.5114 1.7471 1.7471 1.9367 1.9367 1.9980 1.9980 2.1608 2.1608 2.2270 2.2270 2.8194 2.8194 3.0656 3.0656 3.3148 3.3148 3.6616 3.6616 3.8911 3.8911 4.0568 4.0568 4.8685 4.8685 5.0401 5.0401 5.8236 5.8236 6.3107 6.3107 6.4493 6.4493 7.0203 7.0203 9.0781 9.0781 9.8020 9.8020 10.4044 10.4044 11.0314 11.0314 k = 0.0000 0.0571-0.0000 ( 5489 PWs) bands (ev): -23.7502 -23.7502 -23.7266 -23.7266 -7.4951 -7.4951 -7.4246 -7.4246 -7.2482 -7.2482 -7.2154 -7.2154 -7.1741 -7.1741 -7.1236 -7.1236 -5.8467 -5.8467 -5.5097 -5.5097 1.7546 1.7546 1.9412 1.9412 1.9979 1.9979 2.1600 2.1600 2.2339 2.2339 2.8174 2.8174 3.0624 3.0624 3.3131 3.3131 3.6567 3.6567 3.8871 3.8871 4.0424 4.0424 4.8463 4.8463 5.0422 5.0422 5.8226 5.8226 6.2618 6.2618 6.4350 6.4350 7.0820 7.0820 9.1040 9.1040 9.8291 9.8291 10.4316 10.4316 10.9632 10.9632 k = 0.0000 0.0714-0.0000 ( 5491 PWs) bands (ev): -23.7500 -23.7500 -23.7267 -23.7267 -7.4959 -7.4959 -7.4259 -7.4259 -7.2484 -7.2484 -7.2179 -7.2179 -7.1724 -7.1724 -7.1256 -7.1256 -5.8404 -5.8404 -5.5076 -5.5076 1.7641 1.7641 1.9469 1.9469 1.9979 1.9979 2.1595 2.1595 2.2423 2.2423 2.8148 2.8148 3.0585 3.0585 3.3109 3.3109 3.6505 3.6505 3.8819 3.8819 4.0247 4.0247 4.8128 4.8128 5.0503 5.0503 5.8209 5.8209 6.2047 6.2047 6.4231 6.4231 7.1495 7.1495 9.1349 9.1349 9.8640 9.8640 10.4659 10.4659 10.8855 10.8855 k = 0.0000 0.0857-0.0000 ( 5499 PWs) bands (ev): -23.7498 -23.7498 -23.7268 -23.7268 -7.4969 -7.4969 -7.4275 -7.4275 -7.2487 -7.2487 -7.2205 -7.2205 -7.1708 -7.1708 -7.1279 -7.1279 -5.8328 -5.8328 -5.5050 -5.5050 1.7756 1.7756 1.9538 1.9538 1.9980 1.9980 2.1595 2.1595 2.2520 2.2520 2.8117 2.8117 3.0538 3.0538 3.3080 3.3080 3.6429 3.6429 3.8753 3.8753 4.0045 4.0045 4.7687 4.7687 5.0642 5.0642 5.8185 5.8185 6.1435 6.1435 6.4121 6.4121 7.2205 7.2205 9.1693 9.1693 9.9063 9.9063 10.5063 10.5063 10.8041 10.8041 k = 0.0000 0.1000-0.0000 ( 5513 PWs) bands (ev): -23.7496 -23.7496 -23.7269 -23.7269 -7.4981 -7.4981 -7.4293 -7.4293 -7.2494 -7.2494 -7.2229 -7.2229 -7.1695 -7.1695 -7.1303 -7.1303 -5.8240 -5.8240 -5.5020 -5.5020 1.7892 1.7892 1.9618 1.9618 1.9984 1.9984 2.1600 2.1600 2.2629 2.2629 2.8080 2.8080 3.0486 3.0486 3.3044 3.3044 3.6338 3.6338 3.8671 3.8671 3.9824 3.9824 4.7156 4.7156 5.0828 5.0828 5.8151 5.8151 6.0809 6.0809 6.4010 6.4010 7.2938 7.2938 9.2055 9.2055 9.9551 9.9551 10.5509 10.5509 10.7249 10.7249 k = 0.0000 0.1143-0.0000 ( 5503 PWs) bands (ev): -23.7493 -23.7493 -23.7270 -23.7270 -7.4995 -7.4995 -7.4314 -7.4314 -7.2504 -7.2504 -7.2249 -7.2249 -7.1685 -7.1685 -7.1326 -7.1326 -5.8141 -5.8141 -5.4986 -5.4986 1.8048 1.8048 1.9708 1.9708 1.9990 1.9990 2.1613 2.1613 2.2749 2.2749 2.8037 2.8037 3.0428 3.0428 3.3001 3.3001 3.6235 3.6235 3.8570 3.8570 3.9590 3.9590 4.6552 4.6552 5.1049 5.1049 5.8100 5.8100 6.0190 6.0190 6.3894 6.3894 7.3687 7.3687 9.2420 9.2420 10.0082 10.0082 10.5889 10.5889 10.6626 10.6626 k = 0.0000 0.1286-0.0000 ( 5515 PWs) bands (ev): -23.7491 -23.7491 -23.7271 -23.7271 -7.5012 -7.5012 -7.4337 -7.4337 -7.2520 -7.2520 -7.2264 -7.2264 -7.1682 -7.1682 -7.1346 -7.1346 -5.8032 -5.8032 -5.4949 -5.4949 1.8223 1.8223 1.9807 1.9807 2.0000 2.0000 2.1633 2.1633 2.2878 2.2878 2.7988 2.7988 3.0367 3.0367 3.2949 3.2949 3.6117 3.6117 3.8445 3.8445 3.9352 3.9352 4.5889 4.5889 5.1297 5.1297 5.8022 5.8022 5.9597 5.9597 6.3769 6.3769 7.4446 7.4446 9.2776 9.2776 10.0612 10.0612 10.5639 10.5639 10.6781 10.6781 k = 0.0000 0.1429-0.0000 ( 5511 PWs) bands (ev): -23.7487 -23.7487 -23.7272 -23.7272 -7.5030 -7.5030 -7.4362 -7.4362 -7.2540 -7.2540 -7.2275 -7.2275 -7.1685 -7.1685 -7.1362 -7.1362 -5.7914 -5.7914 -5.4910 -5.4910 1.8417 1.8417 1.9912 1.9912 2.0015 2.0015 2.1664 2.1664 2.3017 2.3017 2.7933 2.7933 3.0303 3.0303 3.2888 3.2888 3.5986 3.5986 3.8293 3.8293 3.9119 3.9119 4.5180 4.5180 5.1563 5.1563 5.7890 5.7890 5.9063 5.9063 6.3635 6.3635 7.5213 7.5213 9.3108 9.3108 10.1059 10.1059 10.5229 10.5229 10.7320 10.7320 k = 0.0000 0.1571-0.0000 ( 5505 PWs) bands (ev): -23.7484 -23.7484 -23.7274 -23.7274 -7.5051 -7.5051 -7.4390 -7.4390 -7.2564 -7.2564 -7.2280 -7.2280 -7.1694 -7.1694 -7.1373 -7.1373 -5.7786 -5.7786 -5.4868 -5.4868 1.8628 1.8628 2.0008 2.0008 2.0050 2.0050 2.1705 2.1705 2.3164 2.3164 2.7871 2.7871 3.0239 3.0239 3.2817 3.2817 3.5841 3.5841 3.8108 3.8108 3.8896 3.8896 4.4437 4.4437 5.1843 5.1843 5.7655 5.7655 5.8641 5.8641 6.3492 6.3492 7.5985 7.5985 9.3405 9.3405 10.1303 10.1303 10.5106 10.5106 10.7901 10.7901 k = 0.0000 0.1714-0.0000 ( 5503 PWs) bands (ev): -23.7480 -23.7480 -23.7275 -23.7275 -7.5073 -7.5073 -7.4421 -7.4421 -7.2591 -7.2591 -7.2283 -7.2283 -7.1710 -7.1710 -7.1379 -7.1379 -5.7652 -5.7652 -5.4824 -5.4824 1.8857 1.8857 2.0045 2.0045 2.0155 2.0155 2.1758 2.1758 2.3318 2.3318 2.7803 2.7803 3.0176 3.0176 3.2734 3.2734 3.5683 3.5683 3.7892 3.7892 3.8687 3.8687 4.3669 4.3669 5.2133 5.2133 5.7285 5.7285 5.8367 5.8367 6.3340 6.3340 7.6761 7.6761 9.3653 9.3653 10.1281 10.1281 10.5363 10.5363 10.8459 10.8459 k = 0.0000 0.1857-0.0000 ( 5505 PWs) bands (ev): -23.7476 -23.7476 -23.7277 -23.7277 -7.5098 -7.5098 -7.4454 -7.4454 -7.2619 -7.2619 -7.2283 -7.2283 -7.1729 -7.1729 -7.1381 -7.1381 -5.7511 -5.7511 -5.4779 -5.4779 1.9101 1.9101 2.0074 2.0074 2.0277 2.0277 2.1824 2.1824 2.3480 2.3480 2.7727 2.7727 3.0114 3.0114 3.2639 3.2639 3.5512 3.5512 3.7649 3.7649 3.8489 3.8489 4.2885 4.2885 5.2429 5.2429 5.6831 5.6831 5.8190 5.8190 6.3179 6.3179 7.7540 7.7540 9.3838 9.3838 10.1082 10.1082 10.5916 10.5916 10.8931 10.8931 k = 0.0000 0.2000-0.0000 ( 5509 PWs) bands (ev): -23.7472 -23.7472 -23.7279 -23.7279 -7.5124 -7.5124 -7.4490 -7.4490 -7.2648 -7.2648 -7.2282 -7.2282 -7.1750 -7.1750 -7.1380 -7.1380 -5.7365 -5.7365 -5.4733 -5.4733 1.9361 1.9361 2.0109 2.0109 2.0402 2.0402 2.1905 2.1905 2.3648 2.3648 2.7644 2.7644 3.0057 3.0057 3.2531 3.2531 3.5328 3.5328 3.7385 3.7385 3.8298 3.8298 4.2093 4.2093 5.2728 5.2728 5.6355 5.6355 5.8052 5.8052 6.3009 6.3009 7.8322 7.8322 9.3946 9.3946 10.0844 10.0844 10.6623 10.6623 10.9242 10.9242 k = 0.0000 0.2143-0.0000 ( 5507 PWs) bands (ev): -23.7468 -23.7468 -23.7281 -23.7281 -7.5151 -7.5151 -7.4528 -7.4528 -7.2676 -7.2676 -7.2281 -7.2281 -7.1772 -7.1772 -7.1378 -7.1378 -5.7214 -5.7214 -5.4687 -5.4687 1.9633 1.9633 2.0152 2.0152 2.0530 2.0530 2.2001 2.2001 2.3822 2.3822 2.7554 2.7554 3.0005 3.0005 3.2410 3.2410 3.5131 3.5131 3.7108 3.7108 3.8106 3.8106 4.1300 4.1300 5.3030 5.3030 5.5889 5.5889 5.7923 5.7923 6.2832 6.2832 7.9105 7.9105 9.3966 9.3966 10.0660 10.0660 10.7373 10.7373 10.9339 10.9339 k = 0.0000 0.2286-0.0000 ( 5496 PWs) bands (ev): -23.7463 -23.7463 -23.7283 -23.7283 -7.5180 -7.5180 -7.4568 -7.4568 -7.2703 -7.2703 -7.2282 -7.2282 -7.1791 -7.1791 -7.1375 -7.1375 -5.7060 -5.7060 -5.4641 -5.4641 1.9911 1.9911 2.0207 2.0207 2.0657 2.0657 2.2112 2.2112 2.4002 2.4002 2.7457 2.7457 2.9958 2.9958 3.2273 3.2273 3.4923 3.4923 3.6825 3.6825 3.7910 3.7910 4.0514 4.0514 5.3330 5.3330 5.5446 5.5446 5.7790 5.7790 6.2647 6.2647 7.9887 7.9887 9.3896 9.3896 10.0574 10.0574 10.8046 10.8046 10.9289 10.9289 k = 0.0000 0.2429-0.0000 ( 5492 PWs) bands (ev): -23.7458 -23.7458 -23.7285 -23.7285 -7.5209 -7.5209 -7.4611 -7.4611 -7.2727 -7.2727 -7.2285 -7.2285 -7.1806 -7.1806 -7.1373 -7.1373 -5.6904 -5.6904 -5.4596 -5.4596 2.0160 2.0160 2.0310 2.0310 2.0785 2.0785 2.2239 2.2239 2.4185 2.4185 2.7353 2.7353 2.9919 2.9919 3.2122 3.2122 3.4702 3.4702 3.6539 3.6539 3.7707 3.7707 3.9741 3.9741 5.3628 5.3628 5.5034 5.5034 5.7646 5.7646 6.2454 6.2454 8.0668 8.0668 9.3743 9.3743 10.0603 10.0603 10.8343 10.8343 10.9423 10.9423 k = 0.0000 0.2571-0.0000 ( 5506 PWs) bands (ev): -23.7453 -23.7453 -23.7288 -23.7288 -7.5239 -7.5239 -7.4657 -7.4657 -7.2749 -7.2749 -7.2291 -7.2291 -7.1818 -7.1818 -7.1371 -7.1371 -5.6746 -5.6746 -5.4554 -5.4554 2.0278 2.0278 2.0560 2.0560 2.0913 2.0913 2.2381 2.2381 2.4372 2.4372 2.7244 2.7244 2.9886 2.9886 3.1955 3.1955 3.4471 3.4471 3.6253 3.6253 3.7493 3.7493 3.8989 3.8989 5.3920 5.3920 5.4660 5.4660 5.7490 5.7490 6.2256 6.2256 8.1445 8.1445 9.3525 9.3525 10.0738 10.0738 10.8131 10.8131 10.9915 10.9915 k = 0.0000 0.2714-0.0000 ( 5514 PWs) bands (ev): -23.7448 -23.7448 -23.7291 -23.7291 -7.5268 -7.5268 -7.4704 -7.4704 -7.2767 -7.2767 -7.2300 -7.2300 -7.1824 -7.1824 -7.1370 -7.1370 -5.6588 -5.6588 -5.4513 -5.4513 2.0357 2.0357 2.0858 2.0858 2.1049 2.1049 2.2535 2.2535 2.4561 2.4561 2.7130 2.7130 2.9858 2.9858 3.1774 3.1774 3.4231 3.4231 3.5969 3.5969 3.7265 3.7265 3.8266 3.8266 5.4161 5.4161 5.4370 5.4370 5.7320 5.7320 6.2052 6.2052 8.2217 8.2217 9.3266 9.3266 10.0966 10.0966 10.7749 10.7749 11.0451 11.0451 k = 0.0000 0.2857-0.0000 ( 5516 PWs) bands (ev): -23.7443 -23.7443 -23.7293 -23.7293 -7.5297 -7.5297 -7.4754 -7.4754 -7.2782 -7.2782 -7.2312 -7.2312 -7.1825 -7.1825 -7.1370 -7.1370 -5.6430 -5.6430 -5.4475 -5.4475 2.0438 2.0438 2.1109 2.1109 2.1244 2.1244 2.2702 2.2702 2.4751 2.4751 2.7014 2.7014 2.9832 2.9832 3.1582 3.1582 3.3980 3.3980 3.5689 3.5689 3.7013 3.7013 3.7590 3.7590 5.3978 5.3978 5.4537 5.4537 5.7136 5.7136 6.1843 6.1843 8.2981 8.2981 9.2986 9.2986 10.1268 10.1268 10.7326 10.7326 11.0911 11.0911 k = 0.0000 0.3000-0.0000 ( 5512 PWs) bands (ev): -23.7437 -23.7437 -23.7296 -23.7296 -7.5324 -7.5324 -7.4805 -7.4805 -7.2793 -7.2793 -7.2327 -7.2327 -7.1822 -7.1822 -7.1372 -7.1372 -5.6274 -5.6274 -5.4441 -5.4441 2.0526 2.0526 2.1261 2.1261 2.1544 2.1544 2.2878 2.2878 2.4940 2.4940 2.6899 2.6899 2.9803 2.9803 3.1382 3.1382 3.3720 3.3720 3.5413 3.5413 3.6683 3.6683 3.7022 3.7022 5.3718 5.3718 5.4815 5.4815 5.6937 5.6937 6.1630 6.1630 8.3733 8.3733 9.2703 9.2703 10.1627 10.1627 10.6902 10.6902 11.1267 11.1267 k = 0.0000 0.3143-0.0000 ( 5514 PWs) bands (ev): -23.7432 -23.7432 -23.7300 -23.7300 -7.5351 -7.5351 -7.4857 -7.4857 -7.2801 -7.2801 -7.2345 -7.2345 -7.1814 -7.1814 -7.1375 -7.1375 -5.6120 -5.6120 -5.4411 -5.4411 2.0621 2.0621 2.1393 2.1393 2.1867 2.1867 2.3063 2.3063 2.5125 2.5125 2.6790 2.6790 2.9761 2.9761 3.1185 3.1185 3.3450 3.3450 3.5140 3.5140 3.6185 3.6185 3.6660 3.6660 5.3491 5.3491 5.5093 5.5093 5.6726 5.6726 6.1413 6.1413 8.4469 8.4469 9.2430 9.2430 10.2030 10.2030 10.6494 10.6494 11.1522 11.1522 k = 0.0000 0.3286-0.0000 ( 5518 PWs) bands (ev): -23.7426 -23.7426 -23.7303 -23.7303 -7.5375 -7.5375 -7.4910 -7.4910 -7.2805 -7.2805 -7.2366 -7.2366 -7.1802 -7.1802 -7.1380 -7.1380 -5.5969 -5.5969 -5.4386 -5.4386 2.0725 2.0725 2.1524 2.1524 2.2189 2.2189 2.3254 2.3254 2.5300 2.5300 2.6692 2.6692 2.9692 2.9692 3.1005 3.1005 3.3171 3.3171 3.4871 3.4871 3.5650 3.5650 3.6381 3.6381 5.3300 5.3300 5.5366 5.5366 5.6503 5.6503 6.1193 6.1193 8.5186 8.5186 9.2174 9.2174 10.2464 10.2464 10.6113 10.6113 11.1666 11.1666 k = 0.0000 0.3429-0.0000 ( 5522 PWs) bands (ev): -23.7420 -23.7420 -23.7307 -23.7307 -7.5397 -7.5397 -7.4962 -7.4962 -7.2806 -7.2806 -7.2388 -7.2388 -7.1787 -7.1787 -7.1386 -7.1386 -5.5821 -5.5821 -5.4365 -5.4365 2.0838 2.0838 2.1654 2.1654 2.2502 2.2502 2.3452 2.3452 2.5459 2.5459 2.6616 2.6616 2.9576 2.9576 3.0859 3.0859 3.2884 3.2884 3.4601 3.4601 3.5159 3.5159 3.6115 3.6115 5.3146 5.3146 5.5629 5.5629 5.6277 5.6277 6.0970 6.0970 8.5878 8.5878 9.1943 9.1943 10.2918 10.2918 10.5770 10.5770 11.1700 11.1700 k = 0.0000 0.3571-0.0000 ( 5526 PWs) bands (ev): -23.7414 -23.7414 -23.7310 -23.7310 -7.5417 -7.5417 -7.5015 -7.5015 -7.2804 -7.2804 -7.2411 -7.2411 -7.1770 -7.1770 -7.1394 -7.1394 -5.5678 -5.5678 -5.4351 -5.4351 2.0958 2.0958 2.1785 2.1785 2.2799 2.2799 2.3659 2.3659 2.5586 2.5586 2.6576 2.6576 2.9402 2.9402 3.0759 3.0759 3.2592 3.2592 3.4324 3.4324 3.4737 3.4737 3.5851 3.5851 5.3029 5.3029 5.5833 5.5833 5.6095 5.6095 6.0745 6.0745 8.6539 8.6539 9.1738 9.1738 10.3385 10.3385 10.5472 10.5472 11.1642 11.1642 k = 0.0000 0.3714-0.0000 ( 5526 PWs) bands (ev): -23.7409 -23.7409 -23.7314 -23.7314 -7.5433 -7.5433 -7.5066 -7.5066 -7.2798 -7.2798 -7.2435 -7.2435 -7.1750 -7.1750 -7.1403 -7.1403 -5.5540 -5.5540 -5.4343 -5.4343 2.1085 2.1085 2.1914 2.1914 2.3071 2.3071 2.3875 2.3875 2.5669 2.5669 2.6587 2.6587 2.9174 2.9174 3.0700 3.0700 3.2302 3.2302 3.4034 3.4034 3.4396 3.4396 3.5589 3.5589 5.2947 5.2947 5.5719 5.5719 5.6221 5.6221 6.0518 6.0518 8.7165 8.7165 9.1559 9.1559 10.3852 10.3852 10.5226 10.5226 11.1513 11.1513 k = 0.0000 0.3857-0.0000 ( 5530 PWs) bands (ev): -23.7403 -23.7403 -23.7319 -23.7319 -7.5447 -7.5447 -7.5116 -7.5116 -7.2790 -7.2790 -7.2460 -7.2460 -7.1730 -7.1730 -7.1415 -7.1415 -5.5408 -5.5408 -5.4341 -5.4341 2.1218 2.1218 2.2039 2.2039 2.3310 2.3310 2.4103 2.4103 2.5702 2.5702 2.6655 2.6655 2.8910 2.8910 3.0659 3.0659 3.2032 3.2032 3.3739 3.3739 3.4129 3.4129 3.5327 3.5327 5.2900 5.2900 5.5478 5.5478 5.6465 5.6465 6.0290 6.0290 8.7749 8.7749 9.1406 9.1406 10.4308 10.4308 10.5039 10.5039 11.1333 11.1333 k = 0.0000 0.4000-0.0000 ( 5526 PWs) bands (ev): -23.7397 -23.7397 -23.7323 -23.7323 -7.5456 -7.5456 -7.5164 -7.5164 -7.2780 -7.2780 -7.2485 -7.2485 -7.1708 -7.1708 -7.1427 -7.1427 -5.5282 -5.5282 -5.4347 -5.4347 2.1356 2.1356 2.2156 2.2156 2.3516 2.3516 2.4338 2.4338 2.5699 2.5699 2.6762 2.6762 2.8635 2.8635 3.0599 3.0599 3.1809 3.1809 3.3459 3.3459 3.3915 3.3915 3.5070 3.5070 5.2887 5.2887 5.5224 5.5224 5.6717 5.6717 6.0060 6.0060 8.8285 8.8285 9.1275 9.1275 10.4722 10.4722 10.4932 10.4932 11.1129 11.1129 k = 0.0000 0.4143-0.0000 ( 5530 PWs) bands (ev): -23.7391 -23.7391 -23.7327 -23.7327 -7.5462 -7.5462 -7.5209 -7.5209 -7.2767 -7.2767 -7.2510 -7.2510 -7.1686 -7.1686 -7.1441 -7.1441 -5.5163 -5.5163 -5.4360 -5.4360 2.1497 2.1497 2.2258 2.2258 2.3694 2.3694 2.4568 2.4568 2.5681 2.5681 2.6877 2.6877 2.8380 2.8380 3.0480 3.0480 3.1667 3.1667 3.3204 3.3204 3.3743 3.3743 3.4818 3.4818 5.2905 5.2905 5.4968 5.4968 5.6968 5.6968 5.9829 5.9829 8.8769 8.8769 9.1162 9.1162 10.4824 10.4824 10.5159 10.5159 11.0929 11.0929 k = 0.0000 0.4286-0.0000 ( 5532 PWs) bands (ev): -23.7385 -23.7385 -23.7332 -23.7332 -7.5464 -7.5464 -7.5251 -7.5251 -7.2752 -7.2752 -7.2535 -7.2535 -7.1663 -7.1663 -7.1456 -7.1456 -5.5051 -5.5051 -5.4381 -5.4381 2.1639 2.1639 2.2338 2.2338 2.3855 2.3855 2.4771 2.4771 2.5670 2.5670 2.6955 2.6955 2.8191 2.8191 3.0285 3.0285 3.1619 3.1619 3.2973 3.2973 3.3612 3.3612 3.4575 3.4575 5.2954 5.2954 5.4715 5.4715 5.7216 5.7216 5.9598 5.9598 8.9197 8.9197 9.1063 9.1063 10.4833 10.4833 10.5476 10.5476 11.0769 11.0769 k = 0.0000 0.4429-0.0000 ( 5524 PWs) bands (ev): -23.7379 -23.7379 -23.7337 -23.7337 -7.5462 -7.5462 -7.5290 -7.5290 -7.2735 -7.2735 -7.2560 -7.2560 -7.1640 -7.1640 -7.1473 -7.1473 -5.4946 -5.4946 -5.4410 -5.4410 2.1779 2.1779 2.2389 2.2389 2.4011 2.4011 2.4917 2.4917 2.5693 2.5693 2.6943 2.6943 2.8126 2.8126 3.0032 3.0032 3.1648 3.1648 3.2764 3.2764 3.3524 3.3524 3.4344 3.4344 5.3032 5.3032 5.4468 5.4468 5.7463 5.7463 5.9365 5.9365 8.9567 8.9567 9.0972 9.0972 10.4900 10.4900 10.5706 10.5706 11.0686 11.0686 k = 0.0000 0.4571-0.0000 ( 5532 PWs) bands (ev): -23.7374 -23.7374 -23.7342 -23.7342 -7.5455 -7.5455 -7.5326 -7.5326 -7.2717 -7.2717 -7.2584 -7.2584 -7.1617 -7.1617 -7.1491 -7.1491 -5.4850 -5.4850 -5.4447 -5.4447 2.1915 2.1915 2.2406 2.2406 2.4170 2.4170 2.4969 2.4969 2.5776 2.5776 2.6828 2.6828 2.8202 2.8202 2.9748 2.9748 3.1723 3.1723 3.2572 3.2572 3.3482 3.3482 3.4130 3.4130 5.3137 5.3137 5.4229 5.4229 5.7706 5.7706 5.9132 5.9132 8.9882 8.9882 9.0880 9.0880 10.5020 10.5020 10.5824 10.5824 11.0712 11.0712 k = 0.0000 0.4714-0.0000 ( 5540 PWs) bands (ev): -23.7368 -23.7368 -23.7347 -23.7347 -7.5445 -7.5445 -7.5358 -7.5358 -7.2697 -7.2697 -7.2609 -7.2609 -7.1594 -7.1594 -7.1510 -7.1510 -5.4761 -5.4761 -5.4493 -5.4493 2.2044 2.2044 2.2388 2.2388 2.4337 2.4337 2.4927 2.4927 2.5916 2.5916 2.6654 2.6654 2.8377 2.8377 2.9453 2.9453 3.1827 3.1827 3.2397 3.2397 3.3487 3.3487 3.3936 3.3936 5.3268 5.3268 5.4003 5.4003 5.7948 5.7948 5.8898 5.8898 9.0143 9.0143 9.0782 9.0782 10.5183 10.5183 10.5825 10.5825 11.0859 11.0859 k = 0.0000 0.4857-0.0000 ( 5532 PWs) bands (ev): -23.7363 -23.7363 -23.7352 -23.7352 -7.5429 -7.5429 -7.5386 -7.5386 -7.2676 -7.2676 -7.2632 -7.2632 -7.1572 -7.1572 -7.1530 -7.1530 -5.4681 -5.4681 -5.4547 -5.4547 2.2160 2.2160 2.2338 2.2338 2.4508 2.4508 2.4820 2.4820 2.6087 2.6087 2.6463 2.6463 2.8609 2.8609 2.9158 2.9158 3.1950 3.1950 3.2235 3.2235 3.3539 3.3539 3.3770 3.3770 5.3422 5.3422 5.3792 5.3792 5.8188 5.8188 5.8663 5.8663 9.0356 9.0356 9.0667 9.0667 10.5373 10.5373 10.5727 10.5727 11.1119 11.1119 k = 0.0000 0.5000-0.0000 ( 5530 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5410 -7.5410 -7.5410 -7.5410 -7.2655 -7.2655 -7.2655 -7.2655 -7.1550 -7.1550 -7.1550 -7.1550 -5.4610 -5.4610 -5.4610 -5.4610 2.2260 2.2260 2.2260 2.2260 2.4674 2.4674 2.4674 2.4674 2.6272 2.6272 2.6272 2.6272 2.8874 2.8874 2.8874 2.8874 3.2086 3.2086 3.2086 3.2086 3.3635 3.3635 3.3635 3.3635 5.3597 5.3597 5.3597 5.3597 5.8426 5.8426 5.8426 5.8426 9.0528 9.0528 9.0528 9.0528 10.5564 10.5564 10.5564 10.5564 11.1469 11.1469 k = 0.0000 0.5000-0.0000 ( 5530 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5410 -7.5410 -7.5410 -7.5410 -7.2655 -7.2655 -7.2655 -7.2655 -7.1550 -7.1550 -7.1550 -7.1550 -5.4610 -5.4610 -5.4610 -5.4610 2.2260 2.2260 2.2260 2.2260 2.4674 2.4674 2.4674 2.4674 2.6272 2.6272 2.6272 2.6272 2.8874 2.8874 2.8874 2.8874 3.2086 3.2086 3.2086 3.2086 3.3635 3.3635 3.3635 3.3635 5.3597 5.3597 5.3597 5.3597 5.8426 5.8426 5.8426 5.8426 9.0528 9.0528 9.0528 9.0528 10.5564 10.5564 10.5564 10.5564 11.1469 11.1469 k = 0.0143 0.5000-0.0000 ( 5534 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5412 -7.5412 -7.5405 -7.5405 -7.2674 -7.2674 -7.2635 -7.2635 -7.1567 -7.1567 -7.1535 -7.1535 -5.4612 -5.4612 -5.4610 -5.4610 2.2197 2.2197 2.2309 2.2309 2.4542 2.4542 2.4798 2.4798 2.6101 2.6101 2.6467 2.6467 2.8705 2.8705 2.9042 2.9042 3.2079 3.2079 3.2107 3.2107 3.3609 3.3609 3.3677 3.3677 5.3567 5.3567 5.3604 5.3604 5.8397 5.8397 5.8404 5.8404 9.0526 9.0526 9.0578 9.0578 10.5488 10.5488 10.5558 10.5558 11.1444 11.1444 k = 0.0286 0.5000-0.0000 ( 5530 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5412 -7.5412 -7.5398 -7.5398 -7.2693 -7.2693 -7.2616 -7.2616 -7.1585 -7.1585 -7.1522 -7.1522 -5.4616 -5.4616 -5.4613 -5.4613 2.2120 2.2120 2.2340 2.2340 2.4413 2.4413 2.4901 2.4901 2.5968 2.5968 2.6677 2.6677 2.8539 2.8539 2.9207 2.9207 3.2087 3.2087 3.2139 3.2139 3.3598 3.3598 3.3733 3.3733 5.3513 5.3513 5.3587 5.3587 5.8319 5.8319 5.8333 5.8333 9.0572 9.0572 9.0676 9.0676 10.5331 10.5331 10.5464 10.5464 11.1428 11.1428 k = 0.0429 0.5000-0.0000 ( 5522 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5409 -7.5409 -7.5388 -7.5388 -7.2711 -7.2711 -7.2596 -7.2596 -7.1604 -7.1604 -7.1509 -7.1509 -5.4623 -5.4623 -5.4618 -5.4618 2.2032 2.2032 2.2351 2.2351 2.4296 2.4296 2.4967 2.4967 2.5885 2.5885 2.6893 2.6893 2.8383 2.8383 2.9367 2.9367 3.2112 3.2112 3.2177 3.2177 3.3604 3.3604 3.3807 3.3807 5.3436 5.3436 5.3547 5.3547 5.8194 5.8194 5.8214 5.8214 9.0664 9.0664 9.0818 9.0818 10.5095 10.5095 10.5282 10.5282 11.1446 11.1446 k = 0.0571 0.5000-0.0000 ( 5516 PWs) bands (ev): -23.7356 -23.7356 -23.7356 -23.7356 -7.5403 -7.5403 -7.5375 -7.5375 -7.2730 -7.2730 -7.2576 -7.2576 -7.1625 -7.1625 -7.1499 -7.1499 -5.4632 -5.4632 -5.4626 -5.4626 2.1932 2.1932 2.2336 2.2336 2.4200 2.4200 2.4982 2.4982 2.5864 2.5864 2.7101 2.7101 2.8248 2.8248 2.9522 2.9522 3.2150 3.2150 3.2217 3.2217 3.3630 3.3630 3.3900 3.3900 5.3336 5.3336 5.3481 5.3481 5.8026 5.8026 5.8050 5.8050 9.0796 9.0796 9.1000 9.1000 10.4786 10.4786 10.5014 10.5014 11.1524 11.1524 k = 0.0714 0.5000-0.0000 ( 5516 PWs) bands (ev): -23.7356 -23.7356 -23.7356 -23.7356 -7.5396 -7.5396 -7.5360 -7.5360 -7.2748 -7.2748 -7.2556 -7.2556 -7.1647 -7.1647 -7.1490 -7.1490 -5.4644 -5.4644 -5.4636 -5.4636 2.1822 2.1822 2.2292 2.2292 2.4132 2.4132 2.4954 2.4954 2.5898 2.5898 2.7272 2.7272 2.8159 2.8159 2.9671 2.9671 3.2198 3.2198 3.2257 3.2257 3.3682 3.3682 3.4013 3.4013 5.3211 5.3211 5.3390 5.3390 5.7819 5.7819 5.7845 5.7845 9.0965 9.0965 9.1215 9.1215 10.4410 10.4410 10.4667 10.4667 11.1679 11.1679 k = 0.0857 0.5000-0.0000 ( 5512 PWs) bands (ev): -23.7355 -23.7355 -23.7355 -23.7355 -7.5385 -7.5385 -7.5343 -7.5343 -7.2765 -7.2765 -7.2536 -7.2536 -7.1670 -7.1670 -7.1482 -7.1482 -5.4658 -5.4658 -5.4649 -5.4649 2.1701 2.1701 2.2218 2.2218 2.4094 2.4094 2.4901 2.4901 2.5966 2.5966 2.7361 2.7361 2.8162 2.8162 2.9816 2.9816 3.2247 3.2247 3.2293 3.2293 3.3766 3.3766 3.4148 3.4148 5.3062 5.3062 5.3272 5.3272 5.7579 5.7579 5.7604 5.7604 9.1162 9.1162 9.1457 9.1457 10.3977 10.3977 10.4254 10.4254 11.1921 11.1921 k = 0.1000 0.5000-0.0000 ( 5502 PWs) bands (ev): -23.7354 -23.7354 -23.7354 -23.7354 -7.5373 -7.5373 -7.5324 -7.5324 -7.2782 -7.2782 -7.2515 -7.2515 -7.1694 -7.1694 -7.1475 -7.1475 -5.4674 -5.4674 -5.4663 -5.4663 2.1572 2.1572 2.2116 2.2116 2.4089 2.4089 2.4841 2.4841 2.6049 2.6049 2.7343 2.7343 2.8280 2.8280 2.9958 2.9958 3.2292 3.2292 3.2327 3.2327 3.3888 3.3888 3.4304 3.4304 5.2888 5.2888 5.3127 5.3127 5.7311 5.7311 5.7333 5.7333 9.1381 9.1381 9.1718 9.1718 10.3502 10.3502 10.3791 10.3791 11.2248 11.2250 k = 0.1143 0.5000-0.0000 ( 5494 PWs) bands (ev): -23.7354 -23.7354 -23.7354 -23.7354 -7.5359 -7.5359 -7.5303 -7.5303 -7.2798 -7.2798 -7.2495 -7.2495 -7.1719 -7.1719 -7.1470 -7.1470 -5.4692 -5.4692 -5.4680 -5.4680 2.1434 2.1434 2.1989 2.1989 2.4112 2.4112 2.4784 2.4784 2.6136 2.6136 2.7257 2.7257 2.8469 2.8469 3.0098 3.0098 3.2326 3.2326 3.2357 3.2357 3.4050 3.4050 3.4483 3.4483 5.2689 5.2689 5.2953 5.2953 5.7021 5.7021 5.7037 5.7037 9.1615 9.1615 9.1989 9.1989 10.2998 10.2998 10.3297 10.3297 11.2618 11.2618 k = 0.1286 0.5000-0.0000 ( 5504 PWs) bands (ev): -23.7353 -23.7353 -23.7353 -23.7353 -7.5343 -7.5343 -7.5281 -7.5281 -7.2813 -7.2813 -7.2474 -7.2474 -7.1746 -7.1746 -7.1467 -7.1467 -5.4712 -5.4712 -5.4699 -5.4699 2.1288 2.1288 2.1843 2.1843 2.4160 2.4160 2.4735 2.4735 2.6220 2.6220 2.7144 2.7144 2.8686 2.8686 3.0237 3.0237 3.2348 3.2348 3.2386 3.2386 3.4254 3.4254 3.4683 3.4683 5.2465 5.2465 5.2751 5.2751 5.6715 5.6715 5.6720 5.6720 9.1853 9.1853 9.2261 9.2261 10.2478 10.2478 10.2784 10.2784 11.3066 11.3066 k = 0.1429 0.5000-0.0000 ( 5500 PWs) bands (ev): -23.7352 -23.7352 -23.7352 -23.7352 -7.5326 -7.5326 -7.5257 -7.5257 -7.2827 -7.2827 -7.2453 -7.2453 -7.1772 -7.1772 -7.1465 -7.1465 -5.4733 -5.4733 -5.4720 -5.4720 2.1138 2.1138 2.1683 2.1683 2.4228 2.4228 2.4696 2.4696 2.6301 2.6301 2.7023 2.7023 2.8908 2.8908 3.0374 3.0374 3.2359 3.2359 3.2418 3.2418 3.4497 3.4497 3.4903 3.4903 5.2216 5.2216 5.2520 5.2520 5.6387 5.6387 5.6398 5.6398 9.2090 9.2090 9.2527 9.2527 10.1955 10.1955 10.2268 10.2268 11.3586 11.3586 k = 0.1571 0.5000-0.0000 ( 5508 PWs) bands (ev): -23.7351 -23.7351 -23.7351 -23.7351 -7.5307 -7.5307 -7.5232 -7.5232 -7.2840 -7.2840 -7.2431 -7.2431 -7.1800 -7.1800 -7.1464 -7.1464 -5.4757 -5.4757 -5.4742 -5.4742 2.0984 2.0984 2.1513 2.1513 2.4311 2.4311 2.4667 2.4667 2.6376 2.6376 2.6905 2.6905 2.9121 2.9121 3.0506 3.0506 3.2364 3.2364 3.2455 3.2455 3.4775 3.4775 3.5141 3.5141 5.1944 5.1944 5.2261 5.2261 5.6043 5.6043 5.6073 5.6073 9.2317 9.2317 9.2778 9.2778 10.1440 10.1440 10.1759 10.1759 11.4173 11.4173 k = 0.1714 0.5000-0.0000 ( 5512 PWs) bands (ev): -23.7350 -23.7350 -23.7350 -23.7350 -7.5287 -7.5287 -7.5207 -7.5207 -7.2852 -7.2852 -7.2410 -7.2410 -7.1828 -7.1828 -7.1464 -7.1464 -5.4782 -5.4782 -5.4766 -5.4766 2.0827 2.0827 2.1339 2.1339 2.4407 2.4407 2.4648 2.4648 2.6447 2.6447 2.6792 2.6792 2.9316 2.9316 3.0630 3.0630 3.2366 3.2366 3.2503 3.2503 3.5084 3.5084 3.5399 3.5399 5.1650 5.1650 5.1975 5.1975 5.5691 5.5691 5.5744 5.5744 9.2527 9.2527 9.3007 9.3007 10.0942 10.0942 10.1267 10.1267 11.4820 11.4820 k = 0.1857 0.5000-0.0000 ( 5508 PWs) bands (ev): -23.7349 -23.7349 -23.7349 -23.7349 -7.5266 -7.5266 -7.5181 -7.5181 -7.2861 -7.2861 -7.2387 -7.2387 -7.1856 -7.1856 -7.1465 -7.1465 -5.4808 -5.4808 -5.4792 -5.4792 2.0670 2.0670 2.1162 2.1162 2.4513 2.4513 2.4638 2.4638 2.6514 2.6514 2.6688 2.6688 2.9488 2.9488 3.0741 3.0741 3.2374 3.2374 3.2566 3.2566 3.5421 3.5421 3.5673 3.5673 5.1337 5.1337 5.1667 5.1667 5.5332 5.5332 5.5413 5.5413 9.2713 9.2713 9.3205 9.3205 10.0472 10.0472 10.0801 10.0801 11.5518 11.5518 k = 0.2000 0.5000-0.0000 ( 5508 PWs) bands (ev): -23.7348 -23.7348 -23.7348 -23.7348 -7.5245 -7.5245 -7.5155 -7.5155 -7.2869 -7.2869 -7.2365 -7.2365 -7.1885 -7.1885 -7.1468 -7.1468 -5.4835 -5.4835 -5.4818 -5.4818 2.0512 2.0512 2.0984 2.0984 2.4626 2.4626 2.4636 2.4636 2.6579 2.6579 2.6595 2.6595 2.9630 2.9630 3.0834 3.0834 3.2394 3.2394 3.2646 3.2646 3.5781 3.5781 3.5965 3.5965 5.1007 5.1007 5.1337 5.1337 5.4969 5.4969 5.5080 5.5080 9.2870 9.2870 9.3368 9.3368 10.0035 10.0035 10.0366 10.0366 11.6258 11.6258 k = 0.2143 0.5000-0.0000 ( 5502 PWs) bands (ev): -23.7347 -23.7347 -23.7347 -23.7347 -7.5223 -7.5223 -7.5130 -7.5130 -7.2875 -7.2875 -7.2342 -7.2342 -7.1913 -7.1913 -7.1471 -7.1471 -5.4863 -5.4863 -5.4846 -5.4846 2.0357 2.0357 2.0808 2.0808 2.4641 2.4641 2.4743 2.4743 2.6513 2.6513 2.6642 2.6642 2.9739 2.9739 3.0901 3.0901 3.2432 3.2432 3.2747 3.2747 3.6162 3.6162 3.6274 3.6274 5.0663 5.0663 5.0992 5.0992 5.4601 5.4601 5.4744 5.4744 9.2993 9.2993 9.3489 9.3489 9.9638 9.9638 9.9968 9.9968 11.7030 11.7030 k = 0.2286 0.5000-0.0000 ( 5510 PWs) bands (ev): -23.7346 -23.7346 -23.7346 -23.7346 -7.5202 -7.5202 -7.5105 -7.5105 -7.2879 -7.2879 -7.2318 -7.2318 -7.1942 -7.1942 -7.1476 -7.1476 -5.4892 -5.4892 -5.4874 -5.4874 2.0205 2.0205 2.0634 2.0634 2.4652 2.4652 2.4862 2.4862 2.6443 2.6443 2.6703 2.6703 2.9814 2.9814 3.0940 3.0940 3.2493 3.2493 3.2867 3.2867 3.6562 3.6562 3.6598 3.6598 5.0310 5.0310 5.0635 5.0635 5.4228 5.4228 5.4405 5.4405 9.3081 9.3081 9.3566 9.3566 9.9287 9.9287 9.9610 9.9610 11.7822 11.7822 k = 0.2429 0.5000-0.0000 ( 5506 PWs) bands (ev): -23.7344 -23.7344 -23.7344 -23.7344 -7.5180 -7.5180 -7.5081 -7.5081 -7.2881 -7.2881 -7.2294 -7.2294 -7.1971 -7.1971 -7.1481 -7.1481 -5.4921 -5.4921 -5.4904 -5.4904 2.0056 2.0056 2.0464 2.0464 2.4669 2.4669 2.4980 2.4980 2.6388 2.6388 2.6764 2.6764 2.9857 2.9857 3.0948 3.0948 3.2577 3.2577 3.3005 3.3005 3.6938 3.6938 3.6978 3.6978 4.9950 4.9950 5.0271 5.0271 5.3850 5.3850 5.4060 5.4060 9.3131 9.3131 9.3598 9.3598 9.8981 9.8981 9.9293 9.9293 11.8621 11.8621 k = 0.2571 0.5000-0.0000 ( 5518 PWs) bands (ev): -23.7343 -23.7343 -23.7343 -23.7343 -7.5159 -7.5159 -7.5058 -7.5058 -7.2880 -7.2880 -7.2270 -7.2270 -7.1999 -7.1999 -7.1488 -7.1488 -5.4951 -5.4951 -5.4933 -5.4933 1.9912 1.9912 2.0298 2.0298 2.4691 2.4691 2.5096 2.5096 2.6348 2.6348 2.6823 2.6823 2.9872 2.9872 3.0929 3.0929 3.2682 3.2682 3.3156 3.3156 3.7294 3.7294 3.7409 3.7409 4.9589 4.9589 4.9904 4.9904 5.3467 5.3467 5.3710 5.3710 9.3146 9.3146 9.3587 9.3587 9.8721 9.8721 9.9017 9.9017 11.9413 11.9413 k = 0.2714 0.5000-0.0000 ( 5514 PWs) bands (ev): -23.7342 -23.7342 -23.7342 -23.7342 -7.5138 -7.5138 -7.5036 -7.5036 -7.2876 -7.2876 -7.2246 -7.2246 -7.2027 -7.2027 -7.1496 -7.1496 -5.4980 -5.4980 -5.4963 -5.4963 1.9774 1.9774 2.0138 2.0138 2.4719 2.4719 2.5205 2.5205 2.6324 2.6324 2.6880 2.6880 2.9863 2.9863 3.0888 3.0888 3.2804 3.2804 3.3316 3.3316 3.7665 3.7665 3.7853 3.7853 4.9229 4.9229 4.9539 4.9539 5.3077 5.3077 5.3351 5.3351 9.3129 9.3129 9.3538 9.3538 9.8503 9.8503 9.8779 9.8779 12.0180 12.0180 k = 0.2857 0.5000-0.0000 ( 5518 PWs) bands (ev): -23.7341 -23.7341 -23.7341 -23.7341 -7.5118 -7.5118 -7.5016 -7.5016 -7.2869 -7.2869 -7.2221 -7.2221 -7.2054 -7.2054 -7.1505 -7.1505 -5.5010 -5.5010 -5.4992 -5.4992 1.9642 1.9642 1.9985 1.9985 2.4752 2.4752 2.5306 2.5306 2.6317 2.6317 2.6935 2.6935 2.9835 2.9835 3.0829 3.0829 3.2938 3.2938 3.3479 3.3479 3.8051 3.8051 3.8309 3.8309 4.8873 4.8873 4.9179 4.9179 5.2680 5.2680 5.2984 5.2984 9.3084 9.3084 9.3458 9.3458 9.8321 9.8321 9.8573 9.8573 12.0907 12.0907 k = 0.3000 0.5000-0.0000 ( 5526 PWs) bands (ev): -23.7340 -23.7340 -23.7340 -23.7340 -7.5099 -7.5099 -7.4998 -7.4998 -7.2860 -7.2860 -7.2198 -7.2198 -7.2079 -7.2079 -7.1516 -7.1516 -5.5039 -5.5039 -5.5022 -5.5022 1.9516 1.9516 1.9838 1.9838 2.4789 2.4789 2.5396 2.5396 2.6327 2.6327 2.6986 2.6986 2.9793 2.9793 3.0757 3.0757 3.3079 3.3079 3.3642 3.3642 3.8450 3.8450 3.8775 3.8775 4.8525 4.8525 4.8828 4.8828 5.2275 5.2275 5.2606 5.2606 9.3019 9.3019 9.3355 9.3355 9.8167 9.8167 9.8396 9.8396 12.1576 12.1576 k = 0.3143 0.5000-0.0000 ( 5526 PWs) bands (ev): -23.7339 -23.7339 -23.7339 -23.7339 -7.5081 -7.5081 -7.4982 -7.4982 -7.2848 -7.2848 -7.2181 -7.2181 -7.2098 -7.2098 -7.1527 -7.1527 -5.5067 -5.5067 -5.5050 -5.5050 1.9399 1.9399 1.9698 1.9698 2.4832 2.4832 2.5474 2.5474 2.6353 2.6353 2.7032 2.7032 2.9743 2.9743 3.0676 3.0676 3.3223 3.3223 3.3801 3.3801 3.8862 3.8862 3.9251 3.9251 4.8188 4.8188 4.8490 4.8490 5.1863 5.1863 5.2217 5.2217 9.2941 9.2941 9.3239 9.3239 9.8035 9.8035 9.8240 9.8240 12.2171 12.2171 k = 0.3286 0.5000-0.0000 ( 5530 PWs) bands (ev): -23.7338 -23.7338 -23.7338 -23.7338 -7.5063 -7.5063 -7.4968 -7.4968 -7.2833 -7.2833 -7.2178 -7.2178 -7.2102 -7.2102 -7.1539 -7.1539 -5.5094 -5.5094 -5.5078 -5.5078 1.9289 1.9289 1.9566 1.9566 2.4879 2.4879 2.5540 2.5540 2.6393 2.6393 2.7072 2.7072 2.9688 2.9688 3.0590 3.0590 3.3369 3.3369 3.3952 3.3952 3.9287 3.9287 3.9735 3.9735 4.7865 4.7865 4.8168 4.8168 5.1443 5.1443 5.1817 5.1817 9.2854 9.2854 9.3116 9.3116 9.7919 9.7919 9.8101 9.8101 12.2684 12.2684 k = 0.3429 0.5000-0.0000 ( 5530 PWs) bands (ev): -23.7337 -23.7337 -23.7337 -23.7337 -7.5047 -7.5047 -7.4956 -7.4956 -7.2816 -7.2816 -7.2193 -7.2193 -7.2086 -7.2086 -7.1553 -7.1553 -5.5120 -5.5120 -5.5105 -5.5105 1.9187 1.9187 1.9442 1.9442 2.4932 2.4932 2.5595 2.5595 2.6442 2.6442 2.7104 2.7104 2.9634 2.9634 3.0501 3.0501 3.3513 3.3513 3.4092 3.4092 3.9722 3.9722 4.0225 4.0225 4.7556 4.7556 4.7864 4.7864 5.1016 5.1016 5.1406 5.1406 9.2766 9.2766 9.2994 9.2994 9.7812 9.7812 9.7973 9.7973 12.3108 12.3108 k = 0.3571 0.5000-0.0000 ( 5526 PWs) bands (ev): -23.7336 -23.7336 -23.7336 -23.7336 -7.5032 -7.5032 -7.4947 -7.4947 -7.2796 -7.2796 -7.2217 -7.2217 -7.2062 -7.2062 -7.1567 -7.1567 -5.5144 -5.5144 -5.5130 -5.5130 1.9094 1.9094 1.9327 1.9327 2.4989 2.4989 2.5642 2.5642 2.6496 2.6496 2.7128 2.7128 2.9583 2.9583 3.0411 3.0411 3.3655 3.3655 3.4221 3.4221 4.0166 4.0166 4.0720 4.0720 4.7264 4.7264 4.7581 4.7581 5.0582 5.0582 5.0983 5.0983 9.2681 9.2681 9.2878 9.2878 9.7712 9.7712 9.7854 9.7854 12.3450 12.3450 k = 0.3714 0.5000-0.0000 ( 5524 PWs) bands (ev): -23.7335 -23.7335 -23.7335 -23.7335 -7.5018 -7.5018 -7.4939 -7.4939 -7.2774 -7.2774 -7.2244 -7.2244 -7.2035 -7.2035 -7.1583 -7.1583 -5.5167 -5.5167 -5.5154 -5.5154 1.9010 1.9010 1.9220 1.9220 2.5051 2.5051 2.5682 2.5682 2.6550 2.6550 2.7143 2.7143 2.9539 2.9539 3.0322 3.0322 3.3791 3.3791 3.4335 3.4335 4.0618 4.0618 4.1220 4.1220 4.6990 4.6990 4.7321 4.7321 5.0144 5.0144 5.0551 5.0551 9.2603 9.2603 9.2771 9.2771 9.7617 9.7617 9.7741 9.7741 12.3717 12.3717 k = 0.3857 0.5000-0.0000 ( 5516 PWs) bands (ev): -23.7334 -23.7334 -23.7334 -23.7334 -7.5005 -7.5005 -7.4932 -7.4932 -7.2750 -7.2750 -7.2272 -7.2272 -7.2007 -7.2007 -7.1600 -7.1600 -5.5188 -5.5188 -5.5176 -5.5176 1.8936 1.8936 1.9123 1.9123 2.5116 2.5116 2.5716 2.5716 2.6601 2.6601 2.7148 2.7148 2.9506 2.9506 3.0236 3.0236 3.3922 3.3922 3.4435 3.4435 4.1076 4.1076 4.1721 4.1721 4.6736 4.6736 4.7087 4.7087 4.9703 4.9703 5.0108 5.0108 9.2533 9.2533 9.2676 9.2676 9.7526 9.7526 9.7634 9.7634 12.3925 12.3925 k = 0.4000 0.5000-0.0000 ( 5512 PWs) bands (ev): -23.7333 -23.7333 -23.7333 -23.7333 -7.4993 -7.4993 -7.4928 -7.4928 -7.2724 -7.2724 -7.2300 -7.2300 -7.1978 -7.1978 -7.1618 -7.1618 -5.5207 -5.5207 -5.5197 -5.5197 1.8871 1.8871 1.9035 1.9035 2.5185 2.5185 2.5744 2.5744 2.6646 2.6646 2.7142 2.7142 2.9484 2.9484 3.0152 3.0152 3.4046 3.4046 3.4518 3.4518 4.1536 4.1536 4.2221 4.2221 4.6502 4.6502 4.6881 4.6881 4.9262 4.9262 4.9657 4.9657 9.2473 9.2473 9.2593 9.2593 9.7440 9.7440 9.7533 9.7533 12.4084 12.4084 k = 0.4143 0.5000-0.0000 ( 5510 PWs) bands (ev): -23.7332 -23.7332 -23.7332 -23.7332 -7.4982 -7.4982 -7.4925 -7.4925 -7.2696 -7.2696 -7.2330 -7.2330 -7.1949 -7.1949 -7.1638 -7.1638 -5.5224 -5.5224 -5.5215 -5.5215 1.8816 1.8816 1.8957 1.8957 2.5257 2.5257 2.5765 2.5765 2.6686 2.6686 2.7126 2.7126 2.9475 2.9475 3.0071 3.0071 3.4162 3.4162 3.4585 3.4585 4.1998 4.1998 4.2718 4.2718 4.6288 4.6288 4.6704 4.6704 4.8826 4.8826 4.9200 4.9200 9.2424 9.2424 9.2523 9.2523 9.7360 9.7360 9.7439 9.7439 12.4208 12.4208 k = 0.4286 0.5000-0.0000 ( 5520 PWs) bands (ev): -23.7332 -23.7332 -23.7332 -23.7332 -7.4972 -7.4972 -7.4924 -7.4924 -7.2668 -7.2668 -7.2360 -7.2360 -7.1920 -7.1920 -7.1659 -7.1659 -5.5238 -5.5238 -5.5230 -5.5230 1.8770 1.8770 1.8888 1.8888 2.5329 2.5329 2.5778 2.5778 2.6721 2.6721 2.7102 2.7102 2.9479 2.9479 2.9994 2.9994 3.4268 3.4268 3.4635 3.4635 4.2455 4.2455 4.3204 4.3204 4.6096 4.6096 4.6558 4.6558 4.8400 4.8400 4.8740 4.8740 9.2386 9.2386 9.2466 9.2466 9.7287 9.7287 9.7353 9.7353 12.4303 12.4303 k = 0.4429 0.5000-0.0000 ( 5508 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4963 -7.4963 -7.4924 -7.4924 -7.2638 -7.2638 -7.2390 -7.2390 -7.1890 -7.1890 -7.1680 -7.1680 -5.5250 -5.5250 -5.5244 -5.5244 1.8735 1.8735 1.8830 1.8830 2.5403 2.5403 2.5780 2.5780 2.6753 2.6753 2.7070 2.7070 2.9496 2.9496 2.9920 2.9920 3.4365 3.4365 3.4668 3.4668 4.2904 4.2904 4.3669 4.3669 4.5928 4.5928 4.6444 4.6444 4.7994 4.7994 4.8282 4.8282 9.2358 9.2358 9.2420 9.2420 9.7225 9.7225 9.7278 9.7278 12.4378 12.4378 k = 0.4571 0.5000-0.0000 ( 5508 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4955 -7.4955 -7.4926 -7.4926 -7.2607 -7.2607 -7.2420 -7.2420 -7.1861 -7.1861 -7.1703 -7.1703 -5.5259 -5.5259 -5.5254 -5.5254 1.8711 1.8711 1.8782 1.8782 2.5476 2.5476 2.5771 2.5771 2.6786 2.6786 2.7032 2.7032 2.9525 2.9525 2.9850 2.9850 3.4451 3.4451 3.4683 3.4683 4.3337 4.3337 4.4086 4.4086 4.5796 4.5796 4.6360 4.6360 4.7624 4.7624 4.7836 4.7836 9.2338 9.2338 9.2384 9.2384 9.7176 9.7176 9.7215 9.7215 12.4434 12.4434 k = 0.4714 0.5000-0.0000 ( 5496 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4948 -7.4948 -7.4928 -7.4928 -7.2576 -7.2576 -7.2451 -7.2451 -7.1833 -7.1833 -7.1727 -7.1727 -5.5265 -5.5265 -5.5262 -5.5262 1.8696 1.8696 1.8744 1.8744 2.5545 2.5545 2.5749 2.5749 2.6822 2.6822 2.6990 2.6990 2.9564 2.9564 2.9784 2.9784 3.4525 3.4525 3.4683 3.4683 4.3740 4.3740 4.4395 4.4395 4.5741 4.5741 4.6295 4.6295 4.7309 4.7309 4.7427 4.7427 9.2328 9.2328 9.2358 9.2358 9.7141 9.7141 9.7167 9.7167 12.4476 12.4476 k = 0.4857 0.5000-0.0000 ( 5472 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4941 -7.4941 -7.4931 -7.4931 -7.2545 -7.2545 -7.2482 -7.2482 -7.1805 -7.1805 -7.1752 -7.1752 -5.5269 -5.5269 -5.5267 -5.5267 1.8693 1.8693 1.8717 1.8717 2.5610 2.5610 2.5714 2.5714 2.6860 2.6860 2.6946 2.6946 2.9611 2.9611 2.9722 2.9722 3.4587 3.4587 3.4667 3.4667 4.4096 4.4096 4.4496 4.4496 4.5832 4.5832 4.6209 4.6209 4.7082 4.7082 4.7114 4.7114 9.2325 9.2325 9.2340 9.2340 9.7121 9.7121 9.7135 9.7135 12.4504 12.4504 k = 0.5000 0.5000-0.0000 ( 5476 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4936 -7.4936 -7.4936 -7.4936 -7.2514 -7.2514 -7.2514 -7.2514 -7.1778 -7.1778 -7.1778 -7.1778 -5.5269 -5.5269 -5.5269 -5.5269 1.8699 1.8699 1.8699 1.8699 2.5667 2.5667 2.5667 2.5667 2.6902 2.6902 2.6902 2.6902 2.9664 2.9664 2.9664 2.9664 3.4634 3.4634 3.4634 3.4634 4.4370 4.4370 4.4370 4.4370 4.6038 4.6038 4.6038 4.6038 4.6994 4.6994 4.6994 4.6994 9.2328 9.2328 9.2328 9.2328 9.7119 9.7119 9.7119 9.7119 12.4520 12.4520 k = 0.5000 0.5000-0.0000 ( 5476 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4936 -7.4936 -7.4936 -7.4936 -7.2514 -7.2514 -7.2514 -7.2514 -7.1778 -7.1778 -7.1778 -7.1778 -5.5269 -5.5269 -5.5269 -5.5269 1.8699 1.8699 1.8699 1.8699 2.5667 2.5667 2.5667 2.5667 2.6902 2.6902 2.6902 2.6902 2.9664 2.9664 2.9664 2.9664 3.4634 3.4634 3.4634 3.4634 4.4370 4.4370 4.4370 4.4370 4.6038 4.6038 4.6038 4.6038 4.6994 4.6994 4.6994 4.6994 9.2328 9.2328 9.2328 9.2328 9.7119 9.7119 9.7119 9.7119 12.4520 12.4520 k = 0.4900 0.4900-0.0000 ( 5478 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4941 -7.4941 -7.4932 -7.4932 -7.2545 -7.2545 -7.2483 -7.2483 -7.1805 -7.1805 -7.1752 -7.1752 -5.5270 -5.5270 -5.5266 -5.5266 1.8690 1.8690 1.8719 1.8719 2.5610 2.5610 2.5714 2.5714 2.6861 2.6861 2.6945 2.6945 2.9611 2.9611 2.9721 2.9721 3.4587 3.4587 3.4667 3.4667 4.4095 4.4095 4.4501 4.4501 4.5829 4.5829 4.6223 4.6223 4.7004 4.7004 4.7177 4.7177 9.2324 9.2324 9.2340 9.2340 9.7105 9.7105 9.7150 9.7150 12.4496 12.4496 k = 0.4800 0.4800-0.0000 ( 5501 PWs) bands (ev): -23.7331 -23.7331 -23.7330 -23.7330 -7.4948 -7.4948 -7.4928 -7.4928 -7.2576 -7.2576 -7.2452 -7.2452 -7.1832 -7.1832 -7.1728 -7.1728 -5.5271 -5.5271 -5.5257 -5.5257 1.8681 1.8681 1.8759 1.8759 2.5542 2.5542 2.5752 2.5752 2.6821 2.6821 2.6989 2.6989 2.9563 2.9563 2.9784 2.9784 3.4521 3.4521 3.4689 3.4689 4.3716 4.3716 4.4437 4.4437 4.5733 4.5733 4.6389 4.6389 4.7038 4.7038 4.7593 4.7593 9.2323 9.2323 9.2363 9.2363 9.7066 9.7066 9.7240 9.7240 12.4432 12.4432 k = 0.4700 0.4700-0.0000 ( 5507 PWs) bands (ev): -23.7332 -23.7332 -23.7330 -23.7330 -7.4955 -7.4955 -7.4926 -7.4926 -7.2606 -7.2606 -7.2422 -7.2422 -7.1861 -7.1861 -7.1704 -7.1704 -5.5272 -5.5272 -5.5242 -5.5242 1.8666 1.8666 1.8825 1.8825 2.5464 2.5464 2.5784 2.5784 2.6785 2.6785 2.7032 2.7032 2.9520 2.9520 2.9854 2.9854 3.4437 3.4437 3.4704 3.4704 4.3251 4.3251 4.4212 4.4212 4.5795 4.5795 4.6563 4.6563 4.7116 4.7116 4.8095 4.8095 9.2325 9.2325 9.2398 9.2398 9.7000 9.7000 9.7387 9.7387 12.4324 12.4324 k = 0.4600 0.4600-0.0000 ( 5517 PWs) bands (ev): -23.7333 -23.7333 -23.7330 -23.7330 -7.4962 -7.4962 -7.4925 -7.4925 -7.2636 -7.2636 -7.2392 -7.2392 -7.1889 -7.1889 -7.1681 -7.1681 -5.5275 -5.5275 -5.5221 -5.5221 1.8648 1.8648 1.8916 1.8916 2.5375 2.5375 2.5811 2.5811 2.6749 2.6749 2.7072 2.7072 2.9483 2.9483 2.9929 2.9929 3.4334 3.4334 3.4715 3.4715 4.2722 4.2722 4.3925 4.3925 4.5953 4.5953 4.6714 4.6714 4.7269 4.7269 4.8624 4.8624 9.2333 9.2333 9.2448 9.2448 9.6906 9.6906 9.7591 9.7591 12.4172 12.4172 k = 0.4500 0.4500-0.0000 ( 5523 PWs) bands (ev): -23.7335 -23.7335 -23.7329 -23.7329 -7.4970 -7.4970 -7.4925 -7.4925 -7.2666 -7.2666 -7.2363 -7.2363 -7.1918 -7.1918 -7.1659 -7.1659 -5.5278 -5.5278 -5.5194 -5.5194 1.8624 1.8624 1.9032 1.9032 2.5277 2.5277 2.5832 2.5832 2.6716 2.6716 2.7105 2.7105 2.9452 2.9452 3.0012 3.0012 3.4215 3.4215 3.4724 3.4724 4.2149 4.2149 4.3626 4.3626 4.6163 4.6163 4.6819 4.6819 4.7512 4.7512 4.9158 4.9158 9.2351 9.2351 9.2511 9.2511 9.6783 9.6783 9.7847 9.7847 12.3972 12.3972 k = 0.4400 0.4400-0.0000 ( 5519 PWs) bands (ev): -23.7337 -23.7337 -23.7328 -23.7328 -7.4977 -7.4977 -7.4926 -7.4926 -7.2694 -7.2694 -7.2335 -7.2335 -7.1947 -7.1947 -7.1637 -7.1637 -5.5283 -5.5283 -5.5163 -5.5163 1.8597 1.8597 1.9172 1.9172 2.5170 2.5170 2.5847 2.5847 2.6684 2.6684 2.7129 2.7129 2.9427 2.9427 3.0102 3.0102 3.4082 3.4082 3.4732 3.4732 4.1552 4.1552 4.3332 4.3332 4.6403 4.6403 4.6901 4.6901 4.7820 4.7820 4.9683 4.9683 9.2382 9.2382 9.2589 9.2589 9.6628 9.6628 9.8152 9.8152 12.3724 12.3724 k = 0.4300 0.4300-0.0000 ( 5519 PWs) bands (ev): -23.7339 -23.7339 -23.7328 -23.7328 -7.4985 -7.4985 -7.4928 -7.4928 -7.2721 -7.2721 -7.2308 -7.2308 -7.1976 -7.1976 -7.1617 -7.1617 -5.5290 -5.5290 -5.5128 -5.5128 1.8567 1.8567 1.9337 1.9337 2.5056 2.5056 2.5852 2.5852 2.6654 2.6654 2.7141 2.7141 2.9410 2.9410 3.0199 3.0199 3.3941 3.3941 3.4739 3.4739 4.0942 4.0942 4.3048 4.3048 4.6642 4.6642 4.7004 4.7004 4.8167 4.8167 5.0193 5.0193 9.2432 9.2432 9.2682 9.2682 9.6442 9.6442 9.8501 9.8501 12.3425 12.3425 k = 0.4200 0.4200-0.0000 ( 5523 PWs) bands (ev): -23.7341 -23.7341 -23.7327 -23.7327 -7.4992 -7.4992 -7.4931 -7.4931 -7.2746 -7.2746 -7.2283 -7.2283 -7.2004 -7.2004 -7.1597 -7.1597 -5.5298 -5.5298 -5.5088 -5.5088 1.8534 1.8534 1.9525 1.9525 2.4936 2.4936 2.5847 2.5847 2.6628 2.6628 2.7139 2.7139 2.9402 2.9402 3.0303 3.0303 3.3794 3.3794 3.4746 3.4746 4.0329 4.0329 4.2775 4.2775 4.6811 4.6811 4.7201 4.7201 4.8540 4.8540 5.0684 5.0684 9.2504 9.2504 9.2790 9.2790 9.6224 9.6224 9.8888 9.8888 12.3072 12.3072 k = 0.4100 0.4100-0.0000 ( 5507 PWs) bands (ev): -23.7344 -23.7344 -23.7325 -23.7325 -7.4999 -7.4999 -7.4936 -7.4936 -7.2771 -7.2771 -7.2258 -7.2258 -7.2032 -7.2032 -7.1578 -7.1578 -5.5309 -5.5309 -5.5046 -5.5046 1.8500 1.8500 1.9736 1.9736 2.4811 2.4811 2.5826 2.5826 2.6608 2.6608 2.7122 2.7122 2.9402 2.9402 3.0414 3.0414 3.3646 3.3646 3.4754 3.4754 3.9721 3.9721 4.2517 4.2517 4.6901 4.6901 4.7504 4.7504 4.8930 4.8930 5.1152 5.1152 9.2603 9.2603 9.2914 9.2914 9.5974 9.5974 9.9307 9.9307 12.2663 12.2663 k = 0.4000 0.4000-0.0000 ( 5507 PWs) bands (ev): -23.7347 -23.7347 -23.7324 -23.7324 -7.5006 -7.5006 -7.4942 -7.4942 -7.2793 -7.2793 -7.2236 -7.2236 -7.2058 -7.2058 -7.1560 -7.1560 -5.5322 -5.5322 -5.5001 -5.5001 1.8465 1.8465 1.9967 1.9967 2.4682 2.4682 2.5788 2.5788 2.6596 2.6596 2.7088 2.7088 2.9411 2.9411 3.0529 3.0529 3.3500 3.3500 3.4762 3.4762 3.9124 3.9124 4.2275 4.2275 4.6960 4.6960 4.7862 4.7862 4.9334 4.9334 5.1595 5.1595 9.2730 9.2730 9.3054 9.3054 9.5694 9.5694 9.9751 9.9751 12.2196 12.2196 k = 0.3900 0.3900-0.0000 ( 5517 PWs) bands (ev): -23.7350 -23.7350 -23.7323 -23.7323 -7.5011 -7.5011 -7.4948 -7.4948 -7.2814 -7.2814 -7.2215 -7.2215 -7.2084 -7.2084 -7.1543 -7.1543 -5.5338 -5.5338 -5.4955 -5.4955 1.8430 1.8430 2.0217 2.0217 2.4549 2.4549 2.5730 2.5730 2.6591 2.6591 2.7036 2.7036 2.9429 2.9429 3.0647 3.0647 3.3359 3.3359 3.4771 3.4771 3.8544 3.8544 4.2052 4.2052 4.7011 4.7011 4.8251 4.8251 4.9748 4.9748 5.2011 5.2011 9.2885 9.2885 9.3213 9.3213 9.5389 9.5389 10.0211 10.0211 12.1670 12.1670 k = 0.3800 0.3800-0.0000 ( 5523 PWs) bands (ev): -23.7354 -23.7354 -23.7322 -23.7322 -7.5016 -7.5016 -7.4956 -7.4956 -7.2833 -7.2833 -7.2196 -7.2196 -7.2107 -7.2107 -7.1526 -7.1526 -5.5358 -5.5358 -5.4908 -5.4908 1.8396 1.8396 2.0483 2.0483 2.4414 2.4414 2.5654 2.5654 2.6594 2.6594 2.6964 2.6964 2.9456 2.9456 3.0765 3.0765 3.3223 3.3223 3.4779 3.4779 3.7989 3.7989 4.1851 4.1851 4.7060 4.7060 4.8663 4.8663 5.0172 5.0172 5.2398 5.2398 9.3059 9.3059 9.3392 9.3392 9.5070 9.5070 10.0680 10.0680 12.1083 12.1083 k = 0.3700 0.3700-0.0000 ( 5523 PWs) bands (ev): -23.7358 -23.7358 -23.7320 -23.7320 -7.5020 -7.5020 -7.4963 -7.4963 -7.2850 -7.2850 -7.2182 -7.2182 -7.2126 -7.2126 -7.1510 -7.1510 -5.5382 -5.5382 -5.4860 -5.4860 1.8365 1.8365 2.0764 2.0764 2.4278 2.4278 2.5560 2.5560 2.6601 2.6601 2.6874 2.6874 2.9493 2.9493 3.0882 3.0882 3.3094 3.3094 3.4786 3.4786 3.7470 3.7470 4.1674 4.1674 4.7110 4.7110 4.9092 4.9092 5.0602 5.0602 5.2757 5.2757 9.3230 9.3230 9.3589 9.3589 9.4764 9.4764 10.1149 10.1149 12.0436 12.0436 k = 0.3600 0.3600-0.0000 ( 5523 PWs) bands (ev): -23.7362 -23.7362 -23.7319 -23.7319 -7.5023 -7.5023 -7.4970 -7.4970 -7.2864 -7.2864 -7.2178 -7.2178 -7.2135 -7.2135 -7.1495 -7.1495 -5.5411 -5.5411 -5.4813 -5.4813 1.8336 1.8336 2.1054 2.1054 2.4141 2.4141 2.5454 2.5454 2.6610 2.6610 2.6765 2.6765 2.9537 2.9537 3.0993 3.0993 3.2971 3.2971 3.4788 3.4788 3.6997 3.6997 4.1524 4.1524 4.7161 4.7161 4.9536 4.9536 5.1037 5.1037 5.3087 5.3087 9.3331 9.3331 9.3788 9.3788 9.4561 9.4561 10.1609 10.1609 11.9730 11.9730 k = 0.3500 0.3500-0.0000 ( 5515 PWs) bands (ev): -23.7366 -23.7366 -23.7317 -23.7317 -7.5027 -7.5027 -7.4975 -7.4975 -7.2876 -7.2876 -7.2190 -7.2190 -7.2127 -7.2127 -7.1480 -7.1480 -5.5444 -5.5444 -5.4768 -5.4768 1.8312 1.8312 2.1349 2.1349 2.4007 2.4007 2.5338 2.5338 2.6608 2.6608 2.6648 2.6648 2.9590 2.9590 3.1092 3.1092 3.2851 3.2851 3.4781 3.4781 3.6588 3.6588 4.1403 4.1403 4.7214 4.7214 4.9992 4.9992 5.1476 5.1476 5.3390 5.3390 9.3224 9.3224 9.3971 9.3971 9.4619 9.4619 10.2052 10.2052 11.8967 11.8967 k = 0.3400 0.3400-0.0000 ( 5523 PWs) bands (ev): -23.7371 -23.7371 -23.7315 -23.7315 -7.5032 -7.5032 -7.4978 -7.4978 -7.2885 -7.2885 -7.2207 -7.2207 -7.2115 -7.2115 -7.1466 -7.1466 -5.5482 -5.5482 -5.4724 -5.4724 1.8291 1.8291 2.1639 2.1639 2.3877 2.3877 2.5218 2.5218 2.6486 2.6486 2.6630 2.6630 2.9648 2.9648 3.1173 3.1173 3.2735 3.2735 3.4760 3.4760 3.6258 3.6258 4.1314 4.1314 4.7270 4.7270 5.0459 5.0459 5.1916 5.1916 5.3665 5.3665 9.2892 9.2892 9.4176 9.4176 9.4919 9.4919 10.2470 10.2470 11.8150 11.8150 k = 0.3300 0.3300-0.0000 ( 5527 PWs) bands (ev): -23.7376 -23.7376 -23.7314 -23.7314 -7.5039 -7.5039 -7.4976 -7.4976 -7.2892 -7.2892 -7.2224 -7.2224 -7.2101 -7.2101 -7.1452 -7.1452 -5.5526 -5.5526 -5.4684 -5.4684 1.8277 1.8277 2.1911 2.1911 2.3756 2.3756 2.5102 2.5102 2.6324 2.6324 2.6628 2.6628 2.9710 2.9710 3.1226 3.1226 3.2624 3.2624 3.4722 3.4722 3.6024 3.6024 4.1258 4.1258 4.7328 4.7328 5.0933 5.0933 5.2356 5.2356 5.3916 5.3916 9.2444 9.2444 9.4411 9.4411 9.5344 9.5344 10.2857 10.2857 11.7283 11.7283 k = 0.3200 0.3200-0.0000 ( 5523 PWs) bands (ev): -23.7380 -23.7380 -23.7312 -23.7312 -7.5048 -7.5048 -7.4970 -7.4970 -7.2897 -7.2897 -7.2241 -7.2241 -7.2087 -7.2087 -7.1439 -7.1439 -5.5576 -5.5576 -5.4646 -5.4646 1.8269 1.8269 2.2146 2.2146 2.3653 2.3653 2.5002 2.5002 2.6147 2.6147 2.6620 2.6620 2.9771 2.9771 3.1242 3.1242 3.2530 3.2530 3.4672 3.4672 3.5888 3.5888 4.1237 4.1237 4.7389 4.7389 5.1413 5.1413 5.2796 5.2796 5.4144 5.4144 9.1935 9.1935 9.4670 9.4670 9.5849 9.5849 10.3208 10.3208 11.6369 11.6369 k = 0.3100 0.3100-0.0000 ( 5531 PWs) bands (ev): -23.7385 -23.7385 -23.7310 -23.7310 -7.5058 -7.5058 -7.4960 -7.4960 -7.2898 -7.2898 -7.2257 -7.2257 -7.2073 -7.2073 -7.1427 -7.1427 -5.5631 -5.5631 -5.4612 -5.4612 1.8266 1.8266 2.2315 2.2315 2.3574 2.3574 2.4936 2.4936 2.5957 2.5957 2.6600 2.6600 2.9821 2.9821 3.1214 3.1214 3.2466 3.2466 3.4624 3.4624 3.5837 3.5837 4.1253 4.1253 4.7453 4.7453 5.1897 5.1897 5.3232 5.3232 5.4352 5.4352 9.1386 9.1386 9.4950 9.4950 9.6415 9.6415 10.3521 10.3521 11.5415 11.5415 k = 0.3000 0.3000-0.0000 ( 5533 PWs) bands (ev): -23.7391 -23.7391 -23.7308 -23.7308 -7.5069 -7.5069 -7.4946 -7.4946 -7.2897 -7.2897 -7.2273 -7.2273 -7.2059 -7.2059 -7.1416 -7.1416 -5.5694 -5.5694 -5.4583 -5.4583 1.8272 1.8272 2.2395 2.2395 2.3515 2.3515 2.4929 2.4929 2.5756 2.5756 2.6567 2.6567 2.9848 2.9848 3.1157 3.1157 3.2443 3.2443 3.4595 3.4595 3.5850 3.5850 4.1305 4.1305 4.7519 4.7519 5.2383 5.2383 5.3665 5.3665 5.4543 5.4543 9.0804 9.0804 9.5249 9.5249 9.7034 9.7034 10.3794 10.3794 11.4424 11.4424 k = 0.2900 0.2900-0.0000 ( 5535 PWs) bands (ev): -23.7396 -23.7396 -23.7306 -23.7306 -7.5079 -7.5079 -7.4929 -7.4929 -7.2893 -7.2893 -7.2287 -7.2287 -7.2045 -7.2045 -7.1406 -7.1406 -5.5763 -5.5763 -5.4558 -5.4558 1.8284 1.8284 2.2383 2.2383 2.3452 2.3452 2.5002 2.5002 2.5550 2.5550 2.6517 2.6517 2.9832 2.9832 3.1107 3.1107 3.2457 3.2457 3.4592 3.4592 3.5909 3.5909 4.1394 4.1394 4.7589 4.7589 5.2869 5.2869 5.4094 5.4094 5.4721 5.4721 9.0195 9.0195 9.5566 9.5566 9.7703 9.7703 10.4031 10.4031 11.3404 11.3404 k = 0.2800 0.2800-0.0000 ( 5535 PWs) bands (ev): -23.7401 -23.7401 -23.7304 -23.7304 -7.5089 -7.5089 -7.4910 -7.4910 -7.2886 -7.2886 -7.2301 -7.2301 -7.2031 -7.2031 -7.1397 -7.1397 -5.5838 -5.5838 -5.4538 -5.4538 1.8304 1.8304 2.2301 2.2301 2.3359 2.3359 2.5135 2.5135 2.5361 2.5361 2.6446 2.6446 2.9759 2.9759 3.1103 3.1103 3.2500 3.2500 3.4618 3.4618 3.6002 3.6002 4.1519 4.1519 4.7660 4.7660 5.3350 5.3350 5.4517 5.4517 5.4892 5.4892 8.9562 8.9562 9.5903 9.5903 9.8415 9.8415 10.4234 10.4234 11.2358 11.2358 k = 0.2700 0.2700-0.0000 ( 5519 PWs) bands (ev): -23.7407 -23.7407 -23.7302 -23.7302 -7.5098 -7.5098 -7.4887 -7.4887 -7.2876 -7.2876 -7.2314 -7.2314 -7.2016 -7.2016 -7.1388 -7.1388 -5.5920 -5.5920 -5.4523 -5.4523 1.8332 1.8332 2.2174 2.2174 2.3228 2.3228 2.5066 2.5066 2.5433 2.5433 2.6353 2.6353 2.9640 2.9640 3.1159 3.1159 3.2565 3.2565 3.4669 3.4669 3.6119 3.6119 4.1680 4.1680 4.7735 4.7735 5.3822 5.3822 5.4931 5.4931 5.5064 5.5064 8.8905 8.8905 9.6260 9.6260 9.9167 9.9167 10.4408 10.4408 11.1294 11.1294 k = 0.2600 0.2600-0.0000 ( 5519 PWs) bands (ev): -23.7412 -23.7412 -23.7300 -23.7300 -7.5106 -7.5106 -7.4862 -7.4862 -7.2864 -7.2864 -7.2327 -7.2327 -7.2000 -7.2000 -7.1381 -7.1381 -5.6009 -5.6009 -5.4514 -5.4514 1.8367 1.8367 2.2018 2.2018 2.3068 2.3068 2.4851 2.4851 2.5682 2.5682 2.6232 2.6232 2.9501 2.9501 3.1268 3.1268 3.2644 3.2644 3.4742 3.4742 3.6255 3.6255 4.1874 4.1874 4.7813 4.7813 5.4279 5.4279 5.5210 5.5210 5.5369 5.5369 8.8227 8.8227 9.6635 9.6635 9.9953 9.9953 10.4562 10.4562 11.0216 11.0216 k = 0.2500 0.2500-0.0000 ( 5519 PWs) bands (ev): -23.7417 -23.7417 -23.7298 -23.7298 -7.5112 -7.5112 -7.4834 -7.4834 -7.2849 -7.2849 -7.2339 -7.2339 -7.1983 -7.1983 -7.1375 -7.1375 -5.6104 -5.6104 -5.4510 -5.4510 1.8410 1.8410 2.1841 2.1841 2.2886 2.2886 2.4624 2.4624 2.5951 2.5951 2.6084 2.6084 2.9370 2.9370 3.1416 3.1416 3.2739 3.2739 3.4834 3.4834 3.6406 3.6406 4.2100 4.2100 4.7893 4.7893 5.4710 5.4710 5.5392 5.5392 5.5784 5.5784 8.7528 8.7528 9.7031 9.7031 10.0768 10.0768 10.4700 10.4700 10.9131 10.9131 k = 0.2400 0.2400-0.0000 ( 5523 PWs) bands (ev): -23.7423 -23.7423 -23.7296 -23.7296 -7.5117 -7.5117 -7.4804 -7.4804 -7.2831 -7.2831 -7.2351 -7.2351 -7.1965 -7.1965 -7.1370 -7.1370 -5.6205 -5.6205 -5.4511 -5.4511 1.8459 1.8459 2.1651 2.1651 2.2691 2.2691 2.4394 2.4394 2.5900 2.5900 2.6226 2.6226 2.9267 2.9267 3.1587 3.1587 3.2852 3.2852 3.4943 3.4943 3.6568 3.6568 4.2356 4.2356 4.7976 4.7976 5.5095 5.5095 5.5597 5.5597 5.6208 5.6208 8.6811 8.6811 9.7447 9.7447 10.1605 10.1605 10.4828 10.4828 10.8047 10.8047 k = 0.2300 0.2300-0.0000 ( 5523 PWs) bands (ev): -23.7428 -23.7428 -23.7294 -23.7294 -7.5119 -7.5119 -7.4773 -7.4773 -7.2811 -7.2811 -7.2362 -7.2362 -7.1946 -7.1946 -7.1367 -7.1367 -5.6312 -5.6312 -5.4518 -5.4518 1.8514 1.8514 2.1450 2.1450 2.2487 2.2487 2.4164 2.4164 2.5697 2.5697 2.6480 2.6480 2.9202 2.9202 3.1768 3.1768 3.2989 3.2989 3.5068 3.5068 3.6738 3.6738 4.2640 4.2640 4.8062 4.8062 5.5413 5.5413 5.5848 5.5848 5.6641 5.6641 8.6076 8.6076 9.7882 9.7882 10.2457 10.2457 10.4951 10.4951 10.6976 10.6976 k = 0.2200 0.2200-0.0000 ( 5507 PWs) bands (ev): -23.7434 -23.7434 -23.7291 -23.7291 -7.5120 -7.5120 -7.4740 -7.4740 -7.2788 -7.2788 -7.2373 -7.2373 -7.1925 -7.1925 -7.1365 -7.1365 -5.6425 -5.6425 -5.4530 -5.4530 1.8575 1.8575 2.1240 2.1240 2.2279 2.2279 2.3937 2.3937 2.5474 2.5474 2.6710 2.6710 2.9179 2.9179 3.1948 3.1948 3.3156 3.3156 3.5207 3.5207 3.6914 3.6914 4.2948 4.2948 4.8151 4.8151 5.5665 5.5665 5.6143 5.6143 5.7086 5.7086 8.5324 8.5324 9.8337 9.8337 10.3304 10.3304 10.5045 10.5045 10.5965 10.5965 k = 0.2100 0.2100-0.0000 ( 5509 PWs) bands (ev): -23.7439 -23.7439 -23.7289 -23.7289 -7.5119 -7.5119 -7.4707 -7.4707 -7.2763 -7.2763 -7.2383 -7.2383 -7.1903 -7.1903 -7.1364 -7.1364 -5.6542 -5.6542 -5.4547 -5.4547 1.8640 1.8640 2.1023 2.1023 2.2069 2.2069 2.3713 2.3713 2.5237 2.5237 2.6912 2.6912 2.9195 2.9195 3.2113 3.2113 3.3361 3.3361 3.5361 3.5361 3.7093 3.7093 4.3278 4.3278 4.8243 4.8243 5.5885 5.5885 5.6448 5.6448 5.7541 5.7541 8.4557 8.4557 9.8809 9.8809 10.4001 10.4001 10.4847 10.4847 10.5428 10.5428 k = 0.2000 0.2000-0.0000 ( 5519 PWs) bands (ev): -23.7444 -23.7444 -23.7287 -23.7287 -7.5116 -7.5116 -7.4672 -7.4672 -7.2736 -7.2736 -7.2392 -7.2392 -7.1880 -7.1880 -7.1365 -7.1365 -5.6665 -5.6665 -5.4568 -5.4568 1.8708 1.8708 2.0801 2.0801 2.1859 2.1859 2.3495 2.3495 2.4994 2.4994 2.7085 2.7085 2.9245 2.9245 3.2256 3.2256 3.3602 3.3602 3.5530 3.5530 3.7273 3.7273 4.3627 4.3627 4.8337 4.8337 5.6099 5.6099 5.6742 5.6742 5.8004 5.8004 8.3776 8.3776 9.9295 9.9295 10.3528 10.3528 10.5195 10.5195 10.5554 10.5554 k = 0.1900 0.1900-0.0000 ( 5519 PWs) bands (ev): -23.7450 -23.7450 -23.7286 -23.7286 -7.5111 -7.5111 -7.4637 -7.4637 -7.2707 -7.2707 -7.2400 -7.2400 -7.1855 -7.1855 -7.1367 -7.1367 -5.6790 -5.6790 -5.4593 -5.4593 1.8777 1.8777 2.0577 2.0577 2.1652 2.1652 2.3283 2.3283 2.4751 2.4751 2.7232 2.7232 2.9321 2.9321 3.2378 3.2378 3.3876 3.3876 3.5717 3.5717 3.7451 3.7451 4.3991 4.3991 4.8435 4.8435 5.6319 5.6319 5.7019 5.7019 5.8472 5.8472 8.2981 8.2981 9.9778 9.9778 10.2581 10.2581 10.5616 10.5616 10.6126 10.6126 k = 0.1800 0.1800-0.0000 ( 5523 PWs) bands (ev): -23.7455 -23.7455 -23.7284 -23.7284 -7.5104 -7.5104 -7.4602 -7.4602 -7.2676 -7.2676 -7.2408 -7.2408 -7.1830 -7.1830 -7.1370 -7.1370 -5.6919 -5.6919 -5.4622 -5.4622 1.8844 1.8844 2.0355 2.0355 2.1448 2.1448 2.3078 2.3078 2.4512 2.4512 2.7356 2.7356 2.9417 2.9417 3.2479 3.2479 3.4169 3.4169 3.5926 3.5926 3.7627 3.7627 4.4368 4.4368 4.8536 4.8536 5.6548 5.6548 5.7278 5.7278 5.8941 5.8941 8.2176 8.2176 10.0183 10.0183 10.1707 10.1707 10.5837 10.5837 10.6891 10.6891 k = 0.1700 0.1700-0.0000 ( 5521 PWs) bands (ev): -23.7460 -23.7460 -23.7282 -23.7282 -7.5096 -7.5096 -7.4568 -7.4568 -7.2644 -7.2644 -7.2414 -7.2414 -7.1803 -7.1803 -7.1374 -7.1374 -5.7050 -5.7050 -5.4654 -5.4654 1.8903 1.8903 2.0140 2.0140 2.1250 2.1250 2.2882 2.2882 2.4280 2.4280 2.7462 2.7462 2.9524 2.9524 3.2566 3.2566 3.4467 3.4467 3.6159 3.6159 3.7799 3.7799 4.4753 4.4753 4.8640 4.8640 5.6785 5.6785 5.7526 5.7526 5.9408 5.9408 8.1359 8.1359 10.0066 10.0066 10.1387 10.1387 10.6038 10.6038 10.7009 10.7009 k = 0.1600 0.1600-0.0000 ( 5513 PWs) bands (ev): -23.7464 -23.7464 -23.7280 -23.7280 -7.5086 -7.5086 -7.4534 -7.4534 -7.2610 -7.2610 -7.2419 -7.2419 -7.1776 -7.1776 -7.1378 -7.1378 -5.7183 -5.7183 -5.4689 -5.4689 1.8947 1.8947 1.9941 1.9941 2.1058 2.1058 2.2697 2.2697 2.4059 2.4059 2.7555 2.7555 2.9637 2.9637 3.2641 3.2641 3.4756 3.4756 3.6419 3.6419 3.7966 3.7966 4.5143 4.5143 4.8747 4.8747 5.7024 5.7024 5.7771 5.7771 5.9870 5.9870 8.0535 8.0535 9.9288 9.9288 10.1771 10.1771 10.5922 10.5922 10.6576 10.6576 k = 0.1500 0.1500-0.0000 ( 5503 PWs) bands (ev): -23.7469 -23.7469 -23.7279 -23.7279 -7.5075 -7.5075 -7.4500 -7.4500 -7.2577 -7.2577 -7.2422 -7.2422 -7.1749 -7.1749 -7.1382 -7.1382 -5.7315 -5.7315 -5.4726 -5.4726 1.8961 1.8961 1.9774 1.9774 2.0875 2.0875 2.2524 2.2524 2.3850 2.3850 2.7637 2.7637 2.9751 2.9751 3.2708 3.2708 3.5025 3.5025 3.6707 3.6707 3.8130 3.8130 4.5533 4.5533 4.8857 4.8857 5.7255 5.7255 5.8027 5.8027 6.0324 6.0324 7.9703 7.9703 9.8387 9.8387 10.2323 10.2323 10.5160 10.5160 10.6754 10.6754 k = 0.1400 0.1400-0.0000 ( 5517 PWs) bands (ev): -23.7473 -23.7473 -23.7277 -23.7277 -7.5063 -7.5063 -7.4469 -7.4469 -7.2545 -7.2545 -7.2423 -7.2423 -7.1725 -7.1725 -7.1386 -7.1386 -5.7447 -5.7447 -5.4765 -5.4765 1.8922 1.8922 1.9661 1.9661 2.0700 2.0700 2.2363 2.2363 2.3652 2.3652 2.7711 2.7711 2.9862 2.9862 3.2767 3.2767 3.5268 3.5268 3.7016 3.7016 3.8291 3.8291 4.5920 4.5920 4.8971 4.8971 5.7464 5.7464 5.8309 5.8309 6.0767 6.0767 7.8866 7.8866 9.7488 9.7488 10.2904 10.2904 10.4347 10.4347 10.7053 10.7053 k = 0.1300 0.1300-0.0000 ( 5517 PWs) bands (ev): -23.7477 -23.7477 -23.7275 -23.7275 -7.5051 -7.5051 -7.4438 -7.4438 -7.2518 -7.2518 -7.2417 -7.2417 -7.1702 -7.1702 -7.1387 -7.1387 -5.7577 -5.7577 -5.4804 -5.4804 1.8820 1.8820 1.9612 1.9612 2.0536 2.0536 2.2216 2.2216 2.3467 2.3467 2.7779 2.7779 2.9970 2.9970 3.2821 3.2821 3.5484 3.5484 3.7338 3.7338 3.8453 3.8453 4.6298 4.6298 4.9089 4.9089 5.7642 5.7642 5.8630 5.8630 6.1197 6.1197 7.8026 7.8026 9.6615 9.6615 10.3211 10.3211 10.3861 10.3861 10.7381 10.7381 k = 0.1200 0.1200-0.0000 ( 5509 PWs) bands (ev): -23.7481 -23.7481 -23.7274 -23.7274 -7.5037 -7.5037 -7.4409 -7.4409 -7.2497 -7.2497 -7.2404 -7.2404 -7.1684 -7.1684 -7.1385 -7.1385 -5.7704 -5.7704 -5.4844 -5.4844 1.8674 1.8674 1.9610 1.9610 2.0385 2.0385 2.2083 2.2083 2.3294 2.3294 2.7842 2.7842 3.0072 3.0072 3.2871 3.2871 3.5675 3.5675 3.7657 3.7657 3.8621 3.8621 4.6664 4.6664 4.9211 4.9211 5.7787 5.7787 5.8992 5.8992 6.1612 6.1612 7.7185 7.7185 9.5780 9.5780 10.2602 10.2602 10.4352 10.4352 10.7704 10.7704 k = 0.1100 0.1100-0.0000 ( 5511 PWs) bands (ev): -23.7485 -23.7485 -23.7273 -23.7273 -7.5024 -7.5024 -7.4382 -7.4382 -7.2486 -7.2486 -7.2380 -7.2380 -7.1671 -7.1671 -7.1378 -7.1378 -5.7827 -5.7827 -5.4883 -5.4883 1.8507 1.8507 1.9628 1.9628 2.0249 2.0249 2.1967 2.1967 2.3134 2.3134 2.7900 2.7900 3.0167 3.0167 3.2917 3.2917 3.5845 3.5845 3.7951 3.7951 3.8806 3.8806 4.7012 4.7012 4.9337 4.9337 5.7902 5.7902 5.9394 5.9394 6.2010 6.2010 7.6345 7.6345 9.4988 9.4988 10.1883 10.1883 10.5009 10.5009 10.7860 10.7860 k = 0.1000 0.1000-0.0000 ( 5503 PWs) bands (ev): -23.7488 -23.7488 -23.7271 -23.7271 -7.5011 -7.5011 -7.4356 -7.4356 -7.2481 -7.2481 -7.2350 -7.2350 -7.1666 -7.1666 -7.1365 -7.1365 -5.7944 -5.7944 -5.4921 -5.4921 1.8335 1.8335 1.9646 1.9646 2.0134 2.0134 2.1866 2.1866 2.2986 2.2986 2.7953 2.7953 3.0256 3.0256 3.2959 3.2959 3.5994 3.5994 3.8203 3.8203 3.9017 3.9017 4.7339 4.7339 4.9468 4.9468 5.7992 5.7992 5.9831 5.9831 6.2387 6.2387 7.5509 7.5509 9.4245 9.4245 10.1198 10.1198 10.5674 10.5674 10.7466 10.7466 k = 0.0900 0.0900-0.0000 ( 5507 PWs) bands (ev): -23.7491 -23.7491 -23.7270 -23.7270 -7.4999 -7.4999 -7.4332 -7.4332 -7.2479 -7.2479 -7.2317 -7.2317 -7.1668 -7.1668 -7.1347 -7.1347 -5.8055 -5.8055 -5.4958 -5.4958 1.8169 1.8169 1.9649 1.9649 2.0047 2.0047 2.1784 2.1784 2.2849 2.2849 2.8002 2.8002 3.0337 3.0337 3.2997 3.2997 3.6126 3.6126 3.8401 3.8401 3.9258 3.9258 4.7638 4.7638 4.9602 4.9602 5.8062 5.8062 6.0297 6.0297 6.2742 6.2742 7.4680 7.4680 9.3557 9.3557 10.0560 10.0560 10.6196 10.6196 10.7044 10.7044 k = 0.0800 0.0800-0.0000 ( 5503 PWs) bands (ev): -23.7494 -23.7494 -23.7269 -23.7269 -7.4987 -7.4987 -7.4310 -7.4310 -7.2479 -7.2479 -7.2283 -7.2283 -7.1675 -7.1675 -7.1326 -7.1326 -5.8158 -5.8158 -5.4992 -5.4992 1.8012 1.8012 1.9626 1.9626 1.9994 1.9994 2.1718 2.1718 2.2723 2.2723 2.8046 2.8046 3.0411 3.0411 3.3032 3.3032 3.6244 3.6244 3.8551 3.8551 3.9517 3.9517 4.7908 4.7908 4.9738 4.9738 5.8116 5.8116 6.0787 6.0787 6.3074 6.3074 7.3863 7.3863 9.2926 9.2926 9.9977 9.9977 10.6008 10.6008 10.7360 10.7360 k = 0.0700 0.0700-0.0000 ( 5499 PWs) bands (ev): -23.7496 -23.7496 -23.7268 -23.7268 -7.4976 -7.4976 -7.4291 -7.4291 -7.2479 -7.2479 -7.2248 -7.2248 -7.1688 -7.1688 -7.1302 -7.1302 -5.8252 -5.8252 -5.5024 -5.5024 1.7869 1.7869 1.9578 1.9578 1.9973 1.9973 2.1669 2.1669 2.2609 2.2609 2.8086 2.8086 3.0477 3.0477 3.3063 3.3063 3.6345 3.6345 3.8664 3.8664 3.9775 3.9775 4.8144 4.8144 4.9875 4.9875 5.8157 5.8157 6.1292 6.1292 6.3381 6.3381 7.3061 7.3061 9.2358 9.2358 9.9453 9.9453 10.5525 10.5525 10.8022 10.8022 k = 0.0600 0.0600-0.0000 ( 5495 PWs) bands (ev): -23.7498 -23.7498 -23.7268 -23.7268 -7.4966 -7.4966 -7.4273 -7.4273 -7.2479 -7.2479 -7.2215 -7.2215 -7.1704 -7.1704 -7.1278 -7.1278 -5.8336 -5.8336 -5.5052 -5.5052 1.7742 1.7742 1.9519 1.9519 1.9969 1.9969 2.1636 2.1636 2.2505 2.2505 2.8121 2.8121 3.0534 3.0534 3.3091 3.3091 3.6433 3.6433 3.8752 3.8752 4.0018 4.0018 4.8347 4.8347 5.0008 5.0008 5.8188 5.8188 6.1803 6.1803 6.3665 6.3665 7.2282 7.2282 9.1857 9.1857 9.8991 9.8991 10.5060 10.5060 10.8714 10.8714 k = 0.0500 0.0500-0.0000 ( 5495 PWs) bands (ev): -23.7500 -23.7500 -23.7267 -23.7267 -7.4957 -7.4957 -7.4258 -7.4258 -7.2480 -7.2480 -7.2184 -7.2184 -7.1722 -7.1722 -7.1256 -7.1256 -5.8409 -5.8409 -5.5077 -5.5077 1.7632 1.7632 1.9460 1.9460 1.9972 1.9972 2.1618 2.1618 2.2413 2.2413 2.8150 2.8150 3.0583 3.0583 3.3115 3.3115 3.6508 3.6508 3.8820 3.8820 4.0236 4.0236 4.8515 4.8515 5.0134 5.0134 5.8210 5.8210 6.2306 6.2306 6.3927 6.3927 7.1535 7.1535 9.1426 9.1426 9.8595 9.8595 10.4650 10.4650 10.9383 10.9383 k = 0.0400 0.0400-0.0000 ( 5499 PWs) bands (ev): -23.7502 -23.7502 -23.7266 -23.7266 -7.4950 -7.4950 -7.4246 -7.4246 -7.2480 -7.2480 -7.2156 -7.2156 -7.1740 -7.1740 -7.1235 -7.1235 -5.8470 -5.8470 -5.5098 -5.5098 1.7541 1.7541 1.9407 1.9407 1.9975 1.9975 2.1611 2.1611 2.2333 2.2333 2.8175 2.8175 3.0624 3.0624 3.3134 3.3134 3.6569 3.6569 3.8872 3.8872 4.0421 4.0421 4.8649 4.8649 5.0246 5.0246 5.8226 5.8226 6.2776 6.2776 6.4176 6.4176 7.0834 7.0834 9.1068 9.1068 9.8267 9.8267 10.4308 10.4308 10.9995 10.9995 k = 0.0300 0.0300-0.0000 ( 5499 PWs) bands (ev): -23.7503 -23.7503 -23.7266 -23.7266 -7.4945 -7.4945 -7.4236 -7.4236 -7.2481 -7.2481 -7.2131 -7.2131 -7.1758 -7.1758 -7.1219 -7.1219 -5.8518 -5.8518 -5.5115 -5.5115 1.7469 1.7469 1.9365 1.9365 1.9978 1.9978 2.1612 2.1612 2.2266 2.2266 2.8194 2.8194 3.0656 3.0656 3.3148 3.3148 3.6616 3.6616 3.8911 3.8911 4.0569 4.0569 4.8752 4.8752 5.0340 5.0340 5.8237 5.8237 6.3181 6.3181 6.4419 6.4419 7.0203 7.0203 9.0786 9.0786 9.8009 9.8009 10.4038 10.4038 11.0510 11.0510 k = 0.0200 0.0200-0.0000 ( 5485 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4940 -7.4940 -7.4229 -7.4229 -7.2481 -7.2481 -7.2111 -7.2111 -7.1772 -7.1772 -7.1206 -7.1206 -5.8553 -5.8553 -5.5127 -5.5127 1.7417 1.7417 1.9333 1.9333 1.9980 1.9980 2.1617 2.1617 2.2216 2.2216 2.8208 2.8208 3.0679 3.0679 3.3160 3.3160 3.6651 3.6651 3.8938 3.8938 4.0677 4.0677 4.8824 4.8824 5.0411 5.0411 5.8244 5.8244 6.3482 6.3482 6.4656 6.4656 6.9677 6.9677 9.0583 9.0583 9.7823 9.7823 10.3843 10.3843 11.0884 11.0884 k = 0.0100 0.0100-0.0000 ( 5467 PWs) bands (ev): -23.7504 -23.7504 -23.7265 -23.7265 -7.4938 -7.4938 -7.4224 -7.4224 -7.2481 -7.2481 -7.2098 -7.2098 -7.1782 -7.1782 -7.1198 -7.1198 -5.8574 -5.8574 -5.5134 -5.5134 1.7386 1.7386 1.9315 1.9315 1.9981 1.9981 2.1623 2.1623 2.2184 2.2184 2.8217 2.8217 3.0693 3.0693 3.3167 3.3167 3.6672 3.6672 3.8954 3.8954 4.0743 4.0743 4.8867 4.8867 5.0455 5.0455 5.8247 5.8247 6.3660 6.3660 6.4848 6.4848 6.9316 6.9316 9.0461 9.0461 9.7711 9.7711 10.3726 10.3726 11.1100 11.1100 k = 0.0000 0.0000 0.0000 ( 5475 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4937 -7.4937 -7.4223 -7.4223 -7.2481 -7.2481 -7.2093 -7.2093 -7.1785 -7.1785 -7.1195 -7.1195 -5.8581 -5.8581 -5.5137 -5.5137 1.7375 1.7375 1.9308 1.9308 1.9981 1.9981 2.1625 2.1625 2.2173 2.2173 2.8220 2.8220 3.0698 3.0698 3.3168 3.3168 3.6679 3.6679 3.8960 3.8960 4.0765 4.0765 4.8881 4.8881 5.0470 5.0470 5.8248 5.8248 6.3718 6.3718 6.4925 6.4925 6.9184 6.9184 9.0420 9.0420 9.7674 9.7674 10.3686 10.3686 11.1169 11.1169 k = 0.0000 0.0000 0.0000 ( 5475 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4937 -7.4937 -7.4223 -7.4223 -7.2481 -7.2481 -7.2093 -7.2093 -7.1785 -7.1785 -7.1195 -7.1195 -5.8581 -5.8581 -5.5137 -5.5137 1.7375 1.7375 1.9308 1.9308 1.9981 1.9981 2.1625 2.1625 2.2173 2.2173 2.8220 2.8220 3.0698 3.0698 3.3168 3.3168 3.6679 3.6679 3.8960 3.8960 4.0765 4.0765 4.8881 4.8881 5.0470 5.0470 5.8248 5.8248 6.3718 6.3718 6.4925 6.4925 6.9184 6.9184 9.0420 9.0420 9.7674 9.7674 10.3686 10.3686 11.1169 11.1169 k = 0.0000 0.0000 0.0142 ( 5463 PWs) bands (ev): -23.7504 -23.7504 -23.7265 -23.7265 -7.4937 -7.4937 -7.4224 -7.4224 -7.2481 -7.2481 -7.2093 -7.2093 -7.1787 -7.1787 -7.1195 -7.1195 -5.8575 -5.8575 -5.5139 -5.5139 1.7374 1.7374 1.9303 1.9303 1.9982 1.9982 2.1625 2.1625 2.2173 2.2173 2.8219 2.8219 3.0698 3.0698 3.3170 3.3170 3.6679 3.6679 3.8958 3.8958 4.0765 4.0765 4.8880 4.8880 5.0468 5.0468 5.8214 5.8214 6.3712 6.3712 6.4923 6.4923 6.9263 6.9263 9.0429 9.0429 9.7661 9.7661 10.3637 10.3637 11.1198 11.1198 k = 0.0000 0.0000 0.0284 ( 5463 PWs) bands (ev): -23.7504 -23.7504 -23.7265 -23.7265 -7.4936 -7.4936 -7.4228 -7.4228 -7.2479 -7.2479 -7.2094 -7.2094 -7.1791 -7.1791 -7.1195 -7.1195 -5.8555 -5.8555 -5.5148 -5.5148 1.7370 1.7370 1.9288 1.9288 1.9983 1.9983 2.1623 2.1623 2.2173 2.2173 2.8219 2.8219 3.0698 3.0698 3.3171 3.3171 3.6679 3.6679 3.8951 3.8951 4.0764 4.0764 4.8874 4.8874 5.0462 5.0462 5.8114 5.8114 6.3695 6.3695 6.4919 6.4919 6.9493 6.9493 9.0456 9.0456 9.7622 9.7622 10.3492 10.3492 11.1283 11.1283 k = 0.0000 0.0000 0.0425 ( 5475 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4935 -7.4935 -7.4235 -7.4235 -7.2478 -7.2478 -7.2094 -7.2094 -7.1798 -7.1798 -7.1195 -7.1195 -5.8523 -5.8523 -5.5163 -5.5163 1.7363 1.7363 1.9262 1.9262 1.9986 1.9986 2.1619 2.1619 2.2173 2.2173 2.8219 2.8219 3.0697 3.0697 3.3173 3.3173 3.6679 3.6679 3.8940 3.8940 4.0762 4.0762 4.8866 4.8866 5.0453 5.0453 5.7957 5.7957 6.3671 6.3671 6.4912 6.4912 6.9863 6.9863 9.0501 9.0501 9.7555 9.7555 10.3258 10.3258 11.1425 11.1425 k = 0.0000 0.0000 0.0567 ( 5487 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4934 -7.4934 -7.4245 -7.4245 -7.2475 -7.2475 -7.2094 -7.2094 -7.1808 -7.1808 -7.1195 -7.1195 -5.8478 -5.8478 -5.5183 -5.5183 1.7355 1.7355 1.9228 1.9228 1.9989 1.9989 2.1614 2.1614 2.2173 2.2173 2.8218 2.8218 3.0697 3.0697 3.3175 3.3175 3.6677 3.6677 3.8924 3.8924 4.0760 4.0760 4.8854 4.8854 5.0440 5.0440 5.7756 5.7756 6.3641 6.3641 6.4902 6.4902 7.0356 7.0356 9.0563 9.0563 9.7457 9.7457 10.2946 10.2946 11.1625 11.1625 k = 0.0000 0.0000 0.0709 ( 5491 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4933 -7.4933 -7.4257 -7.4257 -7.2471 -7.2471 -7.2095 -7.2095 -7.1819 -7.1819 -7.1194 -7.1194 -5.8422 -5.8422 -5.5209 -5.5209 1.7345 1.7345 1.9183 1.9183 1.9993 1.9993 2.1608 2.1608 2.2173 2.2173 2.8218 2.8218 3.0697 3.0697 3.3178 3.3178 3.6677 3.6677 3.8905 3.8905 4.0758 4.0758 4.8840 4.8840 5.0424 5.0424 5.7525 5.7525 6.3609 6.3609 6.4889 6.4889 7.0953 7.0953 9.0644 9.0644 9.7325 9.7325 10.2567 10.2567 11.1882 11.1882 k = 0.0000 0.0000 0.0851 ( 5483 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4930 -7.4930 -7.4271 -7.4271 -7.2467 -7.2467 -7.2095 -7.2095 -7.1833 -7.1833 -7.1194 -7.1194 -5.8354 -5.8354 -5.5242 -5.5242 1.7334 1.7334 1.9130 1.9130 1.9998 1.9998 2.1603 2.1603 2.2173 2.2173 2.8217 2.8217 3.0698 3.0698 3.3181 3.3181 3.6677 3.6677 3.8882 3.8882 4.0755 4.0755 4.8823 4.8823 5.0406 5.0406 5.7276 5.7276 6.3575 6.3575 6.4875 6.4875 7.1636 7.1636 9.0743 9.0743 9.7155 9.7155 10.2134 10.2134 11.2196 11.2196 k = 0.0000 0.0000 0.0993 ( 5491 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4928 -7.4928 -7.4287 -7.4287 -7.2462 -7.2462 -7.2095 -7.2095 -7.1849 -7.1849 -7.1193 -7.1193 -5.8276 -5.8276 -5.5280 -5.5280 1.7323 1.7323 1.9068 1.9068 2.0003 2.0003 2.1596 2.1596 2.2173 2.2173 2.8217 2.8217 3.0698 3.0698 3.3184 3.3184 3.6677 3.6677 3.8856 3.8856 4.0752 4.0752 4.8804 4.8804 5.0386 5.0386 5.7021 5.7021 6.3542 6.3542 6.4858 6.4858 7.2391 7.2391 9.0860 9.0860 9.6943 9.6943 10.1660 10.1660 11.2566 11.2566 k = 0.0000 0.0000 0.1134 ( 5483 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4925 -7.4925 -7.4304 -7.4304 -7.2457 -7.2457 -7.2096 -7.2096 -7.1866 -7.1866 -7.1193 -7.1193 -5.8189 -5.8189 -5.5324 -5.5324 1.7312 1.7312 1.8999 1.8999 2.0008 2.0008 2.1590 2.1590 2.2173 2.2173 2.8216 2.8216 3.0699 3.0699 3.3188 3.3188 3.6677 3.6677 3.8826 3.8826 4.0749 4.0749 4.8783 4.8783 5.0363 5.0363 5.6769 5.6769 6.3509 6.3509 6.4840 6.4840 7.3203 7.3203 9.0996 9.0996 9.6684 9.6684 10.1155 10.1155 11.2992 11.2992 k = 0.0000 0.0000 0.1276 ( 5483 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4922 -7.4922 -7.4323 -7.4323 -7.2451 -7.2451 -7.2096 -7.2096 -7.1885 -7.1885 -7.1193 -7.1193 -5.8093 -5.8093 -5.5374 -5.5374 1.7303 1.7303 1.8922 1.8922 2.0014 2.0014 2.1584 2.1584 2.2173 2.2173 2.8215 2.8215 3.0699 3.0699 3.3193 3.3193 3.6677 3.6677 3.8795 3.8795 4.0745 4.0745 4.8762 4.8762 5.0339 5.0339 5.6527 5.6527 6.3478 6.3478 6.4821 6.4821 7.4060 7.4060 9.1150 9.1150 9.6376 9.6376 10.0629 10.0629 11.3470 11.3470 k = 0.0000 0.0000 0.1418 ( 5471 PWs) bands (ev): -23.7504 -23.7504 -23.7266 -23.7266 -7.4918 -7.4918 -7.4343 -7.4343 -7.2444 -7.2444 -7.2097 -7.2097 -7.1904 -7.1904 -7.1192 -7.1192 -5.7990 -5.7990 -5.5430 -5.5430 1.7296 1.7296 1.8841 1.8841 2.0021 2.0021 2.1579 2.1579 2.2173 2.2173 2.8215 2.8215 3.0700 3.0700 3.3197 3.3197 3.6677 3.6677 3.8761 3.8761 4.0742 4.0742 4.8739 4.8739 5.0315 5.0315 5.6299 5.6299 6.3447 6.3447 6.4802 6.4802 7.4952 7.4952 9.1324 9.1324 9.6017 9.6017 10.0091 10.0091 11.4000 11.4000 k = 0.0000 0.0000 0.1560 ( 5479 PWs) bands (ev): -23.7503 -23.7503 -23.7266 -23.7266 -7.4914 -7.4914 -7.4364 -7.4364 -7.2437 -7.2437 -7.2097 -7.2097 -7.1923 -7.1923 -7.1191 -7.1191 -5.7881 -5.7881 -5.5492 -5.5492 1.7291 1.7291 1.8754 1.8754 2.0027 2.0027 2.1575 2.1575 2.2173 2.2173 2.8213 2.8213 3.0700 3.0700 3.3202 3.3202 3.6676 3.6676 3.8725 3.8725 4.0737 4.0737 4.8716 4.8716 5.0290 5.0290 5.6089 5.6089 6.3418 6.3418 6.4782 6.4782 7.5868 7.5868 9.1516 9.1516 9.5605 9.5605 9.9548 9.9548 11.4391 11.4391 k = 0.0000 0.0000 0.1701 ( 5483 PWs) bands (ev): -23.7503 -23.7503 -23.7266 -23.7266 -7.4909 -7.4909 -7.4385 -7.4385 -7.2429 -7.2429 -7.2098 -7.2098 -7.1943 -7.1943 -7.1191 -7.1191 -5.7766 -5.7766 -5.5559 -5.5559 1.7289 1.7289 1.8666 1.8666 2.0034 2.0034 2.1571 2.1571 2.2173 2.2173 2.8212 2.8212 3.0701 3.0701 3.3206 3.3206 3.6676 3.6676 3.8690 3.8690 4.0733 4.0733 4.8693 4.8693 5.0265 5.0265 5.5899 5.5899 6.3391 6.3391 6.4763 6.4763 7.6799 7.6799 9.1727 9.1727 9.5144 9.5144 9.9005 9.9005 11.4334 11.4334 k = 0.0000 0.0000 0.1843 ( 5483 PWs) bands (ev): -23.7503 -23.7503 -23.7267 -23.7267 -7.4904 -7.4904 -7.4405 -7.4405 -7.2421 -7.2421 -7.2098 -7.2098 -7.1963 -7.1963 -7.1190 -7.1190 -5.7649 -5.7649 -5.5631 -5.5631 1.7292 1.7292 1.8575 1.8575 2.0040 2.0040 2.1568 2.1568 2.2173 2.2173 2.8211 2.8211 3.0701 3.0701 3.3211 3.3211 3.6675 3.6675 3.8656 3.8656 4.0729 4.0729 4.8671 4.8671 5.0242 5.0242 5.5730 5.5730 6.3365 6.3365 6.4744 6.4744 7.7734 7.7734 9.1958 9.1958 9.4637 9.4637 9.8467 9.8467 11.4283 11.4283 k = 0.0000 0.0000 0.1985 ( 5483 PWs) bands (ev): -23.7503 -23.7503 -23.7267 -23.7267 -7.4899 -7.4899 -7.4425 -7.4425 -7.2413 -7.2413 -7.2099 -7.2099 -7.1981 -7.1981 -7.1190 -7.1190 -5.7529 -5.7529 -5.5708 -5.5708 1.7299 1.7299 1.8486 1.8486 2.0045 2.0045 2.1566 2.1566 2.2173 2.2173 2.8210 2.8210 3.0702 3.0702 3.3214 3.3214 3.6675 3.6675 3.8622 3.8622 4.0725 4.0725 4.8651 4.8651 5.0219 5.0219 5.5582 5.5582 6.3341 6.3341 6.4727 6.4727 7.8662 7.8662 9.2208 9.2208 9.4091 9.4091 9.7938 9.7938 11.4254 11.4254 k = 0.0000 0.0000 0.2127 ( 5491 PWs) bands (ev): -23.7503 -23.7503 -23.7267 -23.7267 -7.4894 -7.4894 -7.4444 -7.4444 -7.2406 -7.2406 -7.2099 -7.2099 -7.1999 -7.1999 -7.1190 -7.1190 -5.7409 -5.7409 -5.5789 -5.5789 1.7309 1.7309 1.8399 1.8399 2.0050 2.0050 2.1564 2.1564 2.2173 2.2173 2.8208 2.8208 3.0702 3.0702 3.3218 3.3218 3.6675 3.6675 3.8591 3.8591 4.0721 4.0721 4.8632 4.8632 5.0199 5.0199 5.5456 5.5456 6.3320 6.3320 6.4711 6.4711 7.9568 7.9568 9.2477 9.2477 9.3517 9.3517 9.7422 9.7422 11.4247 11.4247 k = 0.0000 0.0000 0.2269 ( 5507 PWs) bands (ev): -23.7503 -23.7503 -23.7267 -23.7267 -7.4889 -7.4889 -7.4462 -7.4462 -7.2398 -7.2398 -7.2100 -7.2100 -7.2015 -7.2015 -7.1189 -7.1189 -5.7291 -5.7291 -5.5873 -5.5873 1.7323 1.7323 1.8317 1.8317 2.0054 2.0054 2.1562 2.1562 2.2173 2.2173 2.8207 2.8207 3.0703 3.0703 3.3221 3.3221 3.6675 3.6675 3.8563 3.8563 4.0717 4.0717 4.8615 4.8615 5.0181 5.0181 5.5351 5.5351 6.3302 6.3302 6.4696 6.4696 8.0435 8.0435 9.2764 9.2764 9.2932 9.2932 9.6922 9.6922 11.4256 11.4256 k = 0.0000 0.0000 0.2410 ( 5503 PWs) bands (ev): -23.7503 -23.7503 -23.7267 -23.7267 -7.4884 -7.4884 -7.4476 -7.4476 -7.2392 -7.2392 -7.2100 -7.2100 -7.2029 -7.2029 -7.1189 -7.1189 -5.7178 -5.7178 -5.5956 -5.5956 1.7340 1.7340 1.8243 1.8243 2.0058 2.0058 2.1562 2.1562 2.2173 2.2173 2.8206 2.8206 3.0703 3.0703 3.3224 3.3224 3.6675 3.6675 3.8540 3.8540 4.0715 4.0715 4.8601 4.8601 5.0165 5.0165 5.5266 5.5266 6.3286 6.3286 6.4684 6.4684 8.1240 8.1240 9.2359 9.2359 9.3068 9.3068 9.6440 9.6440 11.4276 11.4276 k = 0.0000 0.0000 0.2552 ( 5511 PWs) bands (ev): -23.7503 -23.7503 -23.7267 -23.7267 -7.4880 -7.4880 -7.4489 -7.4489 -7.2386 -7.2386 -7.2100 -7.2100 -7.2041 -7.2041 -7.1189 -7.1189 -5.7075 -5.7075 -5.6037 -5.6037 1.7357 1.7357 1.8179 1.8179 2.0061 2.0061 2.1561 2.1561 2.2172 2.2172 2.8205 2.8205 3.0703 3.0703 3.3226 3.3226 3.6675 3.6675 3.8520 3.8520 4.0712 4.0712 4.8589 4.8589 5.0153 5.0153 5.5201 5.5201 6.3274 6.3274 6.4675 6.4675 8.1950 8.1950 9.1828 9.1828 9.3386 9.3386 9.5983 9.5983 11.4300 11.4300 k = 0.0000 0.0000 0.2694 ( 5519 PWs) bands (ev): -23.7503 -23.7503 -23.7267 -23.7267 -7.4877 -7.4877 -7.4498 -7.4498 -7.2382 -7.2382 -7.2101 -7.2101 -7.2050 -7.2050 -7.1189 -7.1189 -5.6987 -5.6987 -5.6107 -5.6107 1.7373 1.7373 1.8129 1.8129 2.0063 2.0063 2.1560 2.1560 2.2172 2.2172 2.8204 2.8204 3.0703 3.0703 3.3227 3.3227 3.6675 3.6675 3.8506 3.8506 4.0711 4.0711 4.8581 4.8581 5.0144 5.0144 5.5155 5.5155 6.3265 6.3265 6.4668 6.4668 8.2520 8.2520 9.1386 9.1386 9.3709 9.3709 9.5560 9.5560 11.4322 11.4322 k = 0.0000 0.0000 0.2836 ( 5535 PWs) bands (ev): -23.7503 -23.7503 -23.7267 -23.7267 -7.4875 -7.4875 -7.4504 -7.4504 -7.2379 -7.2379 -7.2101 -7.2101 -7.2055 -7.2055 -7.1189 -7.1189 -5.6926 -5.6926 -5.6158 -5.6158 1.7383 1.7383 1.8097 1.8097 2.0064 2.0064 2.1560 2.1560 2.2172 2.2172 2.8203 2.8203 3.0703 3.0703 3.3228 3.3228 3.6675 3.6675 3.8496 3.8496 4.0710 4.0710 4.8576 4.8576 5.0138 5.0138 5.5127 5.5127 6.3260 6.3260 6.4663 6.4663 8.2897 8.2897 9.1085 9.1085 9.4006 9.4006 9.5202 9.5202 11.4337 11.4337 k = 0.0000 0.0000 0.2978 ( 5558 PWs) bands (ev): -23.7504 -23.7504 -23.7268 -23.7268 -7.4875 -7.4875 -7.4506 -7.4506 -7.2378 -7.2378 -7.2101 -7.2101 -7.2057 -7.2057 -7.1189 -7.1189 -5.6904 -5.6904 -5.6177 -5.6177 1.7387 1.7387 1.8085 1.8085 2.0064 2.0064 2.1559 2.1559 2.2172 2.2172 2.8203 2.8203 3.0703 3.0703 3.3229 3.3229 3.6675 3.6675 3.8493 3.8493 4.0709 4.0709 4.8574 4.8574 5.0136 5.0136 5.5118 5.5118 6.3257 6.3257 6.4662 6.4662 8.3030 8.3030 9.0978 9.0978 9.4157 9.4157 9.5031 9.5031 11.4342 11.4342 k = 0.0000 0.0000 0.2978 ( 5558 PWs) bands (ev): -23.7504 -23.7504 -23.7268 -23.7268 -7.4875 -7.4875 -7.4506 -7.4506 -7.2378 -7.2378 -7.2101 -7.2101 -7.2057 -7.2057 -7.1189 -7.1189 -5.6904 -5.6904 -5.6177 -5.6177 1.7387 1.7387 1.8085 1.8085 2.0064 2.0064 2.1559 2.1559 2.2172 2.2172 2.8203 2.8203 3.0703 3.0703 3.3229 3.3229 3.6675 3.6675 3.8493 3.8493 4.0709 4.0709 4.8574 4.8574 5.0136 5.0136 5.5118 5.5118 6.3257 6.3257 6.4662 6.4662 8.3030 8.3030 9.0978 9.0978 9.4157 9.4157 9.5031 9.5031 11.4342 11.4342 k = 0.0000 0.0143 0.2978 ( 5550 PWs) bands (ev): -23.7503 -23.7503 -23.7268 -23.7268 -7.4877 -7.4877 -7.4506 -7.4506 -7.2378 -7.2378 -7.2124 -7.2124 -7.2035 -7.2035 -7.1191 -7.1191 -5.6899 -5.6899 -5.6172 -5.6172 1.7396 1.7396 1.8094 1.8094 2.0065 2.0065 2.1558 2.1558 2.2183 2.2183 2.8200 2.8200 3.0697 3.0697 3.3225 3.3225 3.6668 3.6668 3.8486 3.8486 4.0686 4.0686 4.8552 4.8552 5.0119 5.0119 5.5137 5.5137 6.3234 6.3234 6.4634 6.4634 8.3068 8.3068 9.1006 9.1006 9.4201 9.4201 9.5068 9.5068 11.4254 11.4254 k = 0.0000 0.0286 0.2978 ( 5548 PWs) bands (ev): -23.7503 -23.7503 -23.7268 -23.7268 -7.4885 -7.4885 -7.4506 -7.4506 -7.2379 -7.2379 -7.2160 -7.2160 -7.1999 -7.1999 -7.1197 -7.1197 -5.6887 -5.6887 -5.6158 -5.6158 1.7424 1.7424 1.8118 1.8118 2.0067 2.0067 2.1553 2.1553 2.2216 2.2216 2.8190 2.8190 3.0681 3.0681 3.3217 3.3217 3.6646 3.6646 3.8465 3.8465 4.0620 4.0620 4.8474 4.8474 5.0081 5.0081 5.5190 5.5190 6.3161 6.3161 6.4556 6.4556 8.3179 8.3179 9.1083 9.1083 9.4331 9.4331 9.5181 9.5181 11.4002 11.4002 k = 0.0000 0.0429 0.2978 ( 5540 PWs) bands (ev): -23.7502 -23.7502 -23.7268 -23.7268 -7.4897 -7.4897 -7.4506 -7.4506 -7.2379 -7.2379 -7.2197 -7.2197 -7.1963 -7.1963 -7.1207 -7.1207 -5.6866 -5.6866 -5.6136 -5.6136 1.7471 1.7471 1.8160 1.8160 2.0071 2.0071 2.1548 2.1548 2.2268 2.2268 2.8174 2.8174 3.0654 3.0654 3.3203 3.3203 3.6610 3.6610 3.8430 3.8430 4.0512 4.0512 4.8311 4.8311 5.0058 5.0058 5.5273 5.5273 6.3034 6.3034 6.4438 6.4438 8.3357 8.3357 9.1192 9.1192 9.4548 9.4548 9.5386 9.5386 11.3610 11.3610 k = 0.0000 0.0571 0.2978 ( 5540 PWs) bands (ev): -23.7501 -23.7501 -23.7268 -23.7268 -7.4914 -7.4914 -7.4508 -7.4508 -7.2382 -7.2382 -7.2233 -7.2233 -7.1928 -7.1928 -7.1220 -7.1220 -5.6837 -5.6837 -5.6105 -5.6105 1.7535 1.7535 1.8217 1.8217 2.0076 2.0076 2.1543 2.1543 2.2336 2.2336 2.8152 2.8152 3.0618 3.0618 3.3183 3.3183 3.6561 3.6561 3.8380 3.8380 4.0367 4.0367 4.8034 4.8034 5.0086 5.0086 5.5379 5.5379 6.2846 6.2846 6.4296 6.4296 8.3591 8.3591 9.1308 9.1308 9.4849 9.4849 9.5701 9.5701 11.3115 11.3115 k = 0.0000 0.0714 0.2978 ( 5538 PWs) bands (ev): -23.7499 -23.7499 -23.7269 -23.7269 -7.4935 -7.4935 -7.4510 -7.4510 -7.2388 -7.2388 -7.2265 -7.2265 -7.1894 -7.1894 -7.1237 -7.1237 -5.6801 -5.6801 -5.6065 -5.6065 1.7618 1.7618 1.8290 1.8290 2.0084 2.0084 2.1541 2.1541 2.2419 2.2419 2.8123 2.8123 3.0571 3.0571 3.3158 3.3158 3.6496 3.6496 3.8315 3.8315 4.0190 4.0190 4.7641 4.7641 5.0177 5.0177 5.5502 5.5502 6.2592 6.2592 6.4145 6.4145 8.3872 8.3872 9.1402 9.1402 9.5235 9.5235 9.6143 9.6143 11.2549 11.2549 k = 0.0000 0.0857 0.2978 ( 5522 PWs) bands (ev): -23.7497 -23.7497 -23.7269 -23.7269 -7.4960 -7.4960 -7.4513 -7.4513 -7.2400 -7.2400 -7.2290 -7.2290 -7.1863 -7.1863 -7.1255 -7.1255 -5.6756 -5.6756 -5.6017 -5.6017 1.7718 1.7718 1.8380 1.8380 2.0095 2.0095 2.1544 2.1544 2.2515 2.2515 2.8088 2.8088 3.0515 3.0515 3.3125 3.3125 3.6416 3.6416 3.8235 3.8235 3.9987 3.9987 4.7145 4.7145 5.0326 5.0326 5.5635 5.5635 6.2276 6.2276 6.3994 6.3994 8.4185 8.4185 9.1451 9.1451 9.5704 9.5704 9.6723 9.6723 11.1946 11.1946 k = 0.0000 0.1000 0.2978 ( 5508 PWs) bands (ev): -23.7495 -23.7495 -23.7270 -23.7270 -7.4988 -7.4988 -7.4517 -7.4517 -7.2421 -7.2421 -7.2305 -7.2305 -7.1833 -7.1833 -7.1276 -7.1276 -5.6705 -5.6705 -5.5963 -5.5963 1.7835 1.7835 1.8484 1.8484 2.0109 2.0109 2.1553 2.1553 2.2623 2.2623 2.8047 2.8047 3.0450 3.0450 3.3085 3.3085 3.6323 3.6323 3.8139 3.8139 3.9762 3.9762 4.6568 4.6568 5.0519 5.0519 5.5775 5.5775 6.1907 6.1907 6.3847 6.3847 8.4519 8.4519 9.1442 9.1442 9.6256 9.6256 9.7439 9.7439 11.1333 11.1333 k = 0.0000 0.1143 0.2978 ( 5508 PWs) bands (ev): -23.7492 -23.7492 -23.7271 -23.7271 -7.5019 -7.5019 -7.4524 -7.4524 -7.2449 -7.2449 -7.2313 -7.2313 -7.1807 -7.1807 -7.1297 -7.1297 -5.6646 -5.6646 -5.5901 -5.5901 1.7968 1.7968 1.8604 1.8604 2.0127 2.0127 2.1567 2.1567 2.2741 2.2741 2.7999 2.7999 3.0378 3.0378 3.3037 3.3037 3.6214 3.6214 3.8026 3.8026 3.9521 3.9521 4.5927 4.5927 5.0745 5.0745 5.5918 5.5918 6.1497 6.1497 6.3701 6.3701 8.4865 8.4865 9.1372 9.1372 9.6888 9.6888 9.8278 9.8278 11.0732 11.0732 k = 0.0000 0.1286 0.2978 ( 5500 PWs) bands (ev): -23.7489 -23.7489 -23.7272 -23.7272 -7.5052 -7.5052 -7.4532 -7.4532 -7.2482 -7.2482 -7.2315 -7.2315 -7.1784 -7.1784 -7.1317 -7.1317 -5.6580 -5.6580 -5.5834 -5.5834 1.8118 1.8118 1.8736 1.8736 2.0149 2.0149 2.1589 2.1589 2.2868 2.2868 2.7946 2.7946 3.0299 3.0299 3.2981 3.2981 3.6092 3.6092 3.7896 3.7896 3.9269 3.9269 4.5238 4.5238 5.0996 5.0996 5.6062 5.6062 6.1060 6.1060 6.3556 6.3556 8.5213 8.5213 9.1240 9.1240 9.7596 9.7596 9.9223 9.9223 11.0167 11.0167 k = 0.0000 0.1429 0.2978 ( 5508 PWs) bands (ev): -23.7486 -23.7486 -23.7274 -23.7274 -7.5088 -7.5088 -7.4544 -7.4544 -7.2517 -7.2517 -7.2315 -7.2315 -7.1764 -7.1764 -7.1337 -7.1337 -5.6509 -5.6509 -5.5761 -5.5761 1.8282 1.8282 1.8883 1.8883 2.0177 2.0177 2.1619 2.1619 2.3004 2.3004 2.7886 2.7886 3.0214 3.0214 3.2914 3.2914 3.5954 3.5954 3.7747 3.7747 3.9011 3.9011 4.4513 4.4513 5.1264 5.1264 5.6205 5.6205 6.0609 6.0609 6.3408 6.3408 8.5556 8.5556 9.1051 9.1051 9.8373 9.8373 10.0250 10.0250 10.9656 10.9656 k = 0.0000 0.1571 0.2978 ( 5500 PWs) bands (ev): -23.7483 -23.7483 -23.7275 -23.7275 -7.5125 -7.5125 -7.4558 -7.4558 -7.2552 -7.2552 -7.2314 -7.2314 -7.1749 -7.1749 -7.1353 -7.1353 -5.6431 -5.6431 -5.5683 -5.5683 1.8460 1.8460 1.9042 1.9042 2.0212 2.0212 2.1657 2.1657 2.3148 2.3148 2.7820 2.7820 3.0124 3.0124 3.2838 3.2838 3.5802 3.5802 3.7580 3.7580 3.8750 3.8750 4.3762 4.3762 5.1546 5.1546 5.6346 5.6346 6.0153 6.0153 6.3256 6.3256 8.5889 8.5889 9.0811 9.0811 9.9213 9.9213 10.1333 10.1333 10.9221 10.9221 k = 0.0000 0.1714 0.2978 ( 5512 PWs) bands (ev): -23.7479 -23.7479 -23.7276 -23.7276 -7.5163 -7.5163 -7.4575 -7.4575 -7.2586 -7.2586 -7.2313 -7.2313 -7.1738 -7.1738 -7.1367 -7.1367 -5.6348 -5.6348 -5.5602 -5.5602 1.8651 1.8651 1.9213 1.9213 2.0253 2.0253 2.1703 2.1703 2.3298 2.3298 2.7747 2.7747 3.0030 3.0030 3.2750 3.2750 3.5635 3.5635 3.7394 3.7394 3.8489 3.8489 4.2995 4.2995 5.1836 5.1836 5.6482 5.6482 5.9701 5.9701 6.3098 6.3098 8.6208 8.6208 9.0524 9.0524 10.0108 10.0108 10.2435 10.2435 10.8890 10.8890 k = 0.0000 0.1857 0.2978 ( 5506 PWs) bands (ev): -23.7475 -23.7475 -23.7278 -23.7278 -7.5202 -7.5202 -7.4596 -7.4596 -7.2619 -7.2619 -7.2312 -7.2312 -7.1730 -7.1730 -7.1378 -7.1378 -5.6261 -5.6261 -5.5518 -5.5518 1.8854 1.8854 1.9393 1.9393 2.0304 2.0304 2.1760 2.1760 2.3456 2.3456 2.7669 2.7669 2.9934 2.9934 3.2651 3.2651 3.5454 3.5454 3.7192 3.7192 3.8230 3.8230 4.2220 4.2220 5.2132 5.2132 5.6611 5.6611 5.9263 5.9263 6.2934 6.2934 8.6509 8.6509 9.0198 9.0198 10.1047 10.1047 10.3498 10.3498 10.8709 10.8709 k = 0.0000 0.2000 0.2978 ( 5514 PWs) bands (ev): -23.7471 -23.7471 -23.7280 -23.7280 -7.5242 -7.5242 -7.4620 -7.4620 -7.2650 -7.2650 -7.2313 -7.2313 -7.1726 -7.1726 -7.1384 -7.1384 -5.6169 -5.6169 -5.5432 -5.5432 1.9066 1.9066 1.9581 1.9581 2.0364 2.0364 2.1826 2.1826 2.3619 2.3619 2.7585 2.7585 2.9836 2.9836 3.2538 3.2538 3.5258 3.5258 3.6974 3.6974 3.7974 3.7974 4.1445 4.1445 5.2432 5.2432 5.6729 5.6729 5.8845 5.8845 6.2764 6.2764 8.6789 8.6789 8.9839 8.9839 10.2022 10.2022 10.4430 10.4430 10.8757 10.8757 k = 0.0000 0.2143 0.2978 ( 5506 PWs) bands (ev): -23.7466 -23.7466 -23.7282 -23.7282 -7.5281 -7.5281 -7.4647 -7.4647 -7.2678 -7.2678 -7.2315 -7.2315 -7.1724 -7.1724 -7.1388 -7.1388 -5.6074 -5.6074 -5.5345 -5.5345 1.9287 1.9287 1.9774 1.9774 2.0438 2.0438 2.1904 2.1904 2.3787 2.3787 2.7495 2.7495 2.9737 2.9737 3.2413 3.2413 3.5048 3.5048 3.6745 3.6745 3.7720 3.7720 4.0677 4.0677 5.2734 5.2734 5.6834 5.6834 5.8454 5.8454 6.2587 6.2587 8.7048 8.7048 8.9456 8.9456 10.3021 10.3021 10.5114 10.5114 10.9135 10.9135 k = 0.0000 0.2286 0.2978 ( 5502 PWs) bands (ev): -23.7462 -23.7462 -23.7284 -23.7284 -7.5320 -7.5320 -7.4679 -7.4679 -7.2704 -7.2704 -7.2319 -7.2319 -7.1724 -7.1724 -7.1389 -7.1389 -5.5976 -5.5976 -5.5258 -5.5258 1.9514 1.9514 1.9968 1.9968 2.0530 2.0530 2.1993 2.1993 2.3960 2.3960 2.7399 2.7399 2.9637 2.9637 3.2273 3.2273 3.4825 3.4825 3.6505 3.6505 3.7468 3.7468 3.9923 3.9923 5.3036 5.3036 5.6917 5.6917 5.8100 5.8100 6.2404 6.2404 8.7280 8.7280 8.9057 8.9057 10.4028 10.4028 10.5505 10.5505 10.9871 10.9871 k = 0.0000 0.2429 0.2978 ( 5504 PWs) bands (ev): -23.7457 -23.7457 -23.7286 -23.7286 -7.5358 -7.5358 -7.4714 -7.4714 -7.2728 -7.2728 -7.2325 -7.2325 -7.1724 -7.1724 -7.1388 -7.1388 -5.5876 -5.5876 -5.5171 -5.5171 1.9743 1.9743 2.0156 2.0156 2.0645 2.0645 2.2095 2.2095 2.4137 2.4137 2.7297 2.7297 2.9537 2.9537 3.2118 3.2118 3.4589 3.4589 3.6259 3.6259 3.7214 3.7214 3.9189 3.9189 5.3336 5.3336 5.6961 5.6961 5.7801 5.7801 6.2215 6.2215 8.7485 8.7485 8.8652 8.8652 10.5011 10.5011 10.5698 10.5698 11.0864 11.0864 k = 0.0000 0.2571 0.2978 ( 5508 PWs) bands (ev): -23.7452 -23.7452 -23.7289 -23.7289 -7.5394 -7.5394 -7.4752 -7.4752 -7.2748 -7.2748 -7.2333 -7.2333 -7.1723 -7.1723 -7.1386 -7.1386 -5.5774 -5.5774 -5.5085 -5.5085 1.9971 1.9971 2.0335 2.0335 2.0789 2.0789 2.2210 2.2210 2.4316 2.4316 2.7191 2.7191 2.9435 2.9435 3.1950 3.1950 3.4340 3.4340 3.6010 3.6010 3.6959 3.6959 3.8484 3.8484 5.3635 5.3635 5.6934 5.6934 5.7590 5.7590 6.2020 6.2020 8.7657 8.7657 8.8252 8.8252 10.5630 10.5630 10.6118 10.6118 11.1980 11.1980 k = 0.0000 0.2714 0.2978 ( 5504 PWs) bands (ev): -23.7447 -23.7447 -23.7292 -23.7292 -7.5429 -7.5429 -7.4794 -7.4794 -7.2765 -7.2765 -7.2343 -7.2343 -7.1721 -7.1721 -7.1384 -7.1384 -5.5671 -5.5671 -5.5001 -5.5001 2.0191 2.0191 2.0505 2.0505 2.0965 2.0965 2.2338 2.2338 2.4497 2.4497 2.7080 2.7080 2.9331 2.9331 3.1767 3.1767 3.4081 3.4081 3.5759 3.5759 3.6699 3.6699 3.7814 3.7814 5.3930 5.3930 5.6809 5.6809 5.7493 5.7493 6.1820 6.1820 8.7737 8.7737 8.7923 8.7923 10.5694 10.5694 10.6982 10.6982 11.3068 11.3068 k = 0.0000 0.2857 0.2978 ( 5506 PWs) bands (ev): -23.7441 -23.7441 -23.7294 -23.7294 -7.5461 -7.5461 -7.4839 -7.4839 -7.2778 -7.2778 -7.2356 -7.2356 -7.1717 -7.1717 -7.1382 -7.1382 -5.5568 -5.5568 -5.4920 -5.4920 2.0393 2.0393 2.0679 2.0679 2.1166 2.1166 2.2481 2.2481 2.4679 2.4679 2.6967 2.6967 2.9221 2.9221 3.1573 3.1573 3.3810 3.3810 3.5509 3.5509 3.6430 3.6430 3.7190 3.7190 5.4222 5.4222 5.6627 5.6627 5.7470 5.7470 6.1615 6.1615 8.7443 8.7443 8.7952 8.7952 10.5704 10.5704 10.7758 10.7758 11.2827 11.2827 k = 0.0000 0.3000 0.2978 ( 5516 PWs) bands (ev): -23.7436 -23.7436 -23.7297 -23.7297 -7.5491 -7.5491 -7.4886 -7.4886 -7.2788 -7.2788 -7.2371 -7.2371 -7.1711 -7.1711 -7.1380 -7.1380 -5.5465 -5.5465 -5.4843 -5.4843 2.0568 2.0568 2.0870 2.0870 2.1384 2.1384 2.2638 2.2638 2.4861 2.4861 2.6853 2.6853 2.9101 2.9101 3.1370 3.1370 3.3531 3.3531 3.5259 3.5259 3.6144 3.6144 3.6628 3.6628 5.4511 5.4511 5.6438 5.6438 5.7469 5.7469 6.1406 6.1406 8.7096 8.7096 8.8025 8.8025 10.5709 10.5709 10.8317 10.8317 11.2799 11.2799 k = 0.0000 0.3143 0.2978 ( 5516 PWs) bands (ev): -23.7431 -23.7431 -23.7301 -23.7301 -7.5519 -7.5519 -7.4935 -7.4935 -7.2795 -7.2795 -7.2387 -7.2387 -7.1702 -7.1702 -7.1380 -7.1380 -5.5363 -5.5363 -5.4770 -5.4770 2.0721 2.0721 2.1080 2.1080 2.1610 2.1610 2.2809 2.2809 2.5042 2.5042 2.6742 2.6742 2.8966 2.8966 3.1163 3.1163 3.3246 3.3246 3.5011 3.5011 3.5812 3.5812 3.6162 3.6162 5.4795 5.4795 5.6265 5.6265 5.7467 5.7467 6.1192 6.1192 8.6774 8.6774 8.8069 8.8069 10.5719 10.5719 10.8582 10.8582 11.3099 11.3099 k = 0.0000 0.3286 0.2978 ( 5524 PWs) bands (ev): -23.7425 -23.7425 -23.7304 -23.7304 -7.5543 -7.5543 -7.4986 -7.4986 -7.2799 -7.2799 -7.2405 -7.2405 -7.1692 -7.1692 -7.1381 -7.1381 -5.5264 -5.5264 -5.4702 -5.4702 2.0862 2.0862 2.1301 2.1301 2.1836 2.1836 2.2993 2.2993 2.5218 2.5218 2.6636 2.6636 2.8809 2.8809 3.0956 3.0956 3.2959 3.2959 3.4761 3.4761 3.5421 3.5421 3.5811 3.5811 5.5075 5.5075 5.6117 5.6117 5.7453 5.7453 6.0975 6.0975 8.6488 8.6488 8.8079 8.8079 10.5737 10.5737 10.8583 10.8583 11.3690 11.3690 k = 0.0000 0.3429 0.2978 ( 5512 PWs) bands (ev): -23.7419 -23.7419 -23.7307 -23.7307 -7.5564 -7.5564 -7.5038 -7.5038 -7.2799 -7.2799 -7.2424 -7.2424 -7.1679 -7.1679 -7.1383 -7.1383 -5.5167 -5.5167 -5.4640 -5.4640 2.0998 2.0998 2.1526 2.1526 2.2057 2.2057 2.3189 2.3189 2.5386 2.5386 2.6542 2.6542 2.8622 2.8622 3.0756 3.0756 3.2676 3.2676 3.4509 3.4509 3.5031 3.5031 3.5524 3.5524 5.5351 5.5351 5.5997 5.5997 5.7424 5.7424 6.0754 6.0754 8.6241 8.6241 8.8054 8.8054 10.5761 10.5761 10.8424 10.8424 11.4461 11.4461 k = 0.0000 0.3571 0.2978 ( 5504 PWs) bands (ev): -23.7413 -23.7413 -23.7311 -23.7311 -7.5581 -7.5581 -7.5090 -7.5090 -7.2796 -7.2796 -7.2444 -7.2444 -7.1665 -7.1665 -7.1386 -7.1386 -5.5073 -5.5073 -5.4584 -5.4584 2.1134 2.1134 2.1751 2.1751 2.2268 2.2268 2.3394 2.3394 2.5538 2.5538 2.6471 2.6471 2.8400 2.8400 3.0564 3.0564 3.2406 3.2406 3.4249 3.4249 3.4687 3.4687 3.5260 3.5260 5.5623 5.5623 5.5906 5.5906 5.7379 5.7379 6.0530 6.0530 8.6036 8.6036 8.7996 8.7996 10.5793 10.5793 10.8192 10.8192 11.5315 11.5315 k = 0.0000 0.3714 0.2978 ( 5510 PWs) bands (ev): -23.7408 -23.7408 -23.7315 -23.7315 -7.5595 -7.5595 -7.5142 -7.5142 -7.2791 -7.2791 -7.2465 -7.2465 -7.1650 -7.1650 -7.1391 -7.1391 -5.4983 -5.4983 -5.4534 -5.4534 2.1271 2.1271 2.1974 2.1974 2.2466 2.2466 2.3606 2.3606 2.5658 2.5658 2.6438 2.6438 2.8141 2.8141 3.0379 3.0379 3.2161 3.2161 3.3979 3.3979 3.4400 3.4400 3.5009 3.5009 5.5840 5.5840 5.5894 5.5894 5.7316 5.7316 6.0303 6.0303 8.5877 8.5877 8.7905 8.7905 10.5829 10.5829 10.7937 10.7937 11.6192 11.6192 k = 0.0000 0.3857 0.2978 ( 5512 PWs) bands (ev): -23.7402 -23.7402 -23.7319 -23.7319 -7.5604 -7.5604 -7.5194 -7.5194 -7.2784 -7.2784 -7.2486 -7.2486 -7.1634 -7.1634 -7.1398 -7.1398 -5.4898 -5.4898 -5.4492 -5.4492 2.1410 2.1410 2.2188 2.2188 2.2652 2.2652 2.3822 2.3822 2.5727 2.5727 2.6467 2.6467 2.7849 2.7849 3.0195 3.0195 3.1954 3.1954 3.3708 3.3708 3.4164 3.4164 3.4771 3.4771 5.5806 5.5806 5.6156 5.6156 5.7239 5.7239 6.0073 6.0073 8.5764 8.5764 8.7785 8.7785 10.5871 10.5871 10.7685 10.7685 11.7054 11.7054 k = 0.0000 0.4000 0.2978 ( 5508 PWs) bands (ev): -23.7396 -23.7396 -23.7323 -23.7323 -7.5609 -7.5609 -7.5244 -7.5244 -7.2774 -7.2774 -7.2508 -7.2508 -7.1617 -7.1617 -7.1406 -7.1406 -5.4818 -5.4818 -5.4457 -5.4457 2.1551 2.1551 2.2381 2.2381 2.2833 2.2833 2.4040 2.4040 2.5736 2.5736 2.6563 2.6563 2.7535 2.7535 3.0000 3.0000 3.1795 3.1795 3.3445 3.3445 3.3967 3.3967 3.4544 3.4544 5.5797 5.5797 5.6417 5.6417 5.7147 5.7147 5.9841 5.9841 8.5696 8.5696 8.7638 8.7638 10.5916 10.5916 10.7447 10.7447 11.7876 11.7876 k = 0.0000 0.4143 0.2978 ( 5516 PWs) bands (ev): -23.7390 -23.7390 -23.7328 -23.7328 -7.5610 -7.5610 -7.5293 -7.5293 -7.2762 -7.2762 -7.2530 -7.2530 -7.1600 -7.1600 -7.1415 -7.1415 -5.4743 -5.4743 -5.4430 -5.4430 2.1692 2.1692 2.2533 2.2533 2.3027 2.3027 2.4257 2.4257 2.5699 2.5699 2.6699 2.6699 2.7219 2.7219 2.9787 2.9787 3.1693 3.1693 3.3197 3.3197 3.3804 3.3804 3.4332 3.4332 5.5812 5.5812 5.6674 5.6674 5.7043 5.7043 5.9607 5.9607 8.5672 8.5672 8.7470 8.7470 10.5965 10.5965 10.7231 10.7231 11.8637 11.8637 k = 0.0000 0.4286 0.2978 ( 5528 PWs) bands (ev): -23.7385 -23.7385 -23.7332 -23.7332 -7.5607 -7.5607 -7.5339 -7.5339 -7.2748 -7.2748 -7.2552 -7.2552 -7.1582 -7.1582 -7.1425 -7.1425 -5.4675 -5.4675 -5.4411 -5.4411 2.1833 2.1833 2.2630 2.2630 2.3248 2.3248 2.4468 2.4468 2.5631 2.5631 2.6723 2.6723 2.7046 2.7046 2.9553 2.9553 3.1646 3.1646 3.2964 3.2964 3.3672 3.3672 3.4137 3.4137 5.5849 5.5849 5.6900 5.6900 5.6956 5.6956 5.9371 5.9371 8.5690 8.5690 8.7284 8.7284 10.6018 10.6018 10.7037 10.7037 11.9320 11.9320 k = 0.0000 0.4429 0.2978 ( 5526 PWs) bands (ev): -23.7379 -23.7379 -23.7337 -23.7337 -7.5599 -7.5599 -7.5382 -7.5382 -7.2733 -7.2733 -7.2574 -7.2574 -7.1564 -7.1564 -7.1437 -7.1437 -5.4613 -5.4613 -5.4400 -5.4400 2.1972 2.1972 2.2672 2.2672 2.3497 2.3497 2.4672 2.4672 2.5537 2.5537 2.6456 2.6456 2.7197 2.7197 2.9301 2.9301 3.1650 3.1650 3.2746 3.2746 3.3572 3.3572 3.3962 3.3962 5.5907 5.5907 5.6801 5.6801 5.7185 5.7185 5.9134 5.9134 8.5747 8.5747 8.7087 8.7087 10.6076 10.6076 10.6866 10.6866 11.9913 11.9913 k = 0.0000 0.4571 0.2978 ( 5518 PWs) bands (ev): -23.7373 -23.7373 -23.7342 -23.7342 -7.5586 -7.5586 -7.5423 -7.5423 -7.2716 -7.2716 -7.2596 -7.2596 -7.1546 -7.1546 -7.1450 -7.1450 -5.4559 -5.4559 -5.4397 -5.4397 2.2108 2.2108 2.2668 2.2668 2.3769 2.3769 2.4858 2.4858 2.5413 2.5413 2.6157 2.6157 2.7424 2.7424 2.9036 2.9036 3.1697 3.1697 3.2544 3.2544 3.3506 3.3506 3.3809 3.3809 5.5984 5.5984 5.6675 5.6675 5.7434 5.7434 5.8896 5.8896 8.5840 8.5840 8.6883 8.6883 10.6138 10.6138 10.6716 10.6716 12.0404 12.0404 k = 0.0000 0.4714 0.2978 ( 5510 PWs) bands (ev): -23.7368 -23.7368 -23.7347 -23.7347 -7.5570 -7.5570 -7.5460 -7.5460 -7.2698 -7.2698 -7.2618 -7.2618 -7.1529 -7.1529 -7.1464 -7.1464 -5.4512 -5.4512 -5.4403 -5.4403 2.2238 2.2238 2.2627 2.2627 2.4055 2.4055 2.4989 2.4989 2.5286 2.5286 2.5891 2.5891 2.7674 2.7674 2.8762 2.8762 3.1780 3.1780 3.2356 3.2356 3.3474 3.3474 3.3681 3.3681 5.6076 5.6076 5.6546 5.6546 5.7681 5.7681 5.8656 5.8656 8.5965 8.5965 8.6678 8.6678 10.6207 10.6207 10.6585 10.6585 12.0787 12.0787 k = 0.0000 0.4857 0.2978 ( 5506 PWs) bands (ev): -23.7362 -23.7362 -23.7352 -23.7352 -7.5548 -7.5548 -7.5493 -7.5493 -7.2679 -7.2679 -7.2639 -7.2639 -7.1511 -7.1511 -7.1479 -7.1479 -5.4472 -5.4472 -5.4418 -5.4418 2.2358 2.2358 2.2558 2.2558 2.4348 2.4348 2.4890 2.4890 2.5327 2.5327 2.5670 2.5670 2.7937 2.7937 2.8485 2.8485 3.1891 3.1891 3.2183 3.2183 3.3476 3.3476 3.3582 3.3582 5.6181 5.6181 5.6419 5.6419 5.7927 5.7927 5.8414 5.8414 8.6116 8.6116 8.6478 8.6478 10.6285 10.6285 10.6471 10.6471 12.1059 12.1059 k = 0.0000 0.5000 0.2978 ( 5500 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5523 -7.5523 -7.5523 -7.5523 -7.2659 -7.2659 -7.2659 -7.2659 -7.1495 -7.1495 -7.1495 -7.1495 -5.4441 -5.4441 -5.4441 -5.4441 2.2467 2.2467 2.2467 2.2467 2.4636 2.4636 2.4636 2.4636 2.5484 2.5484 2.5484 2.5484 2.8209 2.8209 2.8209 2.8209 3.2027 3.2027 3.2027 3.2027 3.3513 3.3513 3.3513 3.3513 5.6296 5.6296 5.6296 5.6296 5.8171 5.8171 5.8171 5.8171 8.6289 8.6289 8.6289 8.6289 10.6372 10.6372 10.6372 10.6372 12.1223 12.1223 k = 0.0000 0.5000 0.2978 ( 5500 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5523 -7.5523 -7.5523 -7.5523 -7.2659 -7.2659 -7.2659 -7.2659 -7.1495 -7.1495 -7.1495 -7.1495 -5.4441 -5.4441 -5.4441 -5.4441 2.2467 2.2467 2.2467 2.2467 2.4636 2.4636 2.4636 2.4636 2.5484 2.5484 2.5484 2.5484 2.8209 2.8209 2.8209 2.8209 3.2027 3.2027 3.2027 3.2027 3.3513 3.3513 3.3513 3.3513 5.6296 5.6296 5.6296 5.6296 5.8171 5.8171 5.8171 5.8171 8.6289 8.6289 8.6289 8.6289 10.6372 10.6372 10.6372 10.6372 12.1223 12.1223 k = 0.0143 0.5000 0.2978 ( 5512 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5524 -7.5524 -7.5518 -7.5518 -7.2678 -7.2678 -7.2641 -7.2641 -7.1511 -7.1511 -7.1480 -7.1480 -5.4443 -5.4443 -5.4441 -5.4441 2.2427 2.2427 2.2475 2.2475 2.4597 2.4597 2.4633 2.4633 2.5498 2.5498 2.5551 2.5551 2.8112 2.8112 2.8307 2.8307 3.2013 3.2013 3.2050 3.2050 3.3482 3.3482 3.3556 3.3556 5.6233 5.6233 5.6306 5.6306 5.8129 5.8129 5.8178 5.8178 8.6307 8.6307 8.6346 8.6346 10.6358 10.6358 10.6390 10.6390 12.1206 12.1206 k = 0.0286 0.5000 0.2978 ( 5516 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5523 -7.5523 -7.5510 -7.5510 -7.2697 -7.2697 -7.2623 -7.2623 -7.1529 -7.1529 -7.1467 -7.1467 -5.4448 -5.4448 -5.4444 -5.4444 2.2357 2.2357 2.2454 2.2454 2.4533 2.4533 2.4596 2.4596 2.5575 2.5575 2.5690 2.5690 2.8016 2.8016 2.8407 2.8407 3.2007 3.2007 3.2081 3.2081 3.3464 3.3464 3.3611 3.3611 5.6118 5.6118 5.6261 5.6261 5.8055 5.8055 5.8148 5.8148 8.6399 8.6399 8.6477 8.6477 10.6347 10.6347 10.6412 10.6412 12.1172 12.1172 k = 0.0429 0.5000 0.2978 ( 5528 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5518 -7.5518 -7.5500 -7.5500 -7.2716 -7.2716 -7.2606 -7.2606 -7.1549 -7.1549 -7.1456 -7.1456 -5.4456 -5.4456 -5.4450 -5.4450 2.2259 2.2259 2.2403 2.2403 2.4466 2.4466 2.4548 2.4548 2.5686 2.5686 2.5880 2.5880 2.7922 2.7922 2.8512 2.8512 3.2007 3.2007 3.2119 3.2119 3.3461 3.3461 3.3679 3.3679 5.5954 5.5954 5.6158 5.6158 5.7952 5.7952 5.8080 5.8080 8.6564 8.6564 8.6679 8.6679 10.6338 10.6338 10.6435 10.6435 12.1114 12.1114 k = 0.0571 0.5000 0.2978 ( 5512 PWs) bands (ev): -23.7356 -23.7356 -23.7356 -23.7356 -7.5510 -7.5510 -7.5486 -7.5486 -7.2734 -7.2734 -7.2588 -7.2588 -7.1570 -7.1570 -7.1446 -7.1446 -5.4466 -5.4466 -5.4458 -5.4458 2.2137 2.2137 2.2325 2.2325 2.4412 2.4412 2.4507 2.4507 2.5812 2.5812 2.6100 2.6100 2.7834 2.7834 2.8623 2.8623 3.2012 3.2012 3.2163 3.2163 3.3475 3.3475 3.3760 3.3760 5.5743 5.5743 5.5998 5.5998 5.7825 5.7825 5.7977 5.7977 8.6799 8.6799 8.6950 8.6950 10.6330 10.6330 10.6459 10.6459 12.1022 12.1022 k = 0.0714 0.5000 0.2978 ( 5508 PWs) bands (ev): -23.7356 -23.7356 -23.7356 -23.7356 -7.5500 -7.5500 -7.5469 -7.5469 -7.2753 -7.2753 -7.2570 -7.2570 -7.1592 -7.1592 -7.1438 -7.1438 -5.4478 -5.4478 -5.4468 -5.4468 2.1993 2.1993 2.2222 2.2222 2.4375 2.4375 2.4480 2.4480 2.5941 2.5941 2.6332 2.6332 2.7757 2.7757 2.8744 2.8744 3.2020 3.2020 3.2208 3.2208 3.3509 3.3509 3.3854 3.3854 5.5488 5.5488 5.5782 5.5782 5.7678 5.7678 5.7840 5.7840 8.7099 8.7099 8.7283 8.7283 10.6320 10.6320 10.6479 10.6479 12.0875 12.0876 k = 0.0857 0.5000 0.2978 ( 5504 PWs) bands (ev): -23.7355 -23.7355 -23.7355 -23.7355 -7.5486 -7.5486 -7.5449 -7.5449 -7.2771 -7.2771 -7.2553 -7.2553 -7.1616 -7.1616 -7.1432 -7.1432 -5.4493 -5.4493 -5.4482 -5.4482 2.1834 2.1834 2.2097 2.2097 2.4356 2.4356 2.4470 2.4470 2.6063 2.6063 2.6561 2.6561 2.7701 2.7701 2.8878 2.8878 3.2030 3.2030 3.2250 3.2250 3.3566 3.3566 3.3961 3.3961 5.5193 5.5193 5.5512 5.5512 5.7512 5.7512 5.7671 5.7671 8.7458 8.7458 8.7673 8.7673 10.6306 10.6306 10.6492 10.6492 12.0654 12.0654 k = 0.1000 0.5000 0.2978 ( 5512 PWs) bands (ev): -23.7354 -23.7354 -23.7354 -23.7354 -7.5471 -7.5471 -7.5427 -7.5427 -7.2789 -7.2789 -7.2536 -7.2536 -7.1641 -7.1641 -7.1427 -7.1427 -5.4510 -5.4510 -5.4497 -5.4497 2.1663 2.1663 2.1955 2.1955 2.4354 2.4354 2.4479 2.4479 2.6175 2.6175 2.6759 2.6759 2.7688 2.7688 2.9025 2.9025 3.2042 3.2042 3.2287 3.2287 3.3650 3.3650 3.4082 3.4082 5.4860 5.4860 5.5194 5.5194 5.7328 5.7328 5.7472 5.7472 8.7871 8.7871 8.8115 8.8115 10.6283 10.6283 10.6496 10.6496 12.0341 12.0341 k = 0.1143 0.5000 0.2978 ( 5512 PWs) bands (ev): -23.7354 -23.7354 -23.7354 -23.7354 -7.5452 -7.5452 -7.5403 -7.5403 -7.2807 -7.2807 -7.2518 -7.2518 -7.1668 -7.1668 -7.1424 -7.1424 -5.4529 -5.4529 -5.4515 -5.4515 2.1484 2.1484 2.1801 2.1801 2.4367 2.4367 2.4506 2.4506 2.6273 2.6273 2.6890 2.6890 2.7751 2.7751 2.9188 2.9188 3.2055 3.2055 3.2314 3.2314 3.3762 3.3762 3.4216 3.4216 5.4495 5.4495 5.4834 5.4834 5.7126 5.7126 5.7246 5.7246 8.8332 8.8332 8.8603 8.8603 10.6250 10.6250 10.6487 10.6487 11.9935 11.9935 k = 0.1286 0.5000 0.2978 ( 5512 PWs) bands (ev): -23.7353 -23.7353 -23.7353 -23.7353 -7.5432 -7.5432 -7.5377 -7.5377 -7.2824 -7.2824 -7.2501 -7.2501 -7.1695 -7.1695 -7.1423 -7.1423 -5.4551 -5.4551 -5.4535 -5.4535 2.1301 2.1301 2.1637 2.1637 2.4391 2.4391 2.4547 2.4547 2.6358 2.6358 2.6936 2.6936 2.7907 2.7907 2.9364 2.9364 3.2070 3.2070 3.2333 3.2333 3.3903 3.3903 3.4362 3.4362 5.4101 5.4101 5.4440 5.4440 5.6905 5.6905 5.6994 5.6994 8.8835 8.8835 8.9130 8.9130 10.6204 10.6204 10.6461 10.6461 11.9452 11.9452 k = 0.1429 0.5000 0.2978 ( 5520 PWs) bands (ev): -23.7352 -23.7352 -23.7352 -23.7352 -7.5410 -7.5410 -7.5349 -7.5349 -7.2841 -7.2841 -7.2484 -7.2484 -7.1723 -7.1723 -7.1423 -7.1423 -5.4574 -5.4574 -5.4557 -5.4557 2.1117 2.1117 2.1466 2.1466 2.4426 2.4426 2.4602 2.4602 2.6431 2.6431 2.6922 2.6922 2.8125 2.8125 2.9551 2.9551 3.2090 3.2090 3.2344 3.2344 3.4071 3.4071 3.4521 3.4521 5.3684 5.3684 5.4018 5.4018 5.6665 5.6665 5.6717 5.6717 8.9375 8.9375 8.9691 8.9691 10.6143 10.6143 10.6417 10.6417 11.8909 11.8909 k = 0.1571 0.5000 0.2978 ( 5520 PWs) bands (ev): -23.7351 -23.7351 -23.7351 -23.7351 -7.5386 -7.5386 -7.5319 -7.5319 -7.2856 -7.2856 -7.2466 -7.2466 -7.1752 -7.1752 -7.1425 -7.1425 -5.4599 -5.4599 -5.4581 -5.4581 2.0933 2.0933 2.1293 2.1293 2.4468 2.4468 2.4669 2.4669 2.6492 2.6492 2.6878 2.6878 2.8372 2.8372 2.9745 2.9745 3.2116 3.2116 3.2349 3.2349 3.4267 3.4267 3.4691 3.4691 5.3249 5.3249 5.3576 5.3576 5.6405 5.6405 5.6418 5.6418 8.9945 8.9945 9.0280 9.0280 10.6066 10.6066 10.6353 10.6353 11.8327 11.8327 k = 0.1714 0.5000 0.2978 ( 5524 PWs) bands (ev): -23.7350 -23.7350 -23.7350 -23.7350 -7.5361 -7.5361 -7.5289 -7.5289 -7.2870 -7.2870 -7.2448 -7.2448 -7.1781 -7.1781 -7.1427 -7.1427 -5.4626 -5.4626 -5.4606 -5.4606 2.0752 2.0752 2.1118 2.1118 2.4516 2.4516 2.4745 2.4745 2.6545 2.6545 2.6824 2.6824 2.8624 2.8624 2.9941 2.9941 3.2153 3.2153 3.2352 3.2352 3.4486 3.4486 3.4873 3.4873 5.2801 5.2801 5.3118 5.3118 5.6096 5.6096 5.6124 5.6124 9.0542 9.0542 9.0894 9.0894 10.5973 10.5973 10.6268 10.6268 11.7720 11.7720 k = 0.1857 0.5000 0.2978 ( 5524 PWs) bands (ev): -23.7349 -23.7349 -23.7349 -23.7349 -7.5335 -7.5335 -7.5258 -7.5258 -7.2882 -7.2882 -7.2430 -7.2430 -7.1811 -7.1811 -7.1432 -7.1432 -5.4654 -5.4654 -5.4634 -5.4634 2.0575 2.0575 2.0943 2.0943 2.4569 2.4569 2.4829 2.4829 2.6593 2.6593 2.6768 2.6768 2.8867 2.8867 3.0132 3.0132 3.2205 3.2205 3.2359 3.2359 3.4729 3.4729 3.5065 3.5065 5.2344 5.2344 5.2651 5.2651 5.5754 5.5754 5.5822 5.5822 9.1159 9.1159 9.1526 9.1526 10.5865 10.5865 10.6163 10.6163 11.7099 11.7099 k = 0.2000 0.5000 0.2978 ( 5528 PWs) bands (ev): -23.7348 -23.7348 -23.7348 -23.7348 -7.5308 -7.5308 -7.5226 -7.5226 -7.2893 -7.2893 -7.2411 -7.2411 -7.1842 -7.1842 -7.1437 -7.1437 -5.4684 -5.4684 -5.4662 -5.4662 2.0402 2.0402 2.0770 2.0770 2.4625 2.4625 2.4920 2.4920 2.6637 2.6637 2.6715 2.6715 2.9091 2.9091 3.0311 3.0311 3.2277 3.2277 3.2374 3.2374 3.4993 3.4993 3.5269 3.5269 5.1883 5.1883 5.2180 5.2180 5.5392 5.5392 5.5500 5.5500 9.1794 9.1794 9.2174 9.2174 10.5742 10.5742 10.6040 10.6040 11.6474 11.6474 k = 0.2143 0.5000 0.2978 ( 5524 PWs) bands (ev): -23.7347 -23.7347 -23.7347 -23.7347 -7.5281 -7.5281 -7.5195 -7.5195 -7.2901 -7.2901 -7.2392 -7.2392 -7.1872 -7.1872 -7.1444 -7.1444 -5.4714 -5.4714 -5.4692 -5.4692 2.0234 2.0234 2.0599 2.0599 2.4684 2.4684 2.5017 2.5017 2.6668 2.6668 2.6680 2.6680 2.9287 2.9287 3.0470 3.0470 3.2374 3.2374 3.2404 3.2404 3.5278 3.5278 3.5484 3.5484 5.1421 5.1421 5.1709 5.1709 5.5010 5.5010 5.5157 5.5157 9.2442 9.2442 9.2834 9.2834 10.5607 10.5607 10.5902 10.5902 11.5852 11.5852 k = 0.2286 0.5000 0.2978 ( 5528 PWs) bands (ev): -23.7346 -23.7346 -23.7346 -23.7346 -7.5254 -7.5254 -7.5164 -7.5164 -7.2907 -7.2907 -7.2371 -7.2371 -7.1903 -7.1903 -7.1452 -7.1452 -5.4745 -5.4745 -5.4723 -5.4723 2.0073 2.0073 2.0432 2.0432 2.4744 2.4744 2.5117 2.5117 2.6628 2.6628 2.6723 2.6723 2.9449 2.9449 3.0600 3.0600 3.2453 3.2453 3.2497 3.2497 3.5583 3.5583 3.5711 3.5711 5.0963 5.0963 5.1242 5.1242 5.4611 5.4611 5.4794 5.4794 9.3100 9.3100 9.3502 9.3502 10.5462 10.5462 10.5750 10.5750 11.5238 11.5238 k = 0.2429 0.5000 0.2978 ( 5536 PWs) bands (ev): -23.7345 -23.7345 -23.7345 -23.7345 -7.5227 -7.5227 -7.5134 -7.5134 -7.2911 -7.2911 -7.2350 -7.2350 -7.1934 -7.1934 -7.1461 -7.1461 -5.4777 -5.4777 -5.4755 -5.4755 1.9918 1.9918 2.0270 2.0270 2.4805 2.4805 2.5218 2.5218 2.6596 2.6596 2.6767 2.6767 2.9575 2.9575 3.0697 3.0697 3.2527 3.2527 3.2647 3.2647 3.5907 3.5907 3.5952 3.5952 5.0512 5.0512 5.0783 5.0783 5.4194 5.4194 5.4412 5.4412 9.3765 9.3765 9.4176 9.4176 10.5311 10.5311 10.5588 10.5588 11.4636 11.4636 k = 0.2571 0.5000 0.2978 ( 5520 PWs) bands (ev): -23.7343 -23.7343 -23.7343 -23.7343 -7.5200 -7.5200 -7.5105 -7.5105 -7.2912 -7.2912 -7.2328 -7.2328 -7.1966 -7.1966 -7.1471 -7.1471 -5.4809 -5.4809 -5.4787 -5.4787 1.9772 1.9772 2.0113 2.0113 2.4867 2.4867 2.5321 2.5321 2.6574 2.6574 2.6813 2.6813 2.9665 2.9665 3.0759 3.0759 3.2627 3.2627 3.2823 3.2823 3.6207 3.6207 3.6250 3.6250 5.0070 5.0070 5.0334 5.0334 5.3761 5.3761 5.4011 5.4011 9.4433 9.4433 9.4853 9.4853 10.5156 10.5156 10.5421 10.5421 11.4049 11.4049 k = 0.2714 0.5000 0.2978 ( 5500 PWs) bands (ev): -23.7342 -23.7342 -23.7342 -23.7342 -7.5174 -7.5174 -7.5077 -7.5077 -7.2910 -7.2910 -7.2305 -7.2305 -7.1997 -7.1997 -7.1483 -7.1483 -5.4842 -5.4842 -5.4819 -5.4819 1.9632 1.9632 1.9962 1.9962 2.4930 2.4930 2.5423 2.5423 2.6560 2.6560 2.6860 2.6860 2.9722 2.9722 3.0787 3.0787 3.2749 3.2749 3.3016 3.3016 3.6478 3.6478 3.6610 3.6610 4.9641 4.9641 4.9900 4.9900 5.3314 5.3314 5.3594 5.3594 9.5102 9.5102 9.5530 9.5530 10.5002 10.5002 10.5253 10.5253 11.3479 11.3479 k = 0.2857 0.5000 0.2978 ( 5500 PWs) bands (ev): -23.7341 -23.7341 -23.7341 -23.7341 -7.5149 -7.5149 -7.5052 -7.5052 -7.2904 -7.2904 -7.2281 -7.2281 -7.2028 -7.2028 -7.1496 -7.1496 -5.4874 -5.4874 -5.4852 -5.4852 1.9500 1.9500 1.9817 1.9817 2.4993 2.4993 2.5522 2.5522 2.6556 2.6556 2.6907 2.6907 2.9752 2.9752 3.0786 3.0786 3.2888 3.2888 3.3221 3.3221 3.6766 3.6766 3.6988 3.6988 4.9227 4.9227 4.9481 4.9481 5.2854 5.2854 5.3160 5.3160 9.5769 9.5769 9.6205 9.6205 10.4852 10.4852 10.5086 10.5086 11.2929 11.2929 k = 0.3000 0.5000 0.2978 ( 5492 PWs) bands (ev): -23.7340 -23.7340 -23.7339 -23.7339 -7.5125 -7.5125 -7.5029 -7.5029 -7.2896 -7.2896 -7.2255 -7.2255 -7.2059 -7.2059 -7.1509 -7.1509 -5.4905 -5.4905 -5.4884 -5.4884 1.9377 1.9377 1.9679 1.9679 2.5057 2.5057 2.5618 2.5618 2.6560 2.6560 2.6953 2.6953 2.9760 2.9760 3.0761 3.0761 3.3037 3.3037 3.3428 3.3428 3.7074 3.7074 3.7382 3.7382 4.8829 4.8829 4.9080 4.9080 5.2382 5.2382 5.2712 5.2712 9.6430 9.6430 9.6872 9.6872 10.4709 10.4709 10.4927 10.4927 11.2398 11.2398 k = 0.3143 0.5000 0.2978 ( 5500 PWs) bands (ev): -23.7338 -23.7338 -23.7338 -23.7338 -7.5103 -7.5103 -7.5008 -7.5008 -7.2885 -7.2885 -7.2229 -7.2229 -7.2091 -7.2091 -7.1525 -7.1525 -5.4936 -5.4936 -5.4915 -5.4915 1.9261 1.9261 1.9547 1.9547 2.5123 2.5123 2.5709 2.5709 2.6571 2.6571 2.6997 2.6997 2.9753 2.9753 3.0719 3.0719 3.3192 3.3192 3.3631 3.3631 3.7402 3.7402 3.7790 3.7790 4.8450 4.8450 4.8699 4.8699 5.1901 5.1901 5.2251 5.2251 9.7081 9.7081 9.7529 9.7529 10.4579 10.4579 10.4781 10.4781 11.1888 11.1888 k = 0.3286 0.5000 0.2978 ( 5500 PWs) bands (ev): -23.7337 -23.7337 -23.7337 -23.7337 -7.5081 -7.5081 -7.4989 -7.4989 -7.2870 -7.2870 -7.2202 -7.2202 -7.2122 -7.2122 -7.1541 -7.1541 -5.4966 -5.4966 -5.4946 -5.4946 1.9155 1.9155 1.9423 1.9423 2.5190 2.5190 2.5796 2.5796 2.6588 2.6588 2.7038 2.7038 2.9735 2.9735 3.0665 3.0665 3.3347 3.3347 3.3824 3.3824 3.7750 3.7750 3.8211 3.8211 4.8090 4.8090 4.8341 4.8341 5.1413 5.1413 5.1778 5.1778 9.7717 9.7717 9.8170 9.8170 10.4467 10.4467 10.4652 10.4652 11.1399 11.1399 k = 0.3429 0.5000 0.2978 ( 5508 PWs) bands (ev): -23.7336 -23.7336 -23.7336 -23.7336 -7.5061 -7.5061 -7.4973 -7.4973 -7.2852 -7.2852 -7.2174 -7.2174 -7.2153 -7.2153 -7.1558 -7.1558 -5.4995 -5.4995 -5.4976 -5.4976 1.9057 1.9057 1.9306 1.9306 2.5259 2.5259 2.5878 2.5878 2.6608 2.6608 2.7073 2.7073 2.9713 2.9713 3.0602 3.0602 3.3500 3.3500 3.4002 3.4002 3.8119 3.8119 3.8644 3.8644 4.7750 4.7750 4.8005 4.8005 5.0921 5.0921 5.1297 5.1297 9.8332 9.8332 9.8788 9.8788 10.4377 10.4377 10.4548 10.4548 11.0930 11.0930 k = 0.3571 0.5000 0.2978 ( 5496 PWs) bands (ev): -23.7335 -23.7335 -23.7335 -23.7335 -7.5043 -7.5043 -7.4959 -7.4959 -7.2832 -7.2832 -7.2187 -7.2187 -7.2142 -7.2142 -7.1577 -7.1577 -5.5022 -5.5022 -5.5004 -5.5004 1.8968 1.8968 1.9198 1.9198 2.5331 2.5331 2.5955 2.5955 2.6629 2.6629 2.7102 2.7102 2.9690 2.9690 3.0534 3.0534 3.3649 3.3649 3.4162 3.4162 3.8507 3.8507 3.9086 3.9086 4.7432 4.7432 4.7694 4.7694 5.0427 5.0427 5.0809 5.0809 9.8918 9.8918 9.9374 9.9374 10.4318 10.4318 10.4478 10.4478 11.0481 11.0481 k = 0.3714 0.5000 0.2978 ( 5492 PWs) bands (ev): -23.7334 -23.7334 -23.7334 -23.7334 -7.5026 -7.5026 -7.4948 -7.4948 -7.2809 -7.2809 -7.2219 -7.2219 -7.2112 -7.2112 -7.1597 -7.1597 -5.5047 -5.5047 -5.5030 -5.5030 1.8888 1.8888 1.9098 1.9098 2.5405 2.5405 2.6027 2.6027 2.6649 2.6649 2.7123 2.7123 2.9671 2.9671 3.0462 3.0462 3.3790 3.3790 3.4301 3.4301 3.8912 3.8912 3.9534 3.9534 4.7135 4.7135 4.7409 4.7409 4.9937 4.9937 5.0317 5.0317 9.9467 9.9467 9.9916 9.9916 10.4296 10.4296 10.4452 10.4452 11.0049 11.0049 k = 0.3857 0.5000 0.2978 ( 5492 PWs) bands (ev): -23.7334 -23.7334 -23.7334 -23.7334 -7.5010 -7.5010 -7.4939 -7.4939 -7.2783 -7.2783 -7.2252 -7.2252 -7.2081 -7.2081 -7.1618 -7.1618 -5.5070 -5.5070 -5.5055 -5.5055 1.8818 1.8818 1.9006 1.9006 2.5482 2.5482 2.6094 2.6094 2.6665 2.6665 2.7135 2.7135 2.9657 2.9657 3.0389 3.0389 3.3925 3.3925 3.4419 3.4419 3.9331 3.9331 3.9984 3.9984 4.6859 4.6859 4.7149 4.7149 4.9455 4.9455 4.9824 4.9824 9.9967 9.9967 10.0399 10.0399 10.4322 10.4322 10.4484 10.4484 10.9634 10.9634 k = 0.4000 0.5000 0.2978 ( 5492 PWs) bands (ev): -23.7333 -23.7333 -23.7333 -23.7333 -7.4996 -7.4996 -7.4932 -7.4932 -7.2755 -7.2755 -7.2285 -7.2285 -7.2050 -7.2050 -7.1640 -7.1640 -5.5091 -5.5091 -5.5078 -5.5078 1.8758 1.8758 1.8924 1.8924 2.5561 2.5561 2.6154 2.6154 2.6678 2.6678 2.7136 2.7136 2.9651 2.9651 3.0316 3.0316 3.4050 3.4050 3.4515 3.4515 3.9759 3.9759 4.0431 4.0431 4.6603 4.6603 4.6914 4.6914 4.8987 4.8987 4.9337 4.9337 10.0406 10.0406 10.0808 10.0808 10.4406 10.4406 10.4587 10.4587 10.9233 10.9233 k = 0.4143 0.5000 0.2978 ( 5496 PWs) bands (ev): -23.7332 -23.7332 -23.7332 -23.7332 -7.4983 -7.4983 -7.4927 -7.4927 -7.2725 -7.2725 -7.2318 -7.2318 -7.2018 -7.2018 -7.1664 -7.1664 -5.5110 -5.5110 -5.5098 -5.5098 1.8706 1.8706 1.8850 1.8850 2.5642 2.5642 2.6204 2.6204 2.6689 2.6689 2.7128 2.7128 2.9654 2.9654 3.0243 3.0243 3.4167 3.4167 3.4591 3.4591 4.0193 4.0193 4.0868 4.0868 4.6367 4.6367 4.6704 4.6704 4.8543 4.8543 4.8860 4.8860 10.0774 10.0774 10.1132 10.1132 10.4555 10.4555 10.4769 10.4769 10.8843 10.8843 k = 0.4286 0.5000 0.2978 ( 5488 PWs) bands (ev): -23.7332 -23.7332 -23.7332 -23.7332 -7.4972 -7.4972 -7.4924 -7.4924 -7.2694 -7.2694 -7.2352 -7.2352 -7.1986 -7.1986 -7.1688 -7.1688 -5.5125 -5.5125 -5.5115 -5.5115 1.8665 1.8665 1.8785 1.8785 2.5724 2.5724 2.6240 2.6240 2.6702 2.6702 2.7109 2.7109 2.9667 2.9667 3.0173 3.0173 3.4275 3.4275 3.4645 3.4645 4.0625 4.0625 4.1286 4.1286 4.6152 4.6152 4.6516 4.6516 4.8134 4.8134 4.8403 4.8403 10.1065 10.1065 10.1367 10.1367 10.4770 10.4770 10.5029 10.5029 10.8462 10.8462 k = 0.4429 0.5000 0.2978 ( 5496 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4962 -7.4962 -7.4923 -7.4923 -7.2662 -7.2662 -7.2386 -7.2386 -7.1954 -7.1954 -7.1714 -7.1714 -5.5138 -5.5138 -5.5130 -5.5130 1.8633 1.8633 1.8730 1.8730 2.5807 2.5807 2.6257 2.6257 2.6723 2.6723 2.7081 2.7081 2.9690 2.9690 3.0104 3.0104 3.4371 3.4371 3.4680 3.4680 4.1045 4.1045 4.1667 4.1667 4.5959 4.5959 4.6345 4.6345 4.7773 4.7773 4.7981 4.7981 10.1285 10.1285 10.1524 10.1524 10.5045 10.5045 10.5354 10.5354 10.8088 10.8088 k = 0.4571 0.5000 0.2978 ( 5496 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4953 -7.4953 -7.4923 -7.4923 -7.2628 -7.2628 -7.2420 -7.2420 -7.1922 -7.1922 -7.1741 -7.1741 -5.5148 -5.5148 -5.5142 -5.5142 1.8611 1.8611 1.8684 1.8684 2.5889 2.5889 2.6250 2.6250 2.6754 2.6754 2.7044 2.7044 2.9721 2.9721 3.0039 3.0039 3.4457 3.4457 3.4696 3.4696 4.1443 4.1443 4.1989 4.1989 4.5799 4.5799 4.6182 4.6182 4.7476 4.7476 4.7614 4.7614 10.1443 10.1443 10.1619 10.1619 10.5366 10.5366 10.5720 10.5720 10.7720 10.7720 k = 0.4714 0.5000 0.2978 ( 5492 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4945 -7.4945 -7.4925 -7.4925 -7.2594 -7.2594 -7.2455 -7.2455 -7.1890 -7.1890 -7.1769 -7.1769 -5.5155 -5.5155 -5.5151 -5.5151 1.8598 1.8598 1.8647 1.8647 2.5969 2.5969 2.6222 2.6222 2.6796 2.6796 2.7000 2.7000 2.9761 2.9761 2.9975 2.9975 3.4532 3.4532 3.4694 3.4694 4.1798 4.1798 4.2217 4.2217 4.5692 4.5692 4.6018 4.6018 4.7255 4.7255 4.7329 4.7329 10.1551 10.1551 10.1667 10.1667 10.5714 10.5714 10.6097 10.6097 10.7369 10.7369 k = 0.4857 0.5000 0.2978 ( 5488 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4938 -7.4938 -7.4928 -7.4928 -7.2559 -7.2559 -7.2489 -7.2489 -7.1859 -7.1859 -7.1798 -7.1798 -5.5159 -5.5159 -5.5157 -5.5157 1.8596 1.8596 1.8620 1.8620 2.6046 2.6046 2.6176 2.6176 2.6846 2.6846 2.6951 2.6951 2.9807 2.9807 2.9915 2.9915 3.4593 3.4593 3.4676 3.4676 4.2086 4.2086 4.2317 4.2317 4.5664 4.5664 4.5858 4.5858 4.7120 4.7120 4.7149 4.7149 10.1623 10.1623 10.1679 10.1679 10.6068 10.6068 10.6408 10.6408 10.7093 10.7093 k = 0.5000 0.5000 0.2978 ( 5480 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4932 -7.4932 -7.4932 -7.4932 -7.2524 -7.2524 -7.2524 -7.2524 -7.1828 -7.1828 -7.1828 -7.1828 -5.5160 -5.5160 -5.5160 -5.5160 1.8603 1.8603 1.8603 1.8603 2.6116 2.6116 2.6116 2.6116 2.6898 2.6898 2.6898 2.6898 2.9859 2.9859 2.9859 2.9859 3.4642 3.4642 3.4642 3.4642 4.2270 4.2270 4.2270 4.2270 4.5726 4.5726 4.5726 4.5726 4.7082 4.7082 4.7082 4.7082 10.1664 10.1664 10.1664 10.1664 10.6376 10.6376 10.6376 10.6376 10.7159 10.7159 k = 0.5000 0.5000 0.2978 ( 5480 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4932 -7.4932 -7.4932 -7.4932 -7.2524 -7.2524 -7.2524 -7.2524 -7.1828 -7.1828 -7.1828 -7.1828 -5.5160 -5.5160 -5.5160 -5.5160 1.8603 1.8603 1.8603 1.8603 2.6116 2.6116 2.6116 2.6116 2.6898 2.6898 2.6898 2.6898 2.9859 2.9859 2.9859 2.9859 3.4642 3.4642 3.4642 3.4642 4.2270 4.2270 4.2270 4.2270 4.5726 4.5726 4.5726 4.5726 4.7082 4.7082 4.7082 4.7082 10.1664 10.1664 10.1664 10.1664 10.6376 10.6376 10.6376 10.6376 10.7159 10.7159 k = 0.4900 0.4900 0.2978 ( 5480 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4938 -7.4938 -7.4928 -7.4928 -7.2559 -7.2559 -7.2490 -7.2490 -7.1858 -7.1858 -7.1798 -7.1798 -5.5159 -5.5159 -5.5157 -5.5157 1.8594 1.8594 1.8623 1.8623 2.6046 2.6046 2.6176 2.6176 2.6846 2.6846 2.6950 2.6950 2.9808 2.9808 2.9915 2.9915 3.4593 3.4593 3.4676 3.4676 4.2085 4.2085 4.2321 4.2321 4.5663 4.5663 4.5859 4.5859 4.7086 4.7086 4.7180 4.7180 10.1616 10.1616 10.1688 10.1688 10.6018 10.6018 10.6515 10.6515 10.7017 10.7017 k = 0.4800 0.4800 0.2978 ( 5496 PWs) bands (ev): -23.7331 -23.7331 -23.7330 -23.7330 -7.4944 -7.4944 -7.4925 -7.4925 -7.2593 -7.2593 -7.2455 -7.2455 -7.1889 -7.1889 -7.1770 -7.1770 -5.5156 -5.5156 -5.5151 -5.5151 1.8581 1.8581 1.8664 1.8664 2.5968 2.5968 2.6224 2.6224 2.6797 2.6797 2.6999 2.6999 2.9760 2.9760 2.9976 2.9976 3.4528 3.4528 3.4700 3.4700 4.1785 4.1785 4.2243 4.2243 4.5686 4.5686 4.6040 4.6040 4.7105 4.7105 4.7447 4.7447 10.1510 10.1510 10.1720 10.1720 10.5486 10.5486 10.6554 10.6554 10.7064 10.7064 k = 0.4700 0.4700 0.2978 ( 5500 PWs) bands (ev): -23.7332 -23.7332 -23.7330 -23.7330 -7.4952 -7.4952 -7.4924 -7.4924 -7.2627 -7.2627 -7.2421 -7.2421 -7.1921 -7.1921 -7.1742 -7.1742 -5.5149 -5.5149 -5.5142 -5.5142 1.8564 1.8564 1.8729 1.8729 2.5883 2.5883 2.6257 2.6257 2.6755 2.6755 2.7043 2.7043 2.9716 2.9716 3.0042 3.0042 3.4444 3.4444 3.4716 3.4716 4.1393 4.1393 4.2067 4.2067 4.5789 4.5789 4.6260 4.6260 4.7144 4.7144 4.7839 4.7839 10.1344 10.1344 10.1770 10.1770 10.4875 10.4875 10.6564 10.6564 10.7214 10.7214 k = 0.4600 0.4600 0.2978 ( 5504 PWs) bands (ev): -23.7333 -23.7333 -23.7330 -23.7330 -7.4960 -7.4960 -7.4924 -7.4924 -7.2661 -7.2661 -7.2388 -7.2388 -7.1952 -7.1952 -7.1715 -7.1715 -5.5141 -5.5141 -5.5130 -5.5130 1.8540 1.8540 1.8820 1.8820 2.5790 2.5790 2.6271 2.6271 2.6725 2.6725 2.7080 2.7080 2.9676 2.9676 3.0114 3.0114 3.4342 3.4342 3.4727 3.4727 4.0934 4.0934 4.1831 4.1831 4.5954 4.5954 4.6500 4.6500 4.7218 4.7218 4.8311 4.8311 10.1127 10.1127 10.1840 10.1840 10.4222 10.4222 10.6565 10.6565 10.7435 10.7435 k = 0.4500 0.4500 0.2978 ( 5496 PWs) bands (ev): -23.7335 -23.7335 -23.7329 -23.7329 -7.4968 -7.4968 -7.4925 -7.4925 -7.2693 -7.2693 -7.2354 -7.2354 -7.1983 -7.1983 -7.1689 -7.1689 -5.5130 -5.5130 -5.5115 -5.5115 1.8511 1.8511 1.8937 1.8937 2.5691 2.5691 2.6262 2.6262 2.6712 2.6712 2.7108 2.7108 2.9640 2.9640 3.0192 3.0192 3.4225 3.4225 3.4736 3.4736 4.0429 4.0429 4.1565 4.1565 4.6164 4.6164 4.6720 4.6720 4.7366 4.7366 4.8831 4.8831 10.0867 10.0867 10.1929 10.1929 10.3546 10.3546 10.6561 10.6561 10.7709 10.7709 k = 0.4400 0.4400 0.2978 ( 5498 PWs) bands (ev): -23.7336 -23.7336 -23.7328 -23.7328 -7.4977 -7.4977 -7.4928 -7.4928 -7.2725 -7.2725 -7.2322 -7.2322 -7.2015 -7.2015 -7.1665 -7.1665 -5.5119 -5.5119 -5.5097 -5.5097 1.8477 1.8477 1.9078 1.9078 2.5586 2.5586 2.6228 2.6228 2.6716 2.6716 2.7125 2.7125 2.9607 2.9607 3.0276 3.0276 3.4093 3.4093 3.4743 3.4743 3.9894 3.9894 4.1289 4.1289 4.6408 4.6408 4.6876 4.6876 4.7622 4.7622 4.9378 4.9378 10.0574 10.0574 10.2034 10.2034 10.2863 10.2863 10.6555 10.6555 10.8029 10.8029 k = 0.4300 0.4300 0.2978 ( 5500 PWs) bands (ev): -23.7339 -23.7339 -23.7327 -23.7327 -7.4986 -7.4986 -7.4933 -7.4933 -7.2755 -7.2755 -7.2291 -7.2291 -7.2045 -7.2045 -7.1641 -7.1641 -5.5106 -5.5106 -5.5077 -5.5077 1.8439 1.8439 1.9243 1.9243 2.5475 2.5475 2.6174 2.6174 2.6730 2.6730 2.7129 2.7129 2.9579 2.9579 3.0366 3.0366 3.3952 3.3952 3.4749 3.4749 3.9342 3.9342 4.1017 4.1017 4.6670 4.6670 4.6987 4.6987 4.7970 4.7970 4.9938 4.9938 10.0256 10.0256 10.2081 10.2081 10.2255 10.2255 10.6547 10.6547 10.8389 10.8389 k = 0.4200 0.4200 0.2978 ( 5504 PWs) bands (ev): -23.7341 -23.7341 -23.7327 -23.7327 -7.4995 -7.4995 -7.4939 -7.4939 -7.2785 -7.2785 -7.2261 -7.2261 -7.2074 -7.2074 -7.1618 -7.1618 -5.5092 -5.5092 -5.5055 -5.5055 1.8398 1.8398 1.9432 1.9432 2.5359 2.5359 2.6103 2.6103 2.6751 2.6751 2.7118 2.7118 2.9557 2.9557 3.0462 3.0462 3.3804 3.3804 3.4755 3.4755 3.8784 3.8784 4.0755 4.0755 4.6894 4.6894 4.7135 4.7135 4.8370 4.8370 5.0501 5.0501 9.9920 9.9920 10.1472 10.1472 10.2330 10.2330 10.6537 10.6537 10.8784 10.8784 k = 0.4100 0.4100 0.2978 ( 5504 PWs) bands (ev): -23.7344 -23.7344 -23.7326 -23.7326 -7.5003 -7.5003 -7.4947 -7.4947 -7.2813 -7.2813 -7.2233 -7.2233 -7.2102 -7.2102 -7.1596 -7.1596 -5.5079 -5.5079 -5.5031 -5.5031 1.8356 1.8356 1.9642 1.9642 2.5238 2.5238 2.6020 2.6020 2.6772 2.6772 2.7092 2.7092 2.9540 2.9540 3.0562 3.0562 3.3653 3.3653 3.4761 3.4761 3.8227 3.8227 4.0511 4.0511 4.7004 4.7004 4.7411 4.7411 4.8801 4.8801 5.1061 5.1061 9.9571 9.9571 10.0807 10.0807 10.2494 10.2494 10.6525 10.6525 10.9210 10.9210 k = 0.4000 0.4000 0.2978 ( 5500 PWs) bands (ev): -23.7347 -23.7347 -23.7324 -23.7324 -7.5011 -7.5011 -7.4957 -7.4957 -7.2839 -7.2839 -7.2208 -7.2208 -7.2126 -7.2126 -7.1575 -7.1575 -5.5067 -5.5067 -5.5006 -5.5006 1.8312 1.8312 1.9874 1.9874 2.5113 2.5113 2.5925 2.5925 2.6792 2.6792 2.7050 2.7050 2.9530 2.9530 3.0666 3.0666 3.3501 3.3501 3.4767 3.4767 3.7679 3.7679 4.0289 4.0289 4.7066 4.7066 4.7755 4.7755 4.9249 4.9249 5.1614 5.1614 9.9216 9.9216 10.0160 10.0160 10.2679 10.2679 10.6510 10.6510 10.9665 10.9665 k = 0.3900 0.3900 0.2978 ( 5500 PWs) bands (ev): -23.7350 -23.7350 -23.7323 -23.7323 -7.5019 -7.5019 -7.4967 -7.4967 -7.2864 -7.2864 -7.2190 -7.2190 -7.2142 -7.2142 -7.1555 -7.1555 -5.5056 -5.5056 -5.4981 -5.4981 1.8269 1.8269 2.0125 2.0125 2.4984 2.4984 2.5820 2.5820 2.6807 2.6807 2.6989 2.6989 2.9527 2.9527 3.0773 3.0773 3.3350 3.3350 3.4773 3.4773 3.7148 3.7148 4.0093 4.0093 4.7116 4.7116 4.8129 4.8129 4.9709 4.9709 5.2154 5.2154 9.8856 9.8856 9.9537 9.9537 10.2883 10.2883 10.6493 10.6493 11.0145 11.0145 k = 0.3800 0.3800 0.2978 ( 5496 PWs) bands (ev): -23.7353 -23.7353 -23.7322 -23.7322 -7.5026 -7.5026 -7.4979 -7.4979 -7.2886 -7.2886 -7.2195 -7.2195 -7.2136 -7.2136 -7.1536 -7.1536 -5.5048 -5.5048 -5.4956 -5.4956 1.8227 1.8227 2.0392 2.0392 2.4852 2.4852 2.5705 2.5705 2.6815 2.6815 2.6910 2.6910 2.9532 2.9532 3.0879 3.0879 3.3200 3.3200 3.4779 3.4779 3.6645 3.6645 3.9925 3.9925 4.7164 4.7164 4.8524 4.8524 5.0175 5.0175 5.2679 5.2679 9.8494 9.8494 9.8946 9.8946 10.3106 10.3106 10.6473 10.6473 11.0649 11.0649 k = 0.3700 0.3700 0.2978 ( 5488 PWs) bands (ev): -23.7357 -23.7357 -23.7320 -23.7320 -7.5033 -7.5033 -7.4990 -7.4990 -7.2907 -7.2907 -7.2212 -7.2212 -7.2116 -7.2116 -7.1518 -7.1518 -5.5042 -5.5042 -5.4932 -5.4932 1.8188 1.8188 2.0675 2.0675 2.4718 2.4718 2.5581 2.5581 2.6812 2.6812 2.6816 2.6816 2.9546 2.9546 3.0984 3.0984 3.3050 3.3050 3.4781 3.4781 3.6181 3.6181 3.9788 3.9788 4.7211 4.7211 4.8936 4.8936 5.0644 5.0644 5.3186 5.3186 9.8117 9.8117 9.8405 9.8405 10.3345 10.3345 10.6449 10.6449 11.1173 11.1173 k = 0.3600 0.3600 0.2978 ( 5490 PWs) bands (ev): -23.7361 -23.7361 -23.7319 -23.7319 -7.5042 -7.5042 -7.5000 -7.5000 -7.2925 -7.2925 -7.2230 -7.2230 -7.2095 -7.2095 -7.1500 -7.1500 -5.5040 -5.5040 -5.4909 -5.4909 1.8152 1.8152 2.0968 2.0968 2.4581 2.4581 2.5448 2.5448 2.6695 2.6695 2.6807 2.6807 2.9568 2.9568 3.1083 3.1083 3.2896 3.2896 3.4773 3.4773 3.5775 3.5775 3.9684 3.9684 4.7260 4.7260 4.9361 4.9361 5.1113 5.1113 5.3673 5.3673 9.7691 9.7691 9.7952 9.7952 10.3601 10.3601 10.6421 10.6421 11.1716 11.1716 k = 0.3500 0.3500 0.2978 ( 5504 PWs) bands (ev): -23.7366 -23.7366 -23.7317 -23.7317 -7.5054 -7.5054 -7.5006 -7.5006 -7.2941 -7.2941 -7.2248 -7.2248 -7.2074 -7.2074 -7.1484 -7.1484 -5.5041 -5.5041 -5.4888 -5.4888 1.8120 1.8120 2.1266 2.1266 2.4444 2.4444 2.5310 2.5310 2.6560 2.6560 2.6789 2.6789 2.9597 2.9597 3.1173 3.1173 3.2735 3.2735 3.4736 3.4736 3.5459 3.5459 3.9615 3.9615 4.7311 4.7311 4.9799 4.9799 5.1579 5.1579 5.4139 5.4139 9.7215 9.7215 9.7592 9.7592 10.3871 10.3871 10.6387 10.6387 11.2273 11.2273 k = 0.3400 0.3400 0.2978 ( 5512 PWs) bands (ev): -23.7370 -23.7370 -23.7316 -23.7316 -7.5069 -7.5069 -7.5008 -7.5008 -7.2954 -7.2954 -7.2264 -7.2264 -7.2053 -7.2053 -7.1469 -7.1469 -5.5048 -5.5048 -5.4869 -5.4869 1.8094 1.8094 2.1562 2.1562 2.4306 2.4306 2.5172 2.5172 2.6408 2.6408 2.6762 2.6762 2.9632 2.9632 3.1244 3.1244 3.2568 3.2568 3.4649 3.4649 3.5270 3.5270 3.9582 3.9582 4.7364 4.7364 5.0247 5.0247 5.2039 5.2039 5.4583 5.4583 9.6738 9.6738 9.7277 9.7277 10.4154 10.4154 10.6348 10.6348 11.2842 11.2842 k = 0.3300 0.3300 0.2978 ( 5512 PWs) bands (ev): -23.7375 -23.7375 -23.7314 -23.7314 -7.5086 -7.5086 -7.5006 -7.5006 -7.2964 -7.2964 -7.2278 -7.2278 -7.2033 -7.2033 -7.1454 -7.1454 -5.5059 -5.5059 -5.4853 -5.4853 1.8074 1.8074 2.1845 2.1845 2.4170 2.4170 2.5040 2.5040 2.6240 2.6240 2.6725 2.6725 2.9668 2.9668 3.1286 3.1286 3.2406 3.2406 3.4523 3.4523 3.5203 3.5203 3.9585 3.9585 4.7419 4.7419 5.0703 5.0703 5.2491 5.2491 5.5004 5.5004 9.6279 9.6279 9.6991 9.6991 10.4449 10.4449 10.6301 10.6301 11.3419 11.3419 k = 0.3200 0.3200 0.2978 ( 5504 PWs) bands (ev): -23.7380 -23.7380 -23.7312 -23.7312 -7.5104 -7.5104 -7.5001 -7.5001 -7.2971 -7.2971 -7.2291 -7.2291 -7.2014 -7.2014 -7.1441 -7.1441 -5.5075 -5.5075 -5.4841 -5.4841 1.8060 1.8060 2.2099 2.2099 2.4033 2.4033 2.4930 2.4930 2.6057 2.6057 2.6678 2.6678 2.9697 2.9697 3.1280 3.1280 3.2276 3.2276 3.4411 3.4411 3.5207 3.5207 3.9624 3.9624 4.7476 4.7476 5.1166 5.1166 5.2933 5.2933 5.5403 5.5403 9.5839 9.5839 9.6731 9.6731 10.4751 10.4751 10.6244 10.6244 11.3999 11.3999 k = 0.3100 0.3100 0.2978 ( 5504 PWs) bands (ev): -23.7385 -23.7385 -23.7310 -23.7310 -7.5123 -7.5123 -7.4992 -7.4992 -7.2976 -7.2976 -7.2302 -7.2302 -7.1995 -7.1995 -7.1429 -7.1429 -5.5097 -5.5097 -5.4833 -5.4833 1.8054 1.8054 2.2304 2.2304 2.3893 2.3893 2.4864 2.4864 2.5862 2.5862 2.6621 2.6621 2.9707 2.9707 3.1222 3.1222 3.2206 3.2206 3.4339 3.4339 3.5250 3.5250 3.9699 3.9699 4.7535 4.7535 5.1635 5.1635 5.3363 5.3363 5.5781 5.5781 9.5419 9.5419 9.6497 9.6497 10.5058 10.5058 10.6176 10.6176 11.4578 11.4578 k = 0.3000 0.3000 0.2978 ( 5504 PWs) bands (ev): -23.7390 -23.7390 -23.7308 -23.7308 -7.5142 -7.5142 -7.4981 -7.4981 -7.2977 -7.2977 -7.2312 -7.2312 -7.1978 -7.1978 -7.1418 -7.1418 -5.5125 -5.5125 -5.4830 -5.4830 1.8055 1.8055 2.2435 2.2435 2.3741 2.3741 2.4868 2.4868 2.5656 2.5656 2.6552 2.6552 2.9680 2.9680 3.1140 3.1140 3.2200 3.2200 3.4312 3.4312 3.5316 3.5316 3.9809 3.9809 4.7597 4.7597 5.2108 5.2108 5.3777 5.3777 5.6138 5.6138 9.5014 9.5014 9.6290 9.6290 10.5365 10.5365 10.6094 10.6094 11.5149 11.5149 k = 0.2900 0.2900 0.2978 ( 5494 PWs) bands (ev): -23.7395 -23.7395 -23.7306 -23.7306 -7.5160 -7.5160 -7.4967 -7.4967 -7.2975 -7.2975 -7.2320 -7.2320 -7.1960 -7.1960 -7.1408 -7.1408 -5.5159 -5.5159 -5.4831 -5.4831 1.8063 1.8063 2.2482 2.2482 2.3571 2.3571 2.4959 2.4959 2.5444 2.5444 2.6471 2.6471 2.9600 2.9600 3.1085 3.1085 3.2239 3.2239 3.4325 3.4325 3.5401 3.5401 3.9952 3.9952 4.7661 4.7661 5.2584 5.2584 5.4176 5.4176 5.6476 5.6476 9.4623 9.4623 9.6111 9.6111 10.5664 10.5664 10.5996 10.5996 11.5697 11.5697 k = 0.2800 0.2800 0.2978 ( 5492 PWs) bands (ev): -23.7400 -23.7400 -23.7304 -23.7304 -7.5177 -7.5177 -7.4951 -7.4951 -7.2971 -7.2971 -7.2327 -7.2327 -7.1942 -7.1942 -7.1399 -7.1399 -5.5199 -5.5199 -5.4838 -5.4838 1.8079 1.8079 2.2450 2.2450 2.3378 2.3378 2.5111 2.5111 2.5247 2.5247 2.6374 2.6374 2.9469 2.9469 3.1088 3.1088 3.2304 3.2304 3.4369 3.4369 3.5501 3.5501 4.0127 4.0127 4.7727 4.7727 5.3060 5.3060 5.4556 5.4556 5.6797 5.6797 9.4241 9.4241 9.5961 9.5961 10.5877 10.5877 10.5949 10.5949 11.5949 11.5949 k = 0.2700 0.2700 0.2978 ( 5504 PWs) bands (ev): -23.7405 -23.7405 -23.7302 -23.7302 -7.5193 -7.5193 -7.4932 -7.4932 -7.2964 -7.2964 -7.2333 -7.2333 -7.1925 -7.1925 -7.1392 -7.1392 -5.5245 -5.5245 -5.4851 -5.4851 1.8101 1.8101 2.2355 2.2355 2.3166 2.3166 2.4981 2.4981 2.5384 2.5384 2.6260 2.6260 2.9307 2.9307 3.1152 3.1152 3.2385 3.2385 3.4438 3.4438 3.5615 3.5615 4.0333 4.0333 4.7795 4.7795 5.3534 5.3534 5.4918 5.4918 5.7102 5.7102 9.3863 9.3863 9.5839 9.5839 10.5735 10.5735 10.6205 10.6205 11.5176 11.5176 k = 0.2600 0.2600 0.2978 ( 5492 PWs) bands (ev): -23.7411 -23.7411 -23.7300 -23.7300 -7.5206 -7.5206 -7.4912 -7.4912 -7.2953 -7.2953 -7.2338 -7.2338 -7.1908 -7.1908 -7.1386 -7.1386 -5.5297 -5.5297 -5.4869 -5.4869 1.8131 1.8131 2.2216 2.2216 2.2940 2.2940 2.4757 2.4757 2.5637 2.5637 2.6134 2.6134 2.9145 2.9145 3.1264 3.1264 3.2480 3.2480 3.4529 3.4529 3.5743 3.5743 4.0568 4.0568 4.7866 4.7866 5.4004 5.4004 5.5262 5.5262 5.7396 5.7396 9.3487 9.3487 9.5744 9.5744 10.5566 10.5566 10.6417 10.6417 11.4312 11.4312 k = 0.2500 0.2500 0.2978 ( 5480 PWs) bands (ev): -23.7416 -23.7416 -23.7298 -23.7298 -7.5218 -7.5218 -7.4889 -7.4889 -7.2940 -7.2940 -7.2342 -7.2342 -7.1890 -7.1890 -7.1382 -7.1382 -5.5354 -5.5354 -5.4893 -5.4893 1.8166 1.8166 2.2045 2.2045 2.2705 2.2705 2.4529 2.4529 2.5829 2.5829 2.6058 2.6058 2.9006 2.9006 3.1408 3.1408 3.2589 3.2589 3.4638 3.4638 3.5882 3.5882 4.0830 4.0830 4.7938 4.7938 5.4463 5.4463 5.5591 5.5591 5.7680 5.7680 9.3109 9.3109 9.5674 9.5674 10.5365 10.5365 10.6567 10.6567 11.3454 11.3454 k = 0.2400 0.2400 0.2978 ( 5476 PWs) bands (ev): -23.7421 -23.7421 -23.7296 -23.7296 -7.5227 -7.5227 -7.4865 -7.4865 -7.2924 -7.2924 -7.2346 -7.2346 -7.1872 -7.1872 -7.1379 -7.1379 -5.5417 -5.5417 -5.4923 -5.4923 1.8206 1.8206 2.1852 2.1852 2.2465 2.2465 2.4301 2.4301 2.5730 2.5730 2.6244 2.6244 2.8905 2.8905 3.1573 3.1573 3.2714 3.2714 3.4761 3.4761 3.6032 3.6032 4.1117 4.1117 4.8012 4.8012 5.4903 5.4903 5.5911 5.5911 5.7957 5.7957 9.2724 9.2724 9.5627 9.5627 10.5128 10.5128 10.6629 10.6629 11.2616 11.2616 k = 0.2300 0.2300 0.2978 ( 5478 PWs) bands (ev): -23.7427 -23.7427 -23.7294 -23.7294 -7.5233 -7.5233 -7.4839 -7.4839 -7.2905 -7.2905 -7.2349 -7.2349 -7.1854 -7.1854 -7.1378 -7.1378 -5.5484 -5.5484 -5.4959 -5.4959 1.8251 1.8251 2.1642 2.1642 2.2223 2.2223 2.4074 2.4074 2.5536 2.5536 2.6485 2.6485 2.8851 2.8851 3.1747 3.1747 3.2863 3.2863 3.4897 3.4897 3.6191 3.6191 4.1426 4.1426 4.8089 4.8089 5.5310 5.5310 5.6234 5.6234 5.8230 5.8230 9.2329 9.2329 9.5597 9.5597 10.4852 10.4852 10.6578 10.6578 11.1810 11.1810 k = 0.2200 0.2200 0.2978 ( 5486 PWs) bands (ev): -23.7432 -23.7432 -23.7292 -23.7292 -7.5237 -7.5237 -7.4813 -7.4813 -7.2884 -7.2884 -7.2352 -7.2352 -7.1836 -7.1836 -7.1378 -7.1378 -5.5556 -5.5556 -5.5000 -5.5000 1.8298 1.8298 2.1420 2.1420 2.1981 2.1981 2.3850 2.3850 2.5320 2.5320 2.6706 2.6706 2.8847 2.8847 3.1917 3.1917 3.3041 3.3041 3.5045 3.5045 3.6357 3.6357 4.1757 4.1757 4.8167 4.8167 5.5664 5.5664 5.6576 5.6576 5.8502 5.8502 9.1923 9.1923 9.5579 9.5579 10.4533 10.4533 10.6391 10.6391 11.1047 11.1047 k = 0.2100 0.2100 0.2978 ( 5486 PWs) bands (ev): -23.7438 -23.7438 -23.7290 -23.7290 -7.5237 -7.5237 -7.4786 -7.4786 -7.2860 -7.2860 -7.2354 -7.2354 -7.1818 -7.1818 -7.1379 -7.1379 -5.5632 -5.5632 -5.5048 -5.5048 1.8346 1.8346 2.1189 2.1189 2.1742 2.1742 2.3630 2.3630 2.5092 2.5092 2.6897 2.6897 2.8889 2.8889 3.2075 3.2075 3.3255 3.3255 3.5205 3.5205 3.6530 3.6530 4.2106 4.2106 4.8246 4.8246 5.5950 5.5950 5.6951 5.6951 5.8776 5.8776 9.1503 9.1503 9.5564 9.5564 10.4170 10.4170 10.6060 10.6060 11.0341 11.0341 k = 0.2000 0.2000 0.2978 ( 5484 PWs) bands (ev): -23.7443 -23.7443 -23.7288 -23.7288 -7.5235 -7.5235 -7.4759 -7.4759 -7.2834 -7.2834 -7.2356 -7.2356 -7.1799 -7.1799 -7.1381 -7.1381 -5.5711 -5.5711 -5.5100 -5.5100 1.8393 1.8393 2.0953 2.0953 2.1508 2.1508 2.3416 2.3416 2.4860 2.4860 2.7058 2.7058 2.8970 2.8970 3.2214 3.2214 3.3505 3.3505 3.5378 3.5378 3.6708 3.6708 4.2472 4.2472 4.8328 4.8328 5.6169 5.6169 5.7359 5.7359 5.9054 5.9054 9.1067 9.1067 9.5543 9.5543 10.3761 10.3761 10.5588 10.5588 10.9703 10.9703 k = 0.1900 0.1900 0.2978 ( 5486 PWs) bands (ev): -23.7448 -23.7448 -23.7287 -23.7287 -7.5229 -7.5229 -7.4732 -7.4732 -7.2806 -7.2806 -7.2358 -7.2358 -7.1781 -7.1781 -7.1385 -7.1385 -5.5793 -5.5793 -5.5158 -5.5158 1.8437 1.8437 2.0716 2.0716 2.1281 2.1281 2.3209 2.3209 2.4629 2.4629 2.7191 2.7191 2.9079 2.9079 3.2335 3.2335 3.3784 3.3784 3.5565 3.5565 3.6889 3.6889 4.2853 4.2853 4.8412 4.8412 5.6329 5.6329 5.7786 5.7786 5.9339 5.9339 9.0614 9.0614 9.5505 9.5505 10.3308 10.3308 10.4996 10.4996 10.9149 10.9149 k = 0.1800 0.1800 0.2978 ( 5490 PWs) bands (ev): -23.7453 -23.7453 -23.7285 -23.7285 -7.5220 -7.5220 -7.4705 -7.4705 -7.2775 -7.2775 -7.2360 -7.2360 -7.1764 -7.1764 -7.1388 -7.1388 -5.5877 -5.5877 -5.5219 -5.5219 1.8475 1.8475 2.0480 2.0480 2.1064 2.1064 2.3008 2.3008 2.4404 2.4404 2.7304 2.7304 2.9206 2.9206 3.2440 3.2440 3.4082 3.4082 3.5768 3.5768 3.7074 3.7074 4.3245 4.3245 4.8496 4.8496 5.6440 5.6440 5.8222 5.8222 5.9634 5.9634 9.0146 9.0146 9.5438 9.5438 10.2813 10.2813 10.4310 10.4310 10.8696 10.8696 k = 0.1700 0.1700 0.2978 ( 5502 PWs) bands (ev): -23.7458 -23.7458 -23.7283 -23.7283 -7.5208 -7.5208 -7.4680 -7.4680 -7.2743 -7.2743 -7.2361 -7.2361 -7.1748 -7.1748 -7.1392 -7.1392 -5.5961 -5.5961 -5.5285 -5.5285 1.8502 1.8502 2.0247 2.0247 2.0861 2.0861 2.2817 2.2817 2.4186 2.4186 2.7401 2.7401 2.9342 2.9342 3.2531 3.2531 3.4385 3.4385 3.5989 3.5989 3.7262 3.7262 4.3647 4.3647 4.8583 4.8583 5.6511 5.6511 5.8657 5.8657 5.9941 5.9941 8.9663 8.9663 9.5332 9.5332 10.2282 10.2282 10.3557 10.3557 10.8357 10.8357 k = 0.1600 0.1600 0.2978 ( 5494 PWs) bands (ev): -23.7463 -23.7463 -23.7281 -23.7281 -7.5193 -7.5193 -7.4655 -7.4655 -7.2709 -7.2709 -7.2363 -7.2363 -7.1734 -7.1734 -7.1394 -7.1394 -5.6047 -5.6047 -5.5353 -5.5353 1.8515 1.8515 2.0021 2.0021 2.0675 2.0675 2.2636 2.2636 2.3979 2.3979 2.7488 2.7488 2.9480 2.9480 3.2612 3.2612 3.4680 3.4680 3.6229 3.6229 3.7453 3.7453 4.4056 4.4056 4.8671 4.8671 5.6546 5.6546 5.9085 5.9085 6.0263 6.0263 8.9165 8.9165 9.5178 9.5178 10.1719 10.1719 10.2763 10.2763 10.8144 10.8144 k = 0.1500 0.1500 0.2978 ( 5492 PWs) bands (ev): -23.7467 -23.7467 -23.7280 -23.7280 -7.5175 -7.5175 -7.4632 -7.4632 -7.2674 -7.2674 -7.2364 -7.2364 -7.1724 -7.1724 -7.1393 -7.1393 -5.6132 -5.6132 -5.5424 -5.5424 1.8509 1.8509 1.9802 1.9802 2.0513 2.0513 2.2466 2.2466 2.3782 2.3782 2.7568 2.7568 2.9616 2.9616 3.2686 3.2686 3.4958 3.4958 3.6488 3.6488 3.7651 3.7651 4.4470 4.4470 4.8761 4.8761 5.6549 5.6549 5.9501 5.9501 6.0600 6.0600 8.8656 8.8656 9.4971 9.4971 10.1133 10.1133 10.1949 10.1949 10.8064 10.8064 k = 0.1400 0.1400 0.2978 ( 5498 PWs) bands (ev): -23.7472 -23.7472 -23.7278 -23.7278 -7.5155 -7.5155 -7.4611 -7.4611 -7.2638 -7.2638 -7.2365 -7.2365 -7.1718 -7.1718 -7.1390 -7.1390 -5.6216 -5.6216 -5.5496 -5.5496 1.8480 1.8480 1.9593 1.9593 2.0377 2.0377 2.2307 2.2307 2.3597 2.3597 2.7643 2.7643 2.9747 2.9747 3.2754 3.2754 3.5210 3.5210 3.6759 3.6759 3.7859 3.7859 4.4885 4.4885 4.8853 4.8853 5.6523 5.6523 5.9902 5.9902 6.0951 6.0951 8.8139 8.8139 9.4713 9.4713 10.0530 10.0530 10.1132 10.1132 10.8115 10.8115 k = 0.1300 0.1300 0.2978 ( 5498 PWs) bands (ev): -23.7476 -23.7476 -23.7277 -23.7277 -7.5132 -7.5132 -7.4591 -7.4591 -7.2600 -7.2600 -7.2365 -7.2365 -7.1718 -7.1718 -7.1383 -7.1383 -5.6298 -5.6298 -5.5570 -5.5570 1.8427 1.8427 1.9394 1.9394 2.0271 2.0271 2.2163 2.2163 2.3423 2.3423 2.7713 2.7713 2.9872 2.9872 3.2817 3.2817 3.5435 3.5435 3.7029 3.7029 3.8080 3.8080 4.5299 4.5299 4.8946 4.8946 5.6472 5.6472 6.0286 6.0286 6.1316 6.1316 8.7617 8.7617 9.4410 9.4410 9.9919 9.9919 10.0326 10.0326 10.8294 10.8294 k = 0.1200 0.1200 0.2978 ( 5498 PWs) bands (ev): -23.7479 -23.7479 -23.7275 -23.7275 -7.5108 -7.5108 -7.4574 -7.4574 -7.2562 -7.2562 -7.2366 -7.2366 -7.1724 -7.1724 -7.1372 -7.1372 -5.6377 -5.6377 -5.5642 -5.5642 1.8351 1.8351 1.9208 1.9208 2.0194 2.0194 2.2032 2.2032 2.3260 2.3260 2.7780 2.7780 2.9989 2.9989 3.2875 3.2875 3.5634 3.5634 3.7286 3.7286 3.8322 3.8322 4.5708 4.5708 4.9041 4.9041 5.6396 5.6396 6.0654 6.0654 6.1688 6.1688 8.7094 8.7094 9.4070 9.4070 9.9303 9.9303 9.9549 9.9549 10.8589 10.8589 k = 0.1100 0.1100 0.2978 ( 5502 PWs) bands (ev): -23.7483 -23.7483 -23.7274 -23.7274 -7.5082 -7.5082 -7.4558 -7.4558 -7.2524 -7.2524 -7.2366 -7.2366 -7.1736 -7.1736 -7.1357 -7.1357 -5.6453 -5.6453 -5.5714 -5.5714 1.8254 1.8254 1.9034 1.9034 2.0142 2.0142 2.1916 2.1916 2.3108 2.3108 2.7843 2.7843 3.0098 3.0098 3.2929 3.2929 3.5810 3.5810 3.7516 3.7516 3.8585 3.8585 4.6108 4.6108 4.9138 4.9138 5.6301 5.6301 6.1005 6.1005 6.2062 6.2062 8.6576 8.6576 9.3705 9.3705 9.8668 9.8668 9.8831 9.8831 10.8986 10.8986 k = 0.1000 0.1000 0.2978 ( 5514 PWs) bands (ev): -23.7487 -23.7487 -23.7273 -23.7273 -7.5056 -7.5056 -7.4545 -7.4545 -7.2485 -7.2485 -7.2365 -7.2365 -7.1753 -7.1753 -7.1338 -7.1338 -5.6525 -5.6525 -5.5784 -5.5784 1.8145 1.8145 1.8874 1.8874 2.0110 2.0110 2.1817 2.1817 2.2966 2.2966 2.7902 2.7902 3.0199 3.0199 3.2978 3.2978 3.5965 3.5965 3.7714 3.7714 3.8865 3.8865 4.6494 4.6494 4.9237 4.9237 5.6189 5.6189 6.1340 6.1340 6.2433 6.2433 8.6068 8.6068 9.3328 9.3328 9.7996 9.7996 9.8208 9.8208 10.9469 10.9469 k = 0.0900 0.0900 0.2978 ( 5524 PWs) bands (ev): -23.7490 -23.7490 -23.7272 -23.7272 -7.5030 -7.5030 -7.4534 -7.4534 -7.2448 -7.2448 -7.2364 -7.2364 -7.1775 -7.1775 -7.1318 -7.1318 -5.6593 -5.6593 -5.5850 -5.5850 1.8029 1.8029 1.8728 1.8728 2.0092 2.0092 2.1733 2.1733 2.2834 2.2834 2.7957 2.7957 3.0291 3.0291 3.3024 3.3024 3.6103 3.6103 3.7882 3.7882 3.9153 3.9153 4.6862 4.6862 4.9339 4.9339 5.6063 5.6063 6.1659 6.1659 6.2794 6.2794 8.5576 8.5576 9.2951 9.2951 9.7332 9.7332 9.7650 9.7650 11.0022 11.0022 k = 0.0800 0.0800 0.2978 ( 5518 PWs) bands (ev): -23.7492 -23.7492 -23.7271 -23.7271 -7.5003 -7.5003 -7.4525 -7.4525 -7.2414 -7.2414 -7.2358 -7.2358 -7.1800 -7.1800 -7.1297 -7.1297 -5.6655 -5.6655 -5.5913 -5.5913 1.7913 1.7913 1.8595 1.8595 2.0084 2.0084 2.1667 2.1667 2.2713 2.2713 2.8007 2.8007 3.0375 3.0375 3.3065 3.3065 3.6225 3.6225 3.8022 3.8022 3.9438 3.9438 4.7207 4.7207 4.9445 4.9445 5.5928 5.5928 6.1958 6.1958 6.3138 6.3138 8.5107 8.5107 9.2585 9.2585 9.6709 9.6709 9.7137 9.7137 11.0626 11.0626 k = 0.0700 0.0700 0.2978 ( 5518 PWs) bands (ev): -23.7495 -23.7495 -23.7270 -23.7270 -7.4978 -7.4978 -7.4519 -7.4519 -7.2392 -7.2392 -7.2341 -7.2341 -7.1829 -7.1829 -7.1275 -7.1275 -5.6711 -5.6711 -5.5971 -5.5971 1.7801 1.7801 1.8477 1.8477 2.0079 2.0079 2.1617 2.1617 2.2601 2.2601 2.8052 2.8052 3.0450 3.0450 3.3102 3.3102 3.6332 3.6332 3.8140 3.8140 3.9709 3.9709 4.7522 4.7522 4.9554 4.9554 5.5786 5.5786 6.2236 6.2236 6.3461 6.3461 8.4668 8.4668 9.2240 9.2240 9.6141 9.6141 9.6670 9.6670 11.1260 11.1260 k = 0.0600 0.0600 0.2978 ( 5526 PWs) bands (ev): -23.7497 -23.7497 -23.7269 -23.7269 -7.4953 -7.4953 -7.4513 -7.4513 -7.2383 -7.2383 -7.2310 -7.2310 -7.1860 -7.1860 -7.1255 -7.1255 -5.6761 -5.6761 -5.6023 -5.6023 1.7698 1.7698 1.8374 1.8374 2.0077 2.0077 2.1583 2.1583 2.2499 2.2499 2.8091 2.8091 3.0516 3.0516 3.3135 3.3135 3.6423 3.6423 3.8238 3.8238 3.9958 3.9958 4.7802 4.7802 4.9665 4.9665 5.5644 5.5644 6.2489 6.2489 6.3756 6.3756 8.4266 8.4266 9.1925 9.1925 9.5634 9.5634 9.6252 9.6252 11.1903 11.1903 k = 0.0500 0.0500 0.2978 ( 5534 PWs) bands (ev): -23.7499 -23.7499 -23.7269 -23.7269 -7.4931 -7.4931 -7.4510 -7.4510 -7.2380 -7.2380 -7.2274 -7.2274 -7.1893 -7.1893 -7.1236 -7.1236 -5.6803 -5.6803 -5.6068 -5.6068 1.7607 1.7607 1.8287 1.8287 2.0075 2.0075 2.1562 2.1562 2.2408 2.2408 2.8125 2.8125 3.0572 3.0572 3.3163 3.3163 3.6500 3.6500 3.8318 3.8318 4.0178 4.0178 4.8041 4.8041 4.9778 4.9778 5.5507 5.5507 6.2712 6.2712 6.4018 6.4018 8.3908 8.3908 9.1647 9.1647 9.5195 9.5195 9.5889 9.5889 11.2529 11.2529 k = 0.0400 0.0400 0.2978 ( 5542 PWs) bands (ev): -23.7501 -23.7501 -23.7268 -23.7268 -7.4912 -7.4912 -7.4508 -7.4508 -7.2379 -7.2379 -7.2236 -7.2236 -7.1928 -7.1928 -7.1220 -7.1220 -5.6839 -5.6839 -5.6106 -5.6106 1.7530 1.7530 1.8214 1.8214 2.0072 2.0072 2.1552 2.1552 2.2330 2.2330 2.8153 2.8153 3.0619 3.0619 3.3186 3.3186 3.6563 3.6563 3.8382 3.8382 4.0364 4.0364 4.8236 4.8236 4.9887 4.9887 5.5381 5.5381 6.2902 6.2902 6.4242 6.4242 8.3604 8.3604 9.1412 9.1412 9.4828 9.4828 9.5586 9.5586 11.3110 11.3110 k = 0.0300 0.0300 0.2978 ( 5542 PWs) bands (ev): -23.7502 -23.7502 -23.7268 -23.7268 -7.4896 -7.4896 -7.4507 -7.4507 -7.2379 -7.2379 -7.2198 -7.2198 -7.1963 -7.1963 -7.1206 -7.1206 -5.6867 -5.6867 -5.6137 -5.6137 1.7468 1.7468 1.8158 1.8158 2.0069 2.0069 2.1551 2.1551 2.2264 2.2264 2.8175 2.8175 3.0655 3.0655 3.3205 3.3205 3.6612 3.6612 3.8431 3.8431 4.0513 4.0513 4.8386 4.8386 4.9986 4.9986 5.5273 5.5273 6.3055 6.3055 6.4422 6.4422 8.3358 8.3358 9.1225 9.1225 9.4537 9.4537 9.5345 9.5345 11.3614 11.3614 k = 0.0200 0.0200 0.2978 ( 5546 PWs) bands (ev): -23.7503 -23.7503 -23.7268 -23.7268 -7.4885 -7.4885 -7.4506 -7.4506 -7.2378 -7.2378 -7.2160 -7.2160 -7.2000 -7.2000 -7.1197 -7.1197 -5.6887 -5.6887 -5.6159 -5.6159 1.7423 1.7423 1.8118 1.8118 2.0067 2.0067 2.1554 2.1554 2.2214 2.2214 2.8190 2.8190 3.0682 3.0682 3.3218 3.3218 3.6647 3.6647 3.8466 3.8466 4.0621 4.0621 4.8491 4.8491 5.0066 5.0066 5.5189 5.5189 6.3167 6.3167 6.4554 6.4554 8.3178 8.3178 9.1089 9.1089 9.4327 9.4327 9.5172 9.5172 11.4006 11.4006 k = 0.0100 0.0100 0.2978 ( 5550 PWs) bands (ev): -23.7503 -23.7503 -23.7268 -23.7268 -7.4877 -7.4877 -7.4506 -7.4506 -7.2378 -7.2378 -7.2124 -7.2124 -7.2035 -7.2035 -7.1191 -7.1191 -5.6900 -5.6900 -5.6172 -5.6172 1.7396 1.7396 1.8094 1.8094 2.0065 2.0065 2.1558 2.1558 2.2183 2.2183 2.8200 2.8200 3.0697 3.0697 3.3225 3.3225 3.6668 3.6668 3.8487 3.8487 4.0686 4.0686 4.8554 4.8554 5.0118 5.0118 5.5136 5.5136 6.3235 6.3235 6.4635 6.4635 8.3067 8.3067 9.1006 9.1006 9.4200 9.4200 9.5066 9.5066 11.4256 11.4256 k = 0.0000 0.0000 0.2978 ( 5558 PWs) bands (ev): -23.7504 -23.7504 -23.7268 -23.7268 -7.4875 -7.4875 -7.4506 -7.4506 -7.2378 -7.2378 -7.2101 -7.2101 -7.2057 -7.2057 -7.1189 -7.1189 -5.6904 -5.6904 -5.6177 -5.6177 1.7387 1.7387 1.8085 1.8085 2.0064 2.0064 2.1559 2.1559 2.2172 2.2172 2.8203 2.8203 3.0703 3.0703 3.3229 3.3229 3.6675 3.6675 3.8493 3.8493 4.0709 4.0709 4.8574 4.8574 5.0136 5.0136 5.5118 5.5118 6.3257 6.3257 6.4662 6.4662 8.3030 8.3030 9.0978 9.0978 9.4157 9.4157 9.5031 9.5031 11.4342 11.4342 k = 0.0000 0.5000-0.0000 ( 5530 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5410 -7.5410 -7.5410 -7.5410 -7.2655 -7.2655 -7.2655 -7.2655 -7.1550 -7.1550 -7.1550 -7.1550 -5.4610 -5.4610 -5.4610 -5.4610 2.2260 2.2260 2.2260 2.2260 2.4674 2.4674 2.4674 2.4674 2.6272 2.6272 2.6272 2.6272 2.8874 2.8874 2.8874 2.8874 3.2086 3.2086 3.2086 3.2086 3.3635 3.3635 3.3635 3.3635 5.3597 5.3597 5.3597 5.3597 5.8426 5.8426 5.8426 5.8426 9.0528 9.0528 9.0528 9.0528 10.5564 10.5564 10.5564 10.5564 11.1469 11.1469 k = 0.0000 0.5000 0.0142 ( 5540 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5411 -7.5411 -7.5411 -7.5411 -7.2655 -7.2655 -7.2655 -7.2655 -7.1550 -7.1550 -7.1550 -7.1550 -5.4609 -5.4609 -5.4609 -5.4609 2.2261 2.2261 2.2261 2.2261 2.4673 2.4673 2.4673 2.4673 2.6268 2.6268 2.6268 2.6268 2.8869 2.8869 2.8869 2.8869 3.2086 3.2086 3.2086 3.2086 3.3634 3.3634 3.3634 3.3634 5.3612 5.3612 5.3612 5.3612 5.8424 5.8424 5.8424 5.8424 9.0499 9.0499 9.0499 9.0499 10.5572 10.5572 10.5572 10.5572 11.1515 11.1515 k = 0.0000 0.5000 0.0284 ( 5540 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5413 -7.5413 -7.5413 -7.5413 -7.2655 -7.2655 -7.2655 -7.2655 -7.1549 -7.1549 -7.1549 -7.1549 -5.4606 -5.4606 -5.4606 -5.4606 2.2264 2.2264 2.2264 2.2264 2.4673 2.4673 2.4673 2.4673 2.6258 2.6258 2.6258 2.6258 2.8855 2.8855 2.8855 2.8855 3.2084 3.2084 3.2084 3.2084 3.3631 3.3631 3.3631 3.3631 5.3658 5.3658 5.3658 5.3658 5.8420 5.8420 5.8420 5.8420 9.0414 9.0414 9.0414 9.0414 10.5594 10.5594 10.5594 10.5594 11.1655 11.1655 k = 0.0000 0.5000 0.0425 ( 5540 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5416 -7.5416 -7.5416 -7.5416 -7.2655 -7.2655 -7.2655 -7.2655 -7.1548 -7.1548 -7.1548 -7.1548 -5.4601 -5.4601 -5.4601 -5.4601 2.2268 2.2268 2.2268 2.2268 2.4673 2.4673 2.4673 2.4673 2.6241 2.6241 2.6241 2.6241 2.8831 2.8831 2.8831 2.8831 3.2082 3.2082 3.2082 3.2082 3.3627 3.3627 3.3627 3.3627 5.3732 5.3732 5.3732 5.3732 5.8412 5.8412 5.8412 5.8412 9.0275 9.0275 9.0275 9.0275 10.5629 10.5629 10.5629 10.5629 11.1885 11.1885 k = 0.0000 0.5000 0.0567 ( 5536 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5420 -7.5420 -7.5420 -7.5420 -7.2655 -7.2655 -7.2655 -7.2655 -7.1545 -7.1545 -7.1545 -7.1545 -5.4595 -5.4595 -5.4595 -5.4595 2.2274 2.2274 2.2274 2.2274 2.4673 2.4673 2.4673 2.4673 2.6218 2.6218 2.6218 2.6218 2.8799 2.8799 2.8799 2.8799 3.2079 3.2079 3.2079 3.2079 3.3621 3.3621 3.3621 3.3621 5.3834 5.3834 5.3834 5.3834 5.8402 5.8402 5.8402 5.8402 9.0089 9.0089 9.0089 9.0089 10.5674 10.5674 10.5674 10.5674 11.2202 11.2203 k = 0.0000 0.5000 0.0709 ( 5542 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5425 -7.5425 -7.5425 -7.5425 -7.2655 -7.2655 -7.2655 -7.2655 -7.1543 -7.1543 -7.1543 -7.1543 -5.4587 -5.4587 -5.4587 -5.4587 2.2281 2.2281 2.2281 2.2281 2.4672 2.4672 2.4672 2.4672 2.6188 2.6188 2.6188 2.6188 2.8761 2.8761 2.8761 2.8761 3.2075 3.2075 3.2075 3.2075 3.3613 3.3613 3.3613 3.3613 5.3960 5.3960 5.3960 5.3960 5.8390 5.8390 5.8390 5.8390 8.9861 8.9861 8.9861 8.9861 10.5726 10.5726 10.5726 10.5726 11.2601 11.2601 k = 0.0000 0.5000 0.0851 ( 5542 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5432 -7.5432 -7.5432 -7.5432 -7.2656 -7.2656 -7.2656 -7.2656 -7.1540 -7.1540 -7.1540 -7.1540 -5.4578 -5.4578 -5.4578 -5.4578 2.2290 2.2290 2.2290 2.2290 2.4672 2.4672 2.4672 2.4672 2.6152 2.6152 2.6152 2.6152 2.8716 2.8716 2.8716 2.8716 3.2071 3.2071 3.2071 3.2071 3.3605 3.3605 3.3605 3.3605 5.4109 5.4109 5.4109 5.4109 5.8375 5.8375 5.8375 5.8375 8.9601 8.9601 8.9601 8.9601 10.5783 10.5783 10.5783 10.5783 11.3075 11.3075 k = 0.0000 0.5000 0.0993 ( 5542 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5439 -7.5439 -7.5439 -7.5439 -7.2656 -7.2656 -7.2656 -7.2656 -7.1536 -7.1536 -7.1536 -7.1536 -5.4568 -5.4568 -5.4568 -5.4568 2.2301 2.2301 2.2301 2.2301 2.4671 2.4671 2.4671 2.4671 2.6109 2.6109 2.6109 2.6109 2.8668 2.8668 2.8668 2.8668 3.2067 3.2067 3.2067 3.2067 3.3596 3.3596 3.3596 3.3596 5.4276 5.4276 5.4276 5.4276 5.8359 5.8359 5.8359 5.8359 8.9316 8.9316 8.9316 8.9316 10.5842 10.5842 10.5842 10.5842 11.3614 11.3614 k = 0.0000 0.5000 0.1134 ( 5530 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5446 -7.5446 -7.5446 -7.5446 -7.2656 -7.2656 -7.2656 -7.2656 -7.1532 -7.1532 -7.1532 -7.1532 -5.4556 -5.4556 -5.4556 -5.4556 2.2313 2.2313 2.2313 2.2313 2.4670 2.4670 2.4670 2.4670 2.6061 2.6061 2.6061 2.6061 2.8617 2.8617 2.8617 2.8617 3.2063 3.2063 3.2063 3.2063 3.3587 3.3587 3.3587 3.3587 5.4458 5.4458 5.4458 5.4458 5.8341 5.8341 5.8341 5.8341 8.9013 8.9013 8.9013 8.9013 10.5902 10.5902 10.5902 10.5902 11.4211 11.4211 k = 0.0000 0.5000 0.1276 ( 5534 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5454 -7.5454 -7.5454 -7.5454 -7.2657 -7.2657 -7.2657 -7.2657 -7.1528 -7.1528 -7.1528 -7.1528 -5.4544 -5.4544 -5.4544 -5.4544 2.2326 2.2326 2.2326 2.2326 2.4669 2.4669 2.4669 2.4669 2.6008 2.6008 2.6008 2.6008 2.8565 2.8565 2.8565 2.8565 3.2058 3.2058 3.2058 3.2058 3.3577 3.3577 3.3577 3.3577 5.4651 5.4651 5.4651 5.4651 5.8323 5.8323 5.8323 5.8323 8.8701 8.8701 8.8701 8.8701 10.5961 10.5961 10.5961 10.5961 11.4855 11.4855 k = 0.0000 0.5000 0.1418 ( 5530 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5463 -7.5463 -7.5463 -7.5463 -7.2657 -7.2657 -7.2657 -7.2657 -7.1524 -7.1524 -7.1524 -7.1524 -5.4532 -5.4532 -5.4532 -5.4532 2.2340 2.2340 2.2340 2.2340 2.4667 2.4667 2.4667 2.4667 2.5952 2.5952 2.5952 2.5952 2.8514 2.8514 2.8514 2.8514 3.2054 3.2054 3.2054 3.2054 3.3568 3.3568 3.3568 3.3568 5.4850 5.4850 5.4851 5.4851 5.8303 5.8303 5.8303 5.8303 8.8386 8.8386 8.8386 8.8386 10.6018 10.6018 10.6018 10.6018 11.5535 11.5535 k = 0.0000 0.5000 0.1560 ( 5530 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5471 -7.5471 -7.5471 -7.5471 -7.2657 -7.2657 -7.2657 -7.2657 -7.1520 -7.1520 -7.1520 -7.1520 -5.4519 -5.4519 -5.4519 -5.4519 2.2355 2.2355 2.2355 2.2355 2.4665 2.4665 2.4665 2.4665 2.5892 2.5892 2.5892 2.5892 2.8464 2.8464 2.8464 2.8464 3.2049 3.2049 3.2049 3.2049 3.3559 3.3559 3.3559 3.3559 5.5052 5.5052 5.5052 5.5052 5.8284 5.8284 5.8284 5.8284 8.8076 8.8076 8.8076 8.8076 10.6073 10.6073 10.6073 10.6073 11.6238 11.6238 k = 0.0000 0.5000 0.1701 ( 5532 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5480 -7.5480 -7.5480 -7.5480 -7.2658 -7.2658 -7.2658 -7.2658 -7.1516 -7.1516 -7.1516 -7.1516 -5.4507 -5.4507 -5.4507 -5.4507 2.2370 2.2370 2.2370 2.2370 2.4662 2.4662 2.4662 2.4662 2.5832 2.5832 2.5832 2.5832 2.8418 2.8418 2.8418 2.8418 3.2045 3.2045 3.2045 3.2045 3.3551 3.3551 3.3551 3.3551 5.5251 5.5251 5.5251 5.5251 5.8265 5.8265 5.8265 5.8265 8.7776 8.7776 8.7776 8.7776 10.6125 10.6125 10.6125 10.6125 11.6953 11.6953 k = 0.0000 0.5000 0.1843 ( 5528 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5488 -7.5488 -7.5488 -7.5488 -7.2658 -7.2658 -7.2658 -7.2658 -7.1512 -7.1512 -7.1512 -7.1512 -5.4495 -5.4495 -5.4495 -5.4495 2.2386 2.2386 2.2386 2.2386 2.4659 2.4659 2.4659 2.4659 2.5771 2.5771 2.5771 2.5771 2.8375 2.8375 2.8375 2.8375 3.2041 3.2041 3.2042 3.2042 3.3543 3.3543 3.3543 3.3543 5.5443 5.5443 5.5443 5.5443 5.8247 5.8247 5.8247 5.8247 8.7493 8.7493 8.7493 8.7493 10.6173 10.6173 10.6173 10.6173 11.7666 11.7666 k = 0.0000 0.5000 0.1985 ( 5522 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5495 -7.5495 -7.5495 -7.5495 -7.2658 -7.2658 -7.2658 -7.2658 -7.1508 -7.1508 -7.1508 -7.1508 -5.4483 -5.4483 -5.4483 -5.4483 2.2402 2.2402 2.2402 2.2402 2.4656 2.4656 2.4656 2.4656 2.5712 2.5712 2.5712 2.5712 2.8336 2.8336 2.8336 2.8336 3.2038 3.2038 3.2038 3.2038 3.3536 3.3536 3.3536 3.3536 5.5624 5.5624 5.5624 5.5624 5.8230 5.8230 5.8230 5.8230 8.7230 8.7230 8.7230 8.7230 10.6217 10.6217 10.6217 10.6217 11.8360 11.8360 k = 0.0000 0.5000 0.2127 ( 5530 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5502 -7.5502 -7.5502 -7.5502 -7.2659 -7.2659 -7.2659 -7.2659 -7.1505 -7.1505 -7.1505 -7.1505 -5.4473 -5.4473 -5.4473 -5.4473 2.2416 2.2416 2.2416 2.2416 2.4652 2.4652 2.4652 2.4652 2.5657 2.5657 2.5657 2.5657 2.8302 2.8302 2.8302 2.8302 3.2035 3.2035 3.2035 3.2035 3.3530 3.3530 3.3530 3.3530 5.5790 5.5790 5.5790 5.5790 5.8215 5.8215 5.8215 5.8215 8.6993 8.6993 8.6993 8.6993 10.6256 10.6256 10.6256 10.6256 11.9021 11.9021 k = 0.0000 0.5000 0.2269 ( 5518 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5508 -7.5508 -7.5508 -7.5508 -7.2659 -7.2659 -7.2659 -7.2659 -7.1502 -7.1502 -7.1502 -7.1502 -5.4464 -5.4464 -5.4464 -5.4464 2.2430 2.2430 2.2430 2.2430 2.4648 2.4648 2.4648 2.4648 2.5608 2.5608 2.5608 2.5608 2.8274 2.8274 2.8274 2.8274 3.2033 3.2033 3.2033 3.2033 3.3525 3.3525 3.3525 3.3525 5.5938 5.5938 5.5938 5.5938 5.8202 5.8202 5.8202 5.8202 8.6785 8.6785 8.6785 8.6785 10.6291 10.6291 10.6291 10.6291 11.9629 11.9629 k = 0.0000 0.5000 0.2410 ( 5526 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5513 -7.5513 -7.5513 -7.5513 -7.2659 -7.2659 -7.2659 -7.2659 -7.1500 -7.1500 -7.1500 -7.1500 -5.4456 -5.4456 -5.4456 -5.4456 2.2442 2.2442 2.2442 2.2442 2.4644 2.4644 2.4644 2.4644 2.5565 2.5565 2.5565 2.5565 2.8250 2.8250 2.8250 2.8250 3.2031 3.2031 3.2031 3.2031 3.3520 3.3520 3.3520 3.3520 5.6063 5.6063 5.6063 5.6063 5.8191 5.8191 5.8191 5.8191 8.6610 8.6610 8.6610 8.6610 10.6319 10.6319 10.6319 10.6319 12.0165 12.0165 k = 0.0000 0.5000 0.2552 ( 5516 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5517 -7.5517 -7.5517 -7.5517 -7.2659 -7.2659 -7.2659 -7.2659 -7.1498 -7.1498 -7.1498 -7.1498 -5.4449 -5.4449 -5.4449 -5.4449 2.2452 2.2452 2.2452 2.2452 2.4641 2.4641 2.4641 2.4641 2.5530 2.5530 2.5530 2.5530 2.8232 2.8232 2.8232 2.8232 3.2029 3.2029 3.2029 3.2029 3.3517 3.3517 3.3517 3.3517 5.6163 5.6163 5.6163 5.6163 5.8182 5.8182 5.8182 5.8182 8.6471 8.6471 8.6471 8.6471 10.6342 10.6342 10.6342 10.6342 12.0610 12.0610 k = 0.0000 0.5000 0.2694 ( 5512 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5520 -7.5520 -7.5520 -7.5520 -7.2659 -7.2659 -7.2659 -7.2659 -7.1496 -7.1496 -7.1496 -7.1496 -5.4445 -5.4445 -5.4445 -5.4445 2.2460 2.2460 2.2460 2.2460 2.4638 2.4638 2.4638 2.4638 2.5505 2.5505 2.5505 2.5505 2.8219 2.8219 2.8219 2.8219 3.2028 3.2028 3.2028 3.2028 3.3515 3.3515 3.3515 3.3515 5.6237 5.6237 5.6237 5.6237 5.8176 5.8176 5.8176 5.8176 8.6370 8.6370 8.6370 8.6370 10.6359 10.6359 10.6359 10.6359 12.0944 12.0944 k = 0.0000 0.5000 0.2836 ( 5498 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5522 -7.5522 -7.5522 -7.5522 -7.2659 -7.2659 -7.2659 -7.2659 -7.1495 -7.1495 -7.1495 -7.1495 -5.4442 -5.4442 -5.4442 -5.4442 2.2465 2.2465 2.2465 2.2465 2.4637 2.4637 2.4637 2.4637 2.5489 2.5489 2.5489 2.5489 2.8211 2.8211 2.8211 2.8211 3.2028 3.2028 3.2028 3.2028 3.3513 3.3513 3.3513 3.3513 5.6281 5.6281 5.6281 5.6281 5.8173 5.8173 5.8173 5.8173 8.6309 8.6309 8.6309 8.6309 10.6369 10.6369 10.6369 10.6369 12.1152 12.1152 k = 0.0000 0.5000 0.2978 ( 5500 PWs) bands (ev): -23.7357 -23.7357 -23.7357 -23.7357 -7.5523 -7.5523 -7.5523 -7.5523 -7.2659 -7.2659 -7.2659 -7.2659 -7.1495 -7.1495 -7.1495 -7.1495 -5.4441 -5.4441 -5.4441 -5.4441 2.2467 2.2467 2.2467 2.2467 2.4636 2.4636 2.4636 2.4636 2.5484 2.5484 2.5484 2.5484 2.8209 2.8209 2.8209 2.8209 3.2027 3.2027 3.2027 3.2027 3.3513 3.3513 3.3513 3.3513 5.6296 5.6296 5.6296 5.6296 5.8171 5.8171 5.8171 5.8171 8.6289 8.6289 8.6289 8.6289 10.6372 10.6372 10.6372 10.6372 12.1223 12.1223 k = 0.5000 0.5000-0.0000 ( 5476 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4936 -7.4936 -7.4936 -7.4936 -7.2514 -7.2514 -7.2514 -7.2514 -7.1778 -7.1778 -7.1778 -7.1778 -5.5269 -5.5269 -5.5269 -5.5269 1.8699 1.8699 1.8699 1.8699 2.5667 2.5667 2.5667 2.5667 2.6902 2.6902 2.6902 2.6902 2.9664 2.9664 2.9664 2.9664 3.4634 3.4634 3.4634 3.4634 4.4370 4.4370 4.4370 4.4370 4.6038 4.6038 4.6038 4.6038 4.6994 4.6994 4.6994 4.6994 9.2328 9.2328 9.2328 9.2328 9.7119 9.7119 9.7119 9.7119 12.4520 12.4520 k = 0.5000 0.5000 0.0142 ( 5476 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4936 -7.4936 -7.4936 -7.4936 -7.2514 -7.2514 -7.2514 -7.2514 -7.1778 -7.1778 -7.1778 -7.1778 -5.5269 -5.5269 -5.5269 -5.5269 1.8699 1.8699 1.8699 1.8699 2.5669 2.5669 2.5669 2.5669 2.6902 2.6902 2.6902 2.6902 2.9664 2.9664 2.9664 2.9664 3.4634 3.4634 3.4634 3.4634 4.4359 4.4359 4.4359 4.4359 4.6034 4.6034 4.6034 4.6034 4.6994 4.6994 4.6994 4.6994 9.2356 9.2356 9.2356 9.2356 9.7160 9.7160 9.7160 9.7160 12.4416 12.4416 k = 0.5000 0.5000 0.0284 ( 5500 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4936 -7.4936 -7.4936 -7.4936 -7.2514 -7.2514 -7.2514 -7.2514 -7.1780 -7.1780 -7.1780 -7.1780 -5.5267 -5.5267 -5.5267 -5.5267 1.8697 1.8697 1.8697 1.8697 2.5676 2.5676 2.5676 2.5676 2.6901 2.6901 2.6901 2.6901 2.9666 2.9666 2.9666 2.9666 3.4634 3.4634 3.4634 3.4634 4.4329 4.4329 4.4329 4.4329 4.6024 4.6024 4.6024 4.6024 4.6996 4.6996 4.6996 4.6996 9.2439 9.2439 9.2439 9.2439 9.7283 9.7283 9.7283 9.7283 12.4111 12.4111 k = 0.5000 0.5000 0.0425 ( 5524 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4936 -7.4936 -7.4936 -7.4936 -7.2515 -7.2515 -7.2515 -7.2515 -7.1781 -7.1781 -7.1781 -7.1781 -5.5264 -5.5264 -5.5264 -5.5264 1.8694 1.8694 1.8694 1.8694 2.5688 2.5688 2.5688 2.5688 2.6901 2.6901 2.6901 2.6901 2.9670 2.9670 2.9670 2.9670 3.4633 3.4633 3.4633 3.4633 4.4278 4.4278 4.4278 4.4278 4.6007 4.6007 4.6007 4.6007 4.6999 4.6999 4.6999 4.6999 9.2576 9.2576 9.2576 9.2576 9.7485 9.7485 9.7485 9.7485 12.3621 12.3621 k = 0.5000 0.5000 0.0567 ( 5524 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4936 -7.4936 -7.4936 -7.4936 -7.2515 -7.2515 -7.2515 -7.2515 -7.1783 -7.1783 -7.1783 -7.1783 -5.5260 -5.5260 -5.5260 -5.5260 1.8691 1.8691 1.8691 1.8691 2.5704 2.5704 2.5704 2.5704 2.6900 2.6900 2.6900 2.6900 2.9676 2.9676 2.9676 2.9676 3.4633 3.4633 3.4633 3.4633 4.4207 4.4207 4.4207 4.4207 4.5986 4.5986 4.5986 4.5986 4.7003 4.7003 4.7003 4.7003 9.2768 9.2768 9.2768 9.2768 9.7765 9.7765 9.7765 9.7765 12.2969 12.2969 k = 0.5000 0.5000 0.0709 ( 5524 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4936 -7.4936 -7.4936 -7.4936 -7.2516 -7.2516 -7.2516 -7.2516 -7.1785 -7.1785 -7.1785 -7.1785 -5.5255 -5.5255 -5.5255 -5.5255 1.8686 1.8686 1.8686 1.8686 2.5725 2.5725 2.5725 2.5725 2.6899 2.6899 2.6899 2.6899 2.9683 2.9683 2.9683 2.9683 3.4634 3.4634 3.4634 3.4634 4.4117 4.4117 4.4117 4.4117 4.5961 4.5961 4.5961 4.5961 4.7008 4.7008 4.7008 4.7008 9.3014 9.3014 9.3014 9.3014 9.8120 9.8120 9.8120 9.8120 12.2180 12.2180 k = 0.5000 0.5000 0.0851 ( 5540 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4936 -7.4936 -7.4936 -7.4936 -7.2516 -7.2516 -7.2516 -7.2516 -7.1788 -7.1788 -7.1788 -7.1788 -5.5249 -5.5249 -5.5249 -5.5249 1.8680 1.8680 1.8680 1.8680 2.5749 2.5749 2.5749 2.5749 2.6898 2.6898 2.6898 2.6898 2.9692 2.9692 2.9692 2.9692 3.4633 3.4633 3.4633 3.4633 4.4009 4.4009 4.4009 4.4009 4.5935 4.5935 4.5935 4.5935 4.7013 4.7013 4.7013 4.7013 9.3313 9.3313 9.3313 9.3313 9.8546 9.8546 9.8546 9.8546 12.1282 12.1282 k = 0.5000 0.5000 0.0993 ( 5540 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4936 -7.4936 -7.4936 -7.4936 -7.2517 -7.2517 -7.2517 -7.2517 -7.1791 -7.1791 -7.1791 -7.1791 -5.5242 -5.5242 -5.5242 -5.5242 1.8675 1.8675 1.8675 1.8675 2.5777 2.5777 2.5777 2.5777 2.6898 2.6898 2.6898 2.6898 2.9702 2.9702 2.9702 2.9702 3.4634 3.4634 3.4634 3.4634 4.3885 4.3885 4.3885 4.3885 4.5909 4.5909 4.5909 4.5909 4.7019 4.7019 4.7019 4.7019 9.3665 9.3665 9.3665 9.3665 9.9037 9.9037 9.9037 9.9037 12.0297 12.0297 k = 0.5000 0.5000 0.1134 ( 5532 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4935 -7.4935 -7.4935 -7.4935 -7.2518 -7.2518 -7.2518 -7.2518 -7.1794 -7.1794 -7.1794 -7.1794 -5.5234 -5.5234 -5.5234 -5.5234 1.8668 1.8668 1.8668 1.8668 2.5807 2.5807 2.5807 2.5807 2.6897 2.6897 2.6897 2.6897 2.9713 2.9713 2.9713 2.9713 3.4635 3.4635 3.4635 3.4635 4.3747 4.3747 4.3747 4.3747 4.5883 4.5883 4.5883 4.5883 4.7025 4.7025 4.7025 4.7025 9.4068 9.4068 9.4068 9.4068 9.9588 9.9588 9.9588 9.9588 11.9248 11.9248 k = 0.5000 0.5000 0.1276 ( 5516 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4935 -7.4935 -7.4935 -7.4935 -7.2518 -7.2518 -7.2518 -7.2518 -7.1798 -7.1798 -7.1798 -7.1798 -5.5227 -5.5227 -5.5227 -5.5227 1.8662 1.8662 1.8662 1.8662 2.5840 2.5840 2.5840 2.5840 2.6897 2.6897 2.6897 2.6897 2.9726 2.9726 2.9726 2.9726 3.4635 3.4635 3.4635 3.4635 4.3599 4.3599 4.3599 4.3599 4.5859 4.5859 4.5859 4.5859 4.7032 4.7032 4.7032 4.7032 9.4521 9.4521 9.4521 9.4521 10.0192 10.0192 10.0192 10.0192 11.8151 11.8151 k = 0.5000 0.5000 0.1418 ( 5516 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4935 -7.4935 -7.4935 -7.4935 -7.2519 -7.2519 -7.2519 -7.2519 -7.1802 -7.1802 -7.1802 -7.1802 -5.5219 -5.5219 -5.5219 -5.5219 1.8654 1.8654 1.8654 1.8654 2.5873 2.5873 2.5873 2.5873 2.6896 2.6896 2.6896 2.6896 2.9740 2.9740 2.9740 2.9740 3.4636 3.4636 3.4636 3.4636 4.3443 4.3443 4.3443 4.3443 4.5837 4.5837 4.5837 4.5837 4.7038 4.7038 4.7038 4.7038 9.5023 9.5023 9.5023 9.5023 10.0841 10.0841 10.0841 10.0841 11.7022 11.7022 k = 0.5000 0.5000 0.1560 ( 5508 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4934 -7.4934 -7.4934 -7.4934 -7.2520 -7.2520 -7.2520 -7.2520 -7.1805 -7.1805 -7.1805 -7.1805 -5.5210 -5.5210 -5.5210 -5.5210 1.8647 1.8647 1.8647 1.8647 2.5907 2.5907 2.5907 2.5907 2.6896 2.6896 2.6896 2.6896 2.9754 2.9754 2.9754 2.9754 3.4637 3.4637 3.4637 3.4637 4.3284 4.3284 4.3284 4.3284 4.5816 4.5816 4.5816 4.5816 4.7045 4.7045 4.7045 4.7045 9.5572 9.5572 9.5572 9.5572 10.1527 10.1527 10.1527 10.1527 11.5873 11.5873 k = 0.5000 0.5000 0.1701 ( 5484 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4934 -7.4934 -7.4934 -7.4934 -7.2520 -7.2520 -7.2520 -7.2520 -7.1809 -7.1809 -7.1809 -7.1809 -5.5202 -5.5202 -5.5202 -5.5202 1.8640 1.8640 1.8640 1.8640 2.5941 2.5941 2.5941 2.5941 2.6896 2.6896 2.6896 2.6896 2.9769 2.9769 2.9769 2.9769 3.4638 3.4638 3.4638 3.4638 4.3125 4.3125 4.3125 4.3125 4.5799 4.5799 4.5799 4.5799 4.7051 4.7051 4.7051 4.7051 9.6165 9.6165 9.6165 9.6165 10.2238 10.2238 10.2238 10.2238 11.4718 11.4718 k = 0.5000 0.5000 0.1843 ( 5488 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4934 -7.4934 -7.4934 -7.4934 -7.2521 -7.2521 -7.2521 -7.2521 -7.1812 -7.1812 -7.1812 -7.1812 -5.5194 -5.5194 -5.5194 -5.5194 1.8634 1.8634 1.8634 1.8634 2.5973 2.5973 2.5973 2.5973 2.6896 2.6896 2.6896 2.6896 2.9784 2.9784 2.9784 2.9784 3.4638 3.4638 3.4638 3.4638 4.2970 4.2970 4.2970 4.2970 4.5783 4.5783 4.5783 4.5783 4.7057 4.7057 4.7057 4.7057 9.6799 9.6799 9.6799 9.6799 10.2962 10.2962 10.2962 10.2962 11.3566 11.3566 k = 0.5000 0.5000 0.1985 ( 5500 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4933 -7.4933 -7.4933 -7.4933 -7.2522 -7.2522 -7.2522 -7.2522 -7.1816 -7.1816 -7.1816 -7.1816 -5.5187 -5.5187 -5.5187 -5.5187 1.8627 1.8627 1.8627 1.8627 2.6003 2.6003 2.6003 2.6003 2.6896 2.6896 2.6896 2.6896 2.9799 2.9799 2.9799 2.9799 3.4638 3.4638 3.4638 3.4638 4.2822 4.2822 4.2822 4.2822 4.5769 4.5769 4.5769 4.5769 4.7062 4.7062 4.7062 4.7062 9.7471 9.7471 9.7471 9.7471 10.3684 10.3684 10.3684 10.3684 11.2427 11.2427 k = 0.5000 0.5000 0.2127 ( 5508 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4933 -7.4933 -7.4933 -7.4933 -7.2523 -7.2523 -7.2523 -7.2523 -7.1819 -7.1819 -7.1819 -7.1819 -5.5180 -5.5180 -5.5180 -5.5180 1.8621 1.8621 1.8621 1.8621 2.6031 2.6031 2.6031 2.6031 2.6896 2.6896 2.6896 2.6896 2.9813 2.9813 2.9813 2.9813 3.4639 3.4639 3.4639 3.4639 4.2687 4.2687 4.2687 4.2687 4.5757 4.5757 4.5757 4.5757 4.7067 4.7067 4.7067 4.7067 9.8174 9.8174 9.8174 9.8174 10.4386 10.4386 10.4386 10.4386 11.1312 11.1312 k = 0.5000 0.5000 0.2269 ( 5508 PWs) bands (ev): -23.7331 -23.7331 -23.7331 -23.7331 -7.4933 -7.4933 -7.4933 -7.4933 -7.2523 -7.2523 -7.2523 -7.2523 -7.1822 -7.1822 -7.1822 -7.1822 -5.5174 -5.5174 -5.5174 -5.5174 1.8616 1.8616 1.8616 1.8616 2.6055 2.6055 2.6055 2.6055 2.6896 2.6896 2.6896 2.6896 2.9826 2.9826 2.9826 2.9826 3.4640 3.4640 3.4640 3.4640 4.2566 4.2566 4.2566 4.2566 4.5748 4.5748 4.5748 4.5748 4.7072 4.7072 4.7072 4.7072 9.8899 9.8899 9.8899 9.8899 10.5047 10.5047 10.5047 10.5047 11.0236 11.0236 k = 0.5000 0.5000 0.2410 ( 5500 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4933 -7.4933 -7.4933 -7.4933 -7.2524 -7.2524 -7.2524 -7.2524 -7.1824 -7.1824 -7.1824 -7.1824 -5.5169 -5.5169 -5.5169 -5.5169 1.8612 1.8612 1.8612 1.8612 2.6076 2.6076 2.6076 2.6076 2.6897 2.6897 2.6897 2.6897 2.9837 2.9837 2.9837 2.9837 3.4640 3.4640 3.4640 3.4640 4.2463 4.2463 4.2463 4.2463 4.5740 4.5740 4.5740 4.5740 4.7075 4.7075 4.7075 4.7075 9.9632 9.9632 9.9632 9.9632 10.5640 10.5640 10.5640 10.5640 10.9218 10.9218 k = 0.5000 0.5000 0.2552 ( 5500 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4933 -7.4933 -7.4933 -7.4933 -7.2524 -7.2524 -7.2524 -7.2524 -7.1826 -7.1826 -7.1826 -7.1826 -5.5165 -5.5165 -5.5165 -5.5165 1.8608 1.8608 1.8608 1.8608 2.6093 2.6093 2.6093 2.6093 2.6897 2.6897 2.6897 2.6897 2.9846 2.9846 2.9846 2.9846 3.4641 3.4641 3.4641 3.4641 4.2380 4.2380 4.2380 4.2380 4.5734 4.5734 4.5734 4.5734 4.7078 4.7078 4.7078 4.7078 10.0346 10.0346 10.0346 10.0346 10.6129 10.6129 10.6129 10.6129 10.8296 10.8296 k = 0.5000 0.5000 0.2694 ( 5488 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4933 -7.4933 -7.4933 -7.4933 -7.2524 -7.2524 -7.2524 -7.2524 -7.1827 -7.1827 -7.1827 -7.1827 -5.5162 -5.5162 -5.5162 -5.5162 1.8605 1.8605 1.8605 1.8605 2.6106 2.6106 2.6106 2.6106 2.6898 2.6898 2.6898 2.6898 2.9853 2.9853 2.9853 2.9853 3.4641 3.4641 3.4641 3.4641 4.2319 4.2319 4.2319 4.2319 4.5730 4.5730 4.5730 4.5730 4.7080 4.7080 4.7080 4.7080 10.0992 10.0992 10.0992 10.0992 10.6453 10.6453 10.6453 10.6453 10.7554 10.7554 k = 0.5000 0.5000 0.2836 ( 5488 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4932 -7.4932 -7.4932 -7.4932 -7.2524 -7.2524 -7.2524 -7.2524 -7.1828 -7.1828 -7.1828 -7.1828 -5.5160 -5.5160 -5.5160 -5.5160 1.8604 1.8604 1.8604 1.8604 2.6113 2.6113 2.6113 2.6113 2.6898 2.6898 2.6898 2.6898 2.9858 2.9858 2.9858 2.9858 3.4642 3.4642 3.4642 3.4642 4.2282 4.2282 4.2282 4.2282 4.5727 4.5727 4.5727 4.5727 4.7081 4.7081 4.7081 4.7081 10.1476 10.1476 10.1476 10.1476 10.6476 10.6476 10.6476 10.6476 10.7195 10.7195 k = 0.5000 0.5000 0.2978 ( 5480 PWs) bands (ev): -23.7330 -23.7330 -23.7330 -23.7330 -7.4932 -7.4932 -7.4932 -7.4932 -7.2524 -7.2524 -7.2524 -7.2524 -7.1828 -7.1828 -7.1828 -7.1828 -5.5160 -5.5160 -5.5160 -5.5160 1.8603 1.8603 1.8603 1.8603 2.6116 2.6116 2.6116 2.6116 2.6898 2.6898 2.6898 2.6898 2.9859 2.9859 2.9859 2.9859 3.4642 3.4642 3.4642 3.4642 4.2270 4.2270 4.2270 4.2270 4.5726 4.5726 4.5726 4.5726 4.7082 4.7082 4.7082 4.7082 10.1664 10.1664 10.1664 10.1664 10.6376 10.6376 10.6376 10.6376 10.7159 10.7159 Writing output data file KAgSe.save init_run : 0.31s CPU 0.43s WALL ( 1 calls) electrons : 199.50s CPU 202.63s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 199.50s CPU 202.62s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.10s CPU 0.12s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.09s WALL ( 312 calls) cegterg : 182.95s CPU 185.44s WALL ( 423 calls) Called by sum_band: Called by *egterg: h_psi : 92.40s CPU 94.07s WALL ( 6873 calls) s_psi : 7.24s CPU 7.26s WALL ( 6873 calls) g_psi : 0.33s CPU 0.33s WALL ( 6138 calls) cdiaghg : 71.52s CPU 71.83s WALL ( 6450 calls) cegterg:over : 9.67s CPU 9.68s WALL ( 6138 calls) cegterg:upda : 7.90s CPU 8.37s WALL ( 6138 calls) cegterg:last : 4.04s CPU 4.07s WALL ( 1054 calls) cdiaghg:chol : 4.22s CPU 4.14s WALL ( 6450 calls) cdiaghg:inve : 2.96s CPU 2.99s WALL ( 6450 calls) cdiaghg:para : 4.66s CPU 5.02s WALL ( 12900 calls) Called by h_psi: h_psi:vloc : 75.72s CPU 77.28s WALL ( 6873 calls) h_psi:vnl : 16.35s CPU 16.43s WALL ( 6873 calls) add_vuspsi : 8.50s CPU 8.52s WALL ( 6873 calls) General routines calbec : 7.82s CPU 7.89s WALL ( 6873 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 70.40s CPU 72.01s WALL ( 888800 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.25s CPU 0.33s WALL ( 624 calls) Parallel routines fft_scatter : 27.23s CPU 27.83s WALL ( 888823 calls) PWSCF : 3m41.07s CPU 3m54.57s WALL This run was terminated on: 18:25:37 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=