Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16: 3:29 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), 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: ./PbBrF.save/ file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized file Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized file Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 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 43 27 8 2367 1171 188 Max 44 28 9 2378 1194 195 Sum 1581 989 293 85389 42677 6855 bravais-lattice index = 14 lattice parameter (alat) = 7.8991 a.u. unit-cell volume = 894.9337 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 56.00 number of Kohn-Sham states= 68 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 317.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.899055 celldm(2)= 1.000000 celldm(3)= 1.815789 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 1.815789 ) 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 0.550725 ) PseudoPot. # 1 for F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1105 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 Pb read from file: /users/gautes/Pseudo/Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 75f9fe62f948a5acf869e43db2c29526 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 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 Br read from file: /users/gautes/Pseudo/Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5d639767687de88634f0d235e6526498 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1213 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential F 7.00 18.99840 F( 1.00) Pb 14.00 207.20000 Pb( 1.00) Br 7.00 79.90400 Br( 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= 332 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030120 k( 2) = ( 0.0000000 0.0131579 -0.0000000), wk = 0.0030120 k( 3) = ( 0.0000000 0.0263158 -0.0000000), wk = 0.0030120 k( 4) = ( 0.0000000 0.0394737 -0.0000000), wk = 0.0030120 k( 5) = ( 0.0000000 0.0526316 -0.0000000), wk = 0.0030120 k( 6) = ( 0.0000000 0.0657895 -0.0000000), wk = 0.0030120 k( 7) = ( 0.0000000 0.0789474 -0.0000000), wk = 0.0030120 k( 8) = ( 0.0000000 0.0921053 -0.0000000), wk = 0.0030120 k( 9) = ( 0.0000000 0.1052632 -0.0000000), wk = 0.0030120 k( 10) = ( 0.0000000 0.1184210 -0.0000000), wk = 0.0030120 k( 11) = ( 0.0000000 0.1315790 -0.0000000), wk = 0.0030120 k( 12) = ( 0.0000000 0.1447368 -0.0000000), wk = 0.0030120 k( 13) = ( 0.0000000 0.1578947 -0.0000000), wk = 0.0030120 k( 14) = ( 0.0000000 0.1710526 -0.0000000), wk = 0.0030120 k( 15) = ( 0.0000000 0.1842105 -0.0000000), wk = 0.0030120 k( 16) = ( 0.0000000 0.1973684 -0.0000000), wk = 0.0030120 k( 17) = ( 0.0000000 0.2105263 -0.0000000), wk = 0.0030120 k( 18) = ( 0.0000000 0.2236842 -0.0000000), wk = 0.0030120 k( 19) = ( 0.0000000 0.2368421 -0.0000000), wk = 0.0030120 k( 20) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0030120 k( 21) = ( 0.0000000 0.2631579 -0.0000000), wk = 0.0030120 k( 22) = ( 0.0000000 0.2763158 -0.0000000), wk = 0.0030120 k( 23) = ( 0.0000000 0.2894737 -0.0000000), wk = 0.0030120 k( 24) = ( 0.0000000 0.3026316 -0.0000000), wk = 0.0030120 k( 25) = ( 0.0000000 0.3157895 -0.0000000), wk = 0.0030120 k( 26) = ( 0.0000000 0.3289474 -0.0000000), wk = 0.0030120 k( 27) = ( 0.0000000 0.3421053 -0.0000000), wk = 0.0030120 k( 28) = ( 0.0000000 0.3552632 -0.0000000), wk = 0.0030120 k( 29) = ( 0.0000000 0.3684211 -0.0000000), wk = 0.0030120 k( 30) = ( 0.0000000 0.3815789 -0.0000000), wk = 0.0030120 k( 31) = ( 0.0000000 0.3947368 -0.0000000), wk = 0.0030120 k( 32) = ( 0.0000000 0.4078947 -0.0000000), wk = 0.0030120 k( 33) = ( 0.0000000 0.4210526 -0.0000000), wk = 0.0030120 k( 34) = ( 0.0000000 0.4342105 -0.0000000), wk = 0.0030120 k( 35) = ( 0.0000000 0.4473684 -0.0000000), wk = 0.0030120 k( 36) = ( 0.0000000 0.4605263 -0.0000000), wk = 0.0030120 k( 37) = ( 0.0000000 0.4736842 -0.0000000), wk = 0.0030120 k( 38) = ( 0.0000000 0.4868421 -0.0000000), wk = 0.0030120 k( 39) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0030120 k( 40) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0030120 k( 41) = ( 0.0131579 0.5000000 -0.0000000), wk = 0.0030120 k( 42) = ( 0.0263158 0.5000000 -0.0000000), wk = 0.0030120 k( 43) = ( 0.0394737 0.5000000 -0.0000000), wk = 0.0030120 k( 44) = ( 0.0526316 0.5000000 -0.0000000), wk = 0.0030120 k( 45) = ( 0.0657895 0.5000000 -0.0000000), wk = 0.0030120 k( 46) = ( 0.0789474 0.5000000 -0.0000000), wk = 0.0030120 k( 47) = ( 0.0921053 0.5000000 -0.0000000), wk = 0.0030120 k( 48) = ( 0.1052632 0.5000000 -0.0000000), wk = 0.0030120 k( 49) = ( 0.1184210 0.5000000 -0.0000000), wk = 0.0030120 k( 50) = ( 0.1315790 0.5000000 -0.0000000), wk = 0.0030120 k( 51) = ( 0.1447368 0.5000000 -0.0000000), wk = 0.0030120 k( 52) = ( 0.1578947 0.5000000 -0.0000000), wk = 0.0030120 k( 53) = ( 0.1710526 0.5000000 -0.0000000), wk = 0.0030120 k( 54) = ( 0.1842105 0.5000000 -0.0000000), wk = 0.0030120 k( 55) = ( 0.1973684 0.5000000 -0.0000000), wk = 0.0030120 k( 56) = ( 0.2105263 0.5000000 -0.0000000), wk = 0.0030120 k( 57) = ( 0.2236842 0.5000000 -0.0000000), wk = 0.0030120 k( 58) = ( 0.2368421 0.5000000 -0.0000000), wk = 0.0030120 k( 59) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0030120 k( 60) = ( 0.2631579 0.5000000 -0.0000000), wk = 0.0030120 k( 61) = ( 0.2763158 0.5000000 -0.0000000), wk = 0.0030120 k( 62) = ( 0.2894737 0.5000000 -0.0000000), wk = 0.0030120 k( 63) = ( 0.3026316 0.5000000 -0.0000000), wk = 0.0030120 k( 64) = ( 0.3157895 0.5000000 -0.0000000), wk = 0.0030120 k( 65) = ( 0.3289474 0.5000000 -0.0000000), wk = 0.0030120 k( 66) = ( 0.3421053 0.5000000 -0.0000000), wk = 0.0030120 k( 67) = ( 0.3552632 0.5000000 -0.0000000), wk = 0.0030120 k( 68) = ( 0.3684211 0.5000000 -0.0000000), wk = 0.0030120 k( 69) = ( 0.3815789 0.5000000 -0.0000000), wk = 0.0030120 k( 70) = ( 0.3947368 0.5000000 -0.0000000), wk = 0.0030120 k( 71) = ( 0.4078947 0.5000000 -0.0000000), wk = 0.0030120 k( 72) = ( 0.4210526 0.5000000 -0.0000000), wk = 0.0030120 k( 73) = ( 0.4342105 0.5000000 -0.0000000), wk = 0.0030120 k( 74) = ( 0.4473684 0.5000000 -0.0000000), wk = 0.0030120 k( 75) = ( 0.4605263 0.5000000 -0.0000000), wk = 0.0030120 k( 76) = ( 0.4736842 0.5000000 -0.0000000), wk = 0.0030120 k( 77) = ( 0.4868421 0.5000000 -0.0000000), wk = 0.0030120 k( 78) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030120 k( 79) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030120 k( 80) = ( 0.4907407 0.4907407 -0.0000000), wk = 0.0030120 k( 81) = ( 0.4814815 0.4814815 -0.0000000), wk = 0.0030120 k( 82) = ( 0.4722222 0.4722222 -0.0000000), wk = 0.0030120 k( 83) = ( 0.4629630 0.4629630 -0.0000000), wk = 0.0030120 k( 84) = ( 0.4537037 0.4537037 -0.0000000), wk = 0.0030120 k( 85) = ( 0.4444444 0.4444444 -0.0000000), wk = 0.0030120 k( 86) = ( 0.4351852 0.4351852 -0.0000000), wk = 0.0030120 k( 87) = ( 0.4259259 0.4259259 -0.0000000), wk = 0.0030120 k( 88) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0030120 k( 89) = ( 0.4074074 0.4074074 -0.0000000), wk = 0.0030120 k( 90) = ( 0.3981481 0.3981481 -0.0000000), wk = 0.0030120 k( 91) = ( 0.3888889 0.3888889 -0.0000000), wk = 0.0030120 k( 92) = ( 0.3796296 0.3796296 -0.0000000), wk = 0.0030120 k( 93) = ( 0.3703704 0.3703704 -0.0000000), wk = 0.0030120 k( 94) = ( 0.3611111 0.3611111 -0.0000000), wk = 0.0030120 k( 95) = ( 0.3518519 0.3518518 -0.0000000), wk = 0.0030120 k( 96) = ( 0.3425926 0.3425926 -0.0000000), wk = 0.0030120 k( 97) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0030120 k( 98) = ( 0.3240741 0.3240741 -0.0000000), wk = 0.0030120 k( 99) = ( 0.3148148 0.3148148 -0.0000000), wk = 0.0030120 k( 100) = ( 0.3055556 0.3055556 -0.0000000), wk = 0.0030120 k( 101) = ( 0.2962963 0.2962963 -0.0000000), wk = 0.0030120 k( 102) = ( 0.2870370 0.2870370 -0.0000000), wk = 0.0030120 k( 103) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0030120 k( 104) = ( 0.2685185 0.2685185 -0.0000000), wk = 0.0030120 k( 105) = ( 0.2592593 0.2592593 -0.0000000), wk = 0.0030120 k( 106) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0030120 k( 107) = ( 0.2407407 0.2407407 -0.0000000), wk = 0.0030120 k( 108) = ( 0.2314815 0.2314815 -0.0000000), wk = 0.0030120 k( 109) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0030120 k( 110) = ( 0.2129630 0.2129630 -0.0000000), wk = 0.0030120 k( 111) = ( 0.2037037 0.2037037 -0.0000000), wk = 0.0030120 k( 112) = ( 0.1944444 0.1944444 -0.0000000), wk = 0.0030120 k( 113) = ( 0.1851852 0.1851852 -0.0000000), wk = 0.0030120 k( 114) = ( 0.1759259 0.1759259 -0.0000000), wk = 0.0030120 k( 115) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0030120 k( 116) = ( 0.1574074 0.1574074 -0.0000000), wk = 0.0030120 k( 117) = ( 0.1481482 0.1481481 -0.0000000), wk = 0.0030120 k( 118) = ( 0.1388889 0.1388889 -0.0000000), wk = 0.0030120 k( 119) = ( 0.1296296 0.1296296 -0.0000000), wk = 0.0030120 k( 120) = ( 0.1203704 0.1203704 -0.0000000), wk = 0.0030120 k( 121) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0030120 k( 122) = ( 0.1018518 0.1018518 -0.0000000), wk = 0.0030120 k( 123) = ( 0.0925926 0.0925926 -0.0000000), wk = 0.0030120 k( 124) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0030120 k( 125) = ( 0.0740741 0.0740741 -0.0000000), wk = 0.0030120 k( 126) = ( 0.0648148 0.0648148 -0.0000000), wk = 0.0030120 k( 127) = ( 0.0555556 0.0555556 -0.0000000), wk = 0.0030120 k( 128) = ( 0.0462963 0.0462963 -0.0000000), wk = 0.0030120 k( 129) = ( 0.0370370 0.0370370 -0.0000000), wk = 0.0030120 k( 130) = ( 0.0277778 0.0277778 -0.0000000), wk = 0.0030120 k( 131) = ( 0.0185185 0.0185185 -0.0000000), wk = 0.0030120 k( 132) = ( 0.0092593 0.0092593 -0.0000000), wk = 0.0030120 k( 133) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030120 k( 134) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030120 k( 135) = ( 0.0000000 0.0000000 0.0131125), wk = 0.0030120 k( 136) = ( 0.0000000 0.0000000 0.0262250), wk = 0.0030120 k( 137) = ( 0.0000000 0.0000000 0.0393375), wk = 0.0030120 k( 138) = ( 0.0000000 0.0000000 0.0524500), wk = 0.0030120 k( 139) = ( 0.0000000 0.0000000 0.0655625), wk = 0.0030120 k( 140) = ( 0.0000000 0.0000000 0.0786749), wk = 0.0030120 k( 141) = ( 0.0000000 0.0000000 0.0917874), wk = 0.0030120 k( 142) = ( 0.0000000 0.0000000 0.1048999), wk = 0.0030120 k( 143) = ( 0.0000000 0.0000000 0.1180124), wk = 0.0030120 k( 144) = ( 0.0000000 0.0000000 0.1311249), wk = 0.0030120 k( 145) = ( 0.0000000 0.0000000 0.1442374), wk = 0.0030120 k( 146) = ( 0.0000000 0.0000000 0.1573499), wk = 0.0030120 k( 147) = ( 0.0000000 0.0000000 0.1704624), wk = 0.0030120 k( 148) = ( 0.0000000 0.0000000 0.1835749), wk = 0.0030120 k( 149) = ( 0.0000000 0.0000000 0.1966874), wk = 0.0030120 k( 150) = ( 0.0000000 0.0000000 0.2097999), wk = 0.0030120 k( 151) = ( 0.0000000 0.0000000 0.2229124), wk = 0.0030120 k( 152) = ( 0.0000000 0.0000000 0.2360248), wk = 0.0030120 k( 153) = ( 0.0000000 0.0000000 0.2491373), wk = 0.0030120 k( 154) = ( 0.0000000 0.0000000 0.2622498), wk = 0.0030120 k( 155) = ( 0.0000000 0.0000000 0.2753623), wk = 0.0030120 k( 156) = ( 0.0000000 0.0000000 0.2753623), wk = 0.0030120 k( 157) = ( 0.0000000 0.0131579 0.2753623), wk = 0.0030120 k( 158) = ( 0.0000000 0.0263158 0.2753623), wk = 0.0030120 k( 159) = ( 0.0000000 0.0394737 0.2753623), wk = 0.0030120 k( 160) = ( 0.0000000 0.0526316 0.2753623), wk = 0.0030120 k( 161) = ( 0.0000000 0.0657895 0.2753623), wk = 0.0030120 k( 162) = ( 0.0000000 0.0789474 0.2753623), wk = 0.0030120 k( 163) = ( 0.0000000 0.0921053 0.2753623), wk = 0.0030120 k( 164) = ( 0.0000000 0.1052632 0.2753623), wk = 0.0030120 k( 165) = ( 0.0000000 0.1184210 0.2753623), wk = 0.0030120 k( 166) = ( 0.0000000 0.1315790 0.2753623), wk = 0.0030120 k( 167) = ( 0.0000000 0.1447368 0.2753623), wk = 0.0030120 k( 168) = ( 0.0000000 0.1578947 0.2753623), wk = 0.0030120 k( 169) = ( 0.0000000 0.1710526 0.2753623), wk = 0.0030120 k( 170) = ( 0.0000000 0.1842105 0.2753623), wk = 0.0030120 k( 171) = ( 0.0000000 0.1973684 0.2753623), wk = 0.0030120 k( 172) = ( 0.0000000 0.2105263 0.2753623), wk = 0.0030120 k( 173) = ( 0.0000000 0.2236842 0.2753623), wk = 0.0030120 k( 174) = ( 0.0000000 0.2368421 0.2753623), wk = 0.0030120 k( 175) = ( 0.0000000 0.2500000 0.2753623), wk = 0.0030120 k( 176) = ( 0.0000000 0.2631579 0.2753623), wk = 0.0030120 k( 177) = ( 0.0000000 0.2763158 0.2753623), wk = 0.0030120 k( 178) = ( 0.0000000 0.2894737 0.2753623), wk = 0.0030120 k( 179) = ( 0.0000000 0.3026316 0.2753623), wk = 0.0030120 k( 180) = ( 0.0000000 0.3157895 0.2753623), wk = 0.0030120 k( 181) = ( 0.0000000 0.3289474 0.2753623), wk = 0.0030120 k( 182) = ( 0.0000000 0.3421053 0.2753623), wk = 0.0030120 k( 183) = ( 0.0000000 0.3552632 0.2753623), wk = 0.0030120 k( 184) = ( 0.0000000 0.3684211 0.2753623), wk = 0.0030120 k( 185) = ( 0.0000000 0.3815789 0.2753623), wk = 0.0030120 k( 186) = ( 0.0000000 0.3947368 0.2753623), wk = 0.0030120 k( 187) = ( 0.0000000 0.4078947 0.2753623), wk = 0.0030120 k( 188) = ( 0.0000000 0.4210526 0.2753623), wk = 0.0030120 k( 189) = ( 0.0000000 0.4342105 0.2753623), wk = 0.0030120 k( 190) = ( 0.0000000 0.4473684 0.2753623), wk = 0.0030120 k( 191) = ( 0.0000000 0.4605263 0.2753623), wk = 0.0030120 k( 192) = ( 0.0000000 0.4736842 0.2753623), wk = 0.0030120 k( 193) = ( 0.0000000 0.4868421 0.2753623), wk = 0.0030120 k( 194) = ( 0.0000000 0.5000000 0.2753623), wk = 0.0030120 k( 195) = ( 0.0000000 0.5000000 0.2753623), wk = 0.0030120 k( 196) = ( 0.0131579 0.5000000 0.2753623), wk = 0.0030120 k( 197) = ( 0.0263158 0.5000000 0.2753623), wk = 0.0030120 k( 198) = ( 0.0394737 0.5000000 0.2753623), wk = 0.0030120 k( 199) = ( 0.0526316 0.5000000 0.2753623), wk = 0.0030120 k( 200) = ( 0.0657895 0.5000000 0.2753623), wk = 0.0030120 k( 201) = ( 0.0789474 0.5000000 0.2753623), wk = 0.0030120 k( 202) = ( 0.0921053 0.5000000 0.2753623), wk = 0.0030120 k( 203) = ( 0.1052632 0.5000000 0.2753623), wk = 0.0030120 k( 204) = ( 0.1184210 0.5000000 0.2753623), wk = 0.0030120 k( 205) = ( 0.1315790 0.5000000 0.2753623), wk = 0.0030120 k( 206) = ( 0.1447368 0.5000000 0.2753623), wk = 0.0030120 k( 207) = ( 0.1578947 0.5000000 0.2753623), wk = 0.0030120 k( 208) = ( 0.1710526 0.5000000 0.2753623), wk = 0.0030120 k( 209) = ( 0.1842105 0.5000000 0.2753623), wk = 0.0030120 k( 210) = ( 0.1973684 0.5000000 0.2753623), wk = 0.0030120 k( 211) = ( 0.2105263 0.5000000 0.2753623), wk = 0.0030120 k( 212) = ( 0.2236842 0.5000000 0.2753623), wk = 0.0030120 k( 213) = ( 0.2368421 0.5000000 0.2753623), wk = 0.0030120 k( 214) = ( 0.2500000 0.5000000 0.2753623), wk = 0.0030120 k( 215) = ( 0.2631579 0.5000000 0.2753623), wk = 0.0030120 k( 216) = ( 0.2763158 0.5000000 0.2753623), wk = 0.0030120 k( 217) = ( 0.2894737 0.5000000 0.2753623), wk = 0.0030120 k( 218) = ( 0.3026316 0.5000000 0.2753623), wk = 0.0030120 k( 219) = ( 0.3157895 0.5000000 0.2753623), wk = 0.0030120 k( 220) = ( 0.3289474 0.5000000 0.2753623), wk = 0.0030120 k( 221) = ( 0.3421053 0.5000000 0.2753623), wk = 0.0030120 k( 222) = ( 0.3552632 0.5000000 0.2753623), wk = 0.0030120 k( 223) = ( 0.3684211 0.5000000 0.2753623), wk = 0.0030120 k( 224) = ( 0.3815789 0.5000000 0.2753623), wk = 0.0030120 k( 225) = ( 0.3947368 0.5000000 0.2753623), wk = 0.0030120 k( 226) = ( 0.4078947 0.5000000 0.2753623), wk = 0.0030120 k( 227) = ( 0.4210526 0.5000000 0.2753623), wk = 0.0030120 k( 228) = ( 0.4342105 0.5000000 0.2753623), wk = 0.0030120 k( 229) = ( 0.4473684 0.5000000 0.2753623), wk = 0.0030120 k( 230) = ( 0.4605263 0.5000000 0.2753623), wk = 0.0030120 k( 231) = ( 0.4736842 0.5000000 0.2753623), wk = 0.0030120 k( 232) = ( 0.4868421 0.5000000 0.2753623), wk = 0.0030120 k( 233) = ( 0.5000000 0.5000000 0.2753623), wk = 0.0030120 k( 234) = ( 0.5000000 0.5000000 0.2753623), wk = 0.0030120 k( 235) = ( 0.4907407 0.4907407 0.2753623), wk = 0.0030120 k( 236) = ( 0.4814815 0.4814815 0.2753623), wk = 0.0030120 k( 237) = ( 0.4722222 0.4722222 0.2753623), wk = 0.0030120 k( 238) = ( 0.4629630 0.4629630 0.2753623), wk = 0.0030120 k( 239) = ( 0.4537037 0.4537037 0.2753623), wk = 0.0030120 k( 240) = ( 0.4444444 0.4444444 0.2753623), wk = 0.0030120 k( 241) = ( 0.4351852 0.4351852 0.2753623), wk = 0.0030120 k( 242) = ( 0.4259259 0.4259259 0.2753623), wk = 0.0030120 k( 243) = ( 0.4166667 0.4166667 0.2753623), wk = 0.0030120 k( 244) = ( 0.4074074 0.4074074 0.2753623), wk = 0.0030120 k( 245) = ( 0.3981481 0.3981481 0.2753623), wk = 0.0030120 k( 246) = ( 0.3888889 0.3888889 0.2753623), wk = 0.0030120 k( 247) = ( 0.3796296 0.3796296 0.2753623), wk = 0.0030120 k( 248) = ( 0.3703704 0.3703704 0.2753623), wk = 0.0030120 k( 249) = ( 0.3611111 0.3611111 0.2753623), wk = 0.0030120 k( 250) = ( 0.3518519 0.3518518 0.2753623), wk = 0.0030120 k( 251) = ( 0.3425926 0.3425926 0.2753623), wk = 0.0030120 k( 252) = ( 0.3333333 0.3333333 0.2753623), wk = 0.0030120 k( 253) = ( 0.3240741 0.3240741 0.2753623), wk = 0.0030120 k( 254) = ( 0.3148148 0.3148148 0.2753623), wk = 0.0030120 k( 255) = ( 0.3055556 0.3055556 0.2753623), wk = 0.0030120 k( 256) = ( 0.2962963 0.2962963 0.2753623), wk = 0.0030120 k( 257) = ( 0.2870370 0.2870370 0.2753623), wk = 0.0030120 k( 258) = ( 0.2777778 0.2777778 0.2753623), wk = 0.0030120 k( 259) = ( 0.2685185 0.2685185 0.2753623), wk = 0.0030120 k( 260) = ( 0.2592593 0.2592593 0.2753623), wk = 0.0030120 k( 261) = ( 0.2500000 0.2500000 0.2753623), wk = 0.0030120 k( 262) = ( 0.2407407 0.2407407 0.2753623), wk = 0.0030120 k( 263) = ( 0.2314815 0.2314815 0.2753623), wk = 0.0030120 k( 264) = ( 0.2222222 0.2222222 0.2753623), wk = 0.0030120 k( 265) = ( 0.2129630 0.2129630 0.2753623), wk = 0.0030120 k( 266) = ( 0.2037037 0.2037037 0.2753623), wk = 0.0030120 k( 267) = ( 0.1944444 0.1944444 0.2753623), wk = 0.0030120 k( 268) = ( 0.1851852 0.1851852 0.2753623), wk = 0.0030120 k( 269) = ( 0.1759259 0.1759259 0.2753623), wk = 0.0030120 k( 270) = ( 0.1666667 0.1666667 0.2753623), wk = 0.0030120 k( 271) = ( 0.1574074 0.1574074 0.2753623), wk = 0.0030120 k( 272) = ( 0.1481482 0.1481481 0.2753623), wk = 0.0030120 k( 273) = ( 0.1388889 0.1388889 0.2753623), wk = 0.0030120 k( 274) = ( 0.1296296 0.1296296 0.2753623), wk = 0.0030120 k( 275) = ( 0.1203704 0.1203704 0.2753623), wk = 0.0030120 k( 276) = ( 0.1111111 0.1111111 0.2753623), wk = 0.0030120 k( 277) = ( 0.1018518 0.1018518 0.2753623), wk = 0.0030120 k( 278) = ( 0.0925926 0.0925926 0.2753623), wk = 0.0030120 k( 279) = ( 0.0833333 0.0833333 0.2753623), wk = 0.0030120 k( 280) = ( 0.0740741 0.0740741 0.2753623), wk = 0.0030120 k( 281) = ( 0.0648148 0.0648148 0.2753623), wk = 0.0030120 k( 282) = ( 0.0555556 0.0555556 0.2753623), wk = 0.0030120 k( 283) = ( 0.0462963 0.0462963 0.2753623), wk = 0.0030120 k( 284) = ( 0.0370370 0.0370370 0.2753623), wk = 0.0030120 k( 285) = ( 0.0277778 0.0277778 0.2753623), wk = 0.0030120 k( 286) = ( 0.0185185 0.0185185 0.2753623), wk = 0.0030120 k( 287) = ( 0.0092593 0.0092593 0.2753623), wk = 0.0030120 k( 288) = ( 0.0000000 0.0000000 0.2753623), wk = 0.0030120 k( 289) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0030120 k( 290) = ( 0.0000000 0.5000000 0.0131125), wk = 0.0030120 k( 291) = ( 0.0000000 0.5000000 0.0262250), wk = 0.0030120 k( 292) = ( 0.0000000 0.5000000 0.0393375), wk = 0.0030120 k( 293) = ( 0.0000000 0.5000000 0.0524500), wk = 0.0030120 k( 294) = ( 0.0000000 0.5000000 0.0655625), wk = 0.0030120 k( 295) = ( 0.0000000 0.5000000 0.0786749), wk = 0.0030120 k( 296) = ( 0.0000000 0.5000000 0.0917874), wk = 0.0030120 k( 297) = ( 0.0000000 0.5000000 0.1048999), wk = 0.0030120 k( 298) = ( 0.0000000 0.5000000 0.1180124), wk = 0.0030120 k( 299) = ( 0.0000000 0.5000000 0.1311249), wk = 0.0030120 k( 300) = ( 0.0000000 0.5000000 0.1442374), wk = 0.0030120 k( 301) = ( 0.0000000 0.5000000 0.1573499), wk = 0.0030120 k( 302) = ( 0.0000000 0.5000000 0.1704624), wk = 0.0030120 k( 303) = ( 0.0000000 0.5000000 0.1835749), wk = 0.0030120 k( 304) = ( 0.0000000 0.5000000 0.1966874), wk = 0.0030120 k( 305) = ( 0.0000000 0.5000000 0.2097999), wk = 0.0030120 k( 306) = ( 0.0000000 0.5000000 0.2229124), wk = 0.0030120 k( 307) = ( 0.0000000 0.5000000 0.2360248), wk = 0.0030120 k( 308) = ( 0.0000000 0.5000000 0.2491373), wk = 0.0030120 k( 309) = ( 0.0000000 0.5000000 0.2622498), wk = 0.0030120 k( 310) = ( 0.0000000 0.5000000 0.2753623), wk = 0.0030120 k( 311) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030120 k( 312) = ( 0.5000000 0.5000000 0.0131125), wk = 0.0030120 k( 313) = ( 0.5000000 0.5000000 0.0262250), wk = 0.0030120 k( 314) = ( 0.5000000 0.5000000 0.0393375), wk = 0.0030120 k( 315) = ( 0.5000000 0.5000000 0.0524500), wk = 0.0030120 k( 316) = ( 0.5000000 0.5000000 0.0655625), wk = 0.0030120 k( 317) = ( 0.5000000 0.5000000 0.0786749), wk = 0.0030120 k( 318) = ( 0.5000000 0.5000000 0.0917874), wk = 0.0030120 k( 319) = ( 0.5000000 0.5000000 0.1048999), wk = 0.0030120 k( 320) = ( 0.5000000 0.5000000 0.1180124), wk = 0.0030120 k( 321) = ( 0.5000000 0.5000000 0.1311249), wk = 0.0030120 k( 322) = ( 0.5000000 0.5000000 0.1442374), wk = 0.0030120 k( 323) = ( 0.5000000 0.5000000 0.1573499), wk = 0.0030120 k( 324) = ( 0.5000000 0.5000000 0.1704624), wk = 0.0030120 k( 325) = ( 0.5000000 0.5000000 0.1835749), wk = 0.0030120 k( 326) = ( 0.5000000 0.5000000 0.1966874), wk = 0.0030120 k( 327) = ( 0.5000000 0.5000000 0.2097999), wk = 0.0030120 k( 328) = ( 0.5000000 0.5000000 0.2229124), wk = 0.0030120 k( 329) = ( 0.5000000 0.5000000 0.2360248), wk = 0.0030120 k( 330) = ( 0.5000000 0.5000000 0.2491373), wk = 0.0030120 k( 331) = ( 0.5000000 0.5000000 0.2622498), wk = 0.0030120 k( 332) = ( 0.5000000 0.5000000 0.2753623), wk = 0.0030120 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030120 k( 2) = ( 0.0000000 0.0131579 0.0000000), wk = 0.0030120 k( 3) = ( 0.0000000 0.0263158 -0.0000000), wk = 0.0030120 k( 4) = ( 0.0000000 0.0394737 -0.0000000), wk = 0.0030120 k( 5) = ( 0.0000000 0.0526316 -0.0000000), wk = 0.0030120 k( 6) = ( 0.0000000 0.0657895 0.0000000), wk = 0.0030120 k( 7) = ( 0.0000000 0.0789474 -0.0000000), wk = 0.0030120 k( 8) = ( 0.0000000 0.0921053 0.0000000), wk = 0.0030120 k( 9) = ( 0.0000000 0.1052632 -0.0000000), wk = 0.0030120 k( 10) = ( 0.0000000 0.1184210 0.0000000), wk = 0.0030120 k( 11) = ( 0.0000000 0.1315790 -0.0000000), wk = 0.0030120 k( 12) = ( 0.0000000 0.1447368 0.0000000), wk = 0.0030120 k( 13) = ( 0.0000000 0.1578947 -0.0000000), wk = 0.0030120 k( 14) = ( 0.0000000 0.1710526 -0.0000000), wk = 0.0030120 k( 15) = ( 0.0000000 0.1842105 -0.0000000), wk = 0.0030120 k( 16) = ( 0.0000000 0.1973684 -0.0000000), wk = 0.0030120 k( 17) = ( 0.0000000 0.2105263 -0.0000000), wk = 0.0030120 k( 18) = ( 0.0000000 0.2236842 -0.0000000), wk = 0.0030120 k( 19) = ( 0.0000000 0.2368421 -0.0000000), wk = 0.0030120 k( 20) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0030120 k( 21) = ( 0.0000000 0.2631579 0.0000000), wk = 0.0030120 k( 22) = ( 0.0000000 0.2763158 0.0000000), wk = 0.0030120 k( 23) = ( 0.0000000 0.2894737 0.0000000), wk = 0.0030120 k( 24) = ( 0.0000000 0.3026316 0.0000000), wk = 0.0030120 k( 25) = ( 0.0000000 0.3157895 0.0000000), wk = 0.0030120 k( 26) = ( 0.0000000 0.3289474 -0.0000000), wk = 0.0030120 k( 27) = ( 0.0000000 0.3421053 -0.0000000), wk = 0.0030120 k( 28) = ( 0.0000000 0.3552632 -0.0000000), wk = 0.0030120 k( 29) = ( 0.0000000 0.3684211 0.0000000), wk = 0.0030120 k( 30) = ( 0.0000000 0.3815789 0.0000000), wk = 0.0030120 k( 31) = ( 0.0000000 0.3947368 -0.0000000), wk = 0.0030120 k( 32) = ( 0.0000000 0.4078947 0.0000000), wk = 0.0030120 k( 33) = ( 0.0000000 0.4210526 0.0000000), wk = 0.0030120 k( 34) = ( 0.0000000 0.4342105 0.0000000), wk = 0.0030120 k( 35) = ( 0.0000000 0.4473684 -0.0000000), wk = 0.0030120 k( 36) = ( 0.0000000 0.4605263 -0.0000000), wk = 0.0030120 k( 37) = ( 0.0000000 0.4736842 0.0000000), wk = 0.0030120 k( 38) = ( 0.0000000 0.4868421 0.0000000), wk = 0.0030120 k( 39) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0030120 k( 40) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0030120 k( 41) = ( 0.0131579 0.5000000 -0.0000000), wk = 0.0030120 k( 42) = ( 0.0263158 0.5000000 0.0000000), wk = 0.0030120 k( 43) = ( 0.0394737 0.5000000 0.0000000), wk = 0.0030120 k( 44) = ( 0.0526316 0.5000000 0.0000000), wk = 0.0030120 k( 45) = ( 0.0657895 0.5000000 0.0000000), wk = 0.0030120 k( 46) = ( 0.0789474 0.5000000 -0.0000000), wk = 0.0030120 k( 47) = ( 0.0921053 0.5000000 0.0000000), wk = 0.0030120 k( 48) = ( 0.1052632 0.5000000 0.0000000), wk = 0.0030120 k( 49) = ( 0.1184210 0.5000000 -0.0000000), wk = 0.0030120 k( 50) = ( 0.1315790 0.5000000 -0.0000000), wk = 0.0030120 k( 51) = ( 0.1447368 0.5000000 0.0000000), wk = 0.0030120 k( 52) = ( 0.1578947 0.5000000 0.0000000), wk = 0.0030120 k( 53) = ( 0.1710526 0.5000000 0.0000000), wk = 0.0030120 k( 54) = ( 0.1842105 0.5000000 -0.0000000), wk = 0.0030120 k( 55) = ( 0.1973684 0.5000000 0.0000000), wk = 0.0030120 k( 56) = ( 0.2105263 0.5000000 -0.0000000), wk = 0.0030120 k( 57) = ( 0.2236842 0.5000000 0.0000000), wk = 0.0030120 k( 58) = ( 0.2368421 0.5000000 -0.0000000), wk = 0.0030120 k( 59) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0030120 k( 60) = ( 0.2631579 0.5000000 -0.0000000), wk = 0.0030120 k( 61) = ( 0.2763158 0.5000000 0.0000000), wk = 0.0030120 k( 62) = ( 0.2894737 0.5000000 -0.0000000), wk = 0.0030120 k( 63) = ( 0.3026316 0.5000000 -0.0000000), wk = 0.0030120 k( 64) = ( 0.3157895 0.5000000 0.0000000), wk = 0.0030120 k( 65) = ( 0.3289474 0.5000000 -0.0000000), wk = 0.0030120 k( 66) = ( 0.3421053 0.5000000 0.0000000), wk = 0.0030120 k( 67) = ( 0.3552632 0.5000000 -0.0000000), wk = 0.0030120 k( 68) = ( 0.3684211 0.5000000 -0.0000000), wk = 0.0030120 k( 69) = ( 0.3815789 0.5000000 -0.0000000), wk = 0.0030120 k( 70) = ( 0.3947368 0.5000000 0.0000000), wk = 0.0030120 k( 71) = ( 0.4078947 0.5000000 -0.0000000), wk = 0.0030120 k( 72) = ( 0.4210526 0.5000000 0.0000000), wk = 0.0030120 k( 73) = ( 0.4342105 0.5000000 0.0000000), wk = 0.0030120 k( 74) = ( 0.4473684 0.5000000 0.0000000), wk = 0.0030120 k( 75) = ( 0.4605263 0.5000000 0.0000000), wk = 0.0030120 k( 76) = ( 0.4736842 0.5000000 0.0000000), wk = 0.0030120 k( 77) = ( 0.4868421 0.5000000 -0.0000000), wk = 0.0030120 k( 78) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030120 k( 79) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030120 k( 80) = ( 0.4907407 0.4907407 0.0000000), wk = 0.0030120 k( 81) = ( 0.4814815 0.4814815 0.0000000), wk = 0.0030120 k( 82) = ( 0.4722222 0.4722222 0.0000000), wk = 0.0030120 k( 83) = ( 0.4629630 0.4629630 0.0000000), wk = 0.0030120 k( 84) = ( 0.4537037 0.4537037 -0.0000000), wk = 0.0030120 k( 85) = ( 0.4444444 0.4444444 -0.0000000), wk = 0.0030120 k( 86) = ( 0.4351852 0.4351852 0.0000000), wk = 0.0030120 k( 87) = ( 0.4259259 0.4259259 -0.0000000), wk = 0.0030120 k( 88) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0030120 k( 89) = ( 0.4074074 0.4074074 -0.0000000), wk = 0.0030120 k( 90) = ( 0.3981481 0.3981481 -0.0000000), wk = 0.0030120 k( 91) = ( 0.3888889 0.3888889 0.0000000), wk = 0.0030120 k( 92) = ( 0.3796296 0.3796296 -0.0000000), wk = 0.0030120 k( 93) = ( 0.3703704 0.3703704 -0.0000000), wk = 0.0030120 k( 94) = ( 0.3611111 0.3611111 -0.0000000), wk = 0.0030120 k( 95) = ( 0.3518519 0.3518519 -0.0000000), wk = 0.0030120 k( 96) = ( 0.3425926 0.3425926 -0.0000000), wk = 0.0030120 k( 97) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0030120 k( 98) = ( 0.3240741 0.3240741 -0.0000000), wk = 0.0030120 k( 99) = ( 0.3148148 0.3148148 -0.0000000), wk = 0.0030120 k( 100) = ( 0.3055556 0.3055556 0.0000000), wk = 0.0030120 k( 101) = ( 0.2962963 0.2962963 -0.0000000), wk = 0.0030120 k( 102) = ( 0.2870370 0.2870370 -0.0000000), wk = 0.0030120 k( 103) = ( 0.2777778 0.2777778 0.0000000), wk = 0.0030120 k( 104) = ( 0.2685185 0.2685185 0.0000000), wk = 0.0030120 k( 105) = ( 0.2592593 0.2592593 0.0000000), wk = 0.0030120 k( 106) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0030120 k( 107) = ( 0.2407407 0.2407407 0.0000000), wk = 0.0030120 k( 108) = ( 0.2314815 0.2314815 0.0000000), wk = 0.0030120 k( 109) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0030120 k( 110) = ( 0.2129630 0.2129630 0.0000000), wk = 0.0030120 k( 111) = ( 0.2037037 0.2037037 -0.0000000), wk = 0.0030120 k( 112) = ( 0.1944444 0.1944444 -0.0000000), wk = 0.0030120 k( 113) = ( 0.1851852 0.1851852 0.0000000), wk = 0.0030120 k( 114) = ( 0.1759259 0.1759259 -0.0000000), wk = 0.0030120 k( 115) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0030120 k( 116) = ( 0.1574074 0.1574074 -0.0000000), wk = 0.0030120 k( 117) = ( 0.1481482 0.1481482 -0.0000000), wk = 0.0030120 k( 118) = ( 0.1388889 0.1388889 0.0000000), wk = 0.0030120 k( 119) = ( 0.1296296 0.1296296 0.0000000), wk = 0.0030120 k( 120) = ( 0.1203704 0.1203704 0.0000000), wk = 0.0030120 k( 121) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0030120 k( 122) = ( 0.1018518 0.1018518 -0.0000000), wk = 0.0030120 k( 123) = ( 0.0925926 0.0925926 -0.0000000), wk = 0.0030120 k( 124) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0030120 k( 125) = ( 0.0740741 0.0740741 -0.0000000), wk = 0.0030120 k( 126) = ( 0.0648148 0.0648148 -0.0000000), wk = 0.0030120 k( 127) = ( 0.0555556 0.0555556 0.0000000), wk = 0.0030120 k( 128) = ( 0.0462963 0.0462963 -0.0000000), wk = 0.0030120 k( 129) = ( 0.0370370 0.0370370 -0.0000000), wk = 0.0030120 k( 130) = ( 0.0277778 0.0277778 0.0000000), wk = 0.0030120 k( 131) = ( 0.0185185 0.0185185 -0.0000000), wk = 0.0030120 k( 132) = ( 0.0092593 0.0092593 -0.0000000), wk = 0.0030120 k( 133) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030120 k( 134) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030120 k( 135) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0030120 k( 136) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0030120 k( 137) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0030120 k( 138) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0030120 k( 139) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0030120 k( 140) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0030120 k( 141) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0030120 k( 142) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0030120 k( 143) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0030120 k( 144) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0030120 k( 145) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0030120 k( 146) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0030120 k( 147) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0030120 k( 148) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0030120 k( 149) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0030120 k( 150) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0030120 k( 151) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0030120 k( 152) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0030120 k( 153) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0030120 k( 154) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0030120 k( 155) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030120 k( 156) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030120 k( 157) = ( 0.0000000 0.0131579 0.5000000), wk = 0.0030120 k( 158) = ( 0.0000000 0.0263158 0.5000000), wk = 0.0030120 k( 159) = ( 0.0000000 0.0394737 0.5000000), wk = 0.0030120 k( 160) = ( 0.0000000 0.0526316 0.5000000), wk = 0.0030120 k( 161) = ( 0.0000000 0.0657895 0.5000000), wk = 0.0030120 k( 162) = ( 0.0000000 0.0789474 0.5000000), wk = 0.0030120 k( 163) = ( 0.0000000 0.0921053 0.5000000), wk = 0.0030120 k( 164) = ( 0.0000000 0.1052632 0.5000000), wk = 0.0030120 k( 165) = ( 0.0000000 0.1184210 0.5000000), wk = 0.0030120 k( 166) = ( 0.0000000 0.1315790 0.5000000), wk = 0.0030120 k( 167) = ( 0.0000000 0.1447368 0.5000000), wk = 0.0030120 k( 168) = ( 0.0000000 0.1578947 0.5000000), wk = 0.0030120 k( 169) = ( 0.0000000 0.1710526 0.5000000), wk = 0.0030120 k( 170) = ( 0.0000000 0.1842105 0.5000000), wk = 0.0030120 k( 171) = ( 0.0000000 0.1973684 0.5000000), wk = 0.0030120 k( 172) = ( 0.0000000 0.2105263 0.5000000), wk = 0.0030120 k( 173) = ( 0.0000000 0.2236842 0.5000000), wk = 0.0030120 k( 174) = ( 0.0000000 0.2368421 0.5000000), wk = 0.0030120 k( 175) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0030120 k( 176) = ( 0.0000000 0.2631579 0.5000000), wk = 0.0030120 k( 177) = ( 0.0000000 0.2763158 0.5000000), wk = 0.0030120 k( 178) = ( 0.0000000 0.2894737 0.5000000), wk = 0.0030120 k( 179) = ( 0.0000000 0.3026316 0.5000000), wk = 0.0030120 k( 180) = ( 0.0000000 0.3157895 0.5000000), wk = 0.0030120 k( 181) = ( 0.0000000 0.3289474 0.5000000), wk = 0.0030120 k( 182) = ( 0.0000000 0.3421053 0.5000000), wk = 0.0030120 k( 183) = ( 0.0000000 0.3552632 0.5000000), wk = 0.0030120 k( 184) = ( 0.0000000 0.3684211 0.5000000), wk = 0.0030120 k( 185) = ( 0.0000000 0.3815789 0.5000000), wk = 0.0030120 k( 186) = ( 0.0000000 0.3947368 0.5000000), wk = 0.0030120 k( 187) = ( 0.0000000 0.4078947 0.5000000), wk = 0.0030120 k( 188) = ( 0.0000000 0.4210526 0.5000000), wk = 0.0030120 k( 189) = ( 0.0000000 0.4342105 0.5000000), wk = 0.0030120 k( 190) = ( 0.0000000 0.4473684 0.5000000), wk = 0.0030120 k( 191) = ( 0.0000000 0.4605263 0.5000000), wk = 0.0030120 k( 192) = ( 0.0000000 0.4736842 0.5000000), wk = 0.0030120 k( 193) = ( 0.0000000 0.4868421 0.5000000), wk = 0.0030120 k( 194) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0030120 k( 195) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0030120 k( 196) = ( 0.0131579 0.5000000 0.5000000), wk = 0.0030120 k( 197) = ( 0.0263158 0.5000000 0.5000000), wk = 0.0030120 k( 198) = ( 0.0394737 0.5000000 0.5000000), wk = 0.0030120 k( 199) = ( 0.0526316 0.5000000 0.5000000), wk = 0.0030120 k( 200) = ( 0.0657895 0.5000000 0.5000000), wk = 0.0030120 k( 201) = ( 0.0789474 0.5000000 0.5000000), wk = 0.0030120 k( 202) = ( 0.0921053 0.5000000 0.5000000), wk = 0.0030120 k( 203) = ( 0.1052632 0.5000000 0.5000000), wk = 0.0030120 k( 204) = ( 0.1184210 0.5000000 0.5000000), wk = 0.0030120 k( 205) = ( 0.1315790 0.5000000 0.5000000), wk = 0.0030120 k( 206) = ( 0.1447368 0.5000000 0.5000000), wk = 0.0030120 k( 207) = ( 0.1578947 0.5000000 0.5000000), wk = 0.0030120 k( 208) = ( 0.1710526 0.5000000 0.5000000), wk = 0.0030120 k( 209) = ( 0.1842105 0.5000000 0.5000000), wk = 0.0030120 k( 210) = ( 0.1973684 0.5000000 0.5000000), wk = 0.0030120 k( 211) = ( 0.2105263 0.5000000 0.5000000), wk = 0.0030120 k( 212) = ( 0.2236842 0.5000000 0.5000000), wk = 0.0030120 k( 213) = ( 0.2368421 0.5000000 0.5000000), wk = 0.0030120 k( 214) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0030120 k( 215) = ( 0.2631579 0.5000000 0.5000000), wk = 0.0030120 k( 216) = ( 0.2763158 0.5000000 0.5000000), wk = 0.0030120 k( 217) = ( 0.2894737 0.5000000 0.5000000), wk = 0.0030120 k( 218) = ( 0.3026316 0.5000000 0.5000000), wk = 0.0030120 k( 219) = ( 0.3157895 0.5000000 0.5000000), wk = 0.0030120 k( 220) = ( 0.3289474 0.5000000 0.5000000), wk = 0.0030120 k( 221) = ( 0.3421053 0.5000000 0.5000000), wk = 0.0030120 k( 222) = ( 0.3552632 0.5000000 0.5000000), wk = 0.0030120 k( 223) = ( 0.3684211 0.5000000 0.5000000), wk = 0.0030120 k( 224) = ( 0.3815789 0.5000000 0.5000000), wk = 0.0030120 k( 225) = ( 0.3947368 0.5000000 0.5000000), wk = 0.0030120 k( 226) = ( 0.4078947 0.5000000 0.5000000), wk = 0.0030120 k( 227) = ( 0.4210526 0.5000000 0.5000000), wk = 0.0030120 k( 228) = ( 0.4342105 0.5000000 0.5000000), wk = 0.0030120 k( 229) = ( 0.4473684 0.5000000 0.5000000), wk = 0.0030120 k( 230) = ( 0.4605263 0.5000000 0.5000000), wk = 0.0030120 k( 231) = ( 0.4736842 0.5000000 0.5000000), wk = 0.0030120 k( 232) = ( 0.4868421 0.5000000 0.5000000), wk = 0.0030120 k( 233) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030120 k( 234) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030120 k( 235) = ( 0.4907407 0.4907407 0.5000000), wk = 0.0030120 k( 236) = ( 0.4814815 0.4814815 0.5000000), wk = 0.0030120 k( 237) = ( 0.4722222 0.4722222 0.5000000), wk = 0.0030120 k( 238) = ( 0.4629630 0.4629630 0.5000000), wk = 0.0030120 k( 239) = ( 0.4537037 0.4537037 0.5000000), wk = 0.0030120 k( 240) = ( 0.4444444 0.4444444 0.5000000), wk = 0.0030120 k( 241) = ( 0.4351852 0.4351852 0.5000000), wk = 0.0030120 k( 242) = ( 0.4259259 0.4259259 0.5000000), wk = 0.0030120 k( 243) = ( 0.4166667 0.4166667 0.5000000), wk = 0.0030120 k( 244) = ( 0.4074074 0.4074074 0.5000000), wk = 0.0030120 k( 245) = ( 0.3981481 0.3981481 0.5000000), wk = 0.0030120 k( 246) = ( 0.3888889 0.3888889 0.5000000), wk = 0.0030120 k( 247) = ( 0.3796296 0.3796296 0.5000000), wk = 0.0030120 k( 248) = ( 0.3703704 0.3703704 0.5000000), wk = 0.0030120 k( 249) = ( 0.3611111 0.3611111 0.5000000), wk = 0.0030120 k( 250) = ( 0.3518519 0.3518519 0.5000000), wk = 0.0030120 k( 251) = ( 0.3425926 0.3425926 0.5000000), wk = 0.0030120 k( 252) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0030120 k( 253) = ( 0.3240741 0.3240741 0.5000000), wk = 0.0030120 k( 254) = ( 0.3148148 0.3148148 0.5000000), wk = 0.0030120 k( 255) = ( 0.3055556 0.3055556 0.5000000), wk = 0.0030120 k( 256) = ( 0.2962963 0.2962963 0.5000000), wk = 0.0030120 k( 257) = ( 0.2870370 0.2870370 0.5000000), wk = 0.0030120 k( 258) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0030120 k( 259) = ( 0.2685185 0.2685185 0.5000000), wk = 0.0030120 k( 260) = ( 0.2592593 0.2592593 0.5000000), wk = 0.0030120 k( 261) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0030120 k( 262) = ( 0.2407407 0.2407407 0.5000000), wk = 0.0030120 k( 263) = ( 0.2314815 0.2314815 0.5000000), wk = 0.0030120 k( 264) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0030120 k( 265) = ( 0.2129630 0.2129630 0.5000000), wk = 0.0030120 k( 266) = ( 0.2037037 0.2037037 0.5000000), wk = 0.0030120 k( 267) = ( 0.1944444 0.1944444 0.5000000), wk = 0.0030120 k( 268) = ( 0.1851852 0.1851852 0.5000000), wk = 0.0030120 k( 269) = ( 0.1759259 0.1759259 0.5000000), wk = 0.0030120 k( 270) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0030120 k( 271) = ( 0.1574074 0.1574074 0.5000000), wk = 0.0030120 k( 272) = ( 0.1481482 0.1481482 0.5000000), wk = 0.0030120 k( 273) = ( 0.1388889 0.1388889 0.5000000), wk = 0.0030120 k( 274) = ( 0.1296296 0.1296296 0.5000000), wk = 0.0030120 k( 275) = ( 0.1203704 0.1203704 0.5000000), wk = 0.0030120 k( 276) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0030120 k( 277) = ( 0.1018518 0.1018518 0.5000000), wk = 0.0030120 k( 278) = ( 0.0925926 0.0925926 0.5000000), wk = 0.0030120 k( 279) = ( 0.0833333 0.0833333 0.5000000), wk = 0.0030120 k( 280) = ( 0.0740741 0.0740741 0.5000000), wk = 0.0030120 k( 281) = ( 0.0648148 0.0648148 0.5000000), wk = 0.0030120 k( 282) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0030120 k( 283) = ( 0.0462963 0.0462963 0.5000000), wk = 0.0030120 k( 284) = ( 0.0370370 0.0370370 0.5000000), wk = 0.0030120 k( 285) = ( 0.0277778 0.0277778 0.5000000), wk = 0.0030120 k( 286) = ( 0.0185185 0.0185185 0.5000000), wk = 0.0030120 k( 287) = ( 0.0092593 0.0092593 0.5000000), wk = 0.0030120 k( 288) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030120 k( 289) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0030120 k( 290) = ( 0.0000000 0.5000000 0.0238095), wk = 0.0030120 k( 291) = ( 0.0000000 0.5000000 0.0476191), wk = 0.0030120 k( 292) = ( 0.0000000 0.5000000 0.0714286), wk = 0.0030120 k( 293) = ( 0.0000000 0.5000000 0.0952381), wk = 0.0030120 k( 294) = ( 0.0000000 0.5000000 0.1190476), wk = 0.0030120 k( 295) = ( 0.0000000 0.5000000 0.1428571), wk = 0.0030120 k( 296) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0030120 k( 297) = ( 0.0000000 0.5000000 0.1904762), wk = 0.0030120 k( 298) = ( 0.0000000 0.5000000 0.2142857), wk = 0.0030120 k( 299) = ( 0.0000000 0.5000000 0.2380952), wk = 0.0030120 k( 300) = ( 0.0000000 0.5000000 0.2619048), wk = 0.0030120 k( 301) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0030120 k( 302) = ( 0.0000000 0.5000000 0.3095238), wk = 0.0030120 k( 303) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0030120 k( 304) = ( 0.0000000 0.5000000 0.3571429), wk = 0.0030120 k( 305) = ( 0.0000000 0.5000000 0.3809524), wk = 0.0030120 k( 306) = ( 0.0000000 0.5000000 0.4047619), wk = 0.0030120 k( 307) = ( 0.0000000 0.5000000 0.4285714), wk = 0.0030120 k( 308) = ( 0.0000000 0.5000000 0.4523810), wk = 0.0030120 k( 309) = ( 0.0000000 0.5000000 0.4761905), wk = 0.0030120 k( 310) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0030120 k( 311) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0030120 k( 312) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0030120 k( 313) = ( 0.5000000 0.5000000 0.0476191), wk = 0.0030120 k( 314) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0030120 k( 315) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0030120 k( 316) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0030120 k( 317) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0030120 k( 318) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0030120 k( 319) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0030120 k( 320) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0030120 k( 321) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0030120 k( 322) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0030120 k( 323) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0030120 k( 324) = ( 0.5000000 0.5000000 0.3095238), wk = 0.0030120 k( 325) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0030120 k( 326) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0030120 k( 327) = ( 0.5000000 0.5000000 0.3809524), wk = 0.0030120 k( 328) = ( 0.5000000 0.5000000 0.4047619), wk = 0.0030120 k( 329) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0030120 k( 330) = ( 0.5000000 0.5000000 0.4523810), wk = 0.0030120 k( 331) = ( 0.5000000 0.5000000 0.4761905), wk = 0.0030120 k( 332) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030120 Dense grid: 85389 G-vectors FFT dimensions: ( 45, 45, 81) Smooth grid: 42677 G-vectors FFT dimensions: ( 36, 36, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.32 Mb ( 308, 68) NL pseudopotentials 0.29 Mb ( 154, 124) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.02 Mb ( 2370) G-vector shells 0.01 Mb ( 1207) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.28 Mb ( 308, 272) Each subspace H/S matrix 0.07 Mb ( 68, 68) Each matrix 0.26 Mb ( 124, 2, 68) The potential is recalculated from file : ./PbBrF.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.5 secs Computing kpt #: 2 total cpu time spent up to now is 5.1 secs Computing kpt #: 3 total cpu time spent up to now is 5.7 secs Computing kpt #: 4 total cpu time spent up to now is 6.2 secs Computing kpt #: 5 total cpu time spent up to now is 6.9 secs Computing kpt #: 6 total cpu time spent up to now is 7.4 secs Computing kpt #: 7 total cpu time spent up to now is 8.0 secs Computing kpt #: 8 total cpu time spent up to now is 8.6 secs Computing kpt #: 9 total cpu time spent up to now is 9.1 secs Computing kpt #: 10 total cpu time spent up to now is 9.7 secs Computing kpt #: 11 total cpu time spent up to now is 10.2 secs Computing kpt #: 12 total cpu time spent up to now is 10.8 secs Computing kpt #: 13 total cpu time spent up to now is 11.3 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 12.3 secs Computing kpt #: 16 total cpu time spent up to now is 12.8 secs Computing kpt #: 17 total cpu time spent up to now is 13.3 secs Computing kpt #: 18 total cpu time spent up to now is 13.8 secs Computing kpt #: 19 total cpu time spent up to now is 14.3 secs Computing kpt #: 20 total cpu time spent up to now is 14.7 secs Computing kpt #: 21 total cpu time spent up to now is 15.2 secs Computing kpt #: 22 total cpu time spent up to now is 15.7 secs Computing kpt #: 23 total cpu time spent up to now is 16.1 secs Computing kpt #: 24 total cpu time spent up to now is 16.6 secs Computing kpt #: 25 total cpu time spent up to now is 17.0 secs Computing kpt #: 26 total cpu time spent up to now is 17.5 secs Computing kpt #: 27 total cpu time spent up to now is 17.9 secs Computing kpt #: 28 total cpu time spent up to now is 18.3 secs Computing kpt #: 29 total cpu time spent up to now is 18.8 secs Computing kpt #: 30 total cpu time spent up to now is 19.2 secs Computing kpt #: 31 total cpu time spent up to now is 19.6 secs Computing kpt #: 32 total cpu time spent up to now is 20.1 secs Computing kpt #: 33 total cpu time spent up to now is 20.5 secs Computing kpt #: 34 total cpu time spent up to now is 21.0 secs Computing kpt #: 35 total cpu time spent up to now is 21.4 secs Computing kpt #: 36 total cpu time spent up to now is 21.8 secs Computing kpt #: 37 total cpu time spent up to now is 22.3 secs Computing kpt #: 38 total cpu time spent up to now is 22.7 secs Computing kpt #: 39 total cpu time spent up to now is 23.2 secs Computing kpt #: 40 total cpu time spent up to now is 23.6 secs Computing kpt #: 41 total cpu time spent up to now is 24.0 secs Computing kpt #: 42 total cpu time spent up to now is 24.5 secs Computing kpt #: 43 total cpu time spent up to now is 24.9 secs Computing kpt #: 44 total cpu time spent up to now is 25.4 secs Computing kpt #: 45 total cpu time spent up to now is 25.8 secs Computing kpt #: 46 total cpu time spent up to now is 26.2 secs Computing kpt #: 47 total cpu time spent up to now is 26.7 secs Computing kpt #: 48 total cpu time spent up to now is 27.1 secs Computing kpt #: 49 total cpu time spent up to now is 27.6 secs Computing kpt #: 50 total cpu time spent up to now is 28.0 secs Computing kpt #: 51 total cpu time spent up to now is 28.5 secs Computing kpt #: 52 total cpu time spent up to now is 28.9 secs Computing kpt #: 53 total cpu time spent up to now is 29.4 secs Computing kpt #: 54 total cpu time spent up to now is 29.9 secs Computing kpt #: 55 total cpu time spent up to now is 30.3 secs Computing kpt #: 56 total cpu time spent up to now is 30.8 secs Computing kpt #: 57 total cpu time spent up to now is 31.2 secs Computing kpt #: 58 total cpu time spent up to now is 31.7 secs Computing kpt #: 59 total cpu time spent up to now is 32.2 secs Computing kpt #: 60 total cpu time spent up to now is 32.6 secs Computing kpt #: 61 total cpu time spent up to now is 33.1 secs Computing kpt #: 62 total cpu time spent up to now is 33.5 secs Computing kpt #: 63 total cpu time spent up to now is 34.0 secs Computing kpt #: 64 total cpu time spent up to now is 34.4 secs Computing kpt #: 65 total cpu time spent up to now is 34.9 secs Computing kpt #: 66 total cpu time spent up to now is 35.3 secs Computing kpt #: 67 total cpu time spent up to now is 35.8 secs Computing kpt #: 68 total cpu time spent up to now is 36.2 secs Computing kpt #: 69 total cpu time spent up to now is 36.7 secs Computing kpt #: 70 total cpu time spent up to now is 37.1 secs Computing kpt #: 71 total cpu time spent up to now is 37.5 secs Computing kpt #: 72 total cpu time spent up to now is 38.2 secs Computing kpt #: 73 total cpu time spent up to now is 38.6 secs Computing kpt #: 74 total cpu time spent up to now is 39.0 secs Computing kpt #: 75 total cpu time spent up to now is 39.5 secs Computing kpt #: 76 total cpu time spent up to now is 39.9 secs Computing kpt #: 77 total cpu time spent up to now is 40.3 secs Computing kpt #: 78 total cpu time spent up to now is 40.8 secs Computing kpt #: 79 total cpu time spent up to now is 41.2 secs Computing kpt #: 80 total cpu time spent up to now is 41.6 secs Computing kpt #: 81 total cpu time spent up to now is 42.1 secs Computing kpt #: 82 total cpu time spent up to now is 42.5 secs Computing kpt #: 83 total cpu time spent up to now is 42.9 secs Computing kpt #: 84 total cpu time spent up to now is 43.3 secs Computing kpt #: 85 total cpu time spent up to now is 43.8 secs Computing kpt #: 86 total cpu time spent up to now is 44.2 secs Computing kpt #: 87 total cpu time spent up to now is 44.6 secs Computing kpt #: 88 total cpu time spent up to now is 45.1 secs Computing kpt #: 89 total cpu time spent up to now is 45.5 secs Computing kpt #: 90 total cpu time spent up to now is 46.0 secs Computing kpt #: 91 total cpu time spent up to now is 46.4 secs Computing kpt #: 92 total cpu time spent up to now is 46.8 secs Computing kpt #: 93 total cpu time spent up to now is 47.3 secs Computing kpt #: 94 total cpu time spent up to now is 47.7 secs Computing kpt #: 95 total cpu time spent up to now is 48.2 secs Computing kpt #: 96 total cpu time spent up to now is 48.6 secs Computing kpt #: 97 total cpu time spent up to now is 49.1 secs Computing kpt #: 98 total cpu time spent up to now is 49.5 secs Computing kpt #: 99 total cpu time spent up to now is 50.0 secs Computing kpt #: 100 total cpu time spent up to now is 50.4 secs Computing kpt #: 101 total cpu time spent up to now is 50.9 secs Computing kpt #: 102 total cpu time spent up to now is 51.3 secs Computing kpt #: 103 total cpu time spent up to now is 51.8 secs Computing kpt #: 104 total cpu time spent up to now is 52.2 secs Computing kpt #: 105 total cpu time spent up to now is 52.7 secs Computing kpt #: 106 total cpu time spent up to now is 53.1 secs Computing kpt #: 107 total cpu time spent up to now is 53.6 secs Computing kpt #: 108 total cpu time spent up to now is 54.0 secs Computing kpt #: 109 total cpu time spent up to now is 54.5 secs Computing kpt #: 110 total cpu time spent up to now is 54.9 secs Computing kpt #: 111 total cpu time spent up to now is 55.3 secs Computing kpt #: 112 total cpu time spent up to now is 55.8 secs Computing kpt #: 113 total cpu time spent up to now is 56.2 secs Computing kpt #: 114 total cpu time spent up to now is 56.7 secs Computing kpt #: 115 total cpu time spent up to now is 57.2 secs Computing kpt #: 116 total cpu time spent up to now is 57.6 secs Computing kpt #: 117 total cpu time spent up to now is 58.1 secs Computing kpt #: 118 total cpu time spent up to now is 58.6 secs Computing kpt #: 119 total cpu time spent up to now is 59.1 secs Computing kpt #: 120 total cpu time spent up to now is 59.6 secs Computing kpt #: 121 total cpu time spent up to now is 60.1 secs Computing kpt #: 122 total cpu time spent up to now is 60.6 secs Computing kpt #: 123 total cpu time spent up to now is 61.2 secs Computing kpt #: 124 total cpu time spent up to now is 61.7 secs Computing kpt #: 125 total cpu time spent up to now is 62.3 secs Computing kpt #: 126 total cpu time spent up to now is 62.8 secs Computing kpt #: 127 total cpu time spent up to now is 63.4 secs Computing kpt #: 128 total cpu time spent up to now is 64.0 secs Computing kpt #: 129 total cpu time spent up to now is 64.6 secs Computing kpt #: 130 total cpu time spent up to now is 65.1 secs Computing kpt #: 131 total cpu time spent up to now is 65.7 secs Computing kpt #: 132 total cpu time spent up to now is 66.3 secs Computing kpt #: 133 total cpu time spent up to now is 66.9 secs Computing kpt #: 134 total cpu time spent up to now is 67.5 secs Computing kpt #: 135 total cpu time spent up to now is 68.1 secs Computing kpt #: 136 total cpu time spent up to now is 68.7 secs Computing kpt #: 137 total cpu time spent up to now is 69.3 secs Computing kpt #: 138 total cpu time spent up to now is 69.9 secs Computing kpt #: 139 total cpu time spent up to now is 70.5 secs Computing kpt #: 140 total cpu time spent up to now is 71.1 secs Computing kpt #: 141 total cpu time spent up to now is 71.7 secs Computing kpt #: 142 total cpu time spent up to now is 72.3 secs Computing kpt #: 143 total cpu time spent up to now is 72.9 secs Computing kpt #: 144 total cpu time spent up to now is 73.5 secs Computing kpt #: 145 total cpu time spent up to now is 74.1 secs Computing kpt #: 146 total cpu time spent up to now is 74.7 secs Computing kpt #: 147 total cpu time spent up to now is 75.3 secs Computing kpt #: 148 total cpu time spent up to now is 75.9 secs Computing kpt #: 149 total cpu time spent up to now is 76.5 secs Computing kpt #: 150 total cpu time spent up to now is 77.1 secs Computing kpt #: 151 total cpu time spent up to now is 77.7 secs Computing kpt #: 152 total cpu time spent up to now is 78.2 secs Computing kpt #: 153 total cpu time spent up to now is 78.7 secs Computing kpt #: 154 total cpu time spent up to now is 79.2 secs Computing kpt #: 155 total cpu time spent up to now is 79.8 secs Computing kpt #: 156 total cpu time spent up to now is 80.3 secs Computing kpt #: 157 total cpu time spent up to now is 80.9 secs Computing kpt #: 158 total cpu time spent up to now is 81.5 secs Computing kpt #: 159 total cpu time spent up to now is 82.1 secs Computing kpt #: 160 total cpu time spent up to now is 82.6 secs Computing kpt #: 161 total cpu time spent up to now is 83.1 secs Computing kpt #: 162 total cpu time spent up to now is 83.7 secs Computing kpt #: 163 total cpu time spent up to now is 84.2 secs Computing kpt #: 164 total cpu time spent up to now is 84.7 secs Computing kpt #: 165 total cpu time spent up to now is 85.2 secs Computing kpt #: 166 total cpu time spent up to now is 85.7 secs Computing kpt #: 167 total cpu time spent up to now is 86.2 secs Computing kpt #: 168 total cpu time spent up to now is 86.7 secs Computing kpt #: 169 total cpu time spent up to now is 87.2 secs Computing kpt #: 170 total cpu time spent up to now is 87.7 secs Computing kpt #: 171 total cpu time spent up to now is 88.1 secs Computing kpt #: 172 total cpu time spent up to now is 88.6 secs Computing kpt #: 173 total cpu time spent up to now is 89.1 secs Computing kpt #: 174 total cpu time spent up to now is 89.5 secs Computing kpt #: 175 total cpu time spent up to now is 90.0 secs Computing kpt #: 176 total cpu time spent up to now is 90.5 secs Computing kpt #: 177 total cpu time spent up to now is 90.9 secs Computing kpt #: 178 total cpu time spent up to now is 91.4 secs Computing kpt #: 179 total cpu time spent up to now is 91.8 secs Computing kpt #: 180 total cpu time spent up to now is 92.3 secs Computing kpt #: 181 total cpu time spent up to now is 92.7 secs Computing kpt #: 182 total cpu time spent up to now is 93.1 secs Computing kpt #: 183 total cpu time spent up to now is 93.6 secs Computing kpt #: 184 total cpu time spent up to now is 94.0 secs Computing kpt #: 185 total cpu time spent up to now is 94.4 secs Computing kpt #: 186 total cpu time spent up to now is 94.8 secs Computing kpt #: 187 total cpu time spent up to now is 95.3 secs Computing kpt #: 188 total cpu time spent up to now is 95.7 secs Computing kpt #: 189 total cpu time spent up to now is 96.1 secs Computing kpt #: 190 total cpu time spent up to now is 96.5 secs Computing kpt #: 191 total cpu time spent up to now is 97.0 secs Computing kpt #: 192 total cpu time spent up to now is 97.4 secs Computing kpt #: 193 total cpu time spent up to now is 97.8 secs Computing kpt #: 194 total cpu time spent up to now is 98.2 secs Computing kpt #: 195 total cpu time spent up to now is 98.7 secs Computing kpt #: 196 total cpu time spent up to now is 99.1 secs Computing kpt #: 197 total cpu time spent up to now is 99.5 secs Computing kpt #: 198 total cpu time spent up to now is 99.9 secs Computing kpt #: 199 total cpu time spent up to now is 100.4 secs Computing kpt #: 200 total cpu time spent up to now is 100.8 secs Computing kpt #: 201 total cpu time spent up to now is 101.2 secs Computing kpt #: 202 total cpu time spent up to now is 101.7 secs Computing kpt #: 203 total cpu time spent up to now is 102.1 secs Computing kpt #: 204 total cpu time spent up to now is 102.5 secs Computing kpt #: 205 total cpu time spent up to now is 103.0 secs Computing kpt #: 206 total cpu time spent up to now is 103.4 secs Computing kpt #: 207 total cpu time spent up to now is 103.9 secs Computing kpt #: 208 total cpu time spent up to now is 104.3 secs Computing kpt #: 209 total cpu time spent up to now is 104.8 secs Computing kpt #: 210 total cpu time spent up to now is 105.2 secs Computing kpt #: 211 total cpu time spent up to now is 105.7 secs Computing kpt #: 212 total cpu time spent up to now is 106.1 secs Computing kpt #: 213 total cpu time spent up to now is 106.6 secs Computing kpt #: 214 total cpu time spent up to now is 107.1 secs Computing kpt #: 215 total cpu time spent up to now is 107.5 secs Computing kpt #: 216 total cpu time spent up to now is 108.0 secs Computing kpt #: 217 total cpu time spent up to now is 108.4 secs Computing kpt #: 218 total cpu time spent up to now is 108.9 secs Computing kpt #: 219 total cpu time spent up to now is 109.4 secs Computing kpt #: 220 total cpu time spent up to now is 109.8 secs Computing kpt #: 221 total cpu time spent up to now is 110.2 secs Computing kpt #: 222 total cpu time spent up to now is 110.7 secs Computing kpt #: 223 total cpu time spent up to now is 111.1 secs Computing kpt #: 224 total cpu time spent up to now is 111.5 secs Computing kpt #: 225 total cpu time spent up to now is 112.0 secs Computing kpt #: 226 total cpu time spent up to now is 112.4 secs Computing kpt #: 227 total cpu time spent up to now is 112.8 secs Computing kpt #: 228 total cpu time spent up to now is 113.2 secs Computing kpt #: 229 total cpu time spent up to now is 113.7 secs Computing kpt #: 230 total cpu time spent up to now is 114.1 secs Computing kpt #: 231 total cpu time spent up to now is 114.5 secs Computing kpt #: 232 total cpu time spent up to now is 114.9 secs Computing kpt #: 233 total cpu time spent up to now is 115.3 secs Computing kpt #: 234 total cpu time spent up to now is 115.8 secs Computing kpt #: 235 total cpu time spent up to now is 116.2 secs Computing kpt #: 236 total cpu time spent up to now is 116.6 secs Computing kpt #: 237 total cpu time spent up to now is 117.0 secs Computing kpt #: 238 total cpu time spent up to now is 117.5 secs Computing kpt #: 239 total cpu time spent up to now is 117.9 secs Computing kpt #: 240 total cpu time spent up to now is 118.3 secs Computing kpt #: 241 total cpu time spent up to now is 118.7 secs Computing kpt #: 242 total cpu time spent up to now is 119.2 secs Computing kpt #: 243 total cpu time spent up to now is 119.6 secs Computing kpt #: 244 total cpu time spent up to now is 120.0 secs Computing kpt #: 245 total cpu time spent up to now is 120.5 secs Computing kpt #: 246 total cpu time spent up to now is 120.9 secs Computing kpt #: 247 total cpu time spent up to now is 121.4 secs Computing kpt #: 248 total cpu time spent up to now is 121.8 secs Computing kpt #: 249 total cpu time spent up to now is 122.3 secs Computing kpt #: 250 total cpu time spent up to now is 122.7 secs Computing kpt #: 251 total cpu time spent up to now is 123.2 secs Computing kpt #: 252 total cpu time spent up to now is 123.6 secs Computing kpt #: 253 total cpu time spent up to now is 124.1 secs Computing kpt #: 254 total cpu time spent up to now is 124.5 secs Computing kpt #: 255 total cpu time spent up to now is 125.0 secs Computing kpt #: 256 total cpu time spent up to now is 125.4 secs Computing kpt #: 257 total cpu time spent up to now is 125.9 secs Computing kpt #: 258 total cpu time spent up to now is 126.3 secs Computing kpt #: 259 total cpu time spent up to now is 126.8 secs Computing kpt #: 260 total cpu time spent up to now is 127.3 secs Computing kpt #: 261 total cpu time spent up to now is 127.7 secs Computing kpt #: 262 total cpu time spent up to now is 128.2 secs Computing kpt #: 263 total cpu time spent up to now is 128.7 secs Computing kpt #: 264 total cpu time spent up to now is 129.1 secs Computing kpt #: 265 total cpu time spent up to now is 129.6 secs Computing kpt #: 266 total cpu time spent up to now is 130.0 secs Computing kpt #: 267 total cpu time spent up to now is 130.5 secs Computing kpt #: 268 total cpu time spent up to now is 130.9 secs Computing kpt #: 269 total cpu time spent up to now is 131.4 secs Computing kpt #: 270 total cpu time spent up to now is 131.8 secs Computing kpt #: 271 total cpu time spent up to now is 132.3 secs Computing kpt #: 272 total cpu time spent up to now is 132.7 secs Computing kpt #: 273 total cpu time spent up to now is 133.2 secs Computing kpt #: 274 total cpu time spent up to now is 133.7 secs Computing kpt #: 275 total cpu time spent up to now is 134.2 secs Computing kpt #: 276 total cpu time spent up to now is 134.7 secs Computing kpt #: 277 total cpu time spent up to now is 135.2 secs Computing kpt #: 278 total cpu time spent up to now is 135.7 secs Computing kpt #: 279 total cpu time spent up to now is 136.2 secs Computing kpt #: 280 total cpu time spent up to now is 136.7 secs Computing kpt #: 281 total cpu time spent up to now is 137.2 secs Computing kpt #: 282 total cpu time spent up to now is 137.7 secs Computing kpt #: 283 total cpu time spent up to now is 138.3 secs Computing kpt #: 284 total cpu time spent up to now is 138.8 secs Computing kpt #: 285 total cpu time spent up to now is 139.4 secs Computing kpt #: 286 total cpu time spent up to now is 139.9 secs Computing kpt #: 287 total cpu time spent up to now is 140.4 secs Computing kpt #: 288 total cpu time spent up to now is 141.0 secs Computing kpt #: 289 total cpu time spent up to now is 141.4 secs Computing kpt #: 290 total cpu time spent up to now is 141.8 secs Computing kpt #: 291 total cpu time spent up to now is 142.3 secs Computing kpt #: 292 total cpu time spent up to now is 142.7 secs Computing kpt #: 293 total cpu time spent up to now is 143.2 secs Computing kpt #: 294 total cpu time spent up to now is 143.6 secs Computing kpt #: 295 total cpu time spent up to now is 144.0 secs Computing kpt #: 296 total cpu time spent up to now is 144.5 secs Computing kpt #: 297 total cpu time spent up to now is 144.9 secs Computing kpt #: 298 total cpu time spent up to now is 145.3 secs Computing kpt #: 299 total cpu time spent up to now is 145.7 secs Computing kpt #: 300 total cpu time spent up to now is 146.2 secs Computing kpt #: 301 total cpu time spent up to now is 146.6 secs Computing kpt #: 302 total cpu time spent up to now is 147.0 secs Computing kpt #: 303 total cpu time spent up to now is 147.5 secs Computing kpt #: 304 total cpu time spent up to now is 147.9 secs Computing kpt #: 305 total cpu time spent up to now is 148.3 secs Computing kpt #: 306 total cpu time spent up to now is 148.7 secs Computing kpt #: 307 total cpu time spent up to now is 149.2 secs Computing kpt #: 308 total cpu time spent up to now is 149.6 secs Computing kpt #: 309 total cpu time spent up to now is 150.0 secs Computing kpt #: 310 total cpu time spent up to now is 150.4 secs Computing kpt #: 311 total cpu time spent up to now is 150.9 secs Computing kpt #: 312 total cpu time spent up to now is 151.3 secs Computing kpt #: 313 total cpu time spent up to now is 151.7 secs Computing kpt #: 314 total cpu time spent up to now is 152.1 secs Computing kpt #: 315 total cpu time spent up to now is 152.6 secs Computing kpt #: 316 total cpu time spent up to now is 153.0 secs Computing kpt #: 317 total cpu time spent up to now is 153.4 secs Computing kpt #: 318 total cpu time spent up to now is 153.9 secs Computing kpt #: 319 total cpu time spent up to now is 154.3 secs Computing kpt #: 320 total cpu time spent up to now is 154.7 secs Computing kpt #: 321 total cpu time spent up to now is 155.2 secs Computing kpt #: 322 total cpu time spent up to now is 155.6 secs Computing kpt #: 323 total cpu time spent up to now is 156.0 secs Computing kpt #: 324 total cpu time spent up to now is 156.5 secs Computing kpt #: 325 total cpu time spent up to now is 156.9 secs Computing kpt #: 326 total cpu time spent up to now is 157.3 secs Computing kpt #: 327 total cpu time spent up to now is 157.7 secs Computing kpt #: 328 total cpu time spent up to now is 158.2 secs Computing kpt #: 329 total cpu time spent up to now is 158.6 secs Computing kpt #: 330 total cpu time spent up to now is 159.0 secs Computing kpt #: 331 total cpu time spent up to now is 159.4 secs Computing kpt #: 332 total cpu time spent up to now is 159.9 secs ethr = 1.79E-08, avg # of iterations = 13.6 total cpu time spent up to now is 159.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5337 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8582 -10.8582 -10.8466 -10.8466 -10.8444 -10.8444 -10.7863 -10.7863 -8.3257 -8.3257 -8.3149 -8.3149 -8.3031 -8.3031 -8.2749 -8.2749 -8.2490 -8.2490 -8.2086 -8.2086 -7.5945 -7.5945 -7.0731 -7.0731 -0.8896 -0.8896 0.4039 0.4039 1.8315 1.8315 1.9607 1.9607 3.0205 3.0205 3.2516 3.2516 3.3486 3.3486 3.8533 3.8533 4.0780 4.0780 4.4503 4.4503 4.7243 4.7243 4.8232 4.8232 5.3164 5.3164 5.8434 5.8434 9.3788 9.3788 9.8591 9.8591 11.8833 11.8833 12.0940 12.0940 12.7153 12.7153 12.7517 12.7517 k = 0.0000 0.0132-0.0000 ( 5327 PWs) bands (ev): -15.8937 -15.8937 -15.5227 -15.5227 -10.8582 -10.8582 -10.8466 -10.8466 -10.8444 -10.8444 -10.7863 -10.7863 -8.3258 -8.3258 -8.3149 -8.3149 -8.3031 -8.3031 -8.2749 -8.2749 -8.2490 -8.2490 -8.2085 -8.2085 -7.5939 -7.5939 -7.0729 -7.0729 -0.8904 -0.8904 0.4020 0.4020 1.8320 1.8320 1.9611 1.9611 3.0192 3.0192 3.2519 3.2519 3.3486 3.3486 3.8506 3.8506 4.0748 4.0748 4.4507 4.4507 4.7255 4.7255 4.8270 4.8270 5.3188 5.3188 5.8432 5.8432 9.3800 9.3800 9.8596 9.8596 11.8783 11.8783 12.0927 12.0927 12.7095 12.7095 12.7550 12.7550 k = 0.0000 0.0263-0.0000 ( 5321 PWs) bands (ev): -15.8932 -15.8932 -15.5231 -15.5231 -10.8582 -10.8582 -10.8465 -10.8465 -10.8443 -10.8443 -10.7862 -10.7862 -8.3259 -8.3259 -8.3147 -8.3147 -8.3029 -8.3029 -8.2750 -8.2750 -8.2491 -8.2491 -8.2084 -8.2084 -7.5922 -7.5922 -7.0725 -7.0725 -0.8927 -0.8927 0.3963 0.3963 1.8335 1.8335 1.9624 1.9624 3.0156 3.0156 3.2527 3.2527 3.3485 3.3485 3.8425 3.8425 4.0653 4.0653 4.4522 4.4522 4.7289 4.7289 4.8378 4.8378 5.3261 5.3261 5.8426 5.8426 9.3835 9.3835 9.8611 9.8611 11.8635 11.8635 12.0890 12.0890 12.6919 12.6919 12.7648 12.7648 k = 0.0000 0.0395-0.0000 ( 5321 PWs) bands (ev): -15.8924 -15.8924 -15.5239 -15.5239 -10.8581 -10.8581 -10.8465 -10.8465 -10.8441 -10.8441 -10.7862 -10.7862 -8.3261 -8.3261 -8.3144 -8.3144 -8.3026 -8.3026 -8.2751 -8.2751 -8.2493 -8.2493 -8.2083 -8.2083 -7.5894 -7.5894 -7.0718 -7.0718 -0.8964 -0.8964 0.3867 0.3867 1.8359 1.8359 1.9645 1.9645 3.0097 3.0097 3.2536 3.2536 3.3485 3.3485 3.8294 3.8294 4.0502 4.0502 4.4554 4.4554 4.7348 4.7348 4.8543 4.8543 5.3381 5.3381 5.8416 5.8416 9.3892 9.3892 9.8636 9.8636 11.8392 11.8392 12.0832 12.0832 12.6630 12.6630 12.7803 12.7803 k = 0.0000 0.0526-0.0000 ( 5329 PWs) bands (ev): -15.8912 -15.8912 -15.5249 -15.5249 -10.8580 -10.8580 -10.8464 -10.8464 -10.8439 -10.8439 -10.7862 -10.7862 -8.3263 -8.3263 -8.3141 -8.3141 -8.3022 -8.3022 -8.2753 -8.2753 -8.2496 -8.2496 -8.2081 -8.2081 -7.5855 -7.5855 -7.0709 -7.0709 -0.9016 -0.9016 0.3735 0.3735 1.8394 1.8394 1.9676 1.9676 3.0018 3.0018 3.2540 3.2540 3.3483 3.3483 3.8118 3.8118 4.0305 4.0305 4.4610 4.4610 4.7430 4.7430 4.8745 4.8745 5.3549 5.3549 5.8402 5.8402 9.3969 9.3969 9.8671 9.8671 11.8062 11.8062 12.0758 12.0758 12.6241 12.6241 12.7996 12.7996 k = 0.0000 0.0658-0.0000 ( 5341 PWs) bands (ev): -15.8897 -15.8897 -15.5263 -15.5263 -10.8579 -10.8579 -10.8464 -10.8464 -10.8437 -10.8437 -10.7861 -10.7861 -8.3265 -8.3265 -8.3137 -8.3137 -8.3018 -8.3018 -8.2755 -8.2755 -8.2499 -8.2499 -8.2079 -8.2079 -7.5805 -7.5805 -7.0697 -7.0697 -0.9082 -0.9082 0.3566 0.3566 1.8437 1.8437 1.9715 1.9715 2.9922 2.9922 3.2534 3.2534 3.3479 3.3479 3.7903 3.7903 4.0078 4.0078 4.4691 4.4691 4.7536 4.7536 4.8969 4.8969 5.3762 5.3762 5.8383 5.8383 9.4063 9.4063 9.8716 9.8716 11.7655 11.7655 12.0672 12.0672 12.5767 12.5767 12.8203 12.8203 k = 0.0000 0.0789-0.0000 ( 5337 PWs) bands (ev): -15.8879 -15.8879 -15.5279 -15.5279 -10.8578 -10.8578 -10.8463 -10.8463 -10.8433 -10.8433 -10.7861 -10.7861 -8.3266 -8.3266 -8.3132 -8.3132 -8.3012 -8.3012 -8.2756 -8.2756 -8.2503 -8.2503 -8.2077 -8.2077 -7.5744 -7.5744 -7.0682 -7.0682 -0.9161 -0.9161 0.3361 0.3361 1.8489 1.8489 1.9763 1.9763 2.9810 2.9810 3.2514 3.2514 3.3468 3.3468 3.7655 3.7655 3.9838 3.9838 4.4798 4.4798 4.7665 4.7665 4.9199 4.9199 5.4017 5.4017 5.8361 5.8361 9.4169 9.4169 9.8772 9.8772 11.7181 11.7181 12.0579 12.0579 12.5221 12.5221 12.8395 12.8395 k = 0.0000 0.0921-0.0000 ( 5341 PWs) bands (ev): -15.8858 -15.8858 -15.5299 -15.5299 -10.8577 -10.8577 -10.8462 -10.8462 -10.8429 -10.8429 -10.7860 -10.7860 -8.3267 -8.3267 -8.3128 -8.3128 -8.3006 -8.3006 -8.2758 -8.2758 -8.2508 -8.2508 -8.2074 -8.2074 -7.5673 -7.5673 -7.0666 -7.0666 -0.9252 -0.9252 0.3123 0.3123 1.8549 1.8549 1.9820 1.9820 2.9684 2.9684 3.2478 3.2478 3.3445 3.3445 3.7381 3.7381 3.9606 3.9606 4.4926 4.4926 4.7817 4.7817 4.9426 4.9426 5.4308 5.4308 5.8334 5.8334 9.4283 9.4283 9.8838 9.8838 11.6652 11.6652 12.0480 12.0480 12.4619 12.4619 12.8541 12.8541 k = 0.0000 0.1053-0.0000 ( 5345 PWs) bands (ev): -15.8833 -15.8833 -15.5321 -15.5321 -10.8575 -10.8575 -10.8462 -10.8462 -10.8423 -10.8423 -10.7860 -10.7860 -8.3267 -8.3267 -8.3124 -8.3124 -8.3000 -8.3000 -8.2759 -8.2759 -8.2514 -8.2514 -8.2071 -8.2071 -7.5592 -7.5592 -7.0647 -7.0647 -0.9353 -0.9353 0.2853 0.2853 1.8617 1.8617 1.9887 1.9887 2.9545 2.9545 3.2422 3.2422 3.3403 3.3403 3.7084 3.7084 3.9399 3.9399 4.5074 4.5074 4.7990 4.7990 4.9645 4.9645 5.4629 5.4629 5.8304 5.8304 9.4398 9.4398 9.8915 9.8915 11.6079 11.6079 12.0379 12.0379 12.3975 12.3975 12.8612 12.8612 k = 0.0000 0.1184-0.0000 ( 5354 PWs) bands (ev): -15.8806 -15.8806 -15.5346 -15.5346 -10.8573 -10.8573 -10.8461 -10.8461 -10.8418 -10.8418 -10.7859 -10.7859 -8.3266 -8.3266 -8.3120 -8.3120 -8.2994 -8.2994 -8.2759 -8.2759 -8.2520 -8.2520 -8.2068 -8.2068 -7.5501 -7.5501 -7.0627 -7.0627 -0.9464 -0.9464 0.2552 0.2552 1.8691 1.8691 1.9964 1.9964 2.9392 2.9392 3.2349 3.2349 3.3334 3.3334 3.6771 3.6771 3.9232 3.9232 4.5237 4.5237 4.8184 4.8184 4.9852 4.9852 5.4970 5.4970 5.8271 5.8271 9.4507 9.4507 9.9006 9.9006 11.5472 11.5472 12.0277 12.0277 12.3299 12.3299 12.8590 12.8590 k = 0.0000 0.1316-0.0000 ( 5354 PWs) bands (ev): -15.8775 -15.8775 -15.5374 -15.5374 -10.8571 -10.8571 -10.8461 -10.8461 -10.8411 -10.8411 -10.7859 -10.7859 -8.3264 -8.3264 -8.3115 -8.3115 -8.2989 -8.2989 -8.2759 -8.2759 -8.2526 -8.2526 -8.2065 -8.2065 -7.5402 -7.5402 -7.0606 -7.0606 -0.9583 -0.9583 0.2223 0.2223 1.8771 1.8771 2.0051 2.0051 2.9225 2.9225 3.2258 3.2258 3.3236 3.3236 3.6444 3.6444 3.9118 3.9118 4.5413 4.5413 4.8398 4.8398 5.0047 5.0047 5.5321 5.5321 5.8240 5.8240 9.4605 9.4605 9.9110 9.9110 11.4843 11.4843 12.0178 12.0178 12.2604 12.2604 12.8466 12.8466 k = 0.0000 0.1447-0.0000 ( 5366 PWs) bands (ev): -15.8741 -15.8741 -15.5405 -15.5405 -10.8569 -10.8569 -10.8460 -10.8460 -10.8404 -10.8404 -10.7858 -10.7858 -8.3260 -8.3260 -8.3111 -8.3111 -8.2984 -8.2984 -8.2757 -8.2757 -8.2534 -8.2534 -8.2062 -8.2062 -7.5293 -7.5293 -7.0584 -7.0584 -0.9709 -0.9709 0.1866 0.1866 1.8855 1.8855 2.0148 2.0148 2.9043 2.9043 3.2150 3.2150 3.3105 3.3105 3.6109 3.6109 3.9065 3.9065 4.5601 4.5601 4.8629 4.8629 5.0230 5.0230 5.5668 5.5668 5.8213 5.8213 9.4682 9.4682 9.9229 9.9229 11.4200 11.4200 12.0084 12.0084 12.1898 12.1898 12.8247 12.8247 k = 0.0000 0.1579-0.0000 ( 5366 PWs) bands (ev): -15.8704 -15.8704 -15.5439 -15.5439 -10.8566 -10.8566 -10.8460 -10.8460 -10.8395 -10.8395 -10.7858 -10.7858 -8.3255 -8.3255 -8.3107 -8.3107 -8.2981 -8.2981 -8.2755 -8.2755 -8.2541 -8.2541 -8.2059 -8.2059 -7.5176 -7.5176 -7.0561 -7.0561 -0.9839 -0.9839 0.1486 0.1486 1.8944 1.8944 2.0257 2.0257 2.8845 2.8845 3.2026 3.2026 3.2947 3.2947 3.5767 3.5767 3.9074 3.9074 4.5797 4.5797 4.8878 4.8878 5.0402 5.0402 5.5996 5.5996 5.8200 5.8200 9.4734 9.4734 9.9362 9.9362 11.3554 11.3554 11.9996 11.9996 12.1190 12.1190 12.7945 12.7945 k = 0.0000 0.1711-0.0000 ( 5364 PWs) bands (ev): -15.8665 -15.8665 -15.5475 -15.5475 -10.8564 -10.8564 -10.8460 -10.8460 -10.8386 -10.8386 -10.7857 -10.7857 -8.3248 -8.3248 -8.3103 -8.3103 -8.2978 -8.2978 -8.2751 -8.2751 -8.2548 -8.2548 -8.2057 -8.2057 -7.5052 -7.5052 -7.0538 -7.0538 -0.9974 -0.9974 0.1082 0.1082 1.9035 1.9035 2.0376 2.0376 2.8628 2.8628 3.1886 3.1886 3.2767 3.2767 3.5424 3.5424 3.9142 3.9142 4.6002 4.6002 4.9141 4.9141 5.0565 5.0565 5.6285 5.6285 5.8214 5.8214 9.4755 9.4755 9.9507 9.9507 11.2914 11.2914 11.9912 11.9912 12.0493 12.0493 12.7574 12.7574 k = 0.0000 0.1842-0.0000 ( 5360 PWs) bands (ev): -15.8622 -15.8622 -15.5514 -15.5514 -10.8561 -10.8561 -10.8460 -10.8460 -10.8377 -10.8377 -10.7857 -10.7857 -8.3240 -8.3240 -8.3099 -8.3099 -8.2976 -8.2976 -8.2747 -8.2747 -8.2556 -8.2556 -8.2055 -8.2055 -7.4921 -7.4921 -7.0516 -7.0516 -1.0109 -1.0109 0.0659 0.0659 1.9128 1.9128 2.0507 2.0507 2.8392 2.8392 3.1733 3.1733 3.2574 3.2574 3.5080 3.5080 3.9265 3.9265 4.6215 4.6215 4.9417 4.9417 5.0721 5.0721 5.6509 5.6509 5.8272 5.8272 9.4742 9.4742 9.9660 9.9660 11.2289 11.2289 11.9709 11.9709 11.9936 11.9936 12.7147 12.7147 k = 0.0000 0.1974-0.0000 ( 5352 PWs) bands (ev): -15.8577 -15.8577 -15.5555 -15.5555 -10.8559 -10.8559 -10.8460 -10.8460 -10.8366 -10.8366 -10.7857 -10.7857 -8.3230 -8.3230 -8.3095 -8.3095 -8.2975 -8.2975 -8.2741 -8.2741 -8.2563 -8.2563 -8.2054 -8.2054 -7.4782 -7.4782 -7.0494 -7.0494 -1.0245 -1.0245 0.0218 0.0218 1.9222 1.9222 2.0649 2.0649 2.8136 2.8136 3.1568 3.1568 3.2376 3.2376 3.4740 3.4740 3.9437 3.9437 4.6435 4.6435 4.9704 4.9704 5.0870 5.0870 5.6649 5.6649 5.8392 5.8392 9.4695 9.4695 9.9812 9.9812 11.1690 11.1690 11.9078 11.9078 11.9835 11.9835 12.6677 12.6677 k = 0.0000 0.2105-0.0000 ( 5344 PWs) bands (ev): -15.8529 -15.8529 -15.5599 -15.5599 -10.8556 -10.8556 -10.8460 -10.8460 -10.8355 -10.8355 -10.7858 -10.7858 -8.3219 -8.3219 -8.3091 -8.3091 -8.2975 -8.2975 -8.2735 -8.2735 -8.2570 -8.2570 -8.2053 -8.2053 -7.4638 -7.4638 -7.0474 -7.0474 -1.0379 -1.0379 -0.0238 -0.0238 1.9316 1.9316 2.0803 2.0803 2.7860 2.7860 3.1392 3.1392 3.2179 3.2179 3.4404 3.4404 3.9651 3.9651 4.6662 4.6662 4.9997 4.9997 5.1015 5.1015 5.6699 5.6699 5.8571 5.8571 9.4615 9.4615 9.9956 9.9956 11.1126 11.1126 11.8421 11.8421 11.9793 11.9793 12.6174 12.6174 k = 0.0000 0.2237-0.0000 ( 5332 PWs) bands (ev): -15.8479 -15.8479 -15.5645 -15.5645 -10.8553 -10.8553 -10.8460 -10.8460 -10.8342 -10.8342 -10.7858 -10.7858 -8.3206 -8.3206 -8.3087 -8.3087 -8.2976 -8.2976 -8.2728 -8.2728 -8.2577 -8.2577 -8.2054 -8.2054 -7.4489 -7.4489 -7.0455 -7.0455 -1.0509 -1.0509 -0.0707 -0.0707 1.9410 1.9410 2.0969 2.0969 2.7565 2.7565 3.1208 3.1208 3.1989 3.1989 3.4076 3.4076 3.9901 3.9901 4.6896 4.6896 5.0290 5.0290 5.1161 5.1161 5.6673 5.6673 5.8792 5.8792 9.4506 9.4506 10.0079 10.0079 11.0608 11.0608 11.7784 11.7784 11.9769 11.9769 12.5648 12.5648 k = 0.0000 0.2368-0.0000 ( 5340 PWs) bands (ev): -15.8426 -15.8426 -15.5694 -15.5694 -10.8550 -10.8550 -10.8460 -10.8460 -10.8330 -10.8330 -10.7859 -10.7859 -8.3193 -8.3193 -8.3084 -8.3084 -8.2978 -8.2978 -8.2721 -8.2721 -8.2582 -8.2582 -8.2055 -8.2055 -7.4335 -7.4335 -7.0438 -7.0438 -1.0634 -1.0634 -0.1187 -0.1187 1.9503 1.9503 2.1145 2.1145 2.7253 2.7253 3.1018 3.1018 3.1808 3.1808 3.3756 3.3756 4.0181 4.0181 4.7135 4.7135 5.0573 5.0573 5.1317 5.1317 5.6591 5.6591 5.9033 5.9033 9.4371 9.4371 10.0168 10.0168 11.0145 11.0145 11.7174 11.7174 11.9757 11.9757 12.5110 12.5110 k = 0.0000 0.2500-0.0000 ( 5344 PWs) bands (ev): -15.8371 -15.8371 -15.5746 -15.5746 -10.8548 -10.8548 -10.8461 -10.8461 -10.8316 -10.8316 -10.7861 -10.7861 -8.3178 -8.3178 -8.3080 -8.3080 -8.2980 -8.2980 -8.2714 -8.2714 -8.2586 -8.2586 -8.2057 -8.2057 -7.4177 -7.4177 -7.0424 -7.0424 -1.0751 -1.0751 -0.1675 -0.1675 1.9595 1.9595 2.1332 2.1332 2.6927 2.6927 3.0824 3.0824 3.1638 3.1638 3.3447 3.3447 4.0488 4.0488 4.7381 4.7381 5.0826 5.0826 5.1500 5.1500 5.6468 5.6468 5.9274 5.9274 9.4216 9.4216 10.0210 10.0210 10.9746 10.9746 11.6595 11.6595 11.9755 11.9755 12.4568 12.4568 k = 0.0000 0.2632-0.0000 ( 5338 PWs) bands (ev): -15.8313 -15.8313 -15.5799 -15.5799 -10.8545 -10.8545 -10.8462 -10.8462 -10.8302 -10.8302 -10.7862 -10.7862 -8.3163 -8.3163 -8.3076 -8.3076 -8.2982 -8.2982 -8.2708 -8.2708 -8.2589 -8.2589 -8.2061 -8.2061 -7.4015 -7.4015 -7.0414 -7.0414 -1.0860 -1.0860 -0.2169 -0.2169 1.9685 1.9685 2.1529 2.1529 2.6591 2.6591 3.0625 3.0625 3.1479 3.1479 3.3149 3.3149 4.0816 4.0816 4.7632 4.7632 5.1026 5.1026 5.1731 5.1731 5.6316 5.6316 5.9504 5.9504 9.4048 9.4048 10.0195 10.0195 10.9417 10.9417 11.6051 11.6051 11.9758 11.9758 12.4034 12.4034 k = 0.0000 0.2763-0.0000 ( 5338 PWs) bands (ev): -15.8254 -15.8254 -15.5855 -15.5855 -10.8542 -10.8542 -10.8463 -10.8463 -10.8287 -10.8287 -10.7865 -10.7865 -8.3147 -8.3147 -8.3072 -8.3072 -8.2985 -8.2985 -8.2704 -8.2704 -8.2589 -8.2589 -8.2065 -8.2065 -7.3851 -7.3851 -7.0407 -7.0407 -1.0958 -1.0958 -0.2667 -0.2667 1.9774 1.9774 2.1736 2.1736 2.6249 2.6249 3.0421 3.0421 3.1333 3.1333 3.2865 3.2865 4.1164 4.1164 4.7888 4.7888 5.1166 5.1166 5.2015 5.2015 5.6141 5.6141 5.9712 5.9712 9.3873 9.3873 10.0114 10.0114 10.9161 10.9161 11.5544 11.5544 11.9760 11.9760 12.3518 12.3518 k = 0.0000 0.2895-0.0000 ( 5346 PWs) bands (ev): -15.8192 -15.8192 -15.5912 -15.5912 -10.8540 -10.8540 -10.8464 -10.8464 -10.8272 -10.8272 -10.7868 -10.7868 -8.3131 -8.3131 -8.3068 -8.3068 -8.2987 -8.2987 -8.2703 -8.2703 -8.2586 -8.2586 -8.2071 -8.2071 -7.3684 -7.3684 -7.0404 -7.0404 -1.1043 -1.1043 -0.3166 -0.3166 1.9861 1.9861 2.1951 2.1951 2.5903 2.5903 3.0212 3.0212 3.1200 3.1200 3.2594 3.2594 4.1529 4.1529 4.8149 4.8149 5.1256 5.1256 5.2337 5.2337 5.5949 5.5949 5.9895 5.9895 9.3697 9.3697 9.9965 9.9965 10.8973 10.8973 11.5076 11.5076 11.9756 11.9756 12.3034 12.3034 k = 0.0000 0.3026-0.0000 ( 5334 PWs) bands (ev): -15.8129 -15.8129 -15.5972 -15.5972 -10.8537 -10.8537 -10.8465 -10.8465 -10.8256 -10.8256 -10.7871 -10.7871 -8.3115 -8.3115 -8.3064 -8.3064 -8.2988 -8.2988 -8.2703 -8.2703 -8.2580 -8.2580 -8.2077 -8.2077 -7.3516 -7.3516 -7.0406 -7.0406 -1.1115 -1.1115 -0.3664 -0.3664 1.9947 1.9947 2.2175 2.2175 2.5559 2.5559 2.9998 2.9998 3.1079 3.1079 3.2339 3.2339 4.1908 4.1908 4.8414 4.8414 5.1308 5.1308 5.2685 5.2685 5.5742 5.5742 6.0047 6.0047 9.3526 9.3526 9.9749 9.9749 10.8848 10.8848 11.4648 11.4648 11.9738 11.9738 12.2594 12.2594 k = 0.0000 0.3158-0.0000 ( 5330 PWs) bands (ev): -15.8064 -15.8064 -15.6033 -15.6033 -10.8534 -10.8534 -10.8466 -10.8466 -10.8240 -10.8240 -10.7875 -10.7875 -8.3101 -8.3101 -8.3059 -8.3059 -8.2988 -8.2988 -8.2705 -8.2705 -8.2571 -8.2571 -8.2085 -8.2085 -7.3347 -7.3347 -7.0414 -7.0414 -1.1172 -1.1172 -0.4159 -0.4159 2.0033 2.0033 2.2404 2.2404 2.5219 2.5219 2.9777 2.9777 3.0970 3.0970 3.2098 3.2098 4.2299 4.2299 4.8682 4.8682 5.1327 5.1327 5.3047 5.3047 5.5525 5.5525 6.0166 6.0166 9.3367 9.3367 9.9474 9.9474 10.8774 10.8774 11.4256 11.4256 11.9699 11.9699 12.2212 12.2212 k = 0.0000 0.3289-0.0000 ( 5334 PWs) bands (ev): -15.7997 -15.7997 -15.6097 -15.6097 -10.8531 -10.8531 -10.8468 -10.8468 -10.8224 -10.8224 -10.7880 -10.7880 -8.3090 -8.3090 -8.3053 -8.3053 -8.2987 -8.2987 -8.2709 -8.2709 -8.2561 -8.2561 -8.2095 -8.2095 -7.3178 -7.3178 -7.0427 -7.0427 -1.1211 -1.1211 -0.4649 -0.4649 2.0118 2.0118 2.2639 2.2639 2.4887 2.4887 2.9552 2.9552 3.0872 3.0872 3.1874 3.1874 4.2702 4.2702 4.8952 4.8952 5.1316 5.1316 5.3419 5.3419 5.5300 5.5300 6.0250 6.0250 9.3224 9.3224 9.9148 9.9148 10.8738 10.8738 11.3898 11.3898 11.9633 11.9633 12.1899 12.1899 k = 0.0000 0.3421-0.0000 ( 5328 PWs) bands (ev): -15.7928 -15.7928 -15.6162 -15.6162 -10.8529 -10.8529 -10.8469 -10.8469 -10.8207 -10.8207 -10.7885 -10.7885 -8.3081 -8.3081 -8.3046 -8.3046 -8.2983 -8.2983 -8.2714 -8.2714 -8.2548 -8.2548 -8.2105 -8.2105 -7.3009 -7.3009 -7.0446 -7.0446 -1.1233 -1.1233 -0.5131 -0.5131 2.0203 2.0203 2.2876 2.2876 2.4569 2.4569 2.9320 2.9320 3.0785 3.0785 3.1665 3.1665 4.3113 4.3113 4.9224 4.9224 5.1273 5.1273 5.3798 5.3798 5.5072 5.5072 6.0297 6.0297 9.3102 9.3102 9.8783 9.8783 10.8730 10.8730 11.3567 11.3567 11.9546 11.9546 12.1658 12.1658 k = 0.0000 0.3553-0.0000 ( 5322 PWs) bands (ev): -15.7858 -15.7858 -15.6228 -15.6228 -10.8526 -10.8526 -10.8471 -10.8471 -10.8190 -10.8190 -10.7892 -10.7892 -8.3075 -8.3075 -8.3041 -8.3041 -8.2975 -8.2975 -8.2720 -8.2720 -8.2533 -8.2533 -8.2117 -8.2117 -7.2842 -7.2842 -7.0472 -7.0472 -1.1235 -1.1235 -0.5605 -0.5605 2.0289 2.0289 2.3107 2.3107 2.4271 2.4271 2.9084 2.9084 3.0708 3.0708 3.1474 3.1474 4.3532 4.3532 4.9496 4.9496 5.1200 5.1200 5.4175 5.4175 5.4846 5.4846 6.0309 6.0309 9.3005 9.3005 9.8389 9.8389 10.8741 10.8741 11.3255 11.3255 11.9449 11.9449 12.1481 12.1481 k = 0.0000 0.3684-0.0000 ( 5320 PWs) bands (ev): -15.7787 -15.7787 -15.6296 -15.6296 -10.8523 -10.8523 -10.8473 -10.8473 -10.8173 -10.8173 -10.7898 -10.7898 -8.3070 -8.3070 -8.3038 -8.3038 -8.2963 -8.2963 -8.2726 -8.2726 -8.2517 -8.2517 -8.2130 -8.2130 -7.2676 -7.2676 -7.0504 -7.0504 -1.1217 -1.1217 -0.6067 -0.6067 2.0377 2.0377 2.3306 2.3306 2.4022 2.4022 2.8842 2.8842 3.0640 3.0640 3.1299 3.1299 4.3958 4.3958 4.9768 4.9768 5.1093 5.1093 5.4483 5.4483 5.4694 5.4694 6.0283 6.0283 9.2936 9.2936 9.7975 9.7975 10.8764 10.8764 11.2953 11.2953 11.9361 11.9361 12.1354 12.1354 k = 0.0000 0.3816-0.0000 ( 5314 PWs) bands (ev): -15.7715 -15.7715 -15.6366 -15.6366 -10.8520 -10.8520 -10.8475 -10.8475 -10.8155 -10.8155 -10.7906 -10.7906 -8.3067 -8.3067 -8.3037 -8.3037 -8.2949 -8.2949 -8.2734 -8.2734 -8.2500 -8.2500 -8.2144 -8.2144 -7.2513 -7.2513 -7.0544 -7.0544 -1.1178 -1.1178 -0.6517 -0.6517 2.0467 2.0467 2.3367 2.3367 2.3929 2.3929 2.8595 2.8595 3.0580 3.0580 3.1140 3.1140 4.4388 4.4388 5.0035 5.0035 5.0955 5.0955 5.4346 5.4346 5.4989 5.4989 6.0221 6.0221 9.2899 9.2899 9.7550 9.7550 10.8800 10.8800 11.2655 11.2655 11.9300 11.9300 12.1258 12.1258 k = 0.0000 0.3947-0.0000 ( 5316 PWs) bands (ev): -15.7642 -15.7642 -15.6437 -15.6437 -10.8518 -10.8518 -10.8477 -10.8477 -10.8138 -10.8138 -10.7914 -10.7914 -8.3064 -8.3064 -8.3037 -8.3037 -8.2934 -8.2934 -8.2741 -8.2741 -8.2482 -8.2482 -8.2160 -8.2160 -7.2353 -7.2353 -7.0591 -7.0591 -1.1117 -1.1117 -0.6953 -0.6953 2.0560 2.0560 2.3211 2.3211 2.4069 2.4069 2.8344 2.8344 3.0529 3.0529 3.0999 3.0999 4.4822 4.4822 5.0287 5.0287 5.0796 5.0796 5.4127 5.4127 5.5370 5.5370 6.0124 6.0124 9.2896 9.2896 9.7122 9.7122 10.8847 10.8847 11.2352 11.2352 11.9279 11.9279 12.1177 12.1177 k = 0.0000 0.4079-0.0000 ( 5320 PWs) bands (ev): -15.7568 -15.7568 -15.6509 -15.6509 -10.8515 -10.8515 -10.8480 -10.8480 -10.8121 -10.8121 -10.7924 -10.7924 -8.3062 -8.3062 -8.3038 -8.3038 -8.2918 -8.2918 -8.2749 -8.2749 -8.2463 -8.2463 -8.2176 -8.2176 -7.2197 -7.2197 -7.0646 -7.0646 -1.1032 -1.1032 -0.7373 -0.7373 2.0658 2.0658 2.2982 2.2982 2.4301 2.4301 2.8088 2.8088 3.0485 3.0485 3.0874 3.0874 4.5258 4.5258 5.0426 5.0426 5.0712 5.0712 5.3906 5.3906 5.5756 5.5756 5.9993 5.9993 9.2927 9.2927 9.6695 9.6695 10.8910 10.8910 11.2045 11.2045 11.9302 11.9302 12.1100 12.1100 k = 0.0000 0.4211-0.0000 ( 5324 PWs) bands (ev): -15.7493 -15.7493 -15.6582 -15.6582 -10.8512 -10.8512 -10.8482 -10.8482 -10.8104 -10.8104 -10.7934 -10.7934 -8.3060 -8.3060 -8.3039 -8.3039 -8.2902 -8.2902 -8.2758 -8.2758 -8.2444 -8.2444 -8.2194 -8.2194 -7.2044 -7.2044 -7.0708 -7.0708 -1.0924 -1.0924 -0.7776 -0.7776 2.0760 2.0760 2.2745 2.2745 2.4558 2.4558 2.7828 2.7828 3.0449 3.0449 3.0764 3.0764 4.5695 4.5695 5.0258 5.0258 5.0898 5.0898 5.3686 5.3686 5.6140 5.6140 5.9830 5.9830 9.2994 9.2994 9.6276 9.6276 10.8990 10.8990 11.1732 11.1732 11.9367 11.9367 12.1019 12.1019 k = 0.0000 0.4342-0.0000 ( 5306 PWs) bands (ev): -15.7417 -15.7417 -15.6655 -15.6655 -10.8510 -10.8510 -10.8484 -10.8484 -10.8087 -10.8087 -10.7944 -10.7944 -8.3058 -8.3058 -8.3040 -8.3040 -8.2887 -8.2887 -8.2767 -8.2767 -8.2423 -8.2423 -8.2212 -8.2212 -7.1897 -7.1897 -7.0779 -7.0779 -1.0793 -1.0793 -0.8161 -0.8161 2.0870 2.0870 2.2515 2.2515 2.4825 2.4825 2.7564 2.7564 3.0421 3.0421 3.0671 3.0671 4.6131 4.6131 4.9992 4.9992 5.1146 5.1146 5.3469 5.3469 5.6520 5.6520 5.9636 5.9636 9.3096 9.3096 9.5868 9.5868 10.9092 10.9092 11.1417 11.1417 11.9471 11.9471 12.0927 12.0927 k = 0.0000 0.4474-0.0000 ( 5316 PWs) bands (ev): -15.7341 -15.7341 -15.6730 -15.6730 -10.8507 -10.8507 -10.8487 -10.8487 -10.8070 -10.8070 -10.7956 -10.7956 -8.3056 -8.3056 -8.3042 -8.3042 -8.2872 -8.2872 -8.2776 -8.2776 -8.2402 -8.2402 -8.2232 -8.2232 -7.1755 -7.1755 -7.0857 -7.0857 -1.0637 -1.0637 -0.8526 -0.8526 2.0986 2.0986 2.2295 2.2295 2.5097 2.5097 2.7297 2.7297 3.0401 3.0401 3.0592 3.0592 4.6565 4.6565 4.9689 4.9689 5.1398 5.1398 5.3253 5.3253 5.6894 5.6894 5.9414 5.9414 9.3235 9.3235 9.5476 9.5476 10.9217 10.9217 11.1105 11.1105 11.9603 11.9603 12.0822 12.0822 k = 0.0000 0.4605-0.0000 ( 5306 PWs) bands (ev): -15.7264 -15.7264 -15.6805 -15.6805 -10.8504 -10.8504 -10.8489 -10.8489 -10.8054 -10.8054 -10.7968 -10.7968 -8.3054 -8.3054 -8.3044 -8.3044 -8.2857 -8.2857 -8.2786 -8.2786 -8.2381 -8.2381 -8.2252 -8.2252 -7.1618 -7.1618 -7.0943 -7.0943 -1.0456 -1.0456 -0.8870 -0.8870 2.1111 2.1111 2.2089 2.2089 2.5372 2.5372 2.7027 2.7027 3.0389 3.0389 3.0527 3.0527 4.6994 4.6994 4.9357 4.9357 5.1647 5.1647 5.3036 5.3036 5.7259 5.7259 5.9165 5.9165 9.3408 9.3408 9.5103 9.5103 10.9368 10.9368 11.0800 11.0800 11.9755 11.9755 12.0701 12.0701 k = 0.0000 0.4737-0.0000 ( 5306 PWs) bands (ev): -15.7188 -15.7188 -15.6881 -15.6881 -10.8502 -10.8502 -10.8491 -10.8491 -10.8038 -10.8038 -10.7981 -10.7981 -8.3052 -8.3052 -8.3046 -8.3046 -8.2843 -8.2843 -8.2796 -8.2796 -8.2359 -8.2359 -8.2273 -8.2273 -7.1488 -7.1488 -7.1037 -7.1037 -1.0251 -1.0251 -0.9192 -0.9192 2.1245 2.1245 2.1895 2.1895 2.5649 2.5649 2.6754 2.6754 3.0386 3.0386 3.0476 3.0476 4.7417 4.7417 4.9002 4.9002 5.1892 5.1892 5.2816 5.2816 5.7615 5.7615 5.8893 5.8893 9.3615 9.3615 9.4752 9.4752 10.9546 10.9546 11.0509 11.0509 11.9920 11.9920 12.0566 12.0566 k = 0.0000 0.4868-0.0000 ( 5308 PWs) bands (ev): -15.7111 -15.7111 -15.6958 -15.6958 -10.8499 -10.8499 -10.8494 -10.8494 -10.8023 -10.8023 -10.7994 -10.7994 -8.3051 -8.3051 -8.3047 -8.3047 -8.2831 -8.2831 -8.2807 -8.2807 -8.2337 -8.2337 -8.2294 -8.2294 -7.1365 -7.1365 -7.1139 -7.1139 -1.0022 -1.0022 -0.9492 -0.9492 2.1390 2.1390 2.1714 2.1714 2.5926 2.5926 2.6479 2.6479 3.0393 3.0393 3.0437 3.0437 4.7832 4.7832 4.8627 4.8627 5.2131 5.2131 5.2593 5.2593 5.7958 5.7958 5.8600 5.8600 9.3855 9.3855 9.4425 9.4425 10.9750 10.9750 11.0234 11.0234 12.0090 12.0090 12.0417 12.0417 k = 0.0000 0.5000-0.0000 ( 5318 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8497 -10.8497 -10.8497 -10.8497 -10.8009 -10.8009 -10.8009 -10.8009 -8.3049 -8.3049 -8.3049 -8.3049 -8.2818 -8.2818 -8.2818 -8.2818 -8.2316 -8.2316 -8.2316 -8.2316 -7.1248 -7.1248 -7.1248 -7.1248 -0.9769 -0.9769 -0.9769 -0.9769 2.1546 2.1546 2.1546 2.1546 2.6203 2.6203 2.6203 2.6203 3.0410 3.0410 3.0410 3.0410 4.8236 4.8236 4.8236 4.8236 5.2365 5.2365 5.2365 5.2365 5.8287 5.8287 5.8287 5.8287 9.4126 9.4126 9.4126 9.4126 10.9980 10.9980 10.9980 10.9980 12.0257 12.0257 12.0257 12.0257 k = 0.0000 0.5000-0.0000 ( 5318 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8497 -10.8497 -10.8497 -10.8497 -10.8009 -10.8009 -10.8009 -10.8009 -8.3049 -8.3049 -8.3049 -8.3049 -8.2818 -8.2818 -8.2818 -8.2818 -8.2316 -8.2316 -8.2316 -8.2316 -7.1248 -7.1248 -7.1248 -7.1248 -0.9769 -0.9769 -0.9769 -0.9769 2.1546 2.1546 2.1546 2.1546 2.6203 2.6203 2.6203 2.6203 3.0410 3.0410 3.0410 3.0410 4.8236 4.8236 4.8236 4.8236 5.2365 5.2365 5.2365 5.2365 5.8287 5.8287 5.8287 5.8287 9.4126 9.4126 9.4126 9.4126 10.9980 10.9980 10.9980 10.9980 12.0257 12.0257 12.0257 12.0257 k = 0.0132 0.5000-0.0000 ( 5310 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8498 -10.8498 -10.8495 -10.8495 -10.8019 -10.8019 -10.7998 -10.7998 -8.3060 -8.3060 -8.3039 -8.3039 -8.2836 -8.2836 -8.2800 -8.2800 -8.2323 -8.2323 -8.2307 -8.2307 -7.1258 -7.1258 -7.1231 -7.1231 -0.9766 -0.9766 -0.9766 -0.9766 2.1442 2.1442 2.1589 2.1589 2.6230 2.6230 2.6237 2.6237 3.0367 3.0367 3.0454 3.0454 4.8163 4.8163 4.8306 4.8306 5.2285 5.2285 5.2381 5.2381 5.8237 5.8237 5.8301 5.8301 9.3950 9.3950 9.4350 9.4350 10.9677 10.9677 11.0322 11.0322 11.9631 11.9631 12.0909 12.0909 k = 0.0263 0.5000-0.0000 ( 5312 PWs) bands (ev): -15.7034 -15.7034 -15.7033 -15.7033 -10.8498 -10.8498 -10.8492 -10.8492 -10.8029 -10.8029 -10.7989 -10.7989 -8.3072 -8.3072 -8.3031 -8.3031 -8.2854 -8.2854 -8.2783 -8.2783 -8.2330 -8.2330 -8.2299 -8.2299 -7.1261 -7.1261 -7.1207 -7.1207 -0.9756 -0.9756 -0.9756 -0.9756 2.1283 2.1283 2.1568 2.1568 2.6319 2.6319 2.6323 2.6323 3.0325 3.0325 3.0500 3.0500 4.8082 4.8082 4.8375 4.8375 5.2140 5.2140 5.2340 5.2340 5.8150 5.8150 5.8277 5.8277 9.3821 9.3821 9.4625 9.4625 10.9423 10.9423 11.0692 11.0692 11.9042 11.9042 12.1578 12.1578 k = 0.0395 0.5000-0.0000 ( 5312 PWs) bands (ev): -15.7033 -15.7033 -15.7032 -15.7032 -10.8499 -10.8499 -10.8489 -10.8489 -10.8039 -10.8039 -10.7979 -10.7979 -8.3086 -8.3086 -8.3023 -8.3023 -8.2869 -8.2869 -8.2768 -8.2768 -8.2335 -8.2335 -8.2291 -8.2291 -7.1257 -7.1257 -7.1177 -7.1177 -0.9739 -0.9739 -0.9739 -0.9739 2.1078 2.1078 2.1489 2.1489 2.6451 2.6451 2.6465 2.6465 3.0284 3.0284 3.0550 3.0550 4.7991 4.7991 4.8443 4.8443 5.1930 5.1930 5.2249 5.2249 5.8027 5.8027 5.8213 5.8213 9.3736 9.3736 9.4950 9.4950 10.9226 10.9226 11.1076 11.1076 11.8499 11.8499 12.2256 12.2256 k = 0.0526 0.5000-0.0000 ( 5312 PWs) bands (ev): -15.7032 -15.7032 -15.7031 -15.7031 -10.8498 -10.8498 -10.8486 -10.8486 -10.8050 -10.8050 -10.7970 -10.7970 -8.3103 -8.3103 -8.3015 -8.3015 -8.2882 -8.2882 -8.2755 -8.2755 -8.2338 -8.2338 -8.2284 -8.2284 -7.1245 -7.1245 -7.1139 -7.1139 -0.9717 -0.9717 -0.9716 -0.9716 2.0841 2.0841 2.1362 2.1362 2.6608 2.6608 2.6656 2.6656 3.0246 3.0246 3.0605 3.0605 4.7884 4.7884 4.8513 4.8513 5.1658 5.1658 5.2118 5.2118 5.7867 5.7867 5.8109 5.8109 9.3691 9.3691 9.5323 9.5323 10.9091 10.9091 11.1455 11.1455 11.8018 11.8018 12.2933 12.2933 k = 0.0658 0.5000-0.0000 ( 5314 PWs) bands (ev): -15.7031 -15.7031 -15.7029 -15.7029 -10.8497 -10.8497 -10.8482 -10.8482 -10.8060 -10.8060 -10.7962 -10.7962 -8.3122 -8.3122 -8.3009 -8.3009 -8.2891 -8.2891 -8.2746 -8.2746 -8.2339 -8.2339 -8.2277 -8.2277 -7.1227 -7.1227 -7.1096 -7.1096 -0.9688 -0.9688 -0.9687 -0.9687 2.0581 2.0581 2.1197 2.1197 2.6780 2.6780 2.6882 2.6882 3.0211 3.0211 3.0668 3.0668 4.7754 4.7754 4.8582 4.8582 5.1329 5.1329 5.1958 5.1958 5.7671 5.7671 5.7964 5.7964 9.3681 9.3681 9.5743 9.5743 10.9023 10.9023 11.1810 11.1810 11.7612 11.7612 12.3601 12.3601 k = 0.0789 0.5000-0.0000 ( 5314 PWs) bands (ev): -15.7030 -15.7030 -15.7027 -15.7027 -10.8496 -10.8496 -10.8477 -10.8477 -10.8070 -10.8070 -10.7953 -10.7953 -8.3143 -8.3143 -8.3004 -8.3004 -8.2898 -8.2898 -8.2739 -8.2739 -8.2337 -8.2337 -8.2272 -8.2272 -7.1201 -7.1201 -7.1047 -7.1047 -0.9653 -0.9653 -0.9652 -0.9652 2.0307 2.0307 2.1006 2.1006 2.6958 2.6958 2.7126 2.7126 3.0183 3.0183 3.0739 3.0739 4.7595 4.7595 4.8650 4.8650 5.0949 5.0949 5.1784 5.1784 5.7438 5.7438 5.7776 5.7776 9.3702 9.3702 9.6204 9.6204 10.9025 10.9025 11.2116 11.2116 11.7302 11.7302 12.4250 12.4250 k = 0.0921 0.5000-0.0000 ( 5322 PWs) bands (ev): -15.7028 -15.7028 -15.7025 -15.7025 -10.8494 -10.8494 -10.8472 -10.8472 -10.8080 -10.8080 -10.7946 -10.7946 -8.3167 -8.3167 -8.3000 -8.3000 -8.2901 -8.2901 -8.2736 -8.2736 -8.2331 -8.2331 -8.2267 -8.2267 -7.1169 -7.1169 -7.0992 -7.0992 -0.9613 -0.9613 -0.9612 -0.9612 2.0026 2.0026 2.0798 2.0798 2.7130 2.7130 2.7376 2.7376 3.0165 3.0165 3.0823 3.0823 4.7399 4.7399 4.8710 4.8710 5.0532 5.0532 5.1609 5.1609 5.7169 5.7169 5.7548 5.7548 9.3750 9.3750 9.6703 9.6703 10.9096 10.9096 11.2349 11.2349 11.7106 11.7106 12.4870 12.4870 k = 0.1053 0.5000-0.0000 ( 5326 PWs) bands (ev): -15.7026 -15.7026 -15.7022 -15.7022 -10.8492 -10.8492 -10.8466 -10.8466 -10.8090 -10.8090 -10.7938 -10.7938 -8.3192 -8.3192 -8.2999 -8.2999 -8.2900 -8.2900 -8.2735 -8.2735 -8.2323 -8.2323 -8.2263 -8.2263 -7.1130 -7.1130 -7.0932 -7.0932 -0.9568 -0.9568 -0.9567 -0.9567 1.9746 1.9746 2.0581 2.0581 2.7290 2.7290 2.7618 2.7618 3.0165 3.0165 3.0922 3.0922 4.7159 4.7159 4.8744 4.8744 5.0100 5.0100 5.1446 5.1446 5.6865 5.6865 5.7279 5.7279 9.3821 9.3821 9.7231 9.7231 10.9235 10.9235 11.2490 11.2490 11.7037 11.7037 12.5453 12.5453 k = 0.1184 0.5000-0.0000 ( 5330 PWs) bands (ev): -15.7023 -15.7023 -15.7020 -15.7020 -10.8489 -10.8489 -10.8460 -10.8460 -10.8100 -10.8100 -10.7932 -10.7932 -8.3218 -8.3218 -8.2999 -8.2999 -8.2897 -8.2897 -8.2736 -8.2736 -8.2312 -8.2312 -8.2260 -8.2260 -7.1085 -7.1085 -7.0867 -7.0867 -0.9518 -0.9518 -0.9517 -0.9517 1.9471 1.9471 2.0362 2.0362 2.7430 2.7430 2.7836 2.7836 3.0191 3.0191 3.1036 3.1036 4.6870 4.6870 4.8701 4.8701 4.9711 4.9711 5.1304 5.1304 5.6530 5.6530 5.6974 5.6974 9.3912 9.3912 9.7783 9.7783 10.9439 10.9439 11.2536 11.2536 11.7093 11.7093 12.5989 12.5989 k = 0.1316 0.5000-0.0000 ( 5336 PWs) bands (ev): -15.7020 -15.7020 -15.7017 -15.7017 -10.8486 -10.8486 -10.8454 -10.8454 -10.8109 -10.8109 -10.7926 -10.7926 -8.3246 -8.3246 -8.3004 -8.3004 -8.2891 -8.2891 -8.2737 -8.2737 -8.2299 -8.2299 -8.2258 -8.2258 -7.1034 -7.1034 -7.0799 -7.0799 -0.9465 -0.9465 -0.9464 -0.9464 1.9204 1.9204 2.0146 2.0146 2.7546 2.7546 2.8014 2.8014 3.0253 3.0253 3.1168 3.1168 4.6530 4.6530 4.8465 4.8465 4.9483 4.9483 5.1190 5.1190 5.6166 5.6166 5.6635 5.6635 9.4018 9.4018 9.8348 9.8348 10.9702 10.9702 11.2504 11.2504 11.7254 11.7254 12.6470 12.6470 k = 0.1447 0.5000-0.0000 ( 5344 PWs) bands (ev): -15.7018 -15.7018 -15.7014 -15.7014 -10.8483 -10.8483 -10.8448 -10.8448 -10.8117 -10.8117 -10.7920 -10.7920 -8.3273 -8.3273 -8.3012 -8.3012 -8.2883 -8.2883 -8.2738 -8.2738 -8.2284 -8.2284 -8.2256 -8.2256 -7.0977 -7.0977 -7.0726 -7.0726 -0.9408 -0.9408 -0.9407 -0.9407 1.8950 1.8950 1.9936 1.9936 2.7635 2.7635 2.8142 2.8142 3.0359 3.0359 3.1318 3.1318 4.6140 4.6140 4.8016 4.8016 4.9443 4.9443 5.1107 5.1107 5.5779 5.5779 5.6266 5.6266 9.4137 9.4137 9.8917 9.8917 11.0017 11.0017 11.2417 11.2417 11.7490 11.7490 12.6891 12.6891 k = 0.1579 0.5000-0.0000 ( 5336 PWs) bands (ev): -15.7014 -15.7014 -15.7010 -15.7010 -10.8480 -10.8480 -10.8441 -10.8441 -10.8125 -10.8125 -10.7915 -10.7915 -8.3301 -8.3301 -8.3023 -8.3023 -8.2873 -8.2873 -8.2737 -8.2737 -8.2268 -8.2268 -8.2256 -8.2256 -7.0915 -7.0915 -7.0650 -7.0650 -0.9348 -0.9348 -0.9347 -0.9347 1.8710 1.8710 1.9738 1.9738 2.7696 2.7696 2.8214 2.8214 3.0511 3.0511 3.1484 3.1484 4.5704 4.5704 4.7455 4.7455 4.9490 4.9490 5.1054 5.1054 5.5374 5.5374 5.5873 5.5873 9.4269 9.4269 9.9481 9.9481 11.0377 11.0377 11.2305 11.2305 11.7773 11.7773 12.7245 12.7245 k = 0.1711 0.5000-0.0000 ( 5336 PWs) bands (ev): -15.7011 -15.7011 -15.7007 -15.7007 -10.8476 -10.8476 -10.8434 -10.8434 -10.8132 -10.8132 -10.7910 -10.7910 -8.3328 -8.3328 -8.3039 -8.3039 -8.2860 -8.2860 -8.2735 -8.2735 -8.2256 -8.2256 -8.2251 -8.2251 -7.0848 -7.0848 -7.0571 -7.0571 -0.9287 -0.9287 -0.9286 -0.9286 1.8489 1.8489 1.9553 1.9553 2.7729 2.7729 2.8233 2.8233 3.0705 3.0705 3.1664 3.1664 4.5228 4.5228 4.6839 4.6839 4.9570 4.9570 5.1026 5.1026 5.4959 5.4959 5.5463 5.5463 9.4409 9.4409 10.0028 10.0028 11.0771 11.0771 11.2187 11.2187 11.8078 11.8078 12.7530 12.7530 k = 0.1842 0.5000-0.0000 ( 5338 PWs) bands (ev): -15.7008 -15.7008 -15.7003 -15.7003 -10.8472 -10.8472 -10.8427 -10.8427 -10.8138 -10.8138 -10.7906 -10.7906 -8.3355 -8.3355 -8.3059 -8.3059 -8.2846 -8.2846 -8.2730 -8.2730 -8.2258 -8.2258 -8.2235 -8.2235 -7.0777 -7.0777 -7.0491 -7.0491 -0.9224 -0.9224 -0.9223 -0.9223 1.8287 1.8287 1.9384 1.9384 2.7735 2.7735 2.8206 2.8206 3.0929 3.0929 3.1855 3.1855 4.4716 4.4716 4.6190 4.6190 4.9660 4.9660 5.1019 5.1019 5.4541 5.4541 5.5043 5.5043 9.4558 9.4558 10.0547 10.0547 11.1190 11.1190 11.2081 11.2081 11.8392 11.8392 12.7747 12.7747 k = 0.1974 0.5000-0.0000 ( 5354 PWs) bands (ev): -15.7004 -15.7004 -15.6999 -15.6999 -10.8468 -10.8468 -10.8421 -10.8421 -10.8143 -10.8143 -10.7903 -10.7903 -8.3382 -8.3382 -8.3081 -8.3081 -8.2830 -8.2830 -8.2724 -8.2724 -8.2259 -8.2259 -8.2218 -8.2218 -7.0703 -7.0703 -7.0408 -7.0408 -0.9161 -0.9161 -0.9160 -0.9160 1.8107 1.8107 1.9233 1.9233 2.7719 2.7719 2.8144 2.8144 3.1174 3.1174 3.2054 3.2054 4.4175 4.4175 4.5517 4.5517 4.9750 4.9750 5.1025 5.1025 5.4130 5.4130 5.4621 5.4621 9.4714 9.4714 10.1027 10.1027 11.1623 11.1623 11.1997 11.1997 11.8704 11.8704 12.7898 12.7898 k = 0.2105 0.5000-0.0000 ( 5350 PWs) bands (ev): -15.7000 -15.7000 -15.6995 -15.6995 -10.8464 -10.8464 -10.8415 -10.8415 -10.8147 -10.8147 -10.7900 -10.7900 -8.3407 -8.3407 -8.3106 -8.3106 -8.2813 -8.2813 -8.2717 -8.2717 -8.2262 -8.2262 -8.2202 -8.2202 -7.0625 -7.0625 -7.0325 -7.0325 -0.9098 -0.9098 -0.9097 -0.9097 1.7951 1.7951 1.9101 1.9101 2.7682 2.7682 2.8056 2.8056 3.1429 3.1429 3.2257 3.2257 4.3608 4.3608 4.4825 4.4825 4.9831 4.9831 5.1035 5.1035 5.3737 5.3737 5.4209 5.4209 9.4877 9.4877 10.1456 10.1456 11.1943 11.1943 11.2058 11.2058 11.9009 11.9009 12.7991 12.7991 k = 0.2237 0.5000-0.0000 ( 5354 PWs) bands (ev): -15.6996 -15.6996 -15.6991 -15.6991 -10.8460 -10.8460 -10.8410 -10.8410 -10.8149 -10.8149 -10.7898 -10.7898 -8.3432 -8.3432 -8.3134 -8.3134 -8.2795 -8.2795 -8.2708 -8.2708 -8.2264 -8.2264 -8.2187 -8.2187 -7.0545 -7.0545 -7.0241 -7.0241 -0.9035 -0.9035 -0.9034 -0.9034 1.7818 1.7818 1.8990 1.8990 2.7628 2.7628 2.7949 2.7949 3.1687 3.1687 3.2462 3.2462 4.3021 4.3021 4.4118 4.4118 4.9893 4.9893 5.1038 5.1038 5.3375 5.3375 5.3820 5.3820 9.5044 9.5044 10.1827 10.1827 11.1923 11.1923 11.2486 11.2486 11.9307 11.9307 12.8032 12.8032 k = 0.2368 0.5000-0.0000 ( 5348 PWs) bands (ev): -15.6992 -15.6992 -15.6987 -15.6987 -10.8456 -10.8456 -10.8405 -10.8405 -10.8150 -10.8150 -10.7896 -10.7896 -8.3456 -8.3456 -8.3162 -8.3162 -8.2775 -8.2775 -8.2698 -8.2698 -8.2267 -8.2267 -8.2172 -8.2172 -7.0462 -7.0462 -7.0157 -7.0157 -0.8974 -0.8974 -0.8973 -0.8973 1.7711 1.7711 1.8900 1.8900 2.7560 2.7560 2.7829 2.7829 3.1943 3.1943 3.2664 3.2664 4.2416 4.2416 4.3398 4.3398 4.9924 4.9924 5.1016 5.1016 5.3060 5.3060 5.3474 5.3474 9.5215 9.5215 10.2132 10.2132 11.1940 11.1940 11.2897 11.2897 11.9597 11.9597 12.8032 12.8032 k = 0.2500 0.5000-0.0000 ( 5338 PWs) bands (ev): -15.6988 -15.6988 -15.6983 -15.6983 -10.8452 -10.8452 -10.8400 -10.8400 -10.8150 -10.8150 -10.7895 -10.7895 -8.3478 -8.3478 -8.3192 -8.3192 -8.2754 -8.2754 -8.2688 -8.2688 -8.2271 -8.2271 -8.2159 -8.2159 -7.0378 -7.0378 -7.0073 -7.0073 -0.8914 -0.8914 -0.8914 -0.8914 1.7630 1.7630 1.8833 1.8833 2.7482 2.7482 2.7701 2.7701 3.2192 3.2192 3.2862 3.2862 4.1796 4.1796 4.2668 4.2668 4.9913 4.9913 5.0952 5.0952 5.2807 5.2807 5.3190 5.3190 9.5391 9.5391 10.2365 10.2365 11.1993 11.1993 11.3280 11.3280 11.9884 11.9884 12.7999 12.7999 k = 0.2632 0.5000-0.0000 ( 5346 PWs) bands (ev): -15.6984 -15.6984 -15.6979 -15.6979 -10.8449 -10.8449 -10.8397 -10.8397 -10.8148 -10.8148 -10.7895 -10.7895 -8.3499 -8.3499 -8.3222 -8.3222 -8.2733 -8.2733 -8.2677 -8.2677 -8.2274 -8.2274 -8.2147 -8.2147 -7.0293 -7.0293 -6.9991 -6.9991 -0.8857 -0.8857 -0.8857 -0.8857 1.7576 1.7576 1.8787 1.8787 2.7397 2.7397 2.7568 2.7568 3.2431 3.2431 3.3052 3.3052 4.1164 4.1164 4.1930 4.1930 4.9848 4.9848 5.0826 5.0826 5.2628 5.2628 5.2989 5.2989 9.5568 9.5568 10.2525 10.2525 11.2078 11.2078 11.3629 11.3629 12.0168 12.0168 12.7945 12.7945 k = 0.2763 0.5000-0.0000 ( 5338 PWs) bands (ev): -15.6980 -15.6980 -15.6975 -15.6975 -10.8445 -10.8445 -10.8394 -10.8394 -10.8145 -10.8145 -10.7895 -10.7895 -8.3519 -8.3519 -8.3252 -8.3252 -8.2711 -8.2711 -8.2666 -8.2666 -8.2278 -8.2278 -8.2135 -8.2135 -7.0207 -7.0207 -6.9910 -6.9910 -0.8803 -0.8803 -0.8802 -0.8802 1.7547 1.7547 1.8764 1.8764 2.7308 2.7308 2.7435 2.7435 3.2657 3.2657 3.3233 3.3233 4.0524 4.0524 4.1187 4.1187 4.9728 4.9728 5.0635 5.0635 5.2529 5.2529 5.2878 5.2878 9.5748 9.5748 10.2614 10.2614 11.2191 11.2191 11.3938 11.3938 12.0453 12.0453 12.7876 12.7876 k = 0.2895 0.5000-0.0000 ( 5342 PWs) bands (ev): -15.6976 -15.6976 -15.6971 -15.6971 -10.8441 -10.8441 -10.8393 -10.8393 -10.8140 -10.8140 -10.7896 -10.7896 -8.3538 -8.3538 -8.3283 -8.3283 -8.2689 -8.2689 -8.2655 -8.2655 -8.2281 -8.2281 -8.2126 -8.2126 -7.0122 -7.0122 -6.9832 -6.9832 -0.8752 -0.8752 -0.8751 -0.8751 1.7545 1.7545 1.8760 1.8760 2.7220 2.7220 2.7306 2.7306 3.2867 3.2867 3.3401 3.3401 3.9877 3.9877 4.0444 4.0444 4.9560 4.9560 5.0390 5.0390 5.2501 5.2501 5.2845 5.2845 9.5929 9.5929 10.2635 10.2635 11.2325 11.2325 11.4201 11.4201 12.0742 12.0742 12.7800 12.7800 k = 0.3026 0.5000-0.0000 ( 5350 PWs) bands (ev): -15.6973 -15.6973 -15.6968 -15.6968 -10.8438 -10.8438 -10.8392 -10.8392 -10.8134 -10.8134 -10.7897 -10.7897 -8.3555 -8.3555 -8.3313 -8.3313 -8.2667 -8.2667 -8.2644 -8.2644 -8.2284 -8.2284 -8.2118 -8.2118 -7.0038 -7.0038 -6.9756 -6.9756 -0.8704 -0.8704 -0.8704 -0.8704 1.7567 1.7567 1.8777 1.8777 2.7135 2.7135 2.7185 2.7185 3.3057 3.3057 3.3555 3.3555 3.9227 3.9227 3.9703 3.9703 4.9360 4.9360 5.0113 5.0113 5.2531 5.2531 5.2869 5.2869 9.6111 9.6111 10.2595 10.2595 11.2475 11.2475 11.4418 11.4418 12.1035 12.1035 12.7720 12.7720 k = 0.3158 0.5000-0.0000 ( 5354 PWs) bands (ev): -15.6969 -15.6969 -15.6964 -15.6964 -10.8435 -10.8435 -10.8391 -10.8391 -10.8127 -10.8127 -10.7899 -10.7899 -8.3570 -8.3570 -8.3342 -8.3342 -8.2645 -8.2645 -8.2633 -8.2633 -8.2286 -8.2286 -8.2111 -8.2111 -6.9955 -6.9955 -6.9683 -6.9683 -0.8661 -0.8661 -0.8660 -0.8660 1.7614 1.7614 1.8811 1.8811 2.7057 2.7057 2.7075 2.7075 3.3225 3.3225 3.3690 3.3690 3.8579 3.8579 3.8972 3.8972 4.9143 4.9143 4.9823 4.9823 5.2603 5.2603 5.2932 5.2932 9.6294 9.6294 10.2501 10.2501 11.2633 11.2633 11.4589 11.4589 12.1335 12.1335 12.7640 12.7640 k = 0.3289 0.5000-0.0000 ( 5354 PWs) bands (ev): -15.6965 -15.6965 -15.6961 -15.6961 -10.8432 -10.8432 -10.8391 -10.8391 -10.8119 -10.8119 -10.7902 -10.7902 -8.3584 -8.3584 -8.3371 -8.3371 -8.2623 -8.2623 -8.2622 -8.2622 -8.2288 -8.2288 -8.2106 -8.2106 -6.9874 -6.9874 -6.9614 -6.9614 -0.8621 -0.8621 -0.8620 -0.8620 1.7683 1.7683 1.8860 1.8860 2.6983 2.6983 2.6991 2.6991 3.3364 3.3364 3.3801 3.3801 3.7941 3.7941 3.8259 3.8259 4.8922 4.8922 4.9533 4.9533 5.2703 5.2703 5.3019 5.3019 9.6477 9.6477 10.2361 10.2361 11.2795 11.2795 11.4715 11.4715 12.1640 12.1640 12.7557 12.7557 k = 0.3421 0.5000-0.0000 ( 5348 PWs) bands (ev): -15.6962 -15.6962 -15.6957 -15.6957 -10.8429 -10.8429 -10.8392 -10.8392 -10.8110 -10.8110 -10.7905 -10.7905 -8.3597 -8.3597 -8.3398 -8.3398 -8.2611 -8.2611 -8.2603 -8.2603 -8.2289 -8.2289 -8.2102 -8.2102 -6.9796 -6.9796 -6.9549 -6.9549 -0.8585 -0.8585 -0.8583 -0.8583 1.7773 1.7773 1.8921 1.8921 2.6910 2.6910 2.6939 2.6939 3.3465 3.3465 3.3879 3.3879 3.7322 3.7322 3.7574 3.7574 4.8707 4.8707 4.9254 4.9254 5.2820 5.2820 5.3120 5.3120 9.6660 9.6660 10.2182 10.2182 11.2956 11.2956 11.4801 11.4801 12.1950 12.1950 12.7473 12.7473 k = 0.3553 0.5000-0.0000 ( 5356 PWs) bands (ev): -15.6958 -15.6958 -15.6954 -15.6954 -10.8426 -10.8426 -10.8393 -10.8393 -10.8100 -10.8100 -10.7908 -10.7908 -8.3608 -8.3608 -8.3425 -8.3425 -8.2601 -8.2601 -8.2584 -8.2584 -8.2288 -8.2288 -8.2100 -8.2100 -6.9721 -6.9721 -6.9489 -6.9489 -0.8552 -0.8552 -0.8551 -0.8551 1.7881 1.7881 1.8991 1.8991 2.6864 2.6864 2.6907 2.6907 3.3513 3.3513 3.3908 3.3908 3.6742 3.6742 3.6936 3.6936 4.8503 4.8503 4.8991 4.8991 5.2947 5.2947 5.3227 5.3227 9.6843 9.6843 10.1971 10.1971 11.3113 11.3113 11.4851 11.4851 12.2263 12.2263 12.7384 12.7384 k = 0.3684 0.5000-0.0000 ( 5356 PWs) bands (ev): -15.6955 -15.6955 -15.6951 -15.6951 -10.8424 -10.8424 -10.8394 -10.8394 -10.8090 -10.8090 -10.7912 -10.7912 -8.3617 -8.3617 -8.3450 -8.3450 -8.2591 -8.2591 -8.2566 -8.2566 -8.2287 -8.2287 -8.2100 -8.2100 -6.9649 -6.9649 -6.9434 -6.9434 -0.8524 -0.8524 -0.8522 -0.8522 1.8004 1.8004 1.9065 1.9065 2.6847 2.6847 2.6897 2.6897 3.3484 3.3484 3.3861 3.3861 3.6229 3.6229 3.6373 3.6373 4.8314 4.8314 4.8746 4.8746 5.3078 5.3078 5.3337 5.3337 9.7027 9.7027 10.1736 10.1736 11.3263 11.3263 11.4871 11.4871 12.2579 12.2579 12.7287 12.7287 k = 0.3816 0.5000-0.0000 ( 5360 PWs) bands (ev): -15.6952 -15.6952 -15.6949 -15.6949 -10.8422 -10.8422 -10.8395 -10.8395 -10.8079 -10.8079 -10.7917 -10.7917 -8.3625 -8.3625 -8.3474 -8.3474 -8.2581 -8.2581 -8.2551 -8.2551 -8.2283 -8.2283 -8.2101 -8.2101 -6.9581 -6.9581 -6.9384 -6.9384 -0.8499 -0.8499 -0.8497 -0.8497 1.8138 1.8138 1.9141 1.9141 2.6863 2.6863 2.6915 2.6915 3.3343 3.3343 3.3700 3.3700 3.5825 3.5825 3.5922 3.5922 4.8143 4.8143 4.8523 4.8523 5.3209 5.3209 5.3444 5.3444 9.7212 9.7212 10.1483 10.1483 11.3406 11.3406 11.4867 11.4867 12.2895 12.2895 12.7180 12.7180 k = 0.3947 0.5000-0.0000 ( 5356 PWs) bands (ev): -15.6949 -15.6949 -15.6946 -15.6946 -10.8420 -10.8420 -10.8397 -10.8397 -10.8068 -10.8068 -10.7922 -10.7922 -8.3631 -8.3631 -8.3497 -8.3497 -8.2572 -8.2572 -8.2538 -8.2538 -8.2277 -8.2277 -8.2104 -8.2104 -6.9518 -6.9518 -6.9339 -6.9339 -0.8477 -0.8477 -0.8476 -0.8476 1.8281 1.8281 1.9213 1.9213 2.6918 2.6918 2.6962 2.6962 3.3068 3.3068 3.3399 3.3399 3.5560 3.5560 3.5611 3.5611 4.7991 4.7991 4.8322 4.8322 5.3335 5.3335 5.3546 5.3546 9.7399 9.7399 10.1217 10.1217 11.3541 11.3541 11.4843 11.4843 12.3210 12.3210 12.7060 12.7060 k = 0.4079 0.5000-0.0000 ( 5358 PWs) bands (ev): -15.6947 -15.6947 -15.6944 -15.6944 -10.8418 -10.8418 -10.8398 -10.8398 -10.8057 -10.8057 -10.7928 -10.7928 -8.3636 -8.3636 -8.3518 -8.3518 -8.2563 -8.2563 -8.2527 -8.2527 -8.2270 -8.2270 -8.2109 -8.2109 -6.9459 -6.9459 -6.9301 -6.9301 -0.8459 -0.8459 -0.8458 -0.8458 1.8427 1.8427 1.9276 1.9276 2.7014 2.7014 2.7044 2.7044 3.2671 3.2671 3.2978 3.2978 3.5417 3.5417 3.5432 3.5432 4.7860 4.7860 4.8144 4.8144 5.3454 5.3454 5.3640 5.3640 9.7589 9.7589 10.0943 10.0943 11.3667 11.3667 11.4804 11.4804 12.3522 12.3522 12.6924 12.6924 k = 0.4211 0.5000-0.0000 ( 5354 PWs) bands (ev): -15.6945 -15.6945 -15.6942 -15.6942 -10.8416 -10.8416 -10.8400 -10.8400 -10.8046 -10.8046 -10.7934 -10.7934 -8.3638 -8.3638 -8.3537 -8.3537 -8.2554 -8.2554 -8.2519 -8.2519 -8.2260 -8.2260 -8.2115 -8.2115 -6.9406 -6.9406 -6.9269 -6.9269 -0.8444 -0.8444 -0.8443 -0.8443 1.8575 1.8575 1.9328 1.9328 2.7151 2.7151 2.7161 2.7161 3.2196 3.2196 3.2485 3.2485 3.5346 3.5346 3.5353 3.5353 4.7748 4.7748 4.7987 4.7987 5.3564 5.3564 5.3723 5.3723 9.7783 9.7783 10.0666 10.0666 11.3784 11.3784 11.4754 11.4754 12.3829 12.3829 12.6773 12.6773 k = 0.4342 0.5000-0.0000 ( 5358 PWs) bands (ev): -15.6943 -15.6943 -15.6941 -15.6941 -10.8415 -10.8415 -10.8401 -10.8401 -10.8035 -10.8035 -10.7941 -10.7941 -8.3639 -8.3639 -8.3555 -8.3555 -8.2546 -8.2546 -8.2514 -8.2514 -8.2249 -8.2249 -8.2123 -8.2123 -6.9359 -6.9359 -6.9243 -6.9243 -0.8432 -0.8432 -0.8430 -0.8430 1.8718 1.8718 1.9365 1.9365 2.7315 2.7315 2.7330 2.7330 3.1688 3.1688 3.1962 3.1962 3.5312 3.5312 3.5331 3.5331 4.7657 4.7657 4.7853 4.7853 5.3662 5.3662 5.3795 5.3795 9.7981 9.7981 10.0388 10.0388 11.3894 11.3894 11.4696 11.4696 12.4132 12.4132 12.6605 12.6605 k = 0.4474 0.5000-0.0000 ( 5350 PWs) bands (ev): -15.6941 -15.6941 -15.6940 -15.6940 -10.8413 -10.8413 -10.8403 -10.8403 -10.8024 -10.8024 -10.7949 -10.7949 -8.3639 -8.3639 -8.3571 -8.3571 -8.2539 -8.2539 -8.2511 -8.2511 -8.2236 -8.2236 -8.2132 -8.2132 -6.9318 -6.9318 -6.9224 -6.9224 -0.8422 -0.8422 -0.8421 -0.8421 1.8854 1.8854 1.9385 1.9385 2.7505 2.7505 2.7547 2.7547 3.1183 3.1183 3.1441 3.1441 3.5306 3.5306 3.5328 3.5328 4.7586 4.7586 4.7741 4.7741 5.3746 5.3746 5.3853 5.3853 9.8186 9.8186 10.0113 10.0113 11.3996 11.3996 11.4633 11.4633 12.4428 12.4428 12.6420 12.6420 k = 0.4605 0.5000-0.0000 ( 5350 PWs) bands (ev): -15.6940 -15.6940 -15.6939 -15.6939 -10.8412 -10.8412 -10.8404 -10.8404 -10.8013 -10.8013 -10.7957 -10.7957 -8.3636 -8.3636 -8.3586 -8.3586 -8.2532 -8.2532 -8.2510 -8.2510 -8.2222 -8.2222 -8.2143 -8.2143 -6.9282 -6.9282 -6.9212 -6.9212 -0.8414 -0.8414 -0.8413 -0.8413 1.8980 1.8980 1.9386 1.9386 2.7725 2.7725 2.7791 2.7791 3.0709 3.0709 3.0942 3.0942 3.5312 3.5312 3.5332 3.5332 4.7535 4.7535 4.7650 4.7650 5.3817 5.3817 5.3897 5.3897 9.8397 9.8397 9.9844 9.9844 11.4091 11.4091 11.4565 11.4565 12.4716 12.4716 12.6219 12.6219 k = 0.4737 0.5000-0.0000 ( 5352 PWs) bands (ev): -15.6939 -15.6939 -15.6938 -15.6938 -10.8410 -10.8410 -10.8405 -10.8405 -10.8003 -10.8003 -10.7965 -10.7965 -8.3632 -8.3632 -8.3598 -8.3598 -8.2526 -8.2526 -8.2511 -8.2511 -8.2208 -8.2208 -8.2154 -8.2154 -6.9254 -6.9254 -6.9206 -6.9206 -0.8409 -0.8409 -0.8408 -0.8408 1.9092 1.9092 1.9366 1.9366 2.7961 2.7961 2.8039 2.8039 3.0301 3.0301 3.0493 3.0493 3.5322 3.5322 3.5336 3.5336 4.7504 4.7504 4.7580 4.7580 5.3871 5.3871 5.3925 5.3925 9.8616 9.8616 9.9581 9.9581 11.4180 11.4180 11.4495 11.4495 12.4996 12.4996 12.6001 12.6001 k = 0.4868 0.5000-0.0000 ( 5332 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8409 -10.8409 -10.8406 -10.8406 -10.7993 -10.7993 -10.7974 -10.7974 -8.3626 -8.3626 -8.3609 -8.3609 -8.2521 -8.2521 -8.2513 -8.2513 -8.2194 -8.2194 -8.2167 -8.2167 -6.9232 -6.9232 -6.9208 -6.9208 -0.8406 -0.8406 -0.8405 -0.8405 1.9188 1.9188 1.9327 1.9327 2.8176 2.8176 2.8237 2.8237 3.0016 3.0016 3.0135 3.0135 3.5331 3.5331 3.5339 3.5339 4.7493 4.7493 4.7531 4.7531 5.3910 5.3910 5.3937 5.3937 9.8844 9.8844 9.9326 9.9326 11.4264 11.4264 11.4421 11.4421 12.5265 12.5265 12.5769 12.5769 k = 0.5000 0.5000-0.0000 ( 5328 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8408 -10.8408 -10.8408 -10.8408 -10.7983 -10.7983 -10.7983 -10.7983 -8.3619 -8.3619 -8.3619 -8.3619 -8.2516 -8.2516 -8.2516 -8.2516 -8.2180 -8.2180 -8.2180 -8.2180 -6.9216 -6.9216 -6.9216 -6.9216 -0.8404 -0.8404 -0.8404 -0.8404 1.9267 1.9267 1.9267 1.9267 2.8294 2.8294 2.8294 2.8294 2.9949 2.9949 2.9949 2.9949 3.5337 3.5337 3.5337 3.5337 4.7502 4.7502 4.7502 4.7502 5.3932 5.3932 5.3932 5.3932 9.9081 9.9081 9.9081 9.9081 11.4344 11.4344 11.4345 11.4345 12.5523 12.5523 12.5523 12.5523 k = 0.5000 0.5000-0.0000 ( 5328 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8408 -10.8408 -10.8408 -10.8408 -10.7983 -10.7983 -10.7983 -10.7983 -8.3619 -8.3619 -8.3619 -8.3619 -8.2516 -8.2516 -8.2516 -8.2516 -8.2180 -8.2180 -8.2180 -8.2180 -6.9216 -6.9216 -6.9216 -6.9216 -0.8404 -0.8404 -0.8404 -0.8404 1.9267 1.9267 1.9267 1.9267 2.8294 2.8294 2.8294 2.8294 2.9949 2.9949 2.9949 2.9949 3.5337 3.5337 3.5337 3.5337 4.7502 4.7502 4.7502 4.7502 5.3932 5.3932 5.3932 5.3932 9.9081 9.9081 9.9081 9.9081 11.4344 11.4344 11.4345 11.4345 12.5523 12.5523 12.5523 12.5523 k = 0.4907 0.4907-0.0000 ( 5340 PWs) bands (ev): -15.6939 -15.6939 -15.6936 -15.6936 -10.8409 -10.8409 -10.8407 -10.8407 -10.7993 -10.7993 -10.7974 -10.7974 -8.3626 -8.3626 -8.3609 -8.3609 -8.2521 -8.2521 -8.2513 -8.2513 -8.2194 -8.2194 -8.2167 -8.2167 -6.9232 -6.9232 -6.9208 -6.9208 -0.8411 -0.8411 -0.8399 -0.8399 1.9187 1.9187 1.9329 1.9329 2.8092 2.8092 2.8337 2.8337 2.9933 2.9933 3.0201 3.0201 3.5331 3.5331 3.5339 3.5339 4.7491 4.7491 4.7532 4.7532 5.3905 5.3905 5.3941 5.3941 9.8845 9.8845 9.9325 9.9325 11.4264 11.4264 11.4421 11.4421 12.5267 12.5267 12.5767 12.5767 k = 0.4815 0.4815-0.0000 ( 5348 PWs) bands (ev): -15.6945 -15.6945 -15.6932 -15.6932 -10.8410 -10.8410 -10.8405 -10.8405 -10.8003 -10.8003 -10.7965 -10.7965 -8.3632 -8.3632 -8.3599 -8.3599 -8.2526 -8.2526 -8.2511 -8.2511 -8.2209 -8.2209 -8.2154 -8.2154 -6.9255 -6.9255 -6.9205 -6.9205 -0.8432 -0.8432 -0.8385 -0.8385 1.9078 1.9078 1.9383 1.9383 2.7675 2.7675 2.8447 2.8447 2.9929 2.9929 3.0738 3.0738 3.5321 3.5321 3.5337 3.5337 4.7492 4.7492 4.7591 4.7591 5.3844 5.3844 5.3953 5.3953 9.8618 9.8618 9.9579 9.9579 11.4178 11.4178 11.4496 11.4496 12.5003 12.5003 12.5994 12.5994 k = 0.4722 0.4722-0.0000 ( 5346 PWs) bands (ev): -15.6953 -15.6953 -15.6925 -15.6925 -10.8412 -10.8412 -10.8404 -10.8404 -10.8013 -10.8013 -10.7956 -10.7956 -8.3636 -8.3636 -8.3586 -8.3586 -8.2533 -8.2533 -8.2509 -8.2509 -8.2223 -8.2223 -8.2142 -8.2142 -6.9288 -6.9288 -6.9206 -6.9206 -0.8466 -0.8466 -0.8360 -0.8360 1.8937 1.8937 1.9441 1.9441 2.7209 2.7209 2.8622 2.8622 2.9925 2.9925 3.1401 3.1401 3.5307 3.5307 3.5331 3.5331 4.7500 4.7500 4.7682 4.7682 5.3744 5.3744 5.3972 5.3972 9.8399 9.8399 9.9840 9.9840 11.4083 11.4083 11.4572 11.4572 12.4738 12.4738 12.6201 12.6201 k = 0.4630 0.4630-0.0000 ( 5354 PWs) bands (ev): -15.6965 -15.6965 -15.6915 -15.6915 -10.8413 -10.8413 -10.8403 -10.8403 -10.8024 -10.8024 -10.7949 -10.7949 -8.3638 -8.3638 -8.3572 -8.3572 -8.2540 -8.2540 -8.2509 -8.2509 -8.2238 -8.2238 -8.2131 -8.2131 -6.9330 -6.9330 -6.9211 -6.9211 -0.8514 -0.8514 -0.8325 -0.8325 1.8767 1.8767 1.9507 1.9507 2.6751 2.6751 2.8848 2.8848 2.9921 2.9921 3.2133 3.2133 3.5291 3.5291 3.5322 3.5322 4.7514 4.7514 4.7807 4.7807 5.3606 5.3606 5.3997 5.3997 9.8187 9.8187 10.0110 10.0110 11.3977 11.3977 11.4648 11.4648 12.4477 12.4477 12.6383 12.6383 k = 0.4537 0.4537-0.0000 ( 5362 PWs) bands (ev): -15.6981 -15.6981 -15.6903 -15.6903 -10.8415 -10.8415 -10.8401 -10.8401 -10.8035 -10.8035 -10.7941 -10.7941 -8.3638 -8.3638 -8.3557 -8.3557 -8.2548 -8.2548 -8.2510 -8.2510 -8.2254 -8.2254 -8.2120 -8.2120 -6.9383 -6.9383 -6.9219 -6.9219 -0.8574 -0.8574 -0.8280 -0.8280 1.8574 1.8574 1.9586 1.9586 2.6320 2.6320 2.9104 2.9104 2.9925 2.9925 3.2917 3.2917 3.5273 3.5273 3.5310 3.5310 4.7531 4.7531 4.7967 4.7967 5.3434 5.3434 5.4030 5.4030 9.7981 9.7981 10.0384 10.0384 11.3858 11.3858 11.4724 11.4724 12.4225 12.4225 12.6537 12.6537 k = 0.4444 0.4444-0.0000 ( 5362 PWs) bands (ev): -15.7000 -15.7000 -15.6888 -15.6888 -10.8416 -10.8416 -10.8400 -10.8400 -10.8047 -10.8047 -10.7934 -10.7934 -8.3636 -8.3636 -8.3540 -8.3540 -8.2557 -8.2557 -8.2513 -8.2513 -8.2269 -8.2269 -8.2110 -8.2110 -6.9445 -6.9445 -6.9230 -6.9230 -0.8646 -0.8646 -0.8224 -0.8224 1.8366 1.8366 1.9677 1.9677 2.5923 2.5923 2.9353 2.9353 2.9960 2.9960 3.3741 3.3741 3.5256 3.5256 3.5298 3.5298 4.7553 4.7553 4.8160 4.8160 5.3231 5.3231 5.4070 5.4070 9.7779 9.7779 10.0663 10.0663 11.3724 11.3724 11.4797 11.4797 12.3989 12.3989 12.6662 12.6662 k = 0.4352 0.4352-0.0000 ( 5366 PWs) bands (ev): -15.7022 -15.7022 -15.6870 -15.6870 -10.8418 -10.8418 -10.8398 -10.8398 -10.8059 -10.8059 -10.7927 -10.7927 -8.3633 -8.3633 -8.3523 -8.3523 -8.2567 -8.2567 -8.2517 -8.2517 -8.2284 -8.2284 -8.2101 -8.2101 -6.9518 -6.9518 -6.9244 -6.9244 -0.8729 -0.8729 -0.8158 -0.8158 1.8153 1.8153 1.9783 1.9783 2.5563 2.5563 2.9516 2.9516 3.0090 3.0090 3.4600 3.4600 3.5242 3.5242 3.5287 3.5287 4.7578 4.7578 4.8384 4.8384 5.3002 5.3002 5.4117 5.4117 9.7579 9.7579 10.0943 10.0943 11.3575 11.3575 11.4866 11.4866 12.3772 12.3772 12.6756 12.6756 k = 0.4259 0.4259-0.0000 ( 5370 PWs) bands (ev): -15.7047 -15.7047 -15.6849 -15.6849 -10.8419 -10.8419 -10.8397 -10.8397 -10.8071 -10.8071 -10.7921 -10.7921 -8.3627 -8.3627 -8.3504 -8.3504 -8.2578 -8.2578 -8.2522 -8.2522 -8.2299 -8.2299 -8.2092 -8.2092 -6.9602 -6.9602 -6.9260 -6.9260 -0.8823 -0.8823 -0.8080 -0.8080 1.7940 1.7940 1.9903 1.9903 2.5243 2.5243 2.9553 2.9553 3.0342 3.0342 3.5214 3.5214 3.5274 3.5274 3.5511 3.5511 4.7607 4.7607 4.8634 4.8634 5.2754 5.2754 5.4171 5.4171 9.7382 9.7382 10.1220 10.1220 11.3412 11.3412 11.4927 11.4927 12.3579 12.3579 12.6817 12.6817 k = 0.4167 0.4167-0.0000 ( 5362 PWs) bands (ev): -15.7075 -15.7075 -15.6826 -15.6826 -10.8421 -10.8421 -10.8395 -10.8395 -10.8084 -10.8084 -10.7914 -10.7914 -8.3619 -8.3619 -8.3484 -8.3484 -8.2589 -8.2589 -8.2529 -8.2529 -8.2313 -8.2313 -8.2085 -8.2085 -6.9695 -6.9695 -6.9278 -6.9278 -0.8926 -0.8926 -0.7991 -0.7991 1.7734 1.7734 2.0038 2.0038 2.4962 2.4962 2.9515 2.9515 3.0654 3.0654 3.5200 3.5200 3.5282 3.5282 3.6425 3.6425 4.7639 4.7639 4.8903 4.8903 5.2497 5.2497 5.4231 5.4231 9.7184 9.7184 10.1492 10.1492 11.3235 11.3235 11.4978 11.4978 12.3409 12.3409 12.6846 12.6846 k = 0.4074 0.4074-0.0000 ( 5342 PWs) bands (ev): -15.7106 -15.7106 -15.6800 -15.6800 -10.8423 -10.8423 -10.8393 -10.8393 -10.8096 -10.8096 -10.7909 -10.7909 -8.3610 -8.3610 -8.3463 -8.3463 -8.2600 -8.2600 -8.2538 -8.2538 -8.2327 -8.2327 -8.2078 -8.2078 -6.9798 -6.9798 -6.9299 -6.9299 -0.9037 -0.9037 -0.7890 -0.7890 1.7541 1.7541 2.0186 2.0186 2.4722 2.4722 2.9436 2.9436 3.0981 3.0981 3.5176 3.5176 3.5303 3.5303 3.7374 3.7374 4.7673 4.7673 4.9175 4.9175 5.2248 5.2248 5.4299 5.4299 9.6987 9.6987 10.1755 10.1755 11.3045 11.3045 11.5017 11.5017 12.3263 12.3263 12.6841 12.6841 k = 0.3981 0.3981-0.0000 ( 5352 PWs) bands (ev): -15.7140 -15.7140 -15.6773 -15.6773 -10.8425 -10.8425 -10.8392 -10.8392 -10.8109 -10.8109 -10.7903 -10.7903 -8.3599 -8.3599 -8.3442 -8.3442 -8.2613 -8.2613 -8.2548 -8.2548 -8.2340 -8.2340 -8.2072 -8.2072 -6.9910 -6.9910 -6.9322 -6.9322 -0.9155 -0.9155 -0.7778 -0.7778 1.7363 1.7363 2.0349 2.0349 2.4523 2.4523 2.9327 2.9327 3.1303 3.1303 3.5148 3.5148 3.5343 3.5343 3.8345 3.8345 4.7709 4.7709 4.9425 4.9425 5.2036 5.2036 5.4373 5.4373 9.6788 9.6788 10.2003 10.2003 11.2846 11.2846 11.5044 11.5044 12.3135 12.3135 12.6804 12.6804 k = 0.3889 0.3889-0.0000 ( 5346 PWs) bands (ev): -15.7177 -15.7177 -15.6742 -15.6742 -10.8427 -10.8427 -10.8390 -10.8390 -10.8123 -10.8123 -10.7898 -10.7898 -8.3585 -8.3585 -8.3421 -8.3421 -8.2626 -8.2626 -8.2561 -8.2561 -8.2352 -8.2352 -8.2066 -8.2066 -7.0032 -7.0032 -6.9347 -6.9347 -0.9278 -0.9278 -0.7652 -0.7652 1.7205 1.7205 2.0525 2.0525 2.4363 2.4363 2.9192 2.9192 3.1612 3.1612 3.5116 3.5116 3.5402 3.5402 3.9334 3.9334 4.7744 4.7744 4.9608 4.9608 5.1907 5.1907 5.4454 5.4454 9.6590 9.6590 10.2230 10.2230 11.2642 11.2642 11.5060 11.5060 12.3018 12.3018 12.6735 12.6735 k = 0.3796 0.3796-0.0000 ( 5350 PWs) bands (ev): -15.7216 -15.7216 -15.6710 -15.6710 -10.8430 -10.8430 -10.8388 -10.8388 -10.8136 -10.8136 -10.7894 -10.7894 -8.3571 -8.3571 -8.3399 -8.3399 -8.2639 -8.2639 -8.2575 -8.2575 -8.2364 -8.2364 -8.2061 -8.2061 -7.0162 -7.0162 -6.9374 -6.9374 -0.9405 -0.9405 -0.7514 -0.7514 1.7068 1.7068 2.0714 2.0714 2.4243 2.4243 2.9032 2.9032 3.1902 3.1902 3.5082 3.5082 3.5484 3.5484 4.0336 4.0336 4.7776 4.7776 4.9671 4.9671 5.1916 5.1916 5.4542 5.4542 9.6392 9.6392 10.2430 10.2430 11.2438 11.2438 11.5068 11.5068 12.2902 12.2902 12.6636 12.6636 k = 0.3704 0.3704-0.0000 ( 5346 PWs) bands (ev): -15.7258 -15.7258 -15.6675 -15.6675 -10.8432 -10.8432 -10.8387 -10.8387 -10.8150 -10.8150 -10.7889 -10.7889 -8.3554 -8.3554 -8.3376 -8.3376 -8.2653 -8.2653 -8.2590 -8.2590 -8.2375 -8.2375 -8.2057 -8.2057 -7.0301 -7.0301 -6.9402 -6.9402 -0.9535 -0.9535 -0.7363 -0.7363 1.6953 1.6953 2.0916 2.0916 2.4161 2.4161 2.8847 2.8847 3.2169 3.2169 3.5045 3.5045 3.5588 3.5588 4.1343 4.1343 4.7800 4.7800 4.9599 4.9599 5.2086 5.2086 5.4635 5.4635 9.6197 9.6197 10.2596 10.2596 11.2241 11.2241 11.5072 11.5072 12.2772 12.2772 12.6509 12.6509 k = 0.3611 0.3611-0.0000 ( 5354 PWs) bands (ev): -15.7302 -15.7302 -15.6639 -15.6639 -10.8435 -10.8435 -10.8386 -10.8386 -10.8163 -10.8163 -10.7885 -10.7885 -8.3536 -8.3536 -8.3354 -8.3354 -8.2667 -8.2667 -8.2608 -8.2608 -8.2385 -8.2385 -8.2054 -8.2054 -7.0447 -7.0447 -6.9433 -6.9433 -0.9665 -0.9665 -0.7197 -0.7197 1.6862 1.6862 2.1129 2.1129 2.4118 2.4118 2.8639 2.8639 3.2413 3.2413 3.5007 3.5007 3.5715 3.5715 4.2347 4.2347 4.7804 4.7804 4.9439 4.9439 5.2382 5.2382 5.4736 5.4736 9.6006 9.6006 10.2719 10.2719 11.2058 11.2058 11.5077 11.5077 12.2616 12.2616 12.6357 12.6357 k = 0.3519 0.3519-0.0000 ( 5358 PWs) bands (ev): -15.7348 -15.7348 -15.6601 -15.6601 -10.8438 -10.8438 -10.8385 -10.8385 -10.8177 -10.8177 -10.7882 -10.7882 -8.3516 -8.3516 -8.3332 -8.3332 -8.2682 -8.2682 -8.2626 -8.2626 -8.2395 -8.2395 -8.2051 -8.2051 -7.0600 -7.0600 -6.9466 -6.9466 -0.9794 -0.9794 -0.7018 -0.7018 1.6793 1.6793 2.1355 2.1355 2.4112 2.4112 2.8409 2.8409 3.2632 3.2632 3.4966 3.4966 3.5865 3.5865 4.3333 4.3333 4.7772 4.7772 4.9263 4.9263 5.2753 5.2753 5.4842 5.4842 9.5823 9.5823 10.2792 10.2792 11.1899 11.1899 11.5090 11.5090 12.2419 12.2419 12.6184 12.6184 k = 0.3426 0.3426-0.0000 ( 5362 PWs) bands (ev): -15.7397 -15.7397 -15.6561 -15.6561 -10.8441 -10.8441 -10.8384 -10.8384 -10.8191 -10.8191 -10.7878 -10.7878 -8.3496 -8.3496 -8.3310 -8.3310 -8.2697 -8.2697 -8.2646 -8.2646 -8.2404 -8.2404 -8.2049 -8.2049 -7.0761 -7.0761 -6.9501 -6.9501 -0.9920 -0.9920 -0.6825 -0.6825 1.6747 1.6747 2.1591 2.1591 2.4141 2.4141 2.8159 2.8159 3.2828 3.2828 3.4924 3.4924 3.6036 3.6036 4.4274 4.4274 4.7684 4.7684 4.9144 4.9144 5.3162 5.3162 5.4956 5.4956 9.5651 9.5651 10.2807 10.2807 11.1771 11.1771 11.5117 11.5117 12.2169 12.2169 12.5993 12.5993 k = 0.3333 0.3333-0.0000 ( 5352 PWs) bands (ev): -15.7447 -15.7447 -15.6519 -15.6519 -10.8444 -10.8444 -10.8383 -10.8383 -10.8204 -10.8204 -10.7875 -10.7875 -8.3474 -8.3474 -8.3289 -8.3289 -8.2712 -8.2712 -8.2666 -8.2666 -8.2412 -8.2412 -8.2047 -8.2047 -7.0927 -7.0927 -6.9537 -6.9537 -1.0043 -1.0043 -0.6618 -0.6618 1.6724 1.6724 2.1837 2.1837 2.4205 2.4205 2.7891 2.7891 3.3001 3.3001 3.4881 3.4881 3.6229 3.6229 4.5117 4.5117 4.7551 4.7551 4.9143 4.9143 5.3581 5.3581 5.5076 5.5076 9.5493 9.5493 10.2759 10.2759 11.1682 11.1682 11.5164 11.5164 12.1858 12.1858 12.5790 12.5790 k = 0.3241 0.3241-0.0000 ( 5348 PWs) bands (ev): -15.7498 -15.7498 -15.6475 -15.6475 -10.8448 -10.8448 -10.8383 -10.8383 -10.8218 -10.8218 -10.7872 -10.7872 -8.3450 -8.3450 -8.3268 -8.3268 -8.2728 -8.2728 -8.2686 -8.2686 -8.2421 -8.2421 -8.2045 -8.2045 -7.1099 -7.1099 -6.9574 -6.9574 -1.0160 -1.0160 -0.6395 -0.6395 1.6722 1.6722 2.2093 2.2093 2.4301 2.4301 2.7607 2.7607 3.3155 3.3155 3.4837 3.4837 3.6440 3.6440 4.5739 4.5739 4.7462 4.7462 4.9296 4.9296 5.3994 5.3994 5.5203 5.5203 9.5355 9.5355 10.2645 10.2645 11.1636 11.1636 11.5237 11.5237 12.1481 12.1481 12.5579 12.5579 k = 0.3148 0.3148-0.0000 ( 5350 PWs) bands (ev): -15.7552 -15.7552 -15.6431 -15.6431 -10.8451 -10.8451 -10.8382 -10.8382 -10.8231 -10.8231 -10.7869 -10.7869 -8.3427 -8.3427 -8.3248 -8.3248 -8.2745 -8.2745 -8.2706 -8.2706 -8.2429 -8.2429 -8.2044 -8.2044 -7.1276 -7.1276 -6.9614 -6.9614 -1.0269 -1.0269 -0.6158 -0.6158 1.6739 1.6739 2.2358 2.2358 2.4428 2.4428 2.7311 2.7311 3.3289 3.3289 3.4793 3.4793 3.6668 3.6668 4.5951 4.5951 4.7571 4.7571 4.9638 4.9638 5.4387 5.4387 5.5338 5.5338 9.5239 9.5239 10.2466 10.2466 11.1636 11.1636 11.5342 11.5342 12.1039 12.1039 12.5363 12.5363 k = 0.3056 0.3056-0.0000 ( 5350 PWs) bands (ev): -15.7606 -15.7606 -15.6385 -15.6385 -10.8455 -10.8455 -10.8383 -10.8383 -10.8244 -10.8244 -10.7867 -10.7867 -8.3402 -8.3402 -8.3228 -8.3228 -8.2762 -8.2762 -8.2725 -8.2725 -8.2438 -8.2438 -8.2043 -8.2043 -7.1458 -7.1458 -6.9654 -6.9654 -1.0371 -1.0371 -0.5907 -0.5907 1.6776 1.6776 2.2631 2.2631 2.4582 2.4582 2.7006 2.7006 3.3407 3.3407 3.4749 3.4749 3.6913 3.6913 4.5792 4.5792 4.7822 4.7822 5.0187 5.0187 5.4747 5.4747 5.5482 5.5482 9.5149 9.5149 10.2225 10.2225 11.1680 11.1680 11.5484 11.5484 12.0536 12.0536 12.5146 12.5146 k = 0.2963 0.2963-0.0000 ( 5354 PWs) bands (ev): -15.7662 -15.7662 -15.6338 -15.6338 -10.8459 -10.8459 -10.8383 -10.8383 -10.8256 -10.8256 -10.7865 -10.7865 -8.3377 -8.3377 -8.3210 -8.3210 -8.2781 -8.2781 -8.2743 -8.2743 -8.2446 -8.2446 -8.2042 -8.2042 -7.1643 -7.1643 -6.9696 -6.9696 -1.0463 -1.0463 -0.5641 -0.5641 1.6829 1.6829 2.2911 2.2911 2.4759 2.4759 2.6698 2.6698 3.3510 3.3510 3.4705 3.4705 3.7171 3.7171 4.5470 4.5470 4.8050 4.8050 5.0894 5.0894 5.5068 5.5068 5.5634 5.5634 9.5090 9.5090 10.1932 10.1932 11.1767 11.1767 11.5667 11.5667 11.9981 11.9981 12.4930 12.4930 k = 0.2870 0.2870-0.0000 ( 5346 PWs) bands (ev): -15.7718 -15.7718 -15.6290 -15.6290 -10.8464 -10.8464 -10.8384 -10.8384 -10.8268 -10.8268 -10.7863 -10.7863 -8.3352 -8.3352 -8.3192 -8.3192 -8.2800 -8.2800 -8.2760 -8.2760 -8.2454 -8.2454 -8.2041 -8.2041 -7.1832 -7.1832 -6.9739 -6.9739 -1.0544 -1.0544 -0.5360 -0.5360 1.6897 1.6897 2.3198 2.3198 2.4949 2.4949 2.6398 2.6398 3.3601 3.3601 3.4663 3.4663 3.7441 3.7441 4.5085 4.5085 4.8225 4.8225 5.1678 5.1678 5.5343 5.5343 5.5796 5.5796 9.5062 9.5062 10.1594 10.1594 11.1893 11.1893 11.5894 11.5894 11.9385 11.9385 12.4717 12.4717 k = 0.2778 0.2778-0.0000 ( 5341 PWs) bands (ev): -15.7776 -15.7776 -15.6242 -15.6242 -10.8468 -10.8468 -10.8386 -10.8386 -10.8280 -10.8280 -10.7861 -10.7861 -8.3327 -8.3327 -8.3176 -8.3176 -8.2820 -8.2820 -8.2775 -8.2775 -8.2462 -8.2462 -8.2041 -8.2041 -7.2023 -7.2023 -6.9782 -6.9782 -1.0613 -1.0613 -0.5066 -0.5066 1.6979 1.6979 2.3490 2.3490 2.5122 2.5122 2.6135 2.6135 3.3680 3.3680 3.4624 3.4624 3.7721 3.7721 4.4677 4.4677 4.8366 4.8366 5.2475 5.2475 5.5567 5.5567 5.5970 5.5970 9.5069 9.5069 10.1224 10.1224 11.2054 11.2054 11.6164 11.6164 11.8763 11.8763 12.4510 12.4510 k = 0.2685 0.2685-0.0000 ( 5349 PWs) bands (ev): -15.7834 -15.7834 -15.6193 -15.6193 -10.8473 -10.8473 -10.8388 -10.8388 -10.8291 -10.8291 -10.7860 -10.7860 -8.3302 -8.3302 -8.3161 -8.3161 -8.2840 -8.2840 -8.2790 -8.2790 -8.2470 -8.2470 -8.2041 -8.2041 -7.2216 -7.2216 -6.9827 -6.9827 -1.0670 -1.0670 -0.4757 -0.4757 1.7072 1.7072 2.3786 2.3786 2.5190 2.5190 2.5999 2.5999 3.3748 3.3748 3.4590 3.4590 3.8008 3.8008 4.4261 4.4261 4.8485 4.8485 5.3238 5.3238 5.5733 5.5733 5.6168 5.6168 9.5109 9.5109 10.0833 10.0833 11.2248 11.2248 11.6471 11.6471 11.8133 11.8133 12.4309 12.4309 k = 0.2593 0.2593-0.0000 ( 5355 PWs) bands (ev): -15.7892 -15.7892 -15.6143 -15.6143 -10.8478 -10.8478 -10.8390 -10.8390 -10.8301 -10.8301 -10.7859 -10.7859 -8.3279 -8.3279 -8.3148 -8.3148 -8.2859 -8.2859 -8.2803 -8.2803 -8.2478 -8.2478 -8.2041 -8.2041 -7.2411 -7.2411 -6.9872 -6.9872 -1.0714 -1.0714 -0.4435 -0.4435 1.7174 1.7174 2.4085 2.4085 2.5049 2.5049 2.6094 2.6094 3.3805 3.3805 3.4563 3.4563 3.8300 3.8300 4.3848 4.3848 4.8592 4.8592 5.3931 5.3931 5.5830 5.5830 5.6412 5.6412 9.5183 9.5183 10.0432 10.0432 11.2473 11.2473 11.6764 11.6764 11.7558 11.7558 12.4117 12.4117 k = 0.2500 0.2500-0.0000 ( 5351 PWs) bands (ev): -15.7950 -15.7950 -15.6094 -15.6094 -10.8483 -10.8483 -10.8393 -10.8393 -10.8311 -10.8311 -10.7857 -10.7857 -8.3257 -8.3257 -8.3135 -8.3135 -8.2876 -8.2876 -8.2816 -8.2816 -8.2485 -8.2485 -8.2041 -8.2041 -7.2605 -7.2605 -6.9918 -6.9918 -1.0745 -1.0745 -0.4101 -0.4101 1.7283 1.7283 2.4376 2.4376 2.4790 2.4790 2.6338 2.6338 3.3850 3.3850 3.4546 3.4546 3.8595 3.8595 4.3444 4.3444 4.8692 4.8692 5.4522 5.4522 5.5855 5.5855 5.6714 5.6714 9.5288 9.5288 10.0031 10.0031 11.2728 11.2728 11.6632 11.6632 11.7460 11.7460 12.3935 12.3935 k = 0.2407 0.2407-0.0000 ( 5347 PWs) bands (ev): -15.8008 -15.8008 -15.6044 -15.6044 -10.8488 -10.8488 -10.8396 -10.8396 -10.8320 -10.8320 -10.7856 -10.7856 -8.3238 -8.3238 -8.3124 -8.3124 -8.2892 -8.2892 -8.2828 -8.2828 -8.2492 -8.2492 -8.2041 -8.2041 -7.2800 -7.2800 -6.9964 -6.9964 -1.0761 -1.0761 -0.3754 -0.3754 1.7398 1.7398 2.4423 2.4423 2.4735 2.4735 2.6646 2.6646 3.3881 3.3881 3.4544 3.4544 3.8886 3.8886 4.3056 4.3056 4.8787 4.8787 5.4988 5.4988 5.5817 5.5817 5.7077 5.7077 9.5420 9.5420 9.9642 9.9642 11.3013 11.3013 11.6072 11.6072 11.7850 11.7850 12.3766 12.3766 k = 0.2315 0.2315-0.0000 ( 5343 PWs) bands (ev): -15.8066 -15.8066 -15.5994 -15.5994 -10.8493 -10.8493 -10.8400 -10.8400 -10.8329 -10.8329 -10.7855 -10.7855 -8.3222 -8.3222 -8.3113 -8.3113 -8.2905 -8.2905 -8.2839 -8.2839 -8.2499 -8.2499 -8.2041 -8.2041 -7.2995 -7.2995 -7.0009 -7.0009 -1.0764 -1.0764 -0.3396 -0.3396 1.7516 1.7516 2.4116 2.4116 2.5022 2.5022 2.6988 2.6988 3.3896 3.3896 3.4560 3.4560 3.9167 3.9167 4.2693 4.2693 4.8877 4.8877 5.5309 5.5309 5.5744 5.5744 5.7480 5.7480 9.5575 9.5575 9.9273 9.9273 11.3326 11.3326 11.5483 11.5483 11.8340 11.8340 12.3613 12.3613 k = 0.2222 0.2222-0.0000 ( 5339 PWs) bands (ev): -15.8123 -15.8123 -15.5945 -15.5945 -10.8499 -10.8499 -10.8404 -10.8404 -10.8337 -10.8337 -10.7855 -10.7855 -8.3210 -8.3210 -8.3103 -8.3103 -8.2914 -8.2914 -8.2850 -8.2850 -8.2505 -8.2505 -8.2041 -8.2041 -7.3187 -7.3187 -7.0055 -7.0055 -1.0753 -1.0753 -0.3028 -0.3028 1.7636 1.7636 2.3788 2.3788 2.5327 2.5327 2.7353 2.7353 3.3896 3.3896 3.4597 3.4597 3.9429 3.9429 4.2366 4.2366 4.8964 4.8964 5.5373 5.5373 5.5778 5.5778 5.7888 5.7888 9.5745 9.5745 9.8932 9.8932 11.3664 11.3664 11.4923 11.4923 11.8880 11.8880 12.3478 12.3478 k = 0.2130 0.2130-0.0000 ( 5341 PWs) bands (ev): -15.8180 -15.8180 -15.5896 -15.5896 -10.8505 -10.8505 -10.8408 -10.8408 -10.8344 -10.8344 -10.7854 -10.7854 -8.3202 -8.3202 -8.3094 -8.3094 -8.2920 -8.2920 -8.2860 -8.2860 -8.2511 -8.2511 -8.2041 -8.2041 -7.3378 -7.3378 -7.0101 -7.0101 -1.0728 -1.0728 -0.2651 -0.2651 1.7754 1.7754 2.3459 2.3459 2.5632 2.5632 2.7736 2.7736 3.3881 3.3881 3.4655 3.4655 3.9653 3.9653 4.2093 4.2093 4.9048 4.9048 5.5183 5.5183 5.5945 5.5945 5.8265 5.8265 9.5920 9.5920 9.8631 9.8631 11.3986 11.3986 11.4449 11.4449 11.9457 11.9457 12.3366 12.3366 k = 0.2037 0.2037-0.0000 ( 5345 PWs) bands (ev): -15.8236 -15.8236 -15.5847 -15.5847 -10.8511 -10.8511 -10.8412 -10.8412 -10.8351 -10.8351 -10.7854 -10.7854 -8.3199 -8.3199 -8.3087 -8.3087 -8.2920 -8.2920 -8.2871 -8.2871 -8.2516 -8.2516 -8.2041 -8.2041 -7.3566 -7.3566 -7.0146 -7.0146 -1.0690 -1.0690 -0.2266 -0.2266 1.7870 1.7870 2.3134 2.3134 2.5937 2.5937 2.8132 2.8132 3.3854 3.3854 3.4732 3.4732 3.9813 3.9813 4.1902 4.1902 4.9129 4.9129 5.4898 5.4898 5.6111 5.6111 5.8586 5.8586 9.6085 9.6085 9.8381 9.8381 11.3848 11.3848 11.4516 11.4516 12.0061 12.0061 12.3284 12.3284 k = 0.1944 0.1944-0.0000 ( 5345 PWs) bands (ev): -15.8291 -15.8291 -15.5800 -15.5800 -10.8517 -10.8517 -10.8417 -10.8417 -10.8358 -10.8358 -10.7854 -10.7854 -8.3200 -8.3200 -8.3082 -8.3082 -8.2916 -8.2916 -8.2880 -8.2880 -8.2521 -8.2521 -8.2042 -8.2042 -7.3751 -7.3751 -7.0191 -7.0191 -1.0639 -1.0639 -0.1875 -0.1875 1.7982 1.7982 2.2815 2.2815 2.6240 2.6240 2.8538 2.8538 3.3820 3.3820 3.4826 3.4826 3.9879 3.9879 4.1824 4.1824 4.9205 4.9205 5.4554 5.4554 5.6256 5.6256 5.8835 5.8835 9.6218 9.6218 9.8198 9.8198 11.3467 11.3467 11.4914 11.4914 12.0677 12.0677 12.3242 12.3242 k = 0.1852 0.1852-0.0000 ( 5355 PWs) bands (ev): -15.8344 -15.8344 -15.5753 -15.5753 -10.8523 -10.8523 -10.8421 -10.8421 -10.8365 -10.8365 -10.7854 -10.7854 -8.3204 -8.3204 -8.3079 -8.3079 -8.2908 -8.2908 -8.2890 -8.2890 -8.2525 -8.2525 -8.2043 -8.2043 -7.3932 -7.3932 -7.0235 -7.0235 -1.0576 -1.0576 -0.1479 -0.1479 1.8088 1.8088 2.2504 2.2504 2.6539 2.6539 2.8951 2.8951 3.3779 3.3779 3.4937 3.4937 3.9839 3.9839 4.1870 4.1870 4.9278 4.9278 5.4164 5.4164 5.6380 5.6380 5.9006 5.9006 9.6294 9.6294 9.8101 9.8101 11.3141 11.3141 11.5351 11.5351 12.1277 12.1277 12.3268 12.3268 k = 0.1759 0.1759-0.0000 ( 5353 PWs) bands (ev): -15.8397 -15.8397 -15.5707 -15.5707 -10.8529 -10.8529 -10.8425 -10.8425 -10.8371 -10.8371 -10.7854 -10.7854 -8.3210 -8.3210 -8.3078 -8.3078 -8.2901 -8.2901 -8.2896 -8.2896 -8.2528 -8.2528 -8.2044 -8.2044 -7.4108 -7.4108 -7.0278 -7.0278 -1.0502 -1.0502 -0.1080 -0.1080 1.8187 1.8187 2.2204 2.2204 2.6833 2.6833 2.9366 2.9366 3.3735 3.3735 3.5064 3.5064 3.9718 3.9718 4.2017 4.2017 4.9345 4.9345 5.3735 5.3735 5.6483 5.6483 5.9096 5.9096 9.6293 9.6293 9.8099 9.8099 11.2896 11.2896 11.5805 11.5805 12.1804 12.1804 12.3412 12.3412 k = 0.1667 0.1667-0.0000 ( 5343 PWs) bands (ev): -15.8447 -15.8447 -15.5663 -15.5663 -10.8534 -10.8534 -10.8429 -10.8429 -10.8377 -10.8377 -10.7854 -10.7854 -8.3217 -8.3217 -8.3079 -8.3079 -8.2909 -8.2909 -8.2883 -8.2883 -8.2530 -8.2530 -8.2045 -8.2045 -7.4279 -7.4279 -7.0319 -7.0319 -1.0418 -1.0418 -0.0680 -0.0680 1.8277 1.8277 2.1914 2.1914 2.7122 2.7122 2.9780 2.9780 3.3689 3.3689 3.5205 3.5205 3.9557 3.9557 4.2226 4.2226 4.9407 4.9407 5.3276 5.3276 5.6563 5.6563 5.9111 5.9111 9.6220 9.6220 9.8176 9.8176 11.2745 11.2745 11.6270 11.6270 12.2182 12.2182 12.3746 12.3746 k = 0.1574 0.1574-0.0000 ( 5341 PWs) bands (ev): -15.8496 -15.8496 -15.5620 -15.5620 -10.8540 -10.8540 -10.8433 -10.8433 -10.8383 -10.8383 -10.7854 -10.7854 -8.3225 -8.3225 -8.3081 -8.3081 -8.2919 -8.2919 -8.2869 -8.2869 -8.2531 -8.2531 -8.2046 -8.2046 -7.4444 -7.4444 -7.0360 -7.0360 -1.0325 -1.0325 -0.0280 -0.0280 1.8357 1.8357 2.1638 2.1638 2.7404 2.7404 3.0187 3.0187 3.3642 3.3642 3.5361 3.5361 3.9387 3.9387 4.2467 4.2467 4.9463 4.9463 5.2792 5.2792 5.6615 5.6615 5.9059 5.9059 9.6093 9.6093 9.8300 9.8300 11.2695 11.2695 11.6738 11.6738 12.2404 12.2404 12.4269 12.4269 k = 0.1481 0.1481-0.0000 ( 5335 PWs) bands (ev): -15.8543 -15.8543 -15.5578 -15.5578 -10.8545 -10.8545 -10.8437 -10.8437 -10.8388 -10.8388 -10.7854 -10.7854 -8.3233 -8.3233 -8.3083 -8.3083 -8.2928 -8.2928 -8.2854 -8.2854 -8.2531 -8.2531 -8.2048 -8.2048 -7.4603 -7.4603 -7.0399 -7.0399 -1.0224 -1.0224 0.0117 0.0117 1.8426 1.8426 2.1376 2.1376 2.7678 2.7678 3.0582 3.0582 3.3596 3.3596 3.5530 3.5530 3.9227 3.9227 4.2723 4.2723 4.9510 4.9510 5.2291 5.2291 5.6633 5.6633 5.8956 5.8956 9.5935 9.5935 9.8441 9.8441 11.2752 11.2752 11.7203 11.7203 12.2545 12.2545 12.4896 12.4896 k = 0.1389 0.1389-0.0000 ( 5355 PWs) bands (ev): -15.8588 -15.8588 -15.5539 -15.5539 -10.8550 -10.8550 -10.8440 -10.8440 -10.8394 -10.8394 -10.7855 -10.7855 -8.3241 -8.3241 -8.3087 -8.3087 -8.2937 -8.2937 -8.2840 -8.2840 -8.2531 -8.2531 -8.2051 -8.2051 -7.4756 -7.4756 -7.0436 -7.0436 -1.0117 -1.0117 0.0508 0.0508 1.8484 1.8484 2.1130 2.1130 2.7944 2.7944 3.0959 3.0959 3.3551 3.3551 3.5713 3.5713 3.9091 3.9091 4.2981 4.2981 4.9548 4.9548 5.1779 5.1779 5.6604 5.6604 5.8821 5.8821 9.5759 9.5759 9.8576 9.8576 11.2916 11.2916 11.7659 11.7659 12.2667 12.2667 12.5557 12.5557 k = 0.1296 0.1296-0.0000 ( 5355 PWs) bands (ev): -15.8631 -15.8631 -15.5501 -15.5501 -10.8554 -10.8554 -10.8444 -10.8444 -10.8399 -10.8399 -10.7856 -10.7856 -8.3248 -8.3248 -8.3092 -8.3092 -8.2946 -8.2946 -8.2826 -8.2826 -8.2530 -8.2530 -8.2053 -8.2053 -7.4901 -7.4901 -7.0472 -7.0472 -1.0006 -1.0006 0.0892 0.0892 1.8529 1.8529 2.0900 2.0900 2.8200 2.8200 3.1310 3.1310 3.3509 3.3509 3.5908 3.5908 3.8990 3.8990 4.3235 4.3235 4.9575 4.9575 5.1263 5.1263 5.6517 5.6517 5.8678 5.8678 9.5573 9.5573 9.8689 9.8689 11.3182 11.3182 11.8101 11.8101 12.2803 12.2803 12.6208 12.6208 k = 0.1204 0.1204-0.0000 ( 5355 PWs) bands (ev): -15.8672 -15.8672 -15.5465 -15.5465 -10.8559 -10.8559 -10.8447 -10.8447 -10.8405 -10.8405 -10.7856 -10.7856 -8.3255 -8.3255 -8.3096 -8.3096 -8.2955 -8.2955 -8.2813 -8.2813 -8.2528 -8.2528 -8.2056 -8.2056 -7.5038 -7.5038 -7.0506 -7.0506 -0.9892 -0.9892 0.1266 0.1266 1.8561 1.8561 2.0689 2.0689 2.8445 2.8445 3.1629 3.1629 3.3472 3.3472 3.6115 3.6115 3.8931 3.8931 4.3477 4.3477 4.9588 4.9588 5.0751 5.0751 5.6358 5.6358 5.8550 5.8550 9.5383 9.5383 9.8775 9.8775 11.3543 11.3543 11.8521 11.8521 12.2968 12.2968 12.6819 12.6819 k = 0.1111 0.1111-0.0000 ( 5349 PWs) bands (ev): -15.8710 -15.8710 -15.5431 -15.5431 -10.8562 -10.8562 -10.8449 -10.8449 -10.8410 -10.8410 -10.7857 -10.7857 -8.3260 -8.3260 -8.3101 -8.3101 -8.2964 -8.2964 -8.2802 -8.2802 -8.2525 -8.2525 -8.2059 -8.2059 -7.5167 -7.5167 -7.0538 -7.0538 -0.9776 -0.9776 0.1627 0.1627 1.8580 1.8580 2.0498 2.0498 2.8679 2.8679 3.1907 3.1907 3.3441 3.3441 3.6333 3.6333 3.8920 3.8920 4.3705 4.3705 4.9586 4.9586 5.0248 5.0248 5.6124 5.6124 5.8454 5.8454 9.5192 9.5192 9.8831 9.8831 11.3983 11.3983 11.8914 11.8914 12.3176 12.3176 12.7366 12.7366 k = 0.1019 0.1019-0.0000 ( 5341 PWs) bands (ev): -15.8745 -15.8745 -15.5399 -15.5399 -10.8566 -10.8566 -10.8452 -10.8452 -10.8414 -10.8414 -10.7858 -10.7858 -8.3263 -8.3263 -8.3106 -8.3106 -8.2973 -8.2973 -8.2791 -8.2791 -8.2522 -8.2522 -8.2062 -8.2062 -7.5287 -7.5287 -7.0568 -7.0568 -0.9661 -0.9661 0.1973 0.1973 1.8586 1.8586 2.0327 2.0327 2.8901 2.8901 3.2137 3.2137 3.3420 3.3420 3.6560 3.6560 3.8961 3.8961 4.3913 4.3913 4.9564 4.9564 4.9764 4.9764 5.5826 5.5826 5.8392 5.8392 9.5004 9.5004 9.8860 9.8860 11.4484 11.4484 11.9273 11.9273 12.3433 12.3433 12.7825 12.7825 k = 0.0926 0.0926-0.0000 ( 5349 PWs) bands (ev): -15.8778 -15.8778 -15.5370 -15.5370 -10.8569 -10.8569 -10.8455 -10.8455 -10.8419 -10.8419 -10.7858 -10.7858 -8.3266 -8.3266 -8.3111 -8.3111 -8.2982 -8.2982 -8.2783 -8.2783 -8.2518 -8.2518 -8.2065 -8.2065 -7.5398 -7.5398 -7.0595 -7.0595 -0.9548 -0.9548 0.2301 0.2301 1.8579 1.8579 2.0177 2.0177 2.9108 2.9108 3.2315 3.2315 3.3411 3.3411 3.6793 3.6793 3.9054 3.9054 4.4097 4.4097 4.9299 4.9299 4.9525 4.9525 5.5481 5.5481 5.8359 5.8359 9.4821 9.4821 9.8864 9.8864 11.5028 11.5028 11.9594 11.9594 12.3744 12.3744 12.8174 12.8174 k = 0.0833 0.0833-0.0000 ( 5347 PWs) bands (ev): -15.8808 -15.8808 -15.5343 -15.5343 -10.8572 -10.8572 -10.8457 -10.8457 -10.8423 -10.8423 -10.7859 -10.7859 -8.3268 -8.3268 -8.3116 -8.3116 -8.2990 -8.2990 -8.2775 -8.2775 -8.2514 -8.2514 -8.2068 -8.2068 -7.5500 -7.5500 -7.0620 -7.0620 -0.9439 -0.9439 0.2608 0.2608 1.8561 1.8561 2.0048 2.0048 2.9302 2.9302 3.2439 3.2439 3.3413 3.3413 3.7031 3.7031 3.9196 3.9196 4.4254 4.4254 4.8872 4.8872 4.9456 4.9456 5.5113 5.5113 5.8348 5.8348 9.4646 9.4646 9.8849 9.8849 11.5593 11.5593 11.9875 11.9875 12.4107 12.4107 12.8399 12.8399 k = 0.0741 0.0741-0.0000 ( 5351 PWs) bands (ev): -15.8835 -15.8835 -15.5319 -15.5319 -10.8574 -10.8574 -10.8459 -10.8459 -10.8427 -10.8427 -10.7860 -10.7860 -8.3268 -8.3268 -8.3122 -8.3122 -8.2998 -8.2998 -8.2769 -8.2769 -8.2510 -8.2510 -8.2071 -8.2071 -7.5592 -7.5592 -7.0643 -7.0643 -0.9336 -0.9336 0.2891 0.2891 1.8534 1.8534 1.9940 1.9940 2.9479 2.9479 3.2516 3.2516 3.3425 3.3425 3.7270 3.7270 3.9383 3.9383 4.4378 4.4378 4.8485 4.8485 4.9360 4.9360 5.4742 5.4742 5.8351 5.8351 9.4482 9.4482 9.8820 9.8820 11.6158 11.6158 12.0115 12.0115 12.4517 12.4517 12.8495 12.8495 k = 0.0648 0.0648-0.0000 ( 5349 PWs) bands (ev): -15.8859 -15.8859 -15.5297 -15.5297 -10.8576 -10.8576 -10.8461 -10.8461 -10.8431 -10.8431 -10.7860 -10.7860 -8.3268 -8.3268 -8.3127 -8.3127 -8.3005 -8.3005 -8.2764 -8.2764 -8.2506 -8.2506 -8.2074 -8.2074 -7.5673 -7.5673 -7.0663 -7.0663 -0.9241 -0.9241 0.3148 0.3148 1.8500 1.8500 1.9851 1.9851 2.9640 2.9640 3.2556 3.2556 3.3441 3.3441 3.7505 3.7505 3.9601 3.9601 4.4468 4.4468 4.8148 4.8148 4.9234 4.9234 5.4388 5.4388 5.8361 5.8361 9.4330 9.4330 9.8784 9.8784 11.6704 11.6704 12.0317 12.0317 12.4960 12.4960 12.8472 12.8472 k = 0.0556 0.0556-0.0000 ( 5341 PWs) bands (ev): -15.8880 -15.8880 -15.5278 -15.5278 -10.8578 -10.8578 -10.8462 -10.8462 -10.8434 -10.8434 -10.7861 -10.7861 -8.3267 -8.3267 -8.3132 -8.3132 -8.3011 -8.3011 -8.2759 -8.2759 -8.2502 -8.2502 -8.2077 -8.2077 -7.5745 -7.5745 -7.0681 -7.0681 -0.9154 -0.9154 0.3377 0.3377 1.8462 1.8462 1.9779 1.9779 2.9784 2.9784 3.2569 3.2569 3.3457 3.3457 3.7732 3.7732 3.9839 3.9839 4.4523 4.4523 4.7866 4.7866 4.9080 4.9080 5.4066 5.4066 5.8375 5.8375 9.4193 9.4193 9.8743 9.8743 11.7216 11.7216 12.0486 12.0486 12.5419 12.5419 12.8357 12.8357 k = 0.0463 0.0463-0.0000 ( 5333 PWs) bands (ev): -15.8898 -15.8898 -15.5262 -15.5262 -10.8579 -10.8579 -10.8463 -10.8463 -10.8437 -10.8437 -10.7861 -10.7861 -8.3265 -8.3265 -8.3136 -8.3136 -8.3017 -8.3017 -8.2756 -8.2756 -8.2498 -8.2498 -8.2079 -8.2079 -7.5806 -7.5806 -7.0696 -7.0696 -0.9078 -0.9078 0.3574 0.3574 1.8423 1.8423 1.9722 1.9722 2.9908 2.9908 3.2566 3.2566 3.3469 3.3469 3.7946 3.7946 4.0080 4.0080 4.4547 4.4547 4.7643 4.7643 4.8902 4.8902 5.3788 5.3788 5.8390 5.8390 9.4073 9.4073 9.8703 9.8703 11.7677 11.7677 12.0625 12.0625 12.5869 12.5869 12.8183 12.8183 k = 0.0370 0.0370-0.0000 ( 5331 PWs) bands (ev): -15.8913 -15.8913 -15.5249 -15.5249 -10.8580 -10.8580 -10.8464 -10.8464 -10.8440 -10.8440 -10.7862 -10.7862 -8.3263 -8.3263 -8.3140 -8.3140 -8.3022 -8.3022 -8.2753 -8.2753 -8.2495 -8.2495 -8.2081 -8.2081 -7.5856 -7.5856 -7.0709 -7.0709 -0.9014 -0.9014 0.3739 0.3739 1.8388 1.8388 1.9678 1.9678 3.0013 3.0013 3.2555 3.2555 3.3478 3.3478 3.8138 3.8138 4.0308 4.0308 4.4546 4.4546 4.7477 4.7477 4.8714 4.8714 5.3559 5.3559 5.8405 5.8405 9.3973 9.3973 9.8666 9.8666 11.8075 11.8075 12.0737 12.0737 12.6288 12.6288 12.7987 12.7987 k = 0.0278 0.0278-0.0000 ( 5327 PWs) bands (ev): -15.8924 -15.8924 -15.5239 -15.5239 -10.8581 -10.8581 -10.8465 -10.8465 -10.8441 -10.8441 -10.7862 -10.7862 -8.3261 -8.3261 -8.3144 -8.3144 -8.3026 -8.3026 -8.2752 -8.2752 -8.2493 -8.2493 -8.2083 -8.2083 -7.5895 -7.5895 -7.0718 -7.0718 -0.8963 -0.8963 0.3869 0.3869 1.8357 1.8357 1.9646 1.9646 3.0095 3.0095 3.2541 3.2541 3.3483 3.3483 3.8302 3.8302 4.0504 4.0504 4.4533 4.4533 4.7364 4.7364 4.8531 4.8531 5.3384 5.3384 5.8417 5.8417 9.3893 9.3893 9.8635 9.8635 11.8398 11.8398 12.0825 12.0825 12.6647 12.6647 12.7799 12.7799 k = 0.0185 0.0185-0.0000 ( 5321 PWs) bands (ev): -15.8932 -15.8932 -15.5231 -15.5231 -10.8582 -10.8582 -10.8465 -10.8465 -10.8443 -10.8443 -10.7862 -10.7862 -8.3259 -8.3259 -8.3147 -8.3147 -8.3029 -8.3029 -8.2750 -8.2750 -8.2491 -8.2491 -8.2084 -8.2084 -7.5923 -7.5923 -7.0725 -7.0725 -0.8926 -0.8926 0.3963 0.3963 1.8334 1.8334 1.9624 1.9624 3.0156 3.0156 3.2528 3.2528 3.3485 3.3485 3.8427 3.8427 4.0654 4.0654 4.4518 4.4518 4.7293 4.7293 4.8375 4.8375 5.3261 5.3261 5.8426 5.8426 9.3835 9.3835 9.8611 9.8611 11.8637 11.8637 12.0889 12.0889 12.6923 12.6923 12.7647 12.7647 k = 0.0093 0.0093-0.0000 ( 5325 PWs) bands (ev): -15.8937 -15.8937 -15.5227 -15.5227 -10.8582 -10.8582 -10.8466 -10.8466 -10.8444 -10.8444 -10.7863 -10.7863 -8.3258 -8.3258 -8.3149 -8.3149 -8.3031 -8.3031 -8.2749 -8.2749 -8.2490 -8.2490 -8.2085 -8.2085 -7.5939 -7.5939 -7.0729 -7.0729 -0.8904 -0.8904 0.4020 0.4020 1.8320 1.8320 1.9611 1.9611 3.0192 3.0192 3.2519 3.2519 3.3486 3.3486 3.8506 3.8506 4.0748 4.0748 4.4507 4.4507 4.7255 4.7255 4.8269 4.8269 5.3188 5.3188 5.8432 5.8432 9.3800 9.3800 9.8596 9.8596 11.8784 11.8784 12.0927 12.0927 12.7095 12.7095 12.7549 12.7549 k = 0.0000 0.0000 0.0000 ( 5337 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8582 -10.8582 -10.8466 -10.8466 -10.8444 -10.8444 -10.7863 -10.7863 -8.3257 -8.3257 -8.3149 -8.3149 -8.3031 -8.3031 -8.2749 -8.2749 -8.2490 -8.2490 -8.2086 -8.2086 -7.5945 -7.5945 -7.0731 -7.0731 -0.8896 -0.8896 0.4039 0.4039 1.8315 1.8315 1.9607 1.9607 3.0205 3.0205 3.2516 3.2516 3.3486 3.3486 3.8533 3.8533 4.0780 4.0780 4.4503 4.4503 4.7243 4.7243 4.8232 4.8232 5.3164 5.3164 5.8434 5.8434 9.3788 9.3788 9.8591 9.8591 11.8833 11.8833 12.0940 12.0940 12.7153 12.7153 12.7517 12.7517 k = 0.0000 0.0000 0.0000 ( 5337 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8582 -10.8582 -10.8466 -10.8466 -10.8444 -10.8444 -10.7863 -10.7863 -8.3257 -8.3257 -8.3149 -8.3149 -8.3031 -8.3031 -8.2749 -8.2749 -8.2490 -8.2490 -8.2086 -8.2086 -7.5945 -7.5945 -7.0731 -7.0731 -0.8896 -0.8896 0.4039 0.4039 1.8315 1.8315 1.9607 1.9607 3.0205 3.0205 3.2516 3.2516 3.3486 3.3486 3.8533 3.8533 4.0780 4.0780 4.4503 4.4503 4.7243 4.7243 4.8232 4.8232 5.3164 5.3164 5.8434 5.8434 9.3788 9.3788 9.8591 9.8591 11.8833 11.8833 12.0940 12.0940 12.7153 12.7153 12.7517 12.7517 k = 0.0000 0.0000 0.0131 ( 5337 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8582 -10.8582 -10.8466 -10.8466 -10.8444 -10.8444 -10.7863 -10.7863 -8.3257 -8.3257 -8.3149 -8.3149 -8.3031 -8.3031 -8.2749 -8.2749 -8.2490 -8.2490 -8.2086 -8.2086 -7.5946 -7.5946 -7.0731 -7.0731 -0.8886 -0.8886 0.4020 0.4020 1.8316 1.8316 1.9608 1.9608 3.0205 3.0205 3.2516 3.2516 3.3485 3.3485 3.8513 3.8513 4.0807 4.0807 4.4495 4.4495 4.7230 4.7230 4.8251 4.8251 5.3177 5.3177 5.8452 5.8452 9.3713 9.3713 9.8609 9.8609 11.8816 11.8816 12.0937 12.0937 12.7161 12.7161 12.7526 12.7526 k = 0.0000 0.0000 0.0262 ( 5321 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8582 -10.8582 -10.8465 -10.8465 -10.8444 -10.8444 -10.7863 -10.7863 -8.3256 -8.3256 -8.3149 -8.3149 -8.3032 -8.3032 -8.2749 -8.2749 -8.2490 -8.2490 -8.2086 -8.2086 -7.5948 -7.5948 -7.0729 -7.0729 -0.8854 -0.8854 0.3963 0.3963 1.8321 1.8321 1.9611 1.9611 3.0205 3.0205 3.2516 3.2516 3.3485 3.3485 3.8454 3.8454 4.0883 4.0883 4.4474 4.4474 4.7190 4.7190 4.8309 4.8309 5.3216 5.3216 5.8505 5.8505 9.3494 9.3494 9.8656 9.8656 11.8764 11.8764 12.0925 12.0925 12.7183 12.7183 12.7553 12.7553 k = 0.0000 0.0000 0.0393 ( 5329 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8583 -10.8583 -10.8465 -10.8465 -10.8444 -10.8444 -10.7863 -10.7863 -8.3256 -8.3256 -8.3149 -8.3149 -8.3032 -8.3032 -8.2749 -8.2749 -8.2490 -8.2490 -8.2086 -8.2086 -7.5952 -7.5952 -7.0728 -7.0728 -0.8802 -0.8802 0.3870 0.3870 1.8329 1.8329 1.9617 1.9617 3.0204 3.0204 3.2515 3.2515 3.3485 3.3485 3.8364 3.8364 4.0997 4.0997 4.4446 4.4446 4.7126 4.7126 4.8400 4.8400 5.3279 5.3279 5.8591 5.8591 9.3149 9.3149 9.8720 9.8720 11.8683 11.8683 12.0902 12.0902 12.7220 12.7220 12.7597 12.7597 k = 0.0000 0.0000 0.0524 ( 5325 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8583 -10.8583 -10.8464 -10.8464 -10.8444 -10.8444 -10.7863 -10.7863 -8.3254 -8.3254 -8.3148 -8.3148 -8.3032 -8.3032 -8.2749 -8.2749 -8.2491 -8.2491 -8.2086 -8.2086 -7.5957 -7.5957 -7.0725 -7.0725 -0.8729 -0.8729 0.3741 0.3741 1.8340 1.8340 1.9625 1.9625 3.0204 3.0204 3.2514 3.2514 3.3484 3.3484 3.8253 3.8253 4.1134 4.1134 4.4421 4.4421 4.7041 4.7041 4.8521 4.8521 5.3362 5.3362 5.8710 5.8710 9.2700 9.2700 9.8784 9.8784 11.8580 11.8580 12.0862 12.0862 12.7272 12.7272 12.7658 12.7658 k = 0.0000 0.0000 0.0656 ( 5325 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8584 -10.8584 -10.8463 -10.8463 -10.8444 -10.8444 -10.7863 -10.7863 -8.3253 -8.3253 -8.3148 -8.3148 -8.3033 -8.3033 -8.2749 -8.2749 -8.2492 -8.2492 -8.2086 -8.2086 -7.5963 -7.5963 -7.0722 -7.0722 -0.8636 -0.8636 0.3579 0.3579 1.8354 1.8354 1.9636 1.9636 3.0204 3.0204 3.2512 3.2512 3.3484 3.3484 3.8127 3.8127 4.1278 4.1278 4.4412 4.4412 4.6937 4.6937 4.8664 4.8664 5.3464 5.3464 5.8857 5.8857 9.2169 9.2169 9.8835 9.8835 11.8460 11.8460 12.0801 12.0801 12.7338 12.7338 12.7736 12.7736 k = 0.0000 0.0000 0.0787 ( 5324 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8585 -10.8585 -10.8462 -10.8462 -10.8444 -10.8444 -10.7863 -10.7863 -8.3251 -8.3251 -8.3147 -8.3147 -8.3033 -8.3033 -8.2749 -8.2749 -8.2493 -8.2493 -8.2086 -8.2086 -7.5971 -7.5971 -7.0719 -7.0719 -0.8525 -0.8525 0.3386 0.3386 1.8370 1.8370 1.9648 1.9648 3.0204 3.0204 3.2510 3.2510 3.3483 3.3483 3.7993 3.7993 4.1412 4.1412 4.4433 4.4433 4.6819 4.6819 4.8823 4.8823 5.3580 5.3580 5.9031 5.9031 9.1577 9.1577 9.8863 9.8863 11.8332 11.8332 12.0716 12.0716 12.7419 12.7419 12.7829 12.7829 k = 0.0000 0.0000 0.0918 ( 5332 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8586 -10.8586 -10.8461 -10.8461 -10.8444 -10.8444 -10.7863 -10.7863 -8.3249 -8.3249 -8.3146 -8.3146 -8.3034 -8.3034 -8.2748 -8.2748 -8.2494 -8.2494 -8.2086 -8.2086 -7.5979 -7.5979 -7.0715 -7.0715 -0.8395 -0.8395 0.3166 0.3166 1.8388 1.8388 1.9661 1.9661 3.0203 3.0203 3.2508 3.2508 3.3482 3.3482 3.7856 3.7856 4.1520 4.1520 4.4499 4.4499 4.6690 4.6690 4.8993 4.8993 5.3705 5.3705 5.9228 5.9228 9.0940 9.0940 9.8863 9.8863 11.8200 11.8200 12.0606 12.0606 12.7513 12.7513 12.7935 12.7935 k = 0.0000 0.0000 0.1049 ( 5324 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8587 -10.8587 -10.8459 -10.8459 -10.8443 -10.8443 -10.7863 -10.7863 -8.3246 -8.3246 -8.3146 -8.3146 -8.3035 -8.3035 -8.2748 -8.2748 -8.2495 -8.2495 -8.2086 -8.2086 -7.5988 -7.5988 -7.0711 -7.0711 -0.8248 -0.8248 0.2922 0.2922 1.8408 1.8408 1.9676 1.9676 3.0203 3.0203 3.2505 3.2505 3.3481 3.3481 3.7718 3.7718 4.1593 4.1593 4.4617 4.4617 4.6555 4.6555 4.9169 4.9169 5.3837 5.3837 5.9442 5.9442 9.0275 9.0275 9.8833 9.8833 11.8071 11.8071 12.0472 12.0472 12.7621 12.7621 12.8054 12.8054 k = 0.0000 0.0000 0.1180 ( 5328 PWs) bands (ev): -15.8939 -15.8939 -15.5225 -15.5225 -10.8588 -10.8588 -10.8458 -10.8458 -10.8444 -10.8444 -10.7864 -10.7864 -8.3243 -8.3243 -8.3145 -8.3145 -8.3036 -8.3036 -8.2748 -8.2748 -8.2496 -8.2496 -8.2086 -8.2086 -7.5998 -7.5998 -7.0707 -7.0707 -0.8087 -0.8087 0.2658 0.2658 1.8430 1.8430 1.9692 1.9692 3.0203 3.0203 3.2502 3.2502 3.3479 3.3479 3.7582 3.7582 4.1625 4.1625 4.4791 4.4791 4.6417 4.6417 4.9346 4.9346 5.3972 5.3972 5.9669 5.9669 8.9597 8.9597 9.8772 9.8772 11.7949 11.7949 12.0315 12.0315 12.7741 12.7741 12.8182 12.8182 k = 0.0000 0.0000 0.1311 ( 5340 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8589 -10.8589 -10.8457 -10.8457 -10.8444 -10.8444 -10.7864 -10.7864 -8.3240 -8.3240 -8.3144 -8.3144 -8.3037 -8.3037 -8.2748 -8.2748 -8.2497 -8.2497 -8.2086 -8.2086 -7.6007 -7.6007 -7.0702 -7.0702 -0.7912 -0.7912 0.2379 0.2379 1.8452 1.8452 1.9708 1.9708 3.0202 3.0202 3.2498 3.2498 3.3478 3.3478 3.7451 3.7451 4.1620 4.1620 4.5014 4.5014 4.6279 4.6279 4.9521 4.9521 5.4107 5.4107 5.9905 5.9905 8.8917 8.8917 9.8684 9.8684 11.7839 11.7839 12.0140 12.0140 12.7873 12.7873 12.8319 12.8319 k = 0.0000 0.0000 0.1442 ( 5348 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8590 -10.8590 -10.8455 -10.8455 -10.8443 -10.8443 -10.7864 -10.7864 -8.3237 -8.3237 -8.3143 -8.3143 -8.3039 -8.3039 -8.2748 -8.2748 -8.2499 -8.2499 -8.2086 -8.2086 -7.6017 -7.6017 -7.0697 -7.0697 -0.7727 -0.7727 0.2089 0.2089 1.8474 1.8474 1.9725 1.9725 3.0202 3.0202 3.2495 3.2495 3.3477 3.3477 3.7326 3.7326 4.1585 4.1585 4.5274 4.5274 4.6143 4.6143 4.9689 4.9689 5.4239 5.4239 6.0144 6.0144 8.8249 8.8249 9.8572 9.8572 11.7745 11.7745 11.9950 11.9950 12.8017 12.8017 12.8462 12.8462 k = 0.0000 0.0000 0.1573 ( 5344 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8591 -10.8591 -10.8454 -10.8454 -10.8443 -10.8443 -10.7864 -10.7864 -8.3234 -8.3234 -8.3142 -8.3142 -8.3040 -8.3040 -8.2747 -8.2747 -8.2500 -8.2500 -8.2086 -8.2086 -7.6027 -7.6027 -7.0693 -7.0693 -0.7533 -0.7533 0.1794 0.1794 1.8497 1.8497 1.9741 1.9741 3.0202 3.0202 3.2491 3.2491 3.3475 3.3475 3.7209 3.7209 4.1530 4.1530 4.5559 4.5559 4.6013 4.6013 4.9848 4.9848 5.4365 5.4365 6.0380 6.0380 8.7604 8.7604 9.8441 9.8441 11.7669 11.7669 11.9748 11.9748 12.8170 12.8170 12.8607 12.8607 k = 0.0000 0.0000 0.1705 ( 5340 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8591 -10.8591 -10.8453 -10.8453 -10.8443 -10.8443 -10.7864 -10.7864 -8.3231 -8.3231 -8.3141 -8.3141 -8.3042 -8.3042 -8.2747 -8.2747 -8.2501 -8.2501 -8.2086 -8.2086 -7.6037 -7.6037 -7.0689 -7.0689 -0.7335 -0.7335 0.1498 0.1498 1.8519 1.8519 1.9757 1.9757 3.0201 3.0201 3.2487 3.2487 3.3474 3.3474 3.7101 3.7101 4.1463 4.1463 4.5855 4.5855 4.5891 4.5891 4.9995 4.9995 5.4484 5.4484 6.0609 6.0609 8.6993 8.6993 9.8298 9.8298 11.7613 11.7613 11.9540 11.9540 12.8332 12.8332 12.8751 12.8751 k = 0.0000 0.0000 0.1836 ( 5332 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8592 -10.8592 -10.8451 -10.8451 -10.8443 -10.8443 -10.7864 -10.7864 -8.3227 -8.3227 -8.3141 -8.3141 -8.3043 -8.3043 -8.2746 -8.2746 -8.2502 -8.2502 -8.2086 -8.2086 -7.6046 -7.6046 -7.0685 -7.0685 -0.7137 -0.7137 0.1209 0.1209 1.8539 1.8539 1.9772 1.9772 3.0201 3.0201 3.2484 3.2484 3.3473 3.3473 3.7002 3.7002 4.1391 4.1391 4.5779 4.5779 4.6150 4.6150 5.0129 5.0129 5.4593 5.4593 6.0825 6.0825 8.6426 8.6426 9.8149 9.8149 11.7581 11.7581 11.9328 11.9328 12.8501 12.8501 12.8892 12.8892 k = 0.0000 0.0000 0.1967 ( 5312 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8593 -10.8593 -10.8450 -10.8450 -10.8443 -10.8443 -10.7864 -10.7864 -8.3224 -8.3224 -8.3140 -8.3140 -8.3045 -8.3045 -8.2746 -8.2746 -8.2503 -8.2503 -8.2085 -8.2085 -7.6054 -7.6054 -7.0681 -7.0681 -0.6943 -0.6943 0.0933 0.0933 1.8558 1.8558 1.9786 1.9786 3.0201 3.0201 3.2480 3.2480 3.3472 3.3472 3.6915 3.6915 4.1319 4.1319 4.5679 4.5679 4.6432 4.6432 5.0247 5.0247 5.4690 5.4690 6.1023 6.1023 8.5914 8.5914 9.8001 9.8001 11.7572 11.7572 11.9117 11.9117 12.8673 12.8673 12.9024 12.9024 k = 0.0000 0.0000 0.2098 ( 5320 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8593 -10.8593 -10.8449 -10.8449 -10.8442 -10.8442 -10.7865 -10.7865 -8.3221 -8.3221 -8.3139 -8.3139 -8.3047 -8.3047 -8.2746 -8.2746 -8.2504 -8.2504 -8.2085 -8.2085 -7.6061 -7.6061 -7.0677 -7.0677 -0.6761 -0.6761 0.0677 0.0677 1.8575 1.8575 1.9799 1.9799 3.0201 3.0201 3.2477 3.2477 3.3471 3.3471 3.6840 3.6840 4.1253 4.1253 4.5591 4.5591 4.6690 4.6690 5.0348 5.0348 5.4775 5.4775 6.1199 6.1199 8.5464 8.5464 9.7862 9.7862 11.7586 11.7586 11.8910 11.8910 12.8845 12.8845 12.9145 12.9145 k = 0.0000 0.0000 0.2229 ( 5320 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8594 -10.8594 -10.8448 -10.8448 -10.8442 -10.8442 -10.7865 -10.7865 -8.3218 -8.3218 -8.3139 -8.3139 -8.3048 -8.3048 -8.2746 -8.2746 -8.2505 -8.2505 -8.2085 -8.2085 -7.6067 -7.6067 -7.0675 -7.0675 -0.6595 -0.6595 0.0450 0.0450 1.8590 1.8590 1.9809 1.9809 3.0201 3.0201 3.2475 3.2475 3.3470 3.3470 3.6777 3.6777 4.1195 4.1195 4.5518 4.5518 4.6915 4.6915 5.0432 5.0432 5.4846 5.4846 6.1349 6.1349 8.5084 8.5084 9.7737 9.7737 11.7625 11.7625 11.8711 11.8711 12.9012 12.9012 12.9250 12.9250 k = 0.0000 0.0000 0.2360 ( 5324 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8594 -10.8594 -10.8448 -10.8448 -10.8442 -10.8442 -10.7865 -10.7865 -8.3216 -8.3216 -8.3138 -8.3138 -8.3049 -8.3049 -8.2745 -8.2745 -8.2505 -8.2505 -8.2085 -8.2085 -7.6072 -7.6072 -7.0672 -7.0672 -0.6455 -0.6455 0.0261 0.0261 1.8601 1.8601 1.9818 1.9818 3.0200 3.0200 3.2472 3.2472 3.3469 3.3469 3.6728 3.6728 4.1147 4.1147 4.5460 4.5460 4.7100 4.7100 5.0497 5.0497 5.4902 5.4902 6.1469 6.1469 8.4781 8.4781 9.7633 9.7633 11.7687 11.7687 11.8522 11.8522 12.9166 12.9166 12.9336 12.9336 k = 0.0000 0.0000 0.2491 ( 5312 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8595 -10.8595 -10.8447 -10.8447 -10.8442 -10.8442 -10.7865 -10.7865 -8.3214 -8.3214 -8.3138 -8.3138 -8.3050 -8.3050 -8.2745 -8.2745 -8.2506 -8.2506 -8.2085 -8.2085 -7.6076 -7.6076 -7.0671 -7.0671 -0.6348 -0.6348 0.0118 0.0118 1.8610 1.8610 1.9824 1.9824 3.0200 3.0200 3.2471 3.2471 3.3469 3.3469 3.6692 3.6692 4.1112 4.1112 4.5418 4.5418 4.7237 4.7237 5.0544 5.0544 5.4943 5.4943 6.1557 6.1557 8.4561 8.4561 9.7555 9.7555 11.7769 11.7769 11.8348 11.8348 12.9295 12.9295 12.9399 12.9399 k = 0.0000 0.0000 0.2622 ( 5304 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8595 -10.8595 -10.8447 -10.8447 -10.8442 -10.8442 -10.7865 -10.7865 -8.3213 -8.3213 -8.3137 -8.3137 -8.3051 -8.3051 -8.2745 -8.2745 -8.2506 -8.2506 -8.2085 -8.2085 -7.6078 -7.6078 -7.0670 -7.0670 -0.6280 -0.6280 0.0029 0.0029 1.8615 1.8615 1.9828 1.9828 3.0200 3.0200 3.2470 3.2470 3.3469 3.3469 3.6671 3.6671 4.1091 4.1091 4.5393 4.5393 4.7321 4.7321 5.0572 5.0572 5.4967 5.4967 6.1611 6.1611 8.4427 8.4427 9.7507 9.7507 11.7866 11.7866 11.8195 11.8195 12.9384 12.9384 12.9437 12.9437 k = 0.0000 0.0000 0.2754 ( 5304 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8595 -10.8595 -10.8447 -10.8447 -10.8442 -10.8442 -10.7865 -10.7865 -8.3213 -8.3213 -8.3137 -8.3137 -8.3051 -8.3051 -8.2745 -8.2745 -8.2506 -8.2506 -8.2085 -8.2085 -7.6079 -7.6079 -7.0670 -7.0670 -0.6257 -0.6257 -0.0001 -0.0001 1.8617 1.8617 1.9829 1.9829 3.0200 3.0200 3.2469 3.2469 3.3469 3.3469 3.6664 3.6664 4.1083 4.1083 4.5384 4.5384 4.7349 4.7349 5.0581 5.0581 5.4976 5.4976 6.1629 6.1629 8.4383 8.4383 9.7490 9.7490 11.7933 11.7933 11.8110 11.8110 12.9417 12.9417 12.9449 12.9449 k = 0.0000 0.0000 0.2754 ( 5304 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8595 -10.8595 -10.8447 -10.8447 -10.8442 -10.8442 -10.7865 -10.7865 -8.3213 -8.3213 -8.3137 -8.3137 -8.3051 -8.3051 -8.2745 -8.2745 -8.2506 -8.2506 -8.2085 -8.2085 -7.6079 -7.6079 -7.0670 -7.0670 -0.6257 -0.6257 -0.0001 -0.0001 1.8617 1.8617 1.9829 1.9829 3.0200 3.0200 3.2469 3.2469 3.3469 3.3469 3.6664 3.6664 4.1083 4.1083 4.5384 4.5384 4.7349 4.7349 5.0581 5.0581 5.4976 5.4976 6.1629 6.1629 8.4383 8.4383 9.7490 9.7490 11.7933 11.7933 11.8110 11.8110 12.9417 12.9417 12.9449 12.9449 k = 0.0000 0.0132 0.2754 ( 5308 PWs) bands (ev): -15.8936 -15.8936 -15.5227 -15.5227 -10.8595 -10.8595 -10.8447 -10.8447 -10.8441 -10.8441 -10.7865 -10.7865 -8.3214 -8.3214 -8.3138 -8.3138 -8.3049 -8.3049 -8.2745 -8.2745 -8.2506 -8.2506 -8.2085 -8.2085 -7.6073 -7.6073 -7.0668 -7.0668 -0.6264 -0.6264 -0.0019 -0.0019 1.8619 1.8619 1.9831 1.9831 3.0185 3.0185 3.2471 3.2471 3.3467 3.3467 3.6651 3.6651 4.1090 4.1090 4.5391 4.5391 4.7351 4.7351 5.0591 5.0591 5.4983 5.4983 6.1615 6.1615 8.4410 8.4410 9.7497 9.7497 11.7706 11.7706 11.8284 11.8284 12.9225 12.9225 12.9657 12.9657 k = 0.0000 0.0263 0.2754 ( 5312 PWs) bands (ev): -15.8931 -15.8931 -15.5231 -15.5231 -10.8594 -10.8594 -10.8449 -10.8449 -10.8439 -10.8439 -10.7864 -10.7864 -8.3216 -8.3216 -8.3138 -8.3138 -8.3045 -8.3045 -8.2746 -8.2746 -8.2506 -8.2506 -8.2084 -8.2084 -7.6057 -7.6057 -7.0664 -7.0664 -0.6285 -0.6285 -0.0072 -0.0072 1.8627 1.8627 1.9839 1.9839 3.0142 3.0142 3.2477 3.2477 3.3461 3.3461 3.6613 3.6613 4.1110 4.1110 4.5412 4.5412 4.7355 4.7355 5.0621 5.0621 5.5005 5.5005 6.1574 6.1574 8.4493 8.4493 9.7516 9.7516 11.7357 11.7357 11.8476 11.8476 12.9020 12.9020 12.9908 12.9908 k = 0.0000 0.0395 0.2754 ( 5316 PWs) bands (ev): -15.8923 -15.8923 -15.5239 -15.5239 -10.8594 -10.8594 -10.8450 -10.8450 -10.8435 -10.8435 -10.7864 -10.7864 -8.3220 -8.3220 -8.3139 -8.3139 -8.3038 -8.3038 -8.2748 -8.2748 -8.2505 -8.2505 -8.2083 -8.2083 -7.6031 -7.6031 -7.0657 -7.0657 -0.6320 -0.6320 -0.0160 -0.0160 1.8640 1.8640 1.9851 1.9851 3.0072 3.0072 3.2482 3.2482 3.3451 3.3451 3.6550 3.6550 4.1144 4.1144 4.5447 4.5447 4.7363 4.7363 5.0671 5.0671 5.5043 5.5043 6.1507 6.1507 8.4630 8.4630 9.7546 9.7546 11.6951 11.6951 11.8625 11.8625 12.8806 12.8806 13.0200 13.0200 k = 0.0000 0.0526 0.2754 ( 5320 PWs) bands (ev): -15.8911 -15.8911 -15.5249 -15.5249 -10.8593 -10.8593 -10.8451 -10.8451 -10.8432 -10.8432 -10.7864 -10.7864 -8.3224 -8.3224 -8.3139 -8.3139 -8.3029 -8.3029 -8.2750 -8.2750 -8.2505 -8.2505 -8.2081 -8.2081 -7.5994 -7.5994 -7.0647 -7.0647 -0.6369 -0.6369 -0.0283 -0.0283 1.8657 1.8657 1.9870 1.9870 2.9981 2.9981 3.2482 3.2482 3.3435 3.3435 3.6461 3.6461 4.1194 4.1194 4.5498 4.5498 4.7374 4.7374 5.0738 5.0738 5.5096 5.5096 6.1414 6.1414 8.4820 8.4820 9.7587 9.7587 11.6490 11.6490 11.8731 11.8731 12.8573 12.8573 13.0325 13.0325 k = 0.0000 0.0658 0.2754 ( 5324 PWs) bands (ev): -15.8896 -15.8896 -15.5263 -15.5263 -10.8592 -10.8592 -10.8452 -10.8452 -10.8427 -10.8427 -10.7863 -10.7863 -8.3229 -8.3229 -8.3139 -8.3139 -8.3019 -8.3019 -8.2752 -8.2752 -8.2505 -8.2505 -8.2079 -8.2079 -7.5946 -7.5946 -7.0634 -7.0634 -0.6432 -0.6432 -0.0438 -0.0438 1.8679 1.8679 1.9897 1.9897 2.9871 2.9871 3.2473 3.2473 3.3412 3.3412 3.6348 3.6348 4.1262 4.1262 4.5565 4.5565 4.7389 4.7389 5.0821 5.0821 5.5165 5.5165 6.1295 6.1295 8.5059 8.5059 9.7635 9.7635 11.5980 11.5980 11.8795 11.8795 12.8314 12.8314 12.9871 12.9871 k = 0.0000 0.0789 0.2754 ( 5320 PWs) bands (ev): -15.8878 -15.8878 -15.5279 -15.5279 -10.8591 -10.8591 -10.8453 -10.8453 -10.8423 -10.8423 -10.7862 -10.7862 -8.3234 -8.3234 -8.3138 -8.3138 -8.3009 -8.3009 -8.2754 -8.2754 -8.2504 -8.2504 -8.2076 -8.2076 -7.5889 -7.5889 -7.0619 -7.0619 -0.6507 -0.6507 -0.0624 -0.0624 1.8704 1.8704 1.9932 1.9932 2.9747 2.9747 3.2451 3.2451 3.3380 3.3380 3.6210 3.6210 4.1350 4.1350 4.5651 4.5651 4.7408 4.7408 5.0919 5.0919 5.5250 5.5250 6.1152 6.1152 8.5344 8.5344 9.7689 9.7689 11.5423 11.5423 11.8821 11.8821 12.8021 12.8021 12.9363 12.9363 k = 0.0000 0.0921 0.2754 ( 5320 PWs) bands (ev): -15.8857 -15.8857 -15.5299 -15.5299 -10.8590 -10.8590 -10.8453 -10.8453 -10.8417 -10.8417 -10.7861 -10.7861 -8.3238 -8.3238 -8.3137 -8.3137 -8.2999 -8.2999 -8.2755 -8.2755 -8.2504 -8.2504 -8.2073 -8.2073 -7.5821 -7.5821 -7.0603 -7.0603 -0.6595 -0.6595 -0.0840 -0.0840 1.8732 1.8732 1.9977 1.9977 2.9613 2.9613 3.2414 3.2414 3.3336 3.3336 3.6048 3.6048 4.1461 4.1461 4.5755 4.5755 4.7432 4.7432 5.1028 5.1028 5.5353 5.5353 6.0985 6.0985 8.5673 8.5673 9.7746 9.7746 11.4824 11.4824 11.8810 11.8810 12.7690 12.7690 12.8819 12.8819 k = 0.0000 0.1053 0.2754 ( 5318 PWs) bands (ev): -15.8832 -15.8832 -15.5321 -15.5321 -10.8588 -10.8588 -10.8454 -10.8454 -10.8411 -10.8411 -10.7860 -10.7860 -8.3242 -8.3242 -8.3136 -8.3136 -8.2989 -8.2989 -8.2756 -8.2756 -8.2504 -8.2504 -8.2070 -8.2070 -7.5744 -7.5744 -7.0584 -7.0584 -0.6696 -0.6696 -0.1084 -0.1084 1.8764 1.8764 2.0034 2.0034 2.9470 2.9470 3.2359 3.2359 3.3277 3.3277 3.5863 3.5863 4.1595 4.1595 4.5880 4.5880 4.7460 4.7460 5.1145 5.1145 5.5473 5.5473 6.0797 6.0797 8.6039 8.6039 9.7802 9.7802 11.4191 11.4191 11.8765 11.8765 12.7314 12.7314 12.8260 12.8260 k = 0.0000 0.1184 0.2754 ( 5320 PWs) bands (ev): -15.8804 -15.8804 -15.5346 -15.5346 -10.8586 -10.8586 -10.8454 -10.8454 -10.8404 -10.8404 -10.7859 -10.7859 -8.3245 -8.3245 -8.3134 -8.3134 -8.2980 -8.2980 -8.2756 -8.2756 -8.2505 -8.2505 -8.2067 -8.2067 -7.5657 -7.5657 -7.0564 -7.0564 -0.6808 -0.6808 -0.1354 -0.1354 1.8798 1.8798 2.0102 2.0102 2.9320 2.9320 3.2288 3.2288 3.3201 3.3201 3.5656 3.5656 4.1754 4.1754 4.6026 4.6026 4.7494 4.7494 5.1268 5.1268 5.5611 5.5611 6.0588 6.0588 8.6439 8.6439 9.7854 9.7854 11.3528 11.3528 11.8686 11.8686 12.6881 12.6881 12.7707 12.7707 k = 0.0000 0.1316 0.2754 ( 5320 PWs) bands (ev): -15.8773 -15.8773 -15.5374 -15.5374 -10.8585 -10.8585 -10.8455 -10.8455 -10.8397 -10.8397 -10.7858 -10.7858 -8.3246 -8.3246 -8.3132 -8.3132 -8.2971 -8.2971 -8.2755 -8.2755 -8.2505 -8.2505 -8.2063 -8.2063 -7.5561 -7.5561 -7.0542 -7.0542 -0.6931 -0.6931 -0.1646 -0.1646 1.8835 1.8835 2.0184 2.0184 2.9165 2.9165 3.2201 3.2201 3.3106 3.3106 3.5430 3.5430 4.1938 4.1938 4.6195 4.6195 4.7534 4.7534 5.1393 5.1393 5.5767 5.5767 6.0361 6.0361 8.6867 8.6867 9.7900 9.7900 11.2845 11.2845 11.8573 11.8573 12.6383 12.6383 12.7180 12.7180 k = 0.0000 0.1447 0.2754 ( 5318 PWs) bands (ev): -15.8740 -15.8740 -15.5405 -15.5405 -10.8582 -10.8582 -10.8455 -10.8455 -10.8389 -10.8389 -10.7857 -10.7857 -8.3247 -8.3247 -8.3130 -8.3130 -8.2964 -8.2964 -8.2752 -8.2752 -8.2506 -8.2506 -8.2061 -8.2061 -7.5457 -7.5457 -7.0520 -7.0520 -0.7064 -0.7064 -0.1960 -0.1960 1.8876 1.8876 2.0279 2.0279 2.9005 2.9005 3.2097 3.2097 3.2991 3.2991 3.5185 3.5185 4.2145 4.2145 4.6387 4.6387 4.7580 4.7580 5.1518 5.1518 5.5939 5.5939 6.0119 6.0119 8.7316 8.7316 9.7937 9.7937 11.2146 11.2146 11.8427 11.8427 12.5822 12.5822 12.6689 12.6689 k = 0.0000 0.1579 0.2754 ( 5316 PWs) bands (ev): -15.8703 -15.8703 -15.5438 -15.5438 -10.8580 -10.8580 -10.8456 -10.8456 -10.8380 -10.8380 -10.7856 -10.7856 -8.3247 -8.3247 -8.3128 -8.3128 -8.2958 -8.2958 -8.2748 -8.2748 -8.2507 -8.2507 -8.2058 -8.2058 -7.5344 -7.5344 -7.0497 -7.0497 -0.7206 -0.7206 -0.2292 -0.2292 1.8922 1.8922 2.0387 2.0387 2.8840 2.8840 3.1978 3.1978 3.2856 3.2856 3.4924 3.4924 4.2376 4.2376 4.6602 4.6602 4.7633 4.7633 5.1638 5.1638 5.6126 5.6126 5.9865 5.9865 8.7780 8.7780 9.7963 9.7963 11.1441 11.1441 11.8248 11.8248 12.5212 12.5212 12.6228 12.6228 k = 0.0000 0.1711 0.2754 ( 5316 PWs) bands (ev): -15.8663 -15.8663 -15.5475 -15.5475 -10.8578 -10.8578 -10.8456 -10.8456 -10.8371 -10.8371 -10.7855 -10.7855 -8.3246 -8.3246 -8.3125 -8.3125 -8.2952 -8.2952 -8.2743 -8.2743 -8.2509 -8.2509 -8.2056 -8.2056 -7.5222 -7.5222 -7.0475 -7.0475 -0.7357 -0.7357 -0.2640 -0.2640 1.8972 1.8972 2.0508 2.0508 2.8672 2.8672 3.1844 3.1844 3.2705 3.2705 3.4648 3.4648 4.2626 4.2626 4.6840 4.6840 4.7694 4.7694 5.1752 5.1752 5.6325 5.6325 5.9603 5.9603 8.8250 8.8250 9.7978 9.7978 11.0736 11.0736 11.8035 11.8035 12.4570 12.4570 12.5789 12.5789 k = 0.0000 0.1842 0.2754 ( 5328 PWs) bands (ev): -15.8621 -15.8621 -15.5513 -15.5513 -10.8575 -10.8575 -10.8457 -10.8457 -10.8361 -10.8361 -10.7855 -10.7855 -8.3243 -8.3243 -8.3123 -8.3123 -8.2947 -8.2947 -8.2737 -8.2737 -8.2511 -8.2511 -8.2055 -8.2055 -7.5094 -7.5094 -7.0453 -7.0453 -0.7515 -0.7515 -0.3000 -0.3000 1.9030 1.9030 2.0643 2.0643 2.8499 2.8499 3.1697 3.1697 3.2537 3.2537 3.4362 3.4362 4.2894 4.2894 4.7100 4.7100 4.7766 4.7766 5.1857 5.1857 5.6529 5.6529 5.9338 5.9338 8.8719 8.8719 9.7981 9.7981 11.0039 11.0039 11.7789 11.7789 12.3910 12.3910 12.5370 12.5370 k = 0.0000 0.1974 0.2754 ( 5330 PWs) bands (ev): -15.8576 -15.8576 -15.5555 -15.5555 -10.8572 -10.8572 -10.8458 -10.8458 -10.8350 -10.8350 -10.7854 -10.7854 -8.3240 -8.3240 -8.3121 -8.3121 -8.2943 -8.2943 -8.2730 -8.2730 -8.2513 -8.2513 -8.2054 -8.2054 -7.4958 -7.4958 -7.0432 -7.0432 -0.7679 -0.7679 -0.3372 -0.3372 1.9094 1.9094 2.0789 2.0789 2.8321 2.8321 3.1536 3.1536 3.2357 3.2357 3.4066 3.4066 4.3177 4.3177 4.7378 4.7378 4.7853 4.7853 5.1951 5.1951 5.6730 5.6730 5.9082 5.9082 8.9176 8.9176 9.7975 9.7975 10.9358 10.9358 11.7510 11.7510 12.3236 12.3236 12.4971 12.4971 k = 0.0000 0.2105 0.2754 ( 5338 PWs) bands (ev): -15.8528 -15.8528 -15.5599 -15.5599 -10.8570 -10.8570 -10.8458 -10.8458 -10.8339 -10.8339 -10.7854 -10.7854 -8.3236 -8.3236 -8.3120 -8.3120 -8.2937 -8.2937 -8.2722 -8.2722 -8.2515 -8.2515 -8.2054 -8.2054 -7.4815 -7.4815 -7.0412 -7.0412 -0.7848 -0.7848 -0.3751 -0.3751 1.9166 1.9166 2.0948 2.0948 2.8138 2.8138 3.1363 3.1363 3.2166 3.2166 3.3764 3.3764 4.3470 4.3470 4.7658 4.7658 4.7970 4.7970 5.2032 5.2032 5.6909 5.6909 5.8849 5.8849 8.9611 8.9611 9.7962 9.7962 10.8699 10.8699 11.7203 11.7203 12.2551 12.2551 12.4595 12.4595 k = 0.0000 0.2237 0.2754 ( 5352 PWs) bands (ev): -15.8478 -15.8478 -15.5646 -15.5646 -10.8567 -10.8567 -10.8459 -10.8459 -10.8327 -10.8327 -10.7855 -10.7855 -8.3232 -8.3232 -8.3118 -8.3118 -8.2932 -8.2932 -8.2713 -8.2713 -8.2517 -8.2517 -8.2056 -8.2056 -7.4667 -7.4667 -7.0395 -7.0395 -0.8020 -0.8020 -0.4136 -0.4136 1.9248 1.9248 2.1118 2.1118 2.7949 2.7949 3.1179 3.1179 3.1967 3.1967 3.3458 3.3458 4.3772 4.3772 4.7888 4.7888 4.8171 4.8171 5.2099 5.2099 5.7037 5.7037 5.8670 5.8670 9.0012 9.0012 9.7946 9.7946 10.8071 10.8071 11.6870 11.6870 12.1859 12.1859 12.4242 12.4242 k = 0.0000 0.2368 0.2754 ( 5360 PWs) bands (ev): -15.8425 -15.8425 -15.5694 -15.5694 -10.8564 -10.8564 -10.8460 -10.8460 -10.8314 -10.8314 -10.7855 -10.7855 -8.3227 -8.3227 -8.3118 -8.3118 -8.2925 -8.2925 -8.2704 -8.2704 -8.2519 -8.2519 -8.2058 -8.2058 -7.4513 -7.4513 -7.0380 -7.0380 -0.8195 -0.8195 -0.4523 -0.4523 1.9339 1.9339 2.1298 2.1298 2.7755 2.7755 3.0984 3.0984 3.1764 3.1764 3.3151 3.3151 4.4078 4.4078 4.8041 4.8041 4.8481 4.8481 5.2150 5.2150 5.7073 5.7073 5.8583 5.8583 9.0370 9.0370 9.7930 9.7930 10.7483 10.7483 11.6516 11.6516 12.1161 12.1161 12.3913 12.3913 k = 0.0000 0.2500 0.2754 ( 5364 PWs) bands (ev): -15.8370 -15.8370 -15.5746 -15.5746 -10.8561 -10.8561 -10.8462 -10.8462 -10.8301 -10.8301 -10.7856 -10.7856 -8.3221 -8.3221 -8.3117 -8.3117 -8.2917 -8.2917 -8.2695 -8.2695 -8.2522 -8.2522 -8.2061 -8.2061 -7.4354 -7.4354 -7.0368 -7.0368 -0.8370 -0.8370 -0.4911 -0.4911 1.9441 1.9441 2.1489 2.1489 2.7555 2.7555 3.0781 3.0781 3.1556 3.1556 3.2844 3.2844 4.4386 4.4386 4.8172 4.8172 4.8846 4.8846 5.2185 5.2185 5.6992 5.6992 5.8613 5.8613 9.0672 9.0672 9.7917 9.7917 10.6943 10.6943 11.6149 11.6149 12.0458 12.0458 12.3607 12.3607 k = 0.0000 0.2632 0.2754 ( 5356 PWs) bands (ev): -15.8313 -15.8313 -15.5799 -15.5799 -10.8559 -10.8559 -10.8463 -10.8463 -10.8286 -10.8286 -10.7857 -10.7857 -8.3216 -8.3216 -8.3117 -8.3117 -8.2907 -8.2907 -8.2686 -8.2686 -8.2524 -8.2524 -8.2065 -8.2065 -7.4191 -7.4191 -7.0360 -7.0360 -0.8545 -0.8545 -0.5297 -0.5297 1.9553 1.9553 2.1689 2.1689 2.7348 2.7348 3.0571 3.0571 3.1348 3.1348 3.2541 3.2541 4.4692 4.4692 4.8306 4.8306 4.9239 4.9239 5.2203 5.2203 5.6815 5.6815 5.8737 5.8737 9.0913 9.0913 9.7906 9.7906 10.6461 10.6461 11.5776 11.5776 11.9755 11.9755 12.3319 12.3319 k = 0.0000 0.2763 0.2754 ( 5356 PWs) bands (ev): -15.8253 -15.8253 -15.5855 -15.5855 -10.8556 -10.8556 -10.8464 -10.8464 -10.8272 -10.8272 -10.7859 -10.7859 -8.3210 -8.3210 -8.3118 -8.3118 -8.2895 -8.2895 -8.2677 -8.2677 -8.2526 -8.2526 -8.2070 -8.2070 -7.4025 -7.4025 -7.0356 -7.0356 -0.8718 -0.8718 -0.5679 -0.5679 1.9675 1.9675 2.1897 2.1897 2.7135 2.7135 3.0354 3.0354 3.1140 3.1140 3.2243 3.2243 4.4995 4.4995 4.8449 4.8449 4.9652 4.9652 5.2205 5.2205 5.6582 5.6582 5.8910 5.8910 9.1089 9.1089 9.7891 9.7891 10.6051 10.6051 11.5404 11.5404 11.9054 11.9054 12.3045 12.3045 k = 0.0000 0.2895 0.2754 ( 5348 PWs) bands (ev): -15.8192 -15.8192 -15.5912 -15.5912 -10.8553 -10.8553 -10.8466 -10.8466 -10.8257 -10.8257 -10.7862 -10.7862 -8.3205 -8.3205 -8.3119 -8.3119 -8.2882 -8.2882 -8.2668 -8.2668 -8.2527 -8.2527 -8.2077 -8.2077 -7.3856 -7.3856 -7.0357 -7.0357 -0.8887 -0.8887 -0.6055 -0.6055 1.9809 1.9809 2.2114 2.2114 2.6917 2.6917 3.0133 3.0133 3.0933 3.0933 3.1952 3.1952 4.5292 4.5292 4.8605 4.8605 5.0077 5.0077 5.2192 5.2192 5.6323 5.6323 5.9103 5.9103 9.1200 9.1200 9.7861 9.7861 10.5722 10.5722 11.5039 11.5039 11.8361 11.8361 12.2779 12.2779 k = 0.0000 0.3026 0.2754 ( 5348 PWs) bands (ev): -15.8128 -15.8128 -15.5972 -15.5972 -10.8550 -10.8550 -10.8468 -10.8468 -10.8241 -10.8241 -10.7865 -10.7865 -8.3199 -8.3199 -8.3121 -8.3121 -8.2868 -8.2868 -8.2659 -8.2659 -8.2528 -8.2528 -8.2085 -8.2085 -7.3684 -7.3684 -7.0363 -7.0363 -0.9050 -0.9050 -0.6422 -0.6422 1.9953 1.9953 2.2338 2.2338 2.6693 2.6693 2.9907 2.9907 3.0730 3.0730 3.1669 3.1669 4.5580 4.5580 4.8775 4.8775 5.0504 5.0504 5.2171 5.2171 5.6055 5.6055 5.9295 5.9295 9.1255 9.1255 9.7801 9.7801 10.5488 10.5488 11.4688 11.4688 11.7682 11.7682 12.2516 12.2516 k = 0.0000 0.3158 0.2754 ( 5344 PWs) bands (ev): -15.8063 -15.8063 -15.6033 -15.6033 -10.8547 -10.8547 -10.8469 -10.8469 -10.8225 -10.8225 -10.7868 -10.7868 -8.3195 -8.3195 -8.3123 -8.3123 -8.2852 -8.2852 -8.2651 -8.2651 -8.2528 -8.2528 -8.2095 -8.2095 -7.3511 -7.3511 -7.0374 -7.0374 -0.9208 -0.9208 -0.6780 -0.6780 2.0107 2.0107 2.2569 2.2569 2.6464 2.6464 2.9678 2.9678 3.0533 3.0533 3.1396 3.1396 4.5860 4.5860 4.8960 4.8960 5.0911 5.0911 5.2162 5.2162 5.5787 5.5787 5.9473 5.9473 9.1263 9.1263 9.7694 9.7694 10.5355 10.5355 11.4354 11.4354 11.7025 11.7025 12.2250 12.2250 k = 0.0000 0.3289 0.2754 ( 5346 PWs) bands (ev): -15.7996 -15.7996 -15.6097 -15.6097 -10.8544 -10.8544 -10.8471 -10.8471 -10.8209 -10.8209 -10.7873 -10.7873 -8.3190 -8.3190 -8.3126 -8.3126 -8.2835 -8.2835 -8.2643 -8.2643 -8.2527 -8.2527 -8.2105 -8.2105 -7.3337 -7.3337 -7.0392 -7.0392 -0.9357 -0.9357 -0.7125 -0.7125 2.0272 2.0272 2.2807 2.2807 2.6230 2.6230 2.9445 2.9445 3.0343 3.0343 3.1134 3.1134 4.6129 4.6129 4.9159 4.9159 5.1239 5.1239 5.2221 5.2221 5.5525 5.5525 5.9630 5.9630 9.1238 9.1238 9.7531 9.7531 10.5324 10.5324 11.4036 11.4036 11.6402 11.6402 12.1976 12.1976 k = 0.0000 0.3421 0.2754 ( 5346 PWs) bands (ev): -15.7928 -15.7928 -15.6162 -15.6162 -10.8541 -10.8541 -10.8473 -10.8473 -10.8192 -10.8192 -10.7878 -10.7878 -8.3186 -8.3186 -8.3128 -8.3128 -8.2817 -8.2817 -8.2637 -8.2637 -8.2525 -8.2525 -8.2117 -8.2117 -7.3163 -7.3163 -7.0416 -7.0416 -0.9496 -0.9496 -0.7456 -0.7456 2.0446 2.0446 2.3049 2.3049 2.5993 2.5993 2.9210 2.9210 3.0161 3.0161 3.0882 3.0882 4.6388 4.6388 4.9372 4.9372 5.1392 5.1392 5.2443 5.2443 5.5272 5.5272 5.9757 5.9757 9.1196 9.1196 9.7304 9.7304 10.5388 10.5388 11.3728 11.3728 11.5832 11.5832 12.1690 12.1690 k = 0.0000 0.3553 0.2754 ( 5342 PWs) bands (ev): -15.7858 -15.7858 -15.6228 -15.6228 -10.8538 -10.8538 -10.8476 -10.8476 -10.8176 -10.8176 -10.7884 -10.7884 -8.3182 -8.3182 -8.3131 -8.3131 -8.2798 -8.2798 -8.2631 -8.2631 -8.2522 -8.2522 -8.2131 -8.2131 -7.2989 -7.2989 -7.0447 -7.0447 -0.9624 -0.9624 -0.7773 -0.7773 2.0629 2.0629 2.3297 2.3297 2.5753 2.5753 2.8973 2.8973 2.9991 2.9991 3.0644 3.0644 4.6638 4.6638 4.9598 4.9598 5.1373 5.1373 5.2822 5.2822 5.5029 5.5029 5.9851 5.9851 9.1149 9.1149 9.7018 9.7018 10.5534 10.5534 11.3412 11.3412 11.5341 11.5341 12.1388 12.1388 k = 0.0000 0.3684 0.2754 ( 5332 PWs) bands (ev): -15.7787 -15.7787 -15.6296 -15.6296 -10.8535 -10.8535 -10.8478 -10.8478 -10.8159 -10.8159 -10.7890 -10.7890 -8.3178 -8.3178 -8.3133 -8.3133 -8.2780 -8.2780 -8.2627 -8.2627 -8.2516 -8.2516 -8.2146 -8.2146 -7.2817 -7.2817 -7.0485 -7.0485 -0.9740 -0.9740 -0.8073 -0.8073 2.0821 2.0821 2.3549 2.3549 2.5512 2.5512 2.8733 2.8733 2.9832 2.9832 3.0418 3.0418 4.6878 4.6878 4.9834 4.9834 5.1265 5.1265 5.3276 5.3276 5.4796 5.4796 5.9905 5.9905 9.1109 9.1109 9.6680 9.6680 10.5744 10.5744 11.3066 11.3066 11.4962 11.4962 12.1067 12.1067 k = 0.0000 0.3816 0.2754 ( 5350 PWs) bands (ev): -15.7715 -15.7715 -15.6366 -15.6366 -10.8532 -10.8532 -10.8480 -10.8480 -10.8142 -10.8142 -10.7897 -10.7897 -8.3175 -8.3175 -8.3136 -8.3136 -8.2762 -8.2762 -8.2624 -8.2624 -8.2508 -8.2508 -8.2162 -8.2162 -7.2647 -7.2647 -7.0531 -7.0531 -0.9843 -0.9843 -0.8355 -0.8355 2.1021 2.1021 2.3804 2.3804 2.5269 2.5269 2.8491 2.8491 2.9686 2.9686 3.0207 3.0207 4.7110 4.7110 5.0076 5.0076 5.1116 5.1116 5.3752 5.3752 5.4579 5.4579 5.9918 5.9918 9.1089 9.1089 9.6301 9.6301 10.5997 10.5997 11.2671 11.2671 11.4721 11.4721 12.0725 12.0725 k = 0.0000 0.3947 0.2754 ( 5354 PWs) bands (ev): -15.7642 -15.7642 -15.6437 -15.6437 -10.8529 -10.8529 -10.8483 -10.8483 -10.8125 -10.8125 -10.7906 -10.7906 -8.3172 -8.3172 -8.3139 -8.3139 -8.2744 -8.2744 -8.2623 -8.2623 -8.2498 -8.2498 -8.2179 -8.2179 -7.2479 -7.2479 -7.0585 -7.0585 -0.9930 -0.9930 -0.8618 -0.8618 2.1228 2.1228 2.4061 2.4061 2.5027 2.5027 2.8247 2.8247 2.9554 2.9554 3.0011 3.0011 4.7336 4.7336 5.0312 5.0312 5.0953 5.0953 5.4161 5.4161 5.4449 5.4449 5.9886 5.9886 9.1095 9.1095 9.5891 9.5891 10.6279 10.6279 11.2232 11.2232 11.4619 11.4619 12.0362 12.0362 k = 0.0000 0.4079 0.2754 ( 5362 PWs) bands (ev): -15.7567 -15.7567 -15.6509 -15.6509 -10.8526 -10.8526 -10.8486 -10.8486 -10.8108 -10.8108 -10.7915 -10.7915 -8.3170 -8.3170 -8.3141 -8.3141 -8.2728 -8.2728 -8.2622 -8.2622 -8.2485 -8.2485 -8.2197 -8.2197 -7.2315 -7.2315 -7.0647 -7.0647 -1.0001 -1.0001 -0.8862 -0.8862 2.1441 2.1441 2.4313 2.4313 2.4791 2.4791 2.8000 2.8000 2.9438 2.9438 2.9832 2.9832 4.7557 4.7557 5.0481 5.0481 5.0845 5.0845 5.4082 5.4082 5.4813 5.4813 5.9808 5.9808 9.1135 9.1135 9.5461 9.5461 10.6576 10.6576 11.1766 11.1766 11.4641 11.4641 11.9977 11.9977 k = 0.0000 0.4211 0.2754 ( 5342 PWs) bands (ev): -15.7492 -15.7492 -15.6582 -15.6582 -10.8523 -10.8523 -10.8488 -10.8488 -10.8091 -10.8091 -10.7924 -10.7924 -8.3167 -8.3167 -8.3143 -8.3143 -8.2712 -8.2712 -8.2623 -8.2623 -8.2470 -8.2470 -8.2217 -8.2217 -7.2154 -7.2154 -7.0716 -7.0716 -1.0054 -1.0054 -0.9084 -0.9084 2.1660 2.1660 2.4458 2.4458 2.4665 2.4665 2.7752 2.7752 2.9338 2.9338 2.9671 2.9671 4.7776 4.7776 5.0412 5.0412 5.0967 5.0967 5.3878 5.3878 5.5302 5.5302 5.9684 5.9684 9.1214 9.1214 9.5021 9.5021 10.6879 10.6879 11.1294 11.1294 11.4767 11.4767 11.9571 11.9571 k = 0.0000 0.4342 0.2754 ( 5350 PWs) bands (ev): -15.7417 -15.7417 -15.6655 -15.6655 -10.8520 -10.8520 -10.8491 -10.8491 -10.8075 -10.8075 -10.7934 -10.7934 -8.3165 -8.3165 -8.3146 -8.3146 -8.2698 -8.2698 -8.2625 -8.2625 -8.2453 -8.2453 -8.2237 -8.2237 -7.1998 -7.1998 -7.0794 -7.0794 -1.0089 -1.0089 -0.9286 -0.9286 2.1884 2.1884 2.4263 2.4263 2.4881 2.4881 2.7500 2.7500 2.9255 2.9255 2.9529 2.9529 4.7993 4.7993 5.0219 5.0219 5.1206 5.1206 5.3662 5.3662 5.5794 5.5794 5.9513 5.9513 9.1335 9.1335 9.4579 9.4579 10.7184 10.7184 11.0829 11.0829 11.4980 11.4980 11.9145 11.9145 k = 0.0000 0.4474 0.2754 ( 5348 PWs) bands (ev): -15.7341 -15.7341 -15.6730 -15.6730 -10.8517 -10.8517 -10.8494 -10.8494 -10.8058 -10.8058 -10.7946 -10.7946 -8.3163 -8.3163 -8.3148 -8.3148 -8.2686 -8.2686 -8.2628 -8.2628 -8.2434 -8.2434 -8.2258 -8.2258 -7.1848 -7.1848 -7.0881 -7.0881 -1.0105 -1.0105 -0.9466 -0.9466 2.2112 2.2112 2.4025 2.4025 2.5142 2.5142 2.7246 2.7246 2.9191 2.9191 2.9407 2.9407 4.8210 4.8210 5.0002 5.0002 5.1465 5.1465 5.3441 5.3441 5.6277 5.6277 5.9297 5.9297 9.1499 9.1499 9.4141 9.4141 10.7491 10.7491 11.0379 11.0379 11.5265 11.5265 11.8703 11.8703 k = 0.0000 0.4605 0.2754 ( 5352 PWs) bands (ev): -15.7264 -15.7264 -15.6805 -15.6805 -10.8514 -10.8514 -10.8497 -10.8497 -10.8042 -10.8042 -10.7958 -10.7958 -8.3161 -8.3161 -8.3150 -8.3150 -8.2675 -8.2675 -8.2632 -8.2632 -8.2414 -8.2414 -8.2280 -8.2280 -7.1702 -7.1702 -7.0975 -7.0975 -1.0101 -1.0101 -0.9623 -0.9623 2.2344 2.2344 2.3782 2.3782 2.5407 2.5407 2.6989 2.6989 2.9145 2.9145 2.9305 2.9305 4.8428 4.8428 4.9776 4.9776 5.1727 5.1727 5.3215 5.3215 5.6747 5.6747 5.9038 5.9038 9.1705 9.1705 9.3716 9.3716 10.7802 10.7802 10.9949 10.9949 11.5607 11.5607 11.8248 11.8248 k = 0.0000 0.4737 0.2754 ( 5354 PWs) bands (ev): -15.7188 -15.7188 -15.6881 -15.6881 -10.8511 -10.8511 -10.8499 -10.8499 -10.8027 -10.8027 -10.7970 -10.7970 -8.3159 -8.3159 -8.3152 -8.3152 -8.2665 -8.2665 -8.2637 -8.2637 -8.2393 -8.2393 -8.2303 -8.2303 -7.1563 -7.1563 -7.1077 -7.1077 -1.0076 -1.0076 -0.9759 -0.9759 2.2579 2.2579 2.3540 2.3540 2.5673 2.5673 2.6730 2.6730 2.9119 2.9119 2.9225 2.9225 4.8647 4.8647 4.9548 4.9548 5.1988 5.1988 5.2982 5.2982 5.7198 5.7198 5.8738 5.8738 9.1954 9.1954 9.3308 9.3308 10.8119 10.8119 10.9541 10.9541 11.5996 11.5996 11.7786 11.7786 k = 0.0000 0.4868 0.2754 ( 5344 PWs) bands (ev): -15.7111 -15.7111 -15.6958 -15.6958 -10.8508 -10.8508 -10.8502 -10.8502 -10.8012 -10.8012 -10.7983 -10.7983 -8.3158 -8.3158 -8.3154 -8.3154 -8.2656 -8.2656 -8.2642 -8.2642 -8.2371 -8.2371 -8.2325 -8.2325 -7.1431 -7.1431 -7.1188 -7.1188 -1.0030 -1.0030 -0.9871 -0.9871 2.2817 2.2817 2.3297 2.3297 2.5940 2.5940 2.6469 2.6469 2.9114 2.9114 2.9167 2.9167 4.8869 4.8869 4.9320 4.9320 5.2245 5.2245 5.2743 5.2743 5.7627 5.7627 5.8401 5.8401 9.2242 9.2242 9.2923 9.2923 10.8448 10.8448 10.9156 10.9156 11.6418 11.6418 11.7322 11.7322 k = 0.0000 0.5000 0.2754 ( 5344 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8505 -10.8505 -10.8505 -10.8505 -10.7997 -10.7997 -10.7997 -10.7997 -8.3156 -8.3156 -8.3156 -8.3156 -8.2649 -8.2649 -8.2649 -8.2649 -8.2348 -8.2348 -8.2348 -8.2348 -7.1306 -7.1306 -7.1306 -7.1306 -0.9962 -0.9962 -0.9962 -0.9962 2.3056 2.3056 2.3056 2.3056 2.6205 2.6205 2.6205 2.6205 2.9130 2.9130 2.9130 2.9130 4.9094 4.9094 4.9094 4.9094 5.2497 5.2497 5.2497 5.2497 5.8029 5.8029 5.8029 5.8029 9.2566 9.2566 9.2566 9.2566 10.8793 10.8793 10.8793 10.8793 11.6863 11.6863 11.6863 11.6863 k = 0.0000 0.5000 0.2754 ( 5344 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8505 -10.8505 -10.8505 -10.8505 -10.7997 -10.7997 -10.7997 -10.7997 -8.3156 -8.3156 -8.3156 -8.3156 -8.2649 -8.2649 -8.2649 -8.2649 -8.2348 -8.2348 -8.2348 -8.2348 -7.1306 -7.1306 -7.1306 -7.1306 -0.9962 -0.9962 -0.9962 -0.9962 2.3056 2.3056 2.3056 2.3056 2.6205 2.6205 2.6205 2.6205 2.9130 2.9130 2.9130 2.9130 4.9094 4.9094 4.9094 4.9094 5.2497 5.2497 5.2497 5.2497 5.8029 5.8029 5.8029 5.8029 9.2566 9.2566 9.2566 9.2566 10.8793 10.8793 10.8793 10.8793 11.6863 11.6863 11.6863 11.6863 k = 0.0132 0.5000 0.2754 ( 5344 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8506 -10.8506 -10.8504 -10.8504 -10.8007 -10.8007 -10.7988 -10.7988 -8.3167 -8.3167 -8.3144 -8.3144 -8.2658 -8.2658 -8.2643 -8.2643 -8.2348 -8.2348 -8.2345 -8.2345 -7.1316 -7.1316 -7.1288 -7.1288 -0.9960 -0.9960 -0.9959 -0.9959 2.2990 2.2990 2.3069 2.3069 2.6130 2.6130 2.6305 2.6305 2.9063 2.9063 2.9234 2.9234 4.9021 4.9021 4.9134 4.9134 5.2334 5.2334 5.2574 5.2574 5.7968 5.7968 5.8111 5.8111 9.2242 9.2242 9.2879 9.2879 10.8673 10.8673 10.8961 10.8961 11.6369 11.6369 11.7436 11.7436 k = 0.0263 0.5000 0.2754 ( 5356 PWs) bands (ev): -15.7034 -15.7034 -15.7033 -15.7033 -10.8506 -10.8506 -10.8503 -10.8503 -10.8016 -10.8016 -10.7979 -10.7979 -8.3178 -8.3178 -8.3132 -8.3132 -8.2670 -8.2670 -8.2641 -8.2641 -8.2348 -8.2348 -8.2340 -8.2340 -7.1320 -7.1320 -7.1263 -7.1263 -0.9953 -0.9953 -0.9952 -0.9952 2.2872 2.2872 2.3030 2.3030 2.6083 2.6083 2.6423 2.6423 2.9040 2.9040 2.9373 2.9373 4.8915 4.8915 4.9142 4.9142 5.2092 5.2092 5.2565 5.2565 5.7931 5.7931 5.8207 5.8207 9.1909 9.1909 9.3179 9.3179 10.8616 10.8616 10.9158 10.9158 11.5973 11.5973 11.8069 11.8069 k = 0.0395 0.5000 0.2754 ( 5344 PWs) bands (ev): -15.7033 -15.7033 -15.7032 -15.7032 -10.8505 -10.8505 -10.8500 -10.8500 -10.8026 -10.8026 -10.7971 -10.7971 -8.3189 -8.3189 -8.3119 -8.3119 -8.2684 -8.2684 -8.2643 -8.2643 -8.2345 -8.2345 -8.2331 -8.2331 -7.1316 -7.1316 -7.1231 -7.1231 -0.9941 -0.9941 -0.9940 -0.9940 2.2708 2.2708 2.2946 2.2946 2.6064 2.6064 2.6551 2.6551 2.9064 2.9064 2.9540 2.9540 4.8770 4.8770 4.9117 4.9117 5.1788 5.1788 5.2480 5.2480 5.7911 5.7911 5.8304 5.8304 9.1573 9.1573 9.3467 9.3467 10.8632 10.8632 10.9360 10.9360 11.5698 11.5698 11.8745 11.8745 k = 0.0526 0.5000 0.2754 ( 5336 PWs) bands (ev): -15.7032 -15.7032 -15.7031 -15.7031 -10.8503 -10.8503 -10.8497 -10.8497 -10.8036 -10.8036 -10.7963 -10.7963 -8.3199 -8.3199 -8.3105 -8.3105 -8.2699 -8.2699 -8.2651 -8.2651 -8.2343 -8.2343 -8.2320 -8.2320 -7.1305 -7.1305 -7.1193 -7.1193 -0.9924 -0.9924 -0.9923 -0.9923 2.2505 2.2505 2.2824 2.2824 2.6070 2.6070 2.6679 2.6679 2.9134 2.9134 2.9731 2.9731 4.8583 4.8583 4.9051 4.9051 5.1441 5.1441 5.2335 5.2335 5.7898 5.7898 5.8390 5.8390 9.1240 9.1240 9.3744 9.3744 10.8724 10.8724 10.9544 10.9544 11.5563 11.5563 11.9451 11.9451 k = 0.0658 0.5000 0.2754 ( 5336 PWs) bands (ev): -15.7031 -15.7031 -15.7029 -15.7029 -10.8501 -10.8501 -10.8494 -10.8494 -10.8046 -10.8046 -10.7955 -10.7955 -8.3210 -8.3210 -8.3091 -8.3091 -8.2714 -8.2714 -8.2662 -8.2662 -8.2340 -8.2340 -8.2307 -8.2307 -7.1286 -7.1286 -7.1148 -7.1148 -0.9904 -0.9904 -0.9902 -0.9902 2.2272 2.2272 2.2669 2.2669 2.6098 2.6098 2.6802 2.6802 2.9250 2.9250 2.9942 2.9942 4.8349 4.8349 4.8935 4.8935 5.1076 5.1076 5.2150 5.2150 5.7875 5.7875 5.8451 5.8451 9.0917 9.0917 9.4012 9.4012 10.8895 10.8895 10.9690 10.9690 11.5580 11.5580 12.0173 12.0173 k = 0.0789 0.5000 0.2754 ( 5328 PWs) bands (ev): -15.7029 -15.7029 -15.7027 -15.7027 -10.8499 -10.8499 -10.8489 -10.8489 -10.8055 -10.8055 -10.7948 -10.7948 -8.3220 -8.3220 -8.3077 -8.3077 -8.2729 -8.2729 -8.2677 -8.2677 -8.2337 -8.2337 -8.2291 -8.2291 -7.1261 -7.1261 -7.1098 -7.1098 -0.9879 -0.9879 -0.9877 -0.9877 2.2018 2.2018 2.2490 2.2490 2.6142 2.6142 2.6919 2.6919 2.9408 2.9408 3.0167 3.0167 4.8065 4.8065 4.8752 4.8752 5.0721 5.0721 5.1944 5.1944 5.7830 5.7830 5.8478 5.8478 9.0613 9.0613 9.4275 9.4275 10.9143 10.9143 10.9792 10.9792 11.5749 11.5749 12.0899 12.0899 k = 0.0921 0.5000 0.2754 ( 5332 PWs) bands (ev): -15.7028 -15.7028 -15.7025 -15.7025 -10.8496 -10.8496 -10.8484 -10.8484 -10.8065 -10.8065 -10.7941 -10.7941 -8.3231 -8.3231 -8.3062 -8.3062 -8.2743 -8.2743 -8.2696 -8.2696 -8.2335 -8.2335 -8.2274 -8.2274 -7.1228 -7.1228 -7.1041 -7.1041 -0.9850 -0.9850 -0.9848 -0.9848 2.1750 2.1750 2.2292 2.2292 2.6201 2.6201 2.7028 2.7028 2.9602 2.9602 3.0405 3.0405 4.7729 4.7729 4.8486 4.8486 5.0403 5.0403 5.1733 5.1733 5.7748 5.7748 5.8463 5.8463 9.0337 9.0337 9.4535 9.4535 10.9463 10.9463 10.9854 10.9854 11.6055 11.6055 12.1617 12.1617 k = 0.1053 0.5000 0.2754 ( 5340 PWs) bands (ev): -15.7025 -15.7025 -15.7022 -15.7022 -10.8492 -10.8492 -10.8479 -10.8479 -10.8075 -10.8075 -10.7935 -10.7935 -8.3243 -8.3243 -8.3047 -8.3047 -8.2754 -8.2754 -8.2717 -8.2717 -8.2334 -8.2334 -8.2257 -8.2257 -7.1189 -7.1189 -7.0980 -7.0980 -0.9818 -0.9818 -0.9815 -0.9815 2.1474 2.1474 2.2080 2.2080 2.6271 2.6271 2.7133 2.7133 2.9822 2.9822 3.0650 3.0650 4.7343 4.7343 4.8129 4.8129 5.0140 5.0140 5.1527 5.1527 5.7620 5.7620 5.8398 5.8398 9.0097 9.0097 9.4795 9.4795 10.9848 10.9848 10.9891 10.9891 11.6472 11.6472 12.2316 12.2316 k = 0.1184 0.5000 0.2754 ( 5340 PWs) bands (ev): -15.7023 -15.7023 -15.7020 -15.7020 -10.8488 -10.8488 -10.8473 -10.8473 -10.8084 -10.8084 -10.7930 -10.7930 -8.3255 -8.3255 -8.3032 -8.3032 -8.2764 -8.2764 -8.2741 -8.2741 -8.2333 -8.2333 -8.2239 -8.2239 -7.1144 -7.1144 -7.0914 -7.0914 -0.9783 -0.9783 -0.9780 -0.9780 2.1194 2.1194 2.1858 2.1858 2.6351 2.6351 2.7235 2.7235 3.0064 3.0064 3.0900 3.0900 4.6913 4.6913 4.7691 4.7691 4.9927 4.9927 5.1332 5.1332 5.7439 5.7439 5.8281 5.8281 8.9899 8.9899 9.5060 9.5060 10.9920 10.9920 11.0292 11.0292 11.6971 11.6971 12.2986 12.2986 k = 0.1316 0.5000 0.2754 ( 5344 PWs) bands (ev): -15.7020 -15.7020 -15.7017 -15.7017 -10.8484 -10.8484 -10.8467 -10.8467 -10.8094 -10.8094 -10.7925 -10.7925 -8.3268 -8.3268 -8.3017 -8.3017 -8.2772 -8.2772 -8.2766 -8.2766 -8.2332 -8.2332 -8.2221 -8.2221 -7.1092 -7.1092 -7.0844 -7.0844 -0.9744 -0.9744 -0.9741 -0.9741 2.0914 2.0914 2.1631 2.1631 2.6440 2.6440 2.7338 2.7338 3.0320 3.0320 3.1153 3.1153 4.6445 4.6445 4.7196 4.7196 4.9750 4.9750 5.1148 5.1148 5.7201 5.7201 5.8111 5.8111 8.9751 8.9751 9.5331 9.5331 10.9953 10.9953 11.0786 11.0786 11.7525 11.7525 12.3618 12.3618 k = 0.1447 0.5000 0.2754 ( 5344 PWs) bands (ev): -15.7017 -15.7017 -15.7013 -15.7013 -10.8480 -10.8480 -10.8460 -10.8460 -10.8102 -10.8102 -10.7920 -10.7920 -8.3281 -8.3281 -8.3003 -8.3003 -8.2792 -8.2792 -8.2777 -8.2777 -8.2333 -8.2333 -8.2203 -8.2203 -7.1034 -7.1034 -7.0770 -7.0770 -0.9704 -0.9704 -0.9701 -0.9701 2.0638 2.0638 2.1401 2.1401 2.6538 2.6538 2.7444 2.7444 3.0585 3.0585 3.1407 3.1407 4.5950 4.5950 4.6662 4.6662 4.9593 4.9593 5.0975 5.0975 5.6903 5.6903 5.7886 5.7886 8.9658 8.9658 9.5612 9.5612 10.9999 10.9999 11.1321 11.1321 11.8111 11.8111 12.4202 12.4202 k = 0.1579 0.5000 0.2754 ( 5352 PWs) bands (ev): -15.7014 -15.7014 -15.7010 -15.7010 -10.8475 -10.8475 -10.8453 -10.8453 -10.8111 -10.8111 -10.7917 -10.7917 -8.3295 -8.3295 -8.2990 -8.2990 -8.2819 -8.2819 -8.2780 -8.2780 -8.2334 -8.2334 -8.2186 -8.2186 -7.0972 -7.0972 -7.0692 -7.0692 -0.9661 -0.9661 -0.9658 -0.9658 2.0368 2.0368 2.1170 2.1170 2.6643 2.6643 2.7554 2.7554 3.0854 3.0854 3.1658 3.1658 4.5434 4.5434 4.6108 4.6108 4.9444 4.9444 5.0810 5.0810 5.6547 5.6547 5.7609 5.7609 8.9621 8.9621 9.5905 9.5905 11.0062 11.0062 11.1887 11.1887 11.8711 11.8711 12.4731 12.4731 k = 0.1711 0.5000 0.2754 ( 5340 PWs) bands (ev): -15.7011 -15.7011 -15.7006 -15.7006 -10.8470 -10.8470 -10.8445 -10.8445 -10.8118 -10.8118 -10.7913 -10.7913 -8.3310 -8.3310 -8.2979 -8.2979 -8.2843 -8.2843 -8.2780 -8.2780 -8.2335 -8.2335 -8.2169 -8.2169 -7.0904 -7.0904 -7.0612 -7.0612 -0.9618 -0.9618 -0.9614 -0.9614 2.0106 2.0106 2.0942 2.0942 2.6756 2.6756 2.7669 2.7669 3.1124 3.1124 3.1907 3.1907 4.4908 4.4908 4.5545 4.5545 4.9295 4.9295 5.0647 5.0647 5.6137 5.6137 5.7283 5.7283 8.9643 8.9643 9.6213 9.6213 11.0141 11.0141 11.2474 11.2474 11.9308 11.9308 12.5199 12.5199 k = 0.1842 0.5000 0.2754 ( 5332 PWs) bands (ev): -15.7007 -15.7007 -15.7003 -15.7003 -10.8465 -10.8465 -10.8438 -10.8438 -10.8125 -10.8125 -10.7911 -10.7911 -8.3326 -8.3326 -8.2974 -8.2974 -8.2863 -8.2863 -8.2777 -8.2777 -8.2337 -8.2337 -8.2153 -8.2153 -7.0832 -7.0832 -7.0530 -7.0530 -0.9573 -0.9573 -0.9569 -0.9569 1.9854 1.9854 2.0718 2.0718 2.6876 2.6876 2.7791 2.7791 3.1393 3.1393 3.2150 3.2150 4.4377 4.4377 4.4982 4.4982 4.9139 4.9139 5.0483 5.0483 5.5677 5.5677 5.6912 5.6912 8.9724 8.9724 9.6536 9.6536 11.0235 11.0235 11.3072 11.3072 11.9889 11.9889 12.5598 12.5598 k = 0.1974 0.5000 0.2754 ( 5332 PWs) bands (ev): -15.7004 -15.7004 -15.6999 -15.6999 -10.8460 -10.8460 -10.8430 -10.8430 -10.8131 -10.8131 -10.7909 -10.7909 -8.3342 -8.3342 -8.2979 -8.2979 -8.2874 -8.2874 -8.2772 -8.2772 -8.2339 -8.2339 -8.2138 -8.2138 -7.0756 -7.0756 -7.0446 -7.0446 -0.9527 -0.9527 -0.9524 -0.9524 1.9613 1.9613 2.0498 2.0498 2.7004 2.7004 2.7920 2.7920 3.1657 3.1657 3.2388 3.2388 4.3850 4.3850 4.4426 4.4426 4.8972 4.8972 5.0312 5.0312 5.5177 5.5177 5.6502 5.6502 8.9863 8.9863 9.6877 9.6877 11.0338 11.0338 11.3671 11.3671 12.0444 12.0444 12.5927 12.5927 k = 0.2105 0.5000 0.2754 ( 5332 PWs) bands (ev): -15.7000 -15.7000 -15.6995 -15.6995 -10.8454 -10.8454 -10.8423 -10.8423 -10.8137 -10.8137 -10.7907 -10.7907 -8.3358 -8.3358 -8.2996 -8.2996 -8.2873 -8.2873 -8.2765 -8.2765 -8.2342 -8.2342 -8.2124 -8.2124 -7.0677 -7.0677 -7.0361 -7.0361 -0.9482 -0.9482 -0.9479 -0.9479 1.9385 1.9385 2.0285 2.0285 2.7139 2.7139 2.8056 2.8056 3.1916 3.1916 3.2618 3.2618 4.3331 4.3331 4.3882 4.3882 4.8790 4.8790 5.0127 5.0127 5.4645 5.4645 5.6060 5.6060 9.0058 9.0058 9.7235 9.7235 11.0446 11.0446 11.4260 11.4260 12.0964 12.0964 12.6182 12.6182 k = 0.2237 0.5000 0.2754 ( 5332 PWs) bands (ev): -15.6996 -15.6996 -15.6991 -15.6991 -10.8449 -10.8449 -10.8415 -10.8415 -10.8141 -10.8141 -10.7907 -10.7907 -8.3374 -8.3374 -8.3020 -8.3020 -8.2865 -8.2865 -8.2755 -8.2755 -8.2345 -8.2345 -8.2111 -8.2111 -7.0595 -7.0595 -7.0275 -7.0275 -0.9437 -0.9437 -0.9434 -0.9434 1.9169 1.9169 2.0080 2.0080 2.7283 2.7283 2.8199 2.8199 3.2168 3.2168 3.2841 3.2841 4.2827 4.2827 4.3354 4.3354 4.8588 4.8588 4.9920 4.9920 5.4094 5.4094 5.5595 5.5595 9.0305 9.0305 9.7610 9.7610 11.0555 11.0555 11.4829 11.4829 12.1441 12.1441 12.6361 12.6361 k = 0.2368 0.5000 0.2754 ( 5344 PWs) bands (ev): -15.6992 -15.6992 -15.6987 -15.6987 -10.8444 -10.8444 -10.8409 -10.8409 -10.8144 -10.8144 -10.7907 -10.7907 -8.3390 -8.3390 -8.3049 -8.3049 -8.2853 -8.2853 -8.2744 -8.2744 -8.2348 -8.2348 -8.2100 -8.2100 -7.0510 -7.0510 -7.0190 -7.0190 -0.9393 -0.9393 -0.9391 -0.9391 1.8966 1.8966 1.9882 1.9882 2.7435 2.7435 2.8351 2.8351 3.2412 3.2412 3.3055 3.3055 4.2340 4.2340 4.2847 4.2847 4.8362 4.8362 4.9680 4.9680 5.3542 5.3542 5.5113 5.5113 9.0602 9.0602 9.8001 9.8001 11.0658 11.0658 11.5371 11.5371 12.1869 12.1869 12.6468 12.6468 k = 0.2500 0.5000 0.2754 ( 5348 PWs) bands (ev): -15.6988 -15.6988 -15.6983 -15.6983 -10.8438 -10.8438 -10.8402 -10.8402 -10.8146 -10.8146 -10.7907 -10.7907 -8.3406 -8.3406 -8.3080 -8.3080 -8.2839 -8.2839 -8.2731 -8.2731 -8.2350 -8.2350 -8.2090 -8.2090 -7.0425 -7.0425 -7.0105 -7.0105 -0.9350 -0.9350 -0.9348 -0.9348 1.8778 1.8778 1.9692 1.9692 2.7595 2.7595 2.8511 2.8511 3.2648 3.2648 3.3260 3.3260 4.1874 4.1874 4.2361 4.2361 4.8108 4.8108 4.9394 4.9394 5.3007 5.3007 5.4626 5.4626 9.0945 9.0945 9.8408 9.8408 11.0753 11.0753 11.5876 11.5876 12.2244 12.2244 12.6502 12.6502 k = 0.2632 0.5000 0.2754 ( 5356 PWs) bands (ev): -15.6984 -15.6984 -15.6979 -15.6979 -10.8433 -10.8433 -10.8396 -10.8396 -10.8147 -10.8147 -10.7908 -10.7908 -8.3422 -8.3422 -8.3111 -8.3111 -8.2825 -8.2825 -8.2717 -8.2717 -8.2353 -8.2353 -8.2081 -8.2081 -7.0338 -7.0338 -7.0021 -7.0021 -0.9309 -0.9309 -0.9307 -0.9307 1.8604 1.8604 1.9510 1.9510 2.7765 2.7765 2.8680 2.8680 3.2873 3.2873 3.3454 3.3454 4.1433 4.1433 4.1901 4.1901 4.7822 4.7822 4.9046 4.9046 5.2510 5.2510 5.4141 5.4141 9.1329 9.1329 9.8826 9.8826 11.0838 11.0838 11.6337 11.6337 12.2562 12.2562 12.6468 12.6468 k = 0.2763 0.5000 0.2754 ( 5364 PWs) bands (ev): -15.6980 -15.6980 -15.6975 -15.6975 -10.8428 -10.8428 -10.8391 -10.8391 -10.8147 -10.8147 -10.7910 -10.7910 -8.3436 -8.3436 -8.3142 -8.3142 -8.2810 -8.2810 -8.2702 -8.2702 -8.2355 -8.2355 -8.2073 -8.2073 -7.0251 -7.0251 -6.9939 -6.9939 -0.9269 -0.9269 -0.9268 -0.9268 1.8443 1.8443 1.9337 1.9337 2.7945 2.7945 2.8858 2.8858 3.3089 3.3089 3.3638 3.3638 4.1019 4.1019 4.1467 4.1467 4.7500 4.7500 4.8625 4.8625 5.2068 5.2068 5.3670 5.3670 9.1751 9.1751 9.9252 9.9252 11.0909 11.0909 11.6749 11.6749 12.2822 12.2822 12.6372 12.6372 k = 0.2895 0.5000 0.2754 ( 5372 PWs) bands (ev): -15.6977 -15.6977 -15.6972 -15.6972 -10.8424 -10.8424 -10.8386 -10.8386 -10.8145 -10.8145 -10.7912 -10.7912 -8.3451 -8.3451 -8.3173 -8.3173 -8.2796 -8.2796 -8.2687 -8.2687 -8.2356 -8.2356 -8.2067 -8.2067 -7.0164 -7.0164 -6.9859 -6.9859 -0.9232 -0.9232 -0.9231 -0.9231 1.8297 1.8297 1.9172 1.9172 2.8135 2.8135 2.9045 2.9045 3.3295 3.3295 3.3812 3.3812 4.0633 4.0633 4.1061 4.1061 4.7138 4.7138 4.8127 4.8127 5.1692 5.1692 5.3220 5.3220 9.2207 9.2207 9.9682 9.9682 11.0970 11.0970 11.7106 11.7106 12.3025 12.3025 12.6217 12.6217 k = 0.3026 0.5000 0.2754 ( 5376 PWs) bands (ev): -15.6973 -15.6973 -15.6968 -15.6968 -10.8419 -10.8419 -10.8383 -10.8383 -10.8142 -10.8142 -10.7914 -10.7914 -8.3464 -8.3464 -8.3204 -8.3204 -8.2781 -8.2781 -8.2672 -8.2672 -8.2356 -8.2356 -8.2063 -8.2063 -7.0077 -7.0077 -6.9782 -6.9782 -0.9197 -0.9197 -0.9196 -0.9196 1.8164 1.8164 1.9015 1.9015 2.8335 2.8335 2.9241 2.9241 3.3491 3.3491 3.3975 3.3975 4.0275 4.0275 4.0684 4.0684 4.6736 4.6736 4.7558 4.7558 5.1382 5.1382 5.2799 5.2799 9.2692 9.2692 10.0111 10.0111 11.1021 11.1021 11.7406 11.7406 12.3173 12.3173 12.6012 12.6012 k = 0.3158 0.5000 0.2754 ( 5376 PWs) bands (ev): -15.6969 -15.6969 -15.6964 -15.6964 -10.8415 -10.8415 -10.8379 -10.8379 -10.8137 -10.8137 -10.7918 -10.7918 -8.3476 -8.3476 -8.3234 -8.3234 -8.2767 -8.2767 -8.2657 -8.2657 -8.2355 -8.2355 -8.2060 -8.2060 -6.9993 -6.9993 -6.9708 -6.9708 -0.9164 -0.9164 -0.9164 -0.9164 1.8045 1.8045 1.8866 1.8866 2.8547 2.8547 2.9447 2.9447 3.3676 3.3676 3.4127 3.4127 3.9948 3.9948 4.0336 4.0336 4.6293 4.6293 4.6933 4.6933 5.1129 5.1129 5.2412 5.2412 9.3203 9.3203 10.0530 10.0530 11.1066 11.1066 11.7646 11.7646 12.3270 12.3270 12.5762 12.5762 k = 0.3289 0.5000 0.2754 ( 5372 PWs) bands (ev): -15.6965 -15.6965 -15.6961 -15.6961 -10.8410 -10.8410 -10.8377 -10.8377 -10.8132 -10.8132 -10.7921 -10.7921 -8.3487 -8.3487 -8.3262 -8.3262 -8.2753 -8.2753 -8.2643 -8.2643 -8.2353 -8.2353 -8.2059 -8.2059 -6.9910 -6.9910 -6.9638 -6.9638 -0.9134 -0.9134 -0.9134 -0.9134 1.7939 1.7939 1.8725 1.8725 2.8772 2.8772 2.9662 2.9662 3.3852 3.3852 3.4268 3.4268 3.9650 3.9650 4.0017 4.0017 4.5812 4.5812 4.6268 4.6268 5.0922 5.0922 5.2061 5.2061 9.3735 9.3735 10.0933 10.0933 11.1113 11.1113 11.7825 11.7825 12.3319 12.3319 12.5477 12.5477 k = 0.3421 0.5000 0.2754 ( 5380 PWs) bands (ev): -15.6962 -15.6962 -15.6957 -15.6957 -10.8407 -10.8407 -10.8375 -10.8375 -10.8125 -10.8125 -10.7926 -10.7926 -8.3497 -8.3497 -8.3290 -8.3290 -8.2739 -8.2739 -8.2630 -8.2630 -8.2349 -8.2349 -8.2059 -8.2059 -6.9830 -6.9830 -6.9572 -6.9572 -0.9107 -0.9107 -0.9107 -0.9107 1.7845 1.7845 1.8591 1.8591 2.9007 2.9007 2.9886 2.9886 3.4019 3.4019 3.4398 3.4398 3.9382 3.9382 3.9726 3.9726 4.5299 4.5299 4.5581 4.5581 5.0750 5.0750 5.1748 5.1748 9.4286 9.4286 10.1309 10.1309 11.1167 11.1167 11.7942 11.7942 12.3327 12.3327 12.5165 12.5165 k = 0.3553 0.5000 0.2754 ( 5376 PWs) bands (ev): -15.6958 -15.6958 -15.6954 -15.6954 -10.8403 -10.8403 -10.8374 -10.8374 -10.8117 -10.8117 -10.7930 -10.7930 -8.3506 -8.3506 -8.3316 -8.3316 -8.2726 -8.2726 -8.2619 -8.2619 -8.2343 -8.2343 -8.2061 -8.2061 -6.9752 -6.9752 -6.9510 -6.9510 -0.9083 -0.9083 -0.9082 -0.9082 1.7763 1.7763 1.8464 1.8464 2.9255 2.9255 3.0117 3.0117 3.4176 3.4176 3.4518 3.4518 3.9141 3.9141 3.9462 3.9462 4.4761 4.4761 4.4886 4.4886 5.0607 5.0607 5.1470 5.1470 9.4850 9.4850 10.1647 10.1647 11.1239 11.1239 11.7997 11.7997 12.3300 12.3300 12.4834 12.4834 k = 0.3684 0.5000 0.2754 ( 5376 PWs) bands (ev): -15.6955 -15.6955 -15.6951 -15.6951 -10.8399 -10.8399 -10.8373 -10.8373 -10.8109 -10.8109 -10.7935 -10.7935 -8.3514 -8.3514 -8.3342 -8.3342 -8.2714 -8.2714 -8.2610 -8.2610 -8.2334 -8.2334 -8.2064 -8.2064 -6.9679 -6.9679 -6.9454 -6.9454 -0.9061 -0.9061 -0.9060 -0.9060 1.7693 1.7693 1.8345 1.8345 2.9514 2.9514 3.0354 3.0354 3.4326 3.4326 3.4628 3.4628 3.8927 3.8927 3.9225 3.9225 4.4195 4.4195 4.4206 4.4206 5.0486 5.0486 5.1226 5.1226 9.5425 9.5425 10.1936 10.1936 11.1339 11.1339 11.7991 11.7991 12.3244 12.3244 12.4496 12.4496 k = 0.3816 0.5000 0.2754 ( 5384 PWs) bands (ev): -15.6952 -15.6952 -15.6949 -15.6949 -10.8396 -10.8396 -10.8373 -10.8373 -10.8100 -10.8100 -10.7941 -10.7941 -8.3520 -8.3520 -8.3365 -8.3365 -8.2702 -8.2702 -8.2603 -8.2603 -8.2323 -8.2323 -8.2069 -8.2069 -6.9610 -6.9610 -6.9403 -6.9403 -0.9042 -0.9042 -0.9040 -0.9040 1.7634 1.7634 1.8233 1.8233 2.9783 2.9783 3.0594 3.0594 3.4468 3.4468 3.4729 3.4729 3.8737 3.8737 3.9012 3.9012 4.3519 4.3519 4.3644 4.3644 5.0383 5.0383 5.1013 5.1013 9.6006 9.6006 10.2164 10.2164 11.1477 11.1477 11.7922 11.7922 12.3167 12.3167 12.4160 12.4160 k = 0.3947 0.5000 0.2754 ( 5380 PWs) bands (ev): -15.6950 -15.6950 -15.6946 -15.6946 -10.8394 -10.8394 -10.8373 -10.8373 -10.8091 -10.8091 -10.7947 -10.7947 -8.3525 -8.3525 -8.3388 -8.3388 -8.2690 -8.2690 -8.2598 -8.2598 -8.2311 -8.2311 -8.2075 -8.2075 -6.9545 -6.9545 -6.9358 -6.9358 -0.9025 -0.9025 -0.9023 -0.9023 1.7586 1.7586 1.8128 1.8128 3.0060 3.0060 3.0834 3.0834 3.4604 3.4604 3.4822 3.4822 3.8569 3.8569 3.8821 3.8821 4.2871 4.2871 4.3084 4.3084 5.0296 5.0296 5.0827 5.0827 9.6590 9.6590 10.2321 10.2321 11.1662 11.1662 11.7789 11.7789 12.3076 12.3076 12.3838 12.3838 k = 0.4079 0.5000 0.2754 ( 5376 PWs) bands (ev): -15.6947 -15.6947 -15.6944 -15.6944 -10.8391 -10.8391 -10.8373 -10.8373 -10.8081 -10.8081 -10.7954 -10.7954 -8.3528 -8.3528 -8.3408 -8.3408 -8.2679 -8.2679 -8.2596 -8.2596 -8.2296 -8.2296 -8.2083 -8.2083 -6.9485 -6.9485 -6.9319 -6.9319 -0.9010 -0.9010 -0.9009 -0.9009 1.7549 1.7549 1.8030 1.8030 3.0341 3.0341 3.1068 3.1068 3.4735 3.4735 3.4909 3.4909 3.8421 3.8421 3.8650 3.8650 4.2260 4.2260 4.2537 4.2537 5.0224 5.0224 5.0667 5.0667 9.7173 9.7173 10.2400 10.2400 11.1900 11.1900 11.7594 11.7594 12.2976 12.2976 12.3538 12.3538 k = 0.4211 0.5000 0.2754 ( 5376 PWs) bands (ev): -15.6945 -15.6945 -15.6942 -15.6942 -10.8389 -10.8389 -10.8374 -10.8374 -10.8071 -10.8071 -10.7961 -10.7961 -8.3530 -8.3530 -8.3428 -8.3428 -8.2669 -8.2669 -8.2595 -8.2595 -8.2281 -8.2281 -8.2092 -8.2092 -6.9430 -6.9430 -6.9287 -6.9287 -0.8998 -0.8998 -0.8997 -0.8997 1.7522 1.7522 1.7940 1.7940 3.0623 3.0623 3.1289 3.1289 3.4861 3.4861 3.4989 3.4989 3.8288 3.8288 3.8496 3.8496 4.1700 4.1700 4.2015 4.2015 5.0165 5.0165 5.0529 5.0529 9.7751 9.7751 10.2398 10.2398 11.2193 11.2193 11.7337 11.7337 12.2874 12.2874 12.3271 12.3271 k = 0.4342 0.5000 0.2754 ( 5376 PWs) bands (ev): -15.6943 -15.6943 -15.6941 -15.6941 -10.8387 -10.8387 -10.8374 -10.8374 -10.8061 -10.8061 -10.7968 -10.7968 -8.3530 -8.3530 -8.3445 -8.3445 -8.2659 -8.2659 -8.2596 -8.2596 -8.2264 -8.2264 -8.2103 -8.2103 -6.9382 -6.9382 -6.9261 -6.9261 -0.8988 -0.8988 -0.8986 -0.8986 1.7505 1.7505 1.7857 1.7857 3.0898 3.0898 3.1490 3.1490 3.4981 3.4981 3.5065 3.5065 3.8169 3.8169 3.8356 3.8356 4.1205 4.1205 4.1529 4.1529 5.0118 5.0118 5.0411 5.0411 9.8319 9.8319 10.2313 10.2313 11.2540 11.2540 11.7021 11.7021 12.2776 12.2776 12.3042 12.3042 k = 0.4474 0.5000 0.2754 ( 5372 PWs) bands (ev): -15.6941 -15.6941 -15.6940 -15.6940 -10.8385 -10.8385 -10.8375 -10.8375 -10.8050 -10.8050 -10.7976 -10.7976 -8.3529 -8.3529 -8.3461 -8.3461 -8.2649 -8.2649 -8.2598 -8.2598 -8.2246 -8.2246 -8.2115 -8.2115 -6.9339 -6.9339 -6.9242 -6.9242 -0.8979 -0.8979 -0.8978 -0.8978 1.7498 1.7498 1.7782 1.7782 3.1158 3.1158 3.1660 3.1660 3.5094 3.5094 3.5138 3.5138 3.8062 3.8062 3.8229 3.8229 4.0788 4.0788 4.1093 4.1093 5.0085 5.0085 5.0312 5.0312 9.8873 9.8873 10.2150 10.2150 11.2936 11.2936 11.6652 11.6652 12.2687 12.2687 12.2855 12.2855 k = 0.4605 0.5000 0.2754 ( 5380 PWs) bands (ev): -15.6940 -15.6940 -15.6939 -15.6939 -10.8383 -10.8383 -10.8376 -10.8376 -10.8040 -10.8040 -10.7984 -10.7984 -8.3526 -8.3526 -8.3475 -8.3475 -8.2640 -8.2640 -8.2601 -8.2601 -8.2228 -8.2228 -8.2129 -8.2129 -6.9303 -6.9303 -6.9229 -6.9229 -0.8973 -0.8973 -0.8972 -0.8972 1.7501 1.7501 1.7715 1.7715 3.1395 3.1395 3.1790 3.1790 3.5193 3.5193 3.5205 3.5205 3.7972 3.7972 3.8113 3.8113 4.0464 4.0464 4.0722 4.0722 5.0065 5.0065 5.0231 5.0231 9.9409 9.9409 10.1915 10.1915 11.3372 11.3372 11.6237 11.6237 12.2612 12.2612 12.2711 12.2711 k = 0.4737 0.5000 0.2754 ( 5384 PWs) bands (ev): -15.6939 -15.6939 -15.6938 -15.6938 -10.8382 -10.8382 -10.8377 -10.8377 -10.8031 -10.8031 -10.7993 -10.7993 -8.3522 -8.3522 -8.3488 -8.3488 -8.2632 -8.2632 -8.2606 -8.2606 -8.2210 -8.2210 -8.2144 -8.2144 -6.9273 -6.9273 -6.9224 -6.9224 -0.8969 -0.8969 -0.8968 -0.8968 1.7514 1.7514 1.7657 1.7657 3.1596 3.1596 3.1869 3.1869 3.5264 3.5264 3.5270 3.5270 3.7904 3.7904 3.8010 3.8010 4.0242 4.0242 4.0429 4.0429 5.0057 5.0057 5.0166 5.0166 9.9921 9.9921 10.1615 10.1615 11.3838 11.3838 11.5786 11.5786 12.2556 12.2556 12.2609 12.2609 k = 0.4868 0.5000 0.2754 ( 5388 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8380 -10.8380 -10.8378 -10.8378 -10.8021 -10.8021 -10.8002 -10.8002 -8.3516 -8.3516 -8.3499 -8.3499 -8.2625 -8.2625 -8.2611 -8.2611 -8.2193 -8.2193 -8.2159 -8.2159 -6.9251 -6.9251 -6.9226 -6.9226 -0.8966 -0.8966 -0.8965 -0.8965 1.7536 1.7536 1.7608 1.7608 3.1751 3.1751 3.1891 3.1891 3.5309 3.5309 3.5317 3.5317 3.7871 3.7871 3.7929 3.7929 4.0129 4.0129 4.0227 4.0227 5.0063 5.0063 5.0117 5.0117 10.0405 10.0405 10.1258 10.1258 11.4324 11.4324 11.5309 11.5309 12.2523 12.2523 12.2546 12.2546 k = 0.5000 0.5000 0.2754 ( 5384 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8379 -10.8379 -10.8379 -10.8379 -10.8011 -10.8011 -10.8011 -10.8011 -8.3508 -8.3508 -8.3508 -8.3508 -8.2618 -8.2618 -8.2618 -8.2618 -8.2176 -8.2176 -8.2176 -8.2176 -6.9235 -6.9235 -6.9235 -6.9235 -0.8965 -0.8965 -0.8965 -0.8965 1.7567 1.7567 1.7567 1.7567 3.1851 3.1851 3.1851 3.1851 3.5330 3.5330 3.5330 3.5330 3.7879 3.7879 3.7879 3.7879 4.0125 4.0125 4.0125 4.0125 5.0083 5.0083 5.0083 5.0083 10.0852 10.0852 10.0852 10.0852 11.4818 11.4818 11.4818 11.4818 12.2519 12.2519 12.2519 12.2519 k = 0.5000 0.5000 0.2754 ( 5384 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8379 -10.8379 -10.8379 -10.8379 -10.8011 -10.8011 -10.8011 -10.8011 -8.3508 -8.3508 -8.3508 -8.3508 -8.2618 -8.2618 -8.2618 -8.2618 -8.2176 -8.2176 -8.2176 -8.2176 -6.9235 -6.9235 -6.9235 -6.9235 -0.8965 -0.8965 -0.8965 -0.8965 1.7567 1.7567 1.7567 1.7567 3.1851 3.1851 3.1851 3.1851 3.5330 3.5330 3.5330 3.5330 3.7879 3.7879 3.7879 3.7879 4.0125 4.0125 4.0125 4.0125 5.0083 5.0083 5.0083 5.0083 10.0852 10.0852 10.0852 10.0852 11.4818 11.4818 11.4818 11.4818 12.2519 12.2519 12.2519 12.2519 k = 0.4907 0.4907 0.2754 ( 5388 PWs) bands (ev): -15.6940 -15.6940 -15.6937 -15.6937 -10.8380 -10.8380 -10.8378 -10.8378 -10.8021 -10.8021 -10.8002 -10.8002 -8.3516 -8.3516 -8.3499 -8.3499 -8.2624 -8.2624 -8.2611 -8.2611 -8.2193 -8.2193 -8.2159 -8.2159 -6.9251 -6.9251 -6.9226 -6.9226 -0.8969 -0.8969 -0.8962 -0.8962 1.7535 1.7535 1.7608 1.7608 3.1741 3.1741 3.1902 3.1902 3.5298 3.5298 3.5329 3.5329 3.7870 3.7870 3.7929 3.7929 4.0121 4.0121 4.0234 4.0234 5.0063 5.0063 5.0118 5.0118 10.0405 10.0405 10.1258 10.1258 11.4326 11.4326 11.5307 11.5307 12.2520 12.2520 12.2549 12.2549 k = 0.4815 0.4815 0.2754 ( 5388 PWs) bands (ev): -15.6945 -15.6945 -15.6932 -15.6932 -10.8382 -10.8382 -10.8377 -10.8377 -10.8030 -10.8030 -10.7993 -10.7993 -8.3522 -8.3522 -8.3488 -8.3488 -8.2632 -8.2632 -8.2606 -8.2606 -8.2210 -8.2210 -8.2144 -8.2144 -6.9275 -6.9275 -6.9222 -6.9222 -0.8984 -0.8984 -0.8953 -0.8953 1.7512 1.7512 1.7659 1.7659 3.1529 3.1529 3.1946 3.1946 3.5206 3.5206 3.5325 3.5325 3.7899 3.7899 3.8014 3.8014 4.0187 4.0187 4.0479 4.0479 5.0054 5.0054 5.0170 5.0170 9.9915 9.9915 10.1625 10.1625 11.3841 11.3841 11.5782 11.5782 12.2537 12.2537 12.2625 12.2625 k = 0.4722 0.4722 0.2754 ( 5380 PWs) bands (ev): -15.6954 -15.6954 -15.6925 -15.6925 -10.8383 -10.8383 -10.8376 -10.8376 -10.8040 -10.8040 -10.7984 -10.7984 -8.3526 -8.3526 -8.3476 -8.3476 -8.2640 -8.2640 -8.2601 -8.2601 -8.2229 -8.2229 -8.2129 -8.2129 -6.9309 -6.9309 -6.9223 -6.9223 -0.9006 -0.9006 -0.8938 -0.8938 1.7495 1.7495 1.7722 1.7722 3.1222 3.1222 3.2001 3.2001 3.5058 3.5058 3.5317 3.5317 3.7955 3.7955 3.8126 3.8126 4.0303 4.0303 4.0863 4.0863 5.0053 5.0053 5.0243 5.0243 9.9380 9.9380 10.1956 10.1956 11.3372 11.3372 11.6234 11.6234 12.2567 12.2567 12.2747 12.2747 k = 0.4630 0.4630 0.2754 ( 5380 PWs) bands (ev): -15.6966 -15.6966 -15.6915 -15.6915 -10.8385 -10.8385 -10.8375 -10.8375 -10.8051 -10.8051 -10.7976 -10.7976 -8.3528 -8.3528 -8.3462 -8.3462 -8.2649 -8.2649 -8.2597 -8.2597 -8.2248 -8.2248 -8.2115 -8.2115 -6.9353 -6.9353 -6.9227 -6.9227 -0.9038 -0.9038 -0.8916 -0.8916 1.7483 1.7483 1.7798 1.7798 3.0847 3.0847 3.2066 3.2066 3.4862 3.4862 3.5308 3.5308 3.8027 3.8027 3.8266 3.8266 4.0461 4.0461 4.1371 4.1371 5.0059 5.0059 5.0340 5.0340 9.8801 9.8801 10.2255 10.2255 11.2926 11.2926 11.6652 11.6652 12.2607 12.2607 12.2910 12.2910 k = 0.4537 0.4537 0.2754 ( 5364 PWs) bands (ev): -15.6981 -15.6981 -15.6903 -15.6903 -10.8386 -10.8386 -10.8374 -10.8374 -10.8061 -10.8061 -10.7968 -10.7968 -8.3529 -8.3529 -8.3447 -8.3447 -8.2659 -8.2659 -8.2594 -8.2594 -8.2267 -8.2267 -8.2101 -8.2101 -6.9408 -6.9408 -6.9235 -6.9235 -0.9076 -0.9076 -0.8889 -0.8889 1.7478 1.7478 1.7888 1.7888 3.0432 3.0432 3.2136 3.2136 3.4626 3.4626 3.5295 3.5295 3.8102 3.8102 3.8442 3.8442 4.0653 4.0653 4.1977 4.1977 5.0071 5.0071 5.0464 5.0464 9.8180 9.8180 10.2524 10.2524 11.2509 11.2509 11.7029 11.7029 12.2657 12.2657 12.3105 12.3105 k = 0.4444 0.4444 0.2754 ( 5378 PWs) bands (ev): -15.7000 -15.7000 -15.6888 -15.6888 -10.8389 -10.8389 -10.8374 -10.8374 -10.8072 -10.8072 -10.7960 -10.7960 -8.3527 -8.3527 -8.3431 -8.3431 -8.2669 -8.2669 -8.2591 -8.2591 -8.2286 -8.2286 -8.2089 -8.2089 -6.9473 -6.9473 -6.9245 -6.9245 -0.9121 -0.9121 -0.8856 -0.8856 1.7477 1.7477 1.7993 1.7993 2.9999 2.9999 3.2204 3.2204 3.4359 3.4359 3.5280 3.5280 3.8174 3.8174 3.8662 3.8662 4.0874 4.0874 4.2654 4.2654 5.0089 5.0089 5.0617 5.0617 9.7520 9.7520 10.2765 10.2765 11.2124 11.2124 11.7361 11.7361 12.2716 12.2716 12.3321 12.3321 k = 0.4352 0.4352 0.2754 ( 5378 PWs) bands (ev): -15.7022 -15.7022 -15.6870 -15.6870 -10.8391 -10.8391 -10.8373 -10.8373 -10.8083 -10.8083 -10.7953 -10.7953 -8.3524 -8.3524 -8.3414 -8.3414 -8.2680 -8.2680 -8.2590 -8.2590 -8.2306 -8.2306 -8.2078 -8.2078 -6.9549 -6.9549 -6.9257 -6.9257 -0.9172 -0.9172 -0.8816 -0.8816 1.7481 1.7481 1.8113 1.8113 2.9565 2.9565 3.2261 3.2261 3.4069 3.4069 3.5262 3.5262 3.8245 3.8245 3.8931 3.8931 4.1119 4.1119 4.3376 4.3376 5.0114 5.0114 5.0803 5.0803 9.6827 9.6827 10.2981 10.2981 11.1774 11.1774 11.7645 11.7645 12.2781 12.2781 12.3544 12.3544 k = 0.4259 0.4259 0.2754 ( 5372 PWs) bands (ev): -15.7047 -15.7047 -15.6849 -15.6849 -10.8393 -10.8393 -10.8372 -10.8372 -10.8094 -10.8094 -10.7945 -10.7945 -8.3519 -8.3519 -8.3396 -8.3396 -8.2692 -8.2692 -8.2589 -8.2589 -8.2326 -8.2326 -8.2067 -8.2067 -6.9636 -6.9636 -6.9271 -6.9271 -0.9226 -0.9226 -0.8770 -0.8770 1.7491 1.7491 1.8249 1.8249 2.9141 2.9141 3.2299 3.2299 3.3763 3.3763 3.5240 3.5240 3.8316 3.8316 3.9252 3.9252 4.1385 4.1385 4.4123 4.4123 5.0146 5.0146 5.1027 5.1027 9.6105 9.6105 10.3173 10.3173 11.1458 11.1458 11.7881 11.7881 12.2850 12.2850 12.3757 12.3757 k = 0.4167 0.4167 0.2754 ( 5372 PWs) bands (ev): -15.7075 -15.7075 -15.6826 -15.6826 -10.8396 -10.8396 -10.8372 -10.8372 -10.8106 -10.8106 -10.7938 -10.7938 -8.3512 -8.3512 -8.3377 -8.3377 -8.2704 -8.2704 -8.2589 -8.2589 -8.2346 -8.2346 -8.2058 -8.2058 -6.9734 -6.9734 -6.9288 -6.9288 -0.9282 -0.9282 -0.8718 -0.8718 1.7506 1.7506 1.8400 1.8400 2.8736 2.8736 3.2307 3.2307 3.3452 3.3452 3.5216 3.5216 3.8387 3.8387 3.9623 3.9623 4.1670 4.1670 4.4873 4.4873 5.0189 5.0189 5.1292 5.1292 9.5364 9.5364 10.3341 10.3341 11.1177 11.1177 11.8069 11.8069 12.2921 12.2921 12.3943 12.3943 k = 0.4074 0.4074 0.2754 ( 5378 PWs) bands (ev): -15.7106 -15.7106 -15.6801 -15.6801 -10.8399 -10.8399 -10.8372 -10.8372 -10.8117 -10.8117 -10.7932 -10.7932 -8.3503 -8.3503 -8.3357 -8.3357 -8.2717 -8.2717 -8.2590 -8.2590 -8.2366 -8.2366 -8.2049 -8.2049 -6.9841 -6.9841 -6.9307 -6.9307 -0.9340 -0.9340 -0.8659 -0.8659 1.7527 1.7527 1.8567 1.8567 2.8355 2.8355 3.2268 3.2268 3.3155 3.3155 3.5188 3.5188 3.8461 3.8461 4.0040 4.0040 4.1974 4.1974 4.5608 4.5608 5.0244 5.0244 5.1603 5.1603 9.4611 9.4611 10.3486 10.3486 11.0929 11.0929 11.8212 11.8212 12.2990 12.2990 12.4087 12.4087 k = 0.3981 0.3981 0.2754 ( 5366 PWs) bands (ev): -15.7140 -15.7140 -15.6773 -15.6773 -10.8402 -10.8402 -10.8371 -10.8371 -10.8129 -10.8129 -10.7925 -10.7925 -8.3493 -8.3493 -8.3336 -8.3336 -8.2730 -8.2730 -8.2592 -8.2592 -8.2386 -8.2386 -8.2042 -8.2042 -6.9959 -6.9959 -6.9327 -6.9327 -0.9397 -0.9397 -0.8593 -0.8593 1.7553 1.7553 1.8749 1.8749 2.8005 2.8005 3.2151 3.2151 3.2903 3.2903 3.5157 3.5157 3.8538 3.8538 4.0497 4.0497 4.2298 4.2298 4.6309 4.6309 5.0314 5.0314 5.1967 5.1967 9.3856 9.3856 10.3606 10.3606 11.0713 11.0713 11.8310 11.8310 12.3055 12.3055 12.4170 12.4170 k = 0.3889 0.3889 0.2754 ( 5358 PWs) bands (ev): -15.7177 -15.7177 -15.6742 -15.6742 -10.8405 -10.8405 -10.8371 -10.8371 -10.8140 -10.8140 -10.7919 -10.7919 -8.3481 -8.3481 -8.3315 -8.3315 -8.2743 -8.2743 -8.2595 -8.2595 -8.2405 -8.2405 -8.2035 -8.2035 -7.0085 -7.0085 -6.9350 -6.9350 -0.9451 -0.9451 -0.8521 -0.8521 1.7584 1.7584 1.8946 1.8946 2.7686 2.7686 3.1930 3.1930 3.2728 3.2728 3.5124 3.5124 3.8618 3.8618 4.0982 4.0982 4.2645 4.2645 4.6959 4.6959 5.0405 5.0405 5.2385 5.2385 9.3107 9.3107 10.3700 10.3700 11.0526 11.0526 11.8367 11.8367 12.3112 12.3112 12.4179 12.4179 k = 0.3796 0.3796 0.2754 ( 5374 PWs) bands (ev): -15.7216 -15.7216 -15.6710 -15.6710 -10.8408 -10.8408 -10.8372 -10.8372 -10.8152 -10.8152 -10.7913 -10.7913 -8.3467 -8.3467 -8.3294 -8.3294 -8.2757 -8.2757 -8.2601 -8.2601 -8.2423 -8.2423 -8.2030 -8.2030 -7.0221 -7.0221 -6.9374 -6.9374 -0.9502 -0.9502 -0.8441 -0.8441 1.7619 1.7619 1.9158 1.9158 2.7402 2.7402 3.1621 3.1621 3.2616 3.2616 3.5087 3.5087 3.8702 3.8702 4.1482 4.1482 4.3020 4.3020 4.7548 4.7548 5.0522 5.0522 5.2857 5.2857 9.2377 9.2377 10.3766 10.3766 11.0367 11.0367 11.8386 11.8386 12.3161 12.3161 12.4102 12.4102 k = 0.3704 0.3704 0.2754 ( 5370 PWs) bands (ev): -15.7258 -15.7258 -15.6675 -15.6675 -10.8412 -10.8412 -10.8372 -10.8372 -10.8164 -10.8164 -10.7908 -10.7908 -8.3452 -8.3452 -8.3272 -8.3272 -8.2771 -8.2771 -8.2607 -8.2607 -8.2440 -8.2440 -8.2025 -8.2025 -7.0366 -7.0366 -6.9401 -6.9401 -0.9548 -0.9548 -0.8354 -0.8354 1.7659 1.7659 1.9384 1.9384 2.7155 2.7155 3.1263 3.1263 3.2534 3.2534 3.5047 3.5047 3.8790 3.8790 4.1979 4.1979 4.3430 4.3430 4.8067 4.8067 5.0671 5.0671 5.3377 5.3377 9.1676 9.1676 10.3800 10.3800 11.0234 11.0234 11.8368 11.8368 12.3200 12.3200 12.3930 12.3930 k = 0.3611 0.3611 0.2754 ( 5366 PWs) bands (ev): -15.7302 -15.7302 -15.6639 -15.6639 -10.8416 -10.8416 -10.8372 -10.8372 -10.8175 -10.8175 -10.7902 -10.7902 -8.3436 -8.3436 -8.3250 -8.3250 -8.2785 -8.2785 -8.2615 -8.2615 -8.2455 -8.2455 -8.2022 -8.2022 -7.0518 -7.0518 -6.9429 -6.9429 -0.9588 -0.9588 -0.8259 -0.8259 1.7702 1.7702 1.9625 1.9625 2.6944 2.6944 3.0878 3.0878 3.2464 3.2464 3.5004 3.5004 3.8882 3.8882 4.2458 4.2458 4.3877 4.3877 4.8518 4.8518 5.0856 5.0856 5.3930 5.3930 9.1015 9.1015 10.3799 10.3799 11.0126 11.0126 11.8318 11.8318 12.3231 12.3231 12.3657 12.3657 k = 0.3519 0.3519 0.2754 ( 5374 PWs) bands (ev): -15.7348 -15.7348 -15.6601 -15.6601 -10.8421 -10.8421 -10.8373 -10.8373 -10.8187 -10.8187 -10.7898 -10.7898 -8.3419 -8.3419 -8.3228 -8.3228 -8.2800 -8.2800 -8.2626 -8.2626 -8.2470 -8.2470 -8.2019 -8.2019 -7.0678 -7.0678 -6.9459 -6.9459 -0.9620 -0.9620 -0.8157 -0.8157 1.7748 1.7748 1.9879 1.9879 2.6770 2.6770 3.0479 3.0479 3.2400 3.2400 3.4960 3.4960 3.8979 3.8979 4.2907 4.2907 4.4358 4.4358 4.8912 4.8912 5.1080 5.1080 5.4500 5.4500 9.0407 9.0407 10.3760 10.3760 11.0041 11.0041 11.8241 11.8241 12.3253 12.3253 12.3283 12.3283 k = 0.3426 0.3426 0.2754 ( 5380 PWs) bands (ev): -15.7397 -15.7397 -15.6561 -15.6561 -10.8425 -10.8425 -10.8374 -10.8374 -10.8198 -10.8198 -10.7893 -10.7893 -8.3402 -8.3402 -8.3205 -8.3205 -8.2815 -8.2815 -8.2638 -8.2638 -8.2482 -8.2482 -8.2017 -8.2017 -7.0845 -7.0845 -6.9490 -6.9490 -0.9644 -0.9644 -0.8045 -0.8045 1.7796 1.7796 2.0146 2.0146 2.6632 2.6632 3.0071 3.0071 3.2340 3.2340 3.4913 3.4913 3.9079 3.9079 4.3326 4.3326 4.4857 4.4857 4.9267 4.9267 5.1344 5.1344 5.5065 5.5065 8.9863 8.9863 10.3677 10.3677 10.9980 10.9980 11.8143 11.8143 12.2810 12.2810 12.3271 12.3271 k = 0.3333 0.3333 0.2754 ( 5372 PWs) bands (ev): -15.7447 -15.7447 -15.6519 -15.6519 -10.8430 -10.8430 -10.8376 -10.8376 -10.8209 -10.8209 -10.7888 -10.7888 -8.3383 -8.3383 -8.3183 -8.3183 -8.2829 -8.2829 -8.2651 -8.2651 -8.2493 -8.2493 -8.2016 -8.2016 -7.1018 -7.1018 -6.9523 -6.9523 -0.9658 -0.9658 -0.7925 -0.7925 1.7845 1.7845 2.0425 2.0425 2.6531 2.6531 2.9658 2.9658 3.2287 3.2287 3.4864 3.4864 3.9183 3.9183 4.3719 4.3719 4.5353 4.5353 4.9604 4.9604 5.1643 5.1643 5.5602 5.5602 8.9395 8.9395 10.3547 10.3547 10.9940 10.9940 11.8032 11.8032 12.2247 12.2247 12.3284 12.3284 k = 0.3241 0.3241 0.2754 ( 5360 PWs) bands (ev): -15.7498 -15.7498 -15.6475 -15.6475 -10.8435 -10.8435 -10.8377 -10.8377 -10.8220 -10.8220 -10.7884 -10.7884 -8.3365 -8.3365 -8.3161 -8.3161 -8.2843 -8.2843 -8.2667 -8.2667 -8.2502 -8.2502 -8.2016 -8.2016 -7.1197 -7.1197 -6.9558 -6.9558 -0.9661 -0.9661 -0.7796 -0.7796 1.7894 1.7894 2.0716 2.0716 2.6463 2.6463 2.9245 2.9245 3.2241 3.2241 3.4813 3.4813 3.9291 3.9291 4.4092 4.4092 4.5819 4.5819 4.9948 4.9948 5.1974 5.1974 5.6091 5.6091 8.9015 8.9015 10.3366 10.3366 10.9923 10.9923 11.7916 11.7916 12.1603 12.1603 12.3297 12.3297 k = 0.3148 0.3148 0.2754 ( 5352 PWs) bands (ev): -15.7552 -15.7552 -15.6431 -15.6431 -10.8440 -10.8440 -10.8379 -10.8379 -10.8230 -10.8230 -10.7880 -10.7880 -8.3346 -8.3346 -8.3139 -8.3139 -8.2857 -8.2857 -8.2683 -8.2683 -8.2510 -8.2510 -8.2016 -8.2016 -7.1381 -7.1381 -6.9593 -6.9593 -0.9653 -0.9653 -0.7657 -0.7657 1.7942 1.7942 2.1018 2.1018 2.6427 2.6427 2.8834 2.8834 3.2205 3.2205 3.4761 3.4761 3.9403 3.9403 4.4451 4.4451 4.6235 4.6235 5.0314 5.0314 5.2335 5.2335 5.6514 5.6514 8.8733 8.8733 10.3131 10.3131 10.9928 10.9928 11.7804 11.7804 12.0891 12.0891 12.3311 12.3311 k = 0.3056 0.3056 0.2754 ( 5340 PWs) bands (ev): -15.7606 -15.7606 -15.6385 -15.6385 -10.8446 -10.8446 -10.8381 -10.8381 -10.8240 -10.8240 -10.7876 -10.7876 -8.3327 -8.3327 -8.3117 -8.3117 -8.2871 -8.2871 -8.2700 -8.2700 -8.2516 -8.2516 -8.2017 -8.2017 -7.1569 -7.1569 -6.9631 -6.9631 -0.9634 -0.9634 -0.7508 -0.7508 1.7988 1.7988 2.1330 2.1330 2.6417 2.6417 2.8432 2.8432 3.2181 3.2181 3.4707 3.4707 3.9517 3.9517 4.4799 4.4799 4.6587 4.6587 5.0711 5.0711 5.2723 5.2723 5.6854 5.6854 8.8556 8.8556 10.2842 10.2842 10.9955 10.9955 11.7707 11.7707 12.0127 12.0127 12.3327 12.3327 k = 0.2963 0.2963 0.2754 ( 5336 PWs) bands (ev): -15.7662 -15.7662 -15.6338 -15.6338 -10.8452 -10.8452 -10.8384 -10.8384 -10.8250 -10.8250 -10.7873 -10.7873 -8.3310 -8.3310 -8.3097 -8.3097 -8.2883 -8.2883 -8.2717 -8.2717 -8.2522 -8.2522 -8.2019 -8.2019 -7.1762 -7.1762 -6.9669 -6.9669 -0.9603 -0.9603 -0.7348 -0.7348 1.8032 1.8032 2.1651 2.1651 2.6422 2.6422 2.8048 2.8048 3.2171 3.2171 3.4652 3.4652 3.9634 3.9634 4.5140 4.5140 4.6872 4.6872 5.1137 5.1137 5.3138 5.3138 5.7100 5.7100 8.8489 8.8489 10.2499 10.2499 11.0005 11.0005 11.7631 11.7631 11.9325 11.9325 12.3348 12.3348 k = 0.2870 0.2870 0.2754 ( 5340 PWs) bands (ev): -15.7718 -15.7718 -15.6290 -15.6290 -10.8458 -10.8458 -10.8386 -10.8386 -10.8259 -10.8259 -10.7870 -10.7870 -8.3293 -8.3293 -8.3078 -8.3078 -8.2894 -8.2894 -8.2734 -8.2734 -8.2527 -8.2527 -8.2021 -8.2021 -7.1957 -7.1957 -6.9708 -6.9708 -0.9560 -0.9560 -0.7178 -0.7178 1.8073 1.8073 2.1981 2.1981 2.6420 2.6420 2.7706 2.7706 3.2176 3.2176 3.4596 3.4596 3.9754 3.9754 4.5473 4.5473 4.7094 4.7094 5.1582 5.1582 5.3576 5.3576 5.7247 5.7247 8.8532 8.8532 10.2107 10.2107 11.0078 11.0078 11.7576 11.7576 11.8510 11.8510 12.3373 12.3373 k = 0.2778 0.2778 0.2754 ( 5338 PWs) bands (ev): -15.7775 -15.7775 -15.6242 -15.6242 -10.8464 -10.8464 -10.8389 -10.8389 -10.8268 -10.8268 -10.7867 -10.7867 -8.3277 -8.3277 -8.3062 -8.3062 -8.2903 -8.2903 -8.2751 -8.2751 -8.2531 -8.2531 -8.2024 -8.2024 -7.2155 -7.2155 -6.9749 -6.9749 -0.9504 -0.9504 -0.6997 -0.6997 1.8110 1.8110 2.2318 2.2318 2.6364 2.6364 2.7453 2.7453 3.2198 3.2198 3.4539 3.4539 3.9876 3.9876 4.5798 4.5798 4.7265 4.7265 5.2031 5.2031 5.4033 5.4033 5.7292 5.7292 8.8681 8.8681 10.1670 10.1670 11.0174 11.0174 11.7443 11.7443 11.7804 11.7804 12.3405 12.3405 k = 0.2685 0.2685 0.2754 ( 5338 PWs) bands (ev): -15.7833 -15.7833 -15.6193 -15.6193 -10.8471 -10.8471 -10.8393 -10.8393 -10.8277 -10.8277 -10.7865 -10.7865 -8.3263 -8.3263 -8.3048 -8.3048 -8.2909 -8.2909 -8.2767 -8.2767 -8.2535 -8.2535 -8.2027 -8.2027 -7.2354 -7.2354 -6.9790 -6.9790 -0.9437 -0.9437 -0.6804 -0.6804 1.8144 1.8144 2.2662 2.2662 2.6192 2.6192 2.7348 2.7348 3.2237 3.2237 3.4482 3.4482 4.0000 4.0000 4.6113 4.6113 4.7397 4.7397 5.2473 5.2473 5.4497 5.4497 5.7241 5.7241 8.8925 8.8925 10.1198 10.1198 11.0292 11.0292 11.6764 11.6764 11.7694 11.7694 12.3442 12.3442 k = 0.2593 0.2593 0.2754 ( 5342 PWs) bands (ev): -15.7891 -15.7891 -15.6143 -15.6143 -10.8478 -10.8478 -10.8396 -10.8396 -10.8285 -10.8285 -10.7862 -10.7862 -8.3250 -8.3250 -8.3040 -8.3040 -8.2910 -8.2910 -8.2783 -8.2783 -8.2538 -8.2538 -8.2030 -8.2030 -7.2554 -7.2554 -6.9832 -6.9832 -0.9358 -0.9358 -0.6600 -0.6600 1.8174 1.8174 2.3010 2.3010 2.5908 2.5908 2.7388 2.7388 3.2294 3.2294 3.4424 3.4424 4.0125 4.0125 4.6415 4.6415 4.7503 4.7503 5.2899 5.2899 5.4949 5.4949 5.7112 5.7112 8.9249 8.9249 10.0703 10.0703 11.0430 11.0430 11.5973 11.5973 11.7767 11.7767 12.3486 12.3486 k = 0.2500 0.2500 0.2754 ( 5340 PWs) bands (ev): -15.7949 -15.7949 -15.6094 -15.6094 -10.8485 -10.8485 -10.8400 -10.8400 -10.8293 -10.8293 -10.7860 -10.7860 -8.3240 -8.3240 -8.3037 -8.3037 -8.2906 -8.2906 -8.2798 -8.2798 -8.2540 -8.2540 -8.2033 -8.2033 -7.2755 -7.2755 -6.9875 -6.9875 -0.9268 -0.9268 -0.6385 -0.6385 1.8201 1.8201 2.3363 2.3363 2.5565 2.5565 2.7519 2.7519 3.2369 3.2369 3.4366 3.4366 4.0251 4.0251 4.6696 4.6696 4.7600 4.7600 5.3302 5.3302 5.5346 5.5346 5.6946 5.6946 8.9632 8.9632 10.0198 10.0198 11.0582 11.0582 11.5215 11.5215 11.7900 11.7900 12.3538 12.3538 k = 0.2407 0.2407 0.2754 ( 5340 PWs) bands (ev): -15.8007 -15.8007 -15.6044 -15.6044 -10.8492 -10.8492 -10.8403 -10.8403 -10.8301 -10.8301 -10.7859 -10.7859 -8.3231 -8.3231 -8.3038 -8.3038 -8.2898 -8.2898 -8.2812 -8.2812 -8.2541 -8.2541 -8.2036 -8.2036 -7.2955 -7.2955 -6.9918 -6.9918 -0.9167 -0.9167 -0.6157 -0.6157 1.8225 1.8225 2.3719 2.3719 2.5199 2.5199 2.7705 2.7705 3.2461 3.2461 3.4309 3.4309 4.0376 4.0376 4.6939 4.6939 4.7708 4.7708 5.3673 5.3673 5.5594 5.5594 5.6843 5.6843 9.0048 9.0048 9.9700 9.9700 11.0736 11.0736 11.4527 11.4527 11.8084 11.8084 12.3597 12.3597 k = 0.2315 0.2315 0.2754 ( 5346 PWs) bands (ev): -15.8065 -15.8065 -15.5994 -15.5994 -10.8500 -10.8500 -10.8407 -10.8407 -10.8309 -10.8309 -10.7857 -10.7857 -8.3225 -8.3225 -8.3042 -8.3042 -8.2887 -8.2887 -8.2825 -8.2825 -8.2542 -8.2542 -8.2039 -8.2039 -7.3154 -7.3154 -6.9961 -6.9961 -0.9055 -0.9055 -0.5919 -0.5919 1.8245 1.8245 2.4072 2.4072 2.4829 2.4829 2.7928 2.7928 3.2571 3.2571 3.4252 3.4252 4.0502 4.0502 4.7124 4.7124 4.7853 4.7853 5.3988 5.3988 5.5575 5.5575 5.6944 5.6944 9.0464 9.0464 9.9231 9.9231 11.0866 11.0866 11.3949 11.3949 11.8318 11.8318 12.3665 12.3665 k = 0.2222 0.2222 0.2754 ( 5344 PWs) bands (ev): -15.8123 -15.8123 -15.5945 -15.5945 -10.8507 -10.8507 -10.8411 -10.8411 -10.8316 -10.8316 -10.7856 -10.7856 -8.3221 -8.3221 -8.3049 -8.3049 -8.2875 -8.2875 -8.2837 -8.2837 -8.2542 -8.2542 -8.2042 -8.2042 -7.3351 -7.3351 -7.0004 -7.0004 -0.8935 -0.8935 -0.5669 -0.5669 1.8264 1.8264 2.4350 2.4350 2.4536 2.4536 2.8177 2.8177 3.2696 3.2696 3.4196 3.4196 4.0626 4.0626 4.7238 4.7238 4.8049 4.8049 5.4172 5.4172 5.5407 5.5407 5.7210 5.7210 9.0843 9.0843 9.8813 9.8813 11.0928 11.0928 11.3539 11.3539 11.8602 11.8602 12.3743 12.3743 k = 0.2130 0.2130 0.2754 ( 5348 PWs) bands (ev): -15.8179 -15.8179 -15.5896 -15.5896 -10.8514 -10.8514 -10.8414 -10.8414 -10.8323 -10.8323 -10.7855 -10.7855 -8.3219 -8.3219 -8.3055 -8.3055 -8.2862 -8.2862 -8.2847 -8.2847 -8.2541 -8.2541 -8.2045 -8.2045 -7.3545 -7.3545 -7.0047 -7.0047 -0.8806 -0.8806 -0.5408 -0.5408 1.8282 1.8282 2.4060 2.4060 2.4816 2.4816 2.8448 2.8448 3.2835 3.2835 3.4142 3.4142 4.0748 4.0748 4.7296 4.7296 4.8284 4.8284 5.4071 5.4071 5.5373 5.5373 5.7517 5.7517 9.1145 9.1145 9.8471 9.8471 11.0878 11.0878 11.3357 11.3357 11.8934 11.8934 12.3833 12.3833 k = 0.2037 0.2037 0.2754 ( 5350 PWs) bands (ev): -15.8235 -15.8235 -15.5847 -15.5847 -10.8521 -10.8521 -10.8418 -10.8418 -10.8330 -10.8330 -10.7854 -10.7854 -8.3219 -8.3219 -8.3062 -8.3062 -8.2858 -8.2858 -8.2850 -8.2850 -8.2539 -8.2539 -8.2048 -8.2048 -7.3736 -7.3736 -7.0091 -7.0091 -0.8670 -0.8670 -0.5137 -0.5137 1.8299 1.8299 2.3702 2.3702 2.5169 2.5169 2.8736 2.8736 3.2986 3.2986 3.4092 3.4092 4.0866 4.0866 4.7319 4.7319 4.8539 4.8539 5.3677 5.3677 5.5540 5.5540 5.7812 5.7812 9.1333 9.1333 9.8226 9.8226 11.0718 11.0718 11.3410 11.3410 11.9312 11.9312 12.3935 12.3935 k = 0.1944 0.1944 0.2754 ( 5346 PWs) bands (ev): -15.8290 -15.8290 -15.5800 -15.5800 -10.8528 -10.8528 -10.8421 -10.8421 -10.8337 -10.8337 -10.7853 -10.7853 -8.3221 -8.3221 -8.3069 -8.3069 -8.2867 -8.2867 -8.2840 -8.2840 -8.2536 -8.2536 -8.2050 -8.2050 -7.3924 -7.3924 -7.0133 -7.0133 -0.8528 -0.8528 -0.4857 -0.4857 1.8317 1.8317 2.3350 2.3350 2.5523 2.5523 2.9036 2.9036 3.3144 3.3144 3.4049 3.4049 4.0981 4.0981 4.7321 4.7321 4.8798 4.8798 5.3139 5.3139 5.5782 5.5782 5.8076 5.8076 9.1380 9.1380 9.8088 9.8088 11.0517 11.0517 11.3640 11.3640 11.9738 11.9738 12.4052 12.4052 k = 0.1852 0.1852 0.2754 ( 5346 PWs) bands (ev): -15.8344 -15.8344 -15.5753 -15.5753 -10.8535 -10.8535 -10.8425 -10.8425 -10.8343 -10.8343 -10.7853 -10.7853 -8.3224 -8.3224 -8.3075 -8.3075 -8.2875 -8.2875 -8.2830 -8.2830 -8.2533 -8.2533 -8.2052 -8.2052 -7.4106 -7.4106 -7.0175 -7.0175 -0.8380 -0.8380 -0.4569 -0.4569 1.8335 1.8335 2.3007 2.3007 2.5874 2.5874 2.9345 2.9345 3.3303 3.3303 3.4018 3.4018 4.1091 4.1091 4.7308 4.7308 4.9055 4.9055 5.2540 5.2540 5.6030 5.6030 5.8308 5.8308 9.1281 9.1281 9.8047 9.8047 11.0345 11.0345 11.3983 11.3983 12.0209 12.0209 12.4185 12.4185 k = 0.1759 0.1759 0.2754 ( 5362 PWs) bands (ev): -15.8396 -15.8396 -15.5707 -15.5707 -10.8541 -10.8541 -10.8428 -10.8428 -10.8350 -10.8350 -10.7853 -10.7853 -8.3228 -8.3228 -8.3081 -8.3081 -8.2884 -8.2884 -8.2821 -8.2821 -8.2529 -8.2529 -8.2055 -8.2055 -7.4284 -7.4284 -7.0217 -7.0217 -0.8229 -0.8229 -0.4273 -0.4273 1.8355 1.8355 2.2676 2.2676 2.6220 2.6220 2.9660 2.9660 3.3447 3.3447 3.4013 3.4013 4.1193 4.1193 4.7285 4.7285 4.9305 4.9305 5.1915 5.1915 5.6254 5.6254 5.8512 5.8512 9.1050 9.1050 9.8076 9.8076 11.0249 11.0249 11.4394 11.4394 12.0725 12.0725 12.4339 12.4339 k = 0.1667 0.1667 0.2754 ( 5354 PWs) bands (ev): -15.8446 -15.8446 -15.5663 -15.5663 -10.8548 -10.8548 -10.8431 -10.8431 -10.8357 -10.8357 -10.7853 -10.7853 -8.3233 -8.3233 -8.3087 -8.3087 -8.2892 -8.2892 -8.2814 -8.2814 -8.2525 -8.2525 -8.2056 -8.2056 -7.4455 -7.4455 -7.0257 -7.0257 -0.8075 -0.8075 -0.3970 -0.3970 1.8377 1.8377 2.2359 2.2359 2.6560 2.6560 2.9976 2.9976 3.3549 3.3549 3.4059 3.4059 4.1288 4.1288 4.7253 4.7253 4.9543 4.9543 5.1284 5.1284 5.6435 5.6435 5.8700 5.8700 9.0716 9.0716 9.8139 9.8139 11.0251 11.0251 11.4846 11.4846 12.1283 12.1283 12.4514 12.4514 k = 0.1574 0.1574 0.2754 ( 5354 PWs) bands (ev): -15.8495 -15.8495 -15.5620 -15.5620 -10.8553 -10.8553 -10.8434 -10.8434 -10.8363 -10.8363 -10.7853 -10.7853 -8.3237 -8.3237 -8.3092 -8.3092 -8.2900 -8.2900 -8.2807 -8.2807 -8.2521 -8.2521 -8.2057 -8.2057 -7.4620 -7.4620 -7.0297 -7.0297 -0.7920 -0.7920 -0.3663 -0.3663 1.8402 1.8402 2.2055 2.2055 2.6892 2.6892 3.0290 3.0290 3.3589 3.3589 3.4175 3.4175 4.1373 4.1373 4.7213 4.7213 4.9764 4.9764 5.0666 5.0666 5.6559 5.6559 5.8884 5.8884 9.0307 9.0307 9.8205 9.8205 11.0360 11.0360 11.5317 11.5317 12.1880 12.1880 12.4714 12.4714 k = 0.1481 0.1481 0.2754 ( 5342 PWs) bands (ev): -15.8542 -15.8542 -15.5578 -15.5578 -10.8559 -10.8559 -10.8437 -10.8437 -10.8370 -10.8370 -10.7854 -10.7854 -8.3242 -8.3242 -8.3097 -8.3097 -8.2908 -8.2908 -8.2801 -8.2801 -8.2517 -8.2517 -8.2059 -8.2059 -7.4779 -7.4779 -7.0335 -7.0335 -0.7765 -0.7765 -0.3354 -0.3354 1.8429 1.8429 2.1767 2.1767 2.7215 2.7215 3.0598 3.0598 3.3585 3.3585 3.4342 3.4342 4.1446 4.1446 4.7164 4.7164 4.9910 4.9910 5.0130 5.0130 5.6617 5.6617 5.9075 5.9075 8.9848 8.9848 9.8254 9.8254 11.0574 11.0574 11.5793 11.5793 12.2512 12.2512 12.4942 12.4942 k = 0.1389 0.1389 0.2754 ( 5330 PWs) bands (ev): -15.8587 -15.8587 -15.5538 -15.5538 -10.8564 -10.8564 -10.8439 -10.8439 -10.8376 -10.8376 -10.7854 -10.7854 -8.3246 -8.3246 -8.3102 -8.3102 -8.2916 -8.2916 -8.2795 -8.2795 -8.2513 -8.2513 -8.2060 -8.2060 -7.4929 -7.4929 -7.0372 -7.0372 -0.7612 -0.7612 -0.3043 -0.3043 1.8459 1.8459 2.1496 2.1496 2.7528 2.7528 3.0895 3.0895 3.3559 3.3559 3.4535 3.4535 4.1505 4.1505 4.7103 4.7103 4.9469 4.9469 5.0199 5.0199 5.6609 5.6609 5.9280 5.9280 8.9359 8.9359 9.8275 9.8275 11.0885 11.0885 11.6258 11.6258 12.3172 12.3172 12.5199 12.5199 k = 0.1296 0.1296 0.2754 ( 5336 PWs) bands (ev): -15.8630 -15.8630 -15.5501 -15.5501 -10.8568 -10.8568 -10.8442 -10.8442 -10.8382 -10.8382 -10.7855 -10.7855 -8.3249 -8.3249 -8.3108 -8.3108 -8.2925 -8.2925 -8.2790 -8.2790 -8.2510 -8.2510 -8.2061 -8.2061 -7.5072 -7.5072 -7.0408 -7.0408 -0.7461 -0.7461 -0.2733 -0.2733 1.8490 1.8490 2.1242 2.1242 2.7830 2.7830 3.1179 3.1179 3.3525 3.3525 3.4740 3.4740 4.1548 4.1548 4.7024 4.7024 4.8962 4.8962 5.0366 5.0366 5.6539 5.6539 5.9497 5.9497 8.8854 8.8854 9.8266 9.8266 11.1276 11.1276 11.6701 11.6701 12.3852 12.3852 12.5487 12.5487 k = 0.1204 0.1204 0.2754 ( 5328 PWs) bands (ev): -15.8670 -15.8670 -15.5465 -15.5465 -10.8573 -10.8573 -10.8444 -10.8444 -10.8388 -10.8388 -10.7855 -10.7855 -8.3251 -8.3251 -8.3112 -8.3112 -8.2934 -8.2934 -8.2785 -8.2785 -8.2508 -8.2508 -8.2062 -8.2062 -7.5207 -7.5207 -7.0441 -7.0441 -0.7315 -0.7315 -0.2427 -0.2427 1.8523 1.8523 2.1006 2.1006 2.8119 2.8119 3.1444 3.1444 3.3490 3.3490 3.4949 3.4949 4.1574 4.1574 4.6918 4.6918 4.8518 4.8518 5.0515 5.0515 5.6421 5.6421 5.9725 5.9725 8.8347 8.8347 9.8230 9.8230 11.1733 11.1733 11.7112 11.7112 12.4543 12.4543 12.5806 12.5806 k = 0.1111 0.1111 0.2754 ( 5316 PWs) bands (ev): -15.8708 -15.8708 -15.5431 -15.5431 -10.8576 -10.8576 -10.8445 -10.8445 -10.8394 -10.8394 -10.7856 -10.7856 -8.3251 -8.3251 -8.3117 -8.3117 -8.2943 -8.2943 -8.2780 -8.2780 -8.2506 -8.2506 -8.2064 -8.2064 -7.5333 -7.5333 -7.0473 -7.0473 -0.7174 -0.7174 -0.2126 -0.2126 1.8556 1.8556 2.0791 2.0791 2.8394 2.8394 3.1685 3.1685 3.3455 3.3455 3.5157 3.5157 4.1580 4.1580 4.6775 4.6775 4.8159 4.8159 5.0640 5.0640 5.6267 5.6267 5.9956 5.9956 8.7846 8.7846 9.8174 9.8174 11.2239 11.2239 11.7484 11.7484 12.5229 12.5229 12.6159 12.6159 k = 0.1019 0.1019 0.2754 ( 5324 PWs) bands (ev): -15.8744 -15.8744 -15.5399 -15.5399 -10.8580 -10.8580 -10.8447 -10.8447 -10.8399 -10.8399 -10.7857 -10.7857 -8.3251 -8.3251 -8.3121 -8.3121 -8.2954 -8.2954 -8.2776 -8.2776 -8.2505 -8.2505 -8.2065 -8.2065 -7.5450 -7.5450 -7.0503 -7.0503 -0.7039 -0.7039 -0.1835 -0.1835 1.8587 1.8587 2.0596 2.0596 2.8655 2.8655 3.1900 3.1900 3.3426 3.3426 3.5362 3.5362 4.1568 4.1568 4.6593 4.6593 4.7894 4.7894 5.0739 5.0739 5.6092 5.6092 6.0186 6.0186 8.7358 8.7358 9.8103 9.8103 11.2778 11.2778 11.7811 11.7811 12.5890 12.5890 12.6553 12.6553 k = 0.0926 0.0926 0.2754 ( 5324 PWs) bands (ev): -15.8777 -15.8777 -15.5370 -15.5370 -10.8583 -10.8583 -10.8449 -10.8449 -10.8405 -10.8405 -10.7858 -10.7858 -8.3250 -8.3250 -8.3125 -8.3125 -8.2964 -8.2964 -8.2771 -8.2771 -8.2504 -8.2504 -8.2067 -8.2067 -7.5557 -7.5557 -7.0531 -7.0531 -0.6913 -0.6913 -0.1554 -0.1554 1.8615 1.8615 2.0424 2.0424 2.8900 2.8900 3.2082 3.2082 3.3403 3.3403 3.5560 3.5560 4.1537 4.1537 4.6385 4.6385 4.7714 4.7714 5.0809 5.0809 5.5909 5.5909 6.0408 6.0408 8.6892 8.6892 9.8024 9.8024 11.3337 11.3337 11.8090 11.8090 12.6481 12.6481 12.7015 12.7015 k = 0.0833 0.0833 0.2754 ( 5318 PWs) bands (ev): -15.8807 -15.8807 -15.5343 -15.5343 -10.8585 -10.8585 -10.8450 -10.8450 -10.8410 -10.8410 -10.7859 -10.7859 -8.3247 -8.3247 -8.3129 -8.3129 -8.2975 -8.2975 -8.2767 -8.2767 -8.2503 -8.2503 -8.2069 -8.2069 -7.5655 -7.5655 -7.0556 -7.0556 -0.6795 -0.6795 -0.1288 -0.1288 1.8638 1.8638 2.0276 2.0276 2.9128 2.9128 3.2230 3.2230 3.3389 3.3389 3.5748 3.5748 4.1490 4.1490 4.6175 4.6175 4.7595 4.7595 5.0850 5.0850 5.5728 5.5728 6.0621 6.0621 8.6452 8.6452 9.7941 9.7941 11.3904 11.3904 11.8320 11.8320 12.6966 12.6966 12.7568 12.7568 k = 0.0741 0.0741 0.2754 ( 5316 PWs) bands (ev): -15.8834 -15.8834 -15.5319 -15.5319 -10.8587 -10.8587 -10.8450 -10.8450 -10.8415 -10.8415 -10.7860 -10.7860 -8.3244 -8.3244 -8.3132 -8.3132 -8.2986 -8.2986 -8.2763 -8.2763 -8.2503 -8.2503 -8.2072 -8.2072 -7.5743 -7.5743 -7.0579 -7.0579 -0.6687 -0.6687 -0.1040 -0.1040 1.8654 1.8654 2.0152 2.0152 2.9337 2.9337 3.2341 3.2341 3.3385 3.3385 3.5925 3.5925 4.1431 4.1431 4.5983 4.5983 4.7515 4.7515 5.0863 5.0863 5.5560 5.5560 6.0819 6.0819 8.6044 8.6044 9.7859 9.7859 11.4468 11.4468 11.8498 11.8498 12.7368 12.7368 12.8168 12.8168 k = 0.0648 0.0648 0.2754 ( 5312 PWs) bands (ev): -15.8858 -15.8858 -15.5297 -15.5297 -10.8589 -10.8589 -10.8451 -10.8451 -10.8420 -10.8420 -10.7861 -10.7861 -8.3239 -8.3239 -8.3134 -8.3134 -8.2997 -8.2997 -8.2759 -8.2759 -8.2503 -8.2503 -8.2074 -8.2074 -7.5822 -7.5822 -7.0600 -7.0600 -0.6589 -0.6589 -0.0812 -0.0812 1.8663 1.8663 2.0051 2.0051 2.9528 2.9528 3.2417 3.2417 3.3391 3.3391 3.6087 3.6087 4.1366 4.1366 4.5819 4.5819 4.7461 4.7461 5.0851 5.0851 5.5411 5.5411 6.0999 6.0999 8.5672 8.5672 9.7781 9.7781 11.5021 11.5021 11.8625 11.8625 12.7723 12.7723 12.8767 12.8767 k = 0.0556 0.0556 0.2754 ( 5312 PWs) bands (ev): -15.8879 -15.8879 -15.5278 -15.5278 -10.8591 -10.8591 -10.8451 -10.8451 -10.8424 -10.8424 -10.7862 -10.7862 -8.3234 -8.3234 -8.3136 -8.3136 -8.3008 -8.3008 -8.2756 -8.2756 -8.2504 -8.2504 -8.2077 -8.2077 -7.5889 -7.5889 -7.0618 -7.0618 -0.6503 -0.6503 -0.0607 -0.0607 1.8664 1.8664 1.9974 1.9974 2.9698 2.9698 3.2462 3.2462 3.3405 3.3405 3.6233 3.6233 4.1300 4.1300 4.5686 4.5686 4.7423 4.7423 5.0817 5.0817 5.5285 5.5285 6.1161 6.1161 8.5342 8.5342 9.7708 9.7708 11.5555 11.5555 11.8699 11.8699 12.8041 12.8041 12.9337 12.9337 k = 0.0463 0.0463 0.2754 ( 5316 PWs) bands (ev): -15.8897 -15.8897 -15.5262 -15.5262 -10.8592 -10.8592 -10.8451 -10.8451 -10.8428 -10.8428 -10.7863 -10.7863 -8.3229 -8.3229 -8.3138 -8.3138 -8.3019 -8.3019 -8.2753 -8.2753 -8.2504 -8.2504 -8.2079 -8.2079 -7.5947 -7.5947 -7.0634 -7.0634 -0.6429 -0.6429 -0.0428 -0.0428 1.8659 1.8659 1.9918 1.9918 2.9846 2.9846 3.2483 3.2483 3.3421 3.3421 3.6360 3.6360 4.1238 4.1238 4.5582 4.5582 4.7396 4.7396 5.0769 5.0769 5.5182 5.5182 6.1300 6.1300 8.5056 8.5056 9.7645 9.7645 11.6062 11.6062 11.8722 11.8722 12.8326 12.8326 12.9862 12.9862 k = 0.0370 0.0370 0.2754 ( 5312 PWs) bands (ev): -15.8911 -15.8911 -15.5249 -15.5249 -10.8593 -10.8593 -10.8451 -10.8451 -10.8432 -10.8432 -10.7863 -10.7863 -8.3224 -8.3224 -8.3138 -8.3138 -8.3029 -8.3029 -8.2750 -8.2750 -8.2505 -8.2505 -8.2081 -8.2081 -7.5994 -7.5994 -7.0647 -7.0647 -0.6368 -0.6368 -0.0277 -0.0277 1.8649 1.8649 1.9879 1.9879 2.9970 2.9970 3.2488 3.2488 3.3438 3.3438 3.6467 3.6467 4.1184 4.1184 4.5505 4.5505 4.7377 4.7377 5.0715 5.0715 5.5103 5.5103 6.1417 6.1417 8.4817 8.4817 9.7590 9.7590 11.6536 11.6536 11.8691 11.8691 12.8581 12.8581 13.0324 13.0324 k = 0.0278 0.0278 0.2754 ( 5318 PWs) bands (ev): -15.8923 -15.8923 -15.5239 -15.5239 -10.8594 -10.8594 -10.8450 -10.8450 -10.8436 -10.8436 -10.7864 -10.7864 -8.3220 -8.3220 -8.3138 -8.3138 -8.3038 -8.3038 -8.2748 -8.2748 -8.2505 -8.2505 -8.2083 -8.2083 -7.6031 -7.6031 -7.0657 -7.0657 -0.6320 -0.6320 -0.0158 -0.0158 1.8637 1.8637 1.9854 1.9854 3.0069 3.0069 3.2484 3.2484 3.3451 3.3451 3.6552 3.6552 4.1141 4.1141 4.5449 4.5449 4.7364 4.7364 5.0663 5.0663 5.5045 5.5045 6.1509 6.1509 8.4628 8.4628 9.7547 9.7547 11.6973 11.6973 11.8607 11.8607 12.8811 12.8811 13.0191 13.0191 k = 0.0185 0.0185 0.2754 ( 5316 PWs) bands (ev): -15.8931 -15.8931 -15.5231 -15.5231 -10.8594 -10.8594 -10.8449 -10.8449 -10.8439 -10.8439 -10.7864 -10.7864 -8.3216 -8.3216 -8.3138 -8.3138 -8.3045 -8.3045 -8.2746 -8.2746 -8.2506 -8.2506 -8.2084 -8.2084 -7.6057 -7.6057 -7.0664 -7.0664 -0.6285 -0.6285 -0.0071 -0.0071 1.8627 1.8627 1.9839 1.9839 3.0141 3.0141 3.2477 3.2477 3.3461 3.3461 3.6614 3.6614 4.1109 4.1109 4.5412 4.5412 4.7356 4.7356 5.0619 5.0619 5.5006 5.5006 6.1575 6.1575 8.4492 8.4492 9.7516 9.7516 11.7366 11.7366 11.8470 11.8470 12.9023 12.9023 12.9904 12.9904 k = 0.0093 0.0093 0.2754 ( 5308 PWs) bands (ev): -15.8936 -15.8936 -15.5227 -15.5227 -10.8595 -10.8595 -10.8447 -10.8447 -10.8441 -10.8441 -10.7865 -10.7865 -8.3214 -8.3214 -8.3138 -8.3138 -8.3049 -8.3049 -8.2745 -8.2745 -8.2506 -8.2506 -8.2085 -8.2085 -7.6073 -7.6073 -7.0668 -7.0668 -0.6264 -0.6264 -0.0019 -0.0019 1.8619 1.8619 1.9831 1.9831 3.0185 3.0185 3.2471 3.2471 3.3467 3.3467 3.6651 3.6651 4.1090 4.1090 4.5391 4.5391 4.7351 4.7351 5.0591 5.0591 5.4983 5.4983 6.1615 6.1615 8.4410 8.4410 9.7497 9.7497 11.7708 11.7708 11.8283 11.8283 12.9226 12.9226 12.9655 12.9655 k = 0.0000 0.0000 0.2754 ( 5304 PWs) bands (ev): -15.8938 -15.8938 -15.5225 -15.5225 -10.8595 -10.8595 -10.8447 -10.8447 -10.8442 -10.8442 -10.7865 -10.7865 -8.3213 -8.3213 -8.3137 -8.3137 -8.3051 -8.3051 -8.2745 -8.2745 -8.2506 -8.2506 -8.2085 -8.2085 -7.6079 -7.6079 -7.0670 -7.0670 -0.6257 -0.6257 -0.0001 -0.0001 1.8617 1.8617 1.9829 1.9829 3.0200 3.0200 3.2469 3.2469 3.3469 3.3469 3.6664 3.6664 4.1083 4.1083 4.5384 4.5384 4.7349 4.7349 5.0581 5.0581 5.4976 5.4976 6.1629 6.1629 8.4383 8.4383 9.7490 9.7490 11.7933 11.7933 11.8110 11.8110 12.9417 12.9417 12.9449 12.9449 k = 0.0000 0.5000-0.0000 ( 5318 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8497 -10.8497 -10.8497 -10.8497 -10.8009 -10.8009 -10.8009 -10.8009 -8.3049 -8.3049 -8.3049 -8.3049 -8.2818 -8.2818 -8.2818 -8.2818 -8.2316 -8.2316 -8.2316 -8.2316 -7.1248 -7.1248 -7.1248 -7.1248 -0.9769 -0.9769 -0.9769 -0.9769 2.1546 2.1546 2.1546 2.1546 2.6203 2.6203 2.6203 2.6203 3.0410 3.0410 3.0410 3.0410 4.8236 4.8236 4.8236 4.8236 5.2365 5.2365 5.2365 5.2365 5.8287 5.8287 5.8287 5.8287 9.4126 9.4126 9.4126 9.4126 10.9980 10.9980 10.9980 10.9980 12.0257 12.0257 12.0257 12.0257 k = 0.0000 0.5000 0.0131 ( 5312 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8497 -10.8497 -10.8497 -10.8497 -10.8008 -10.8008 -10.8008 -10.8008 -8.3050 -8.3050 -8.3050 -8.3050 -8.2817 -8.2817 -8.2817 -8.2817 -8.2316 -8.2316 -8.2316 -8.2316 -7.1249 -7.1249 -7.1249 -7.1249 -0.9770 -0.9770 -0.9770 -0.9770 2.1554 2.1554 2.1554 2.1554 2.6203 2.6203 2.6203 2.6203 3.0403 3.0403 3.0403 3.0403 4.8241 4.8241 4.8241 4.8241 5.2365 5.2365 5.2365 5.2365 5.8286 5.8286 5.8286 5.8286 9.4117 9.4117 9.4117 9.4117 10.9974 10.9974 10.9974 10.9974 12.0231 12.0231 12.0231 12.0231 k = 0.0000 0.5000 0.0262 ( 5304 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8497 -10.8497 -10.8497 -10.8497 -10.8008 -10.8008 -10.8008 -10.8008 -8.3053 -8.3053 -8.3053 -8.3053 -8.2813 -8.2813 -8.2813 -8.2813 -8.2316 -8.2316 -8.2316 -8.2316 -7.1250 -7.1250 -7.1250 -7.1250 -0.9773 -0.9773 -0.9773 -0.9773 2.1575 2.1575 2.1576 2.1576 2.6204 2.6204 2.6204 2.6204 3.0385 3.0385 3.0385 3.0385 4.8257 4.8257 4.8257 4.8257 5.2366 5.2366 5.2366 5.2366 5.8282 5.8282 5.8282 5.8282 9.4093 9.4093 9.4093 9.4093 10.9958 10.9958 10.9958 10.9958 12.0153 12.0153 12.0153 12.0153 k = 0.0000 0.5000 0.0393 ( 5304 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8497 -10.8497 -10.8497 -10.8497 -10.8008 -10.8008 -10.8008 -10.8008 -8.3057 -8.3057 -8.3057 -8.3057 -8.2807 -8.2807 -8.2807 -8.2807 -8.2317 -8.2317 -8.2317 -8.2317 -7.1251 -7.1251 -7.1251 -7.1251 -0.9779 -0.9779 -0.9779 -0.9779 2.1612 2.1612 2.1612 2.1612 2.6204 2.6204 2.6204 2.6204 3.0354 3.0354 3.0354 3.0354 4.8281 4.8281 4.8281 4.8281 5.2367 5.2367 5.2367 5.2367 5.8276 5.8276 5.8276 5.8276 9.4052 9.4052 9.4052 9.4052 10.9930 10.9930 10.9930 10.9930 12.0028 12.0028 12.0028 12.0028 k = 0.0000 0.5000 0.0524 ( 5308 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8497 -10.8497 -10.8497 -10.8497 -10.8007 -10.8007 -10.8007 -10.8007 -8.3063 -8.3063 -8.3063 -8.3063 -8.2799 -8.2799 -8.2799 -8.2799 -8.2318 -8.2318 -8.2318 -8.2318 -7.1253 -7.1253 -7.1253 -7.1253 -0.9786 -0.9786 -0.9786 -0.9786 2.1661 2.1661 2.1661 2.1661 2.6205 2.6205 2.6205 2.6205 3.0311 3.0311 3.0311 3.0311 4.8315 4.8315 4.8315 4.8315 5.2370 5.2370 5.2370 5.2370 5.8267 5.8267 5.8267 5.8267 9.3996 9.3996 9.3996 9.3996 10.9891 10.9891 10.9891 10.9891 11.9861 11.9861 11.9861 11.9861 k = 0.0000 0.5000 0.0656 ( 5306 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8498 -10.8498 -10.8498 -10.8498 -10.8007 -10.8007 -10.8007 -10.8007 -8.3070 -8.3070 -8.3070 -8.3070 -8.2790 -8.2790 -8.2790 -8.2790 -8.2319 -8.2319 -8.2319 -8.2319 -7.1256 -7.1256 -7.1256 -7.1256 -0.9795 -0.9795 -0.9795 -0.9795 2.1724 2.1724 2.1724 2.1724 2.6206 2.6206 2.6206 2.6206 3.0258 3.0258 3.0258 3.0258 4.8357 4.8357 4.8357 4.8357 5.2373 5.2373 5.2373 5.2373 5.8256 5.8256 5.8256 5.8256 9.3926 9.3926 9.3926 9.3926 10.9842 10.9842 10.9842 10.9842 11.9659 11.9659 11.9659 11.9659 k = 0.0000 0.5000 0.0787 ( 5322 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8498 -10.8498 -10.8498 -10.8498 -10.8006 -10.8006 -10.8006 -10.8006 -8.3078 -8.3078 -8.3078 -8.3078 -8.2779 -8.2779 -8.2779 -8.2779 -8.2320 -8.2320 -8.2320 -8.2320 -7.1259 -7.1259 -7.1259 -7.1259 -0.9806 -0.9806 -0.9806 -0.9806 2.1798 2.1798 2.1798 2.1798 2.6208 2.6208 2.6208 2.6208 3.0194 3.0194 3.0194 3.0194 4.8406 4.8406 4.8406 4.8406 5.2377 5.2377 5.2377 5.2377 5.8243 5.8243 5.8243 5.8243 9.3843 9.3843 9.3843 9.3843 10.9784 10.9784 10.9784 10.9784 11.9429 11.9429 11.9429 11.9429 k = 0.0000 0.5000 0.0918 ( 5324 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8499 -10.8499 -10.8499 -10.8499 -10.8006 -10.8006 -10.8006 -10.8006 -8.3085 -8.3085 -8.3085 -8.3085 -8.2768 -8.2768 -8.2768 -8.2768 -8.2322 -8.2322 -8.2322 -8.2322 -7.1263 -7.1263 -7.1263 -7.1263 -0.9818 -0.9818 -0.9818 -0.9818 2.1883 2.1883 2.1883 2.1883 2.6209 2.6209 2.6209 2.6209 3.0122 3.0122 3.0122 3.0122 4.8461 4.8461 4.8461 4.8461 5.2382 5.2382 5.2382 5.2382 5.8228 5.8228 5.8228 5.8228 9.3749 9.3749 9.3749 9.3749 10.9717 10.9717 10.9717 10.9717 11.9181 11.9181 11.9181 11.9181 k = 0.0000 0.5000 0.1049 ( 5324 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8499 -10.8499 -10.8499 -10.8499 -10.8005 -10.8005 -10.8005 -10.8005 -8.3093 -8.3093 -8.3093 -8.3093 -8.2756 -8.2756 -8.2756 -8.2756 -8.2324 -8.2324 -8.2324 -8.2324 -7.1267 -7.1267 -7.1267 -7.1267 -0.9831 -0.9831 -0.9831 -0.9831 2.1977 2.1977 2.1977 2.1977 2.6210 2.6210 2.6210 2.6210 3.0041 3.0041 3.0041 3.0041 4.8520 4.8520 4.8520 4.8520 5.2388 5.2388 5.2388 5.2388 5.8212 5.8212 5.8212 5.8212 9.3646 9.3646 9.3646 9.3646 10.9642 10.9642 10.9642 10.9642 11.8922 11.8922 11.8922 11.8922 k = 0.0000 0.5000 0.1180 ( 5336 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8500 -10.8500 -10.8500 -10.8500 -10.8004 -10.8004 -10.8004 -10.8004 -8.3102 -8.3102 -8.3102 -8.3102 -8.2744 -8.2744 -8.2744 -8.2744 -8.2326 -8.2326 -8.2326 -8.2326 -7.1271 -7.1271 -7.1271 -7.1271 -0.9845 -0.9845 -0.9845 -0.9845 2.2079 2.2079 2.2079 2.2079 2.6211 2.6211 2.6211 2.6211 2.9954 2.9954 2.9954 2.9954 4.8583 4.8583 4.8583 4.8583 5.2396 5.2396 5.2396 5.2396 5.8194 5.8194 5.8194 5.8194 9.3537 9.3537 9.3537 9.3537 10.9561 10.9561 10.9561 10.9561 11.8659 11.8659 11.8659 11.8659 k = 0.0000 0.5000 0.1311 ( 5332 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8501 -10.8501 -10.8501 -10.8501 -10.8003 -10.8003 -10.8003 -10.8003 -8.3109 -8.3109 -8.3109 -8.3109 -8.2731 -8.2731 -8.2731 -8.2731 -8.2328 -8.2328 -8.2328 -8.2328 -7.1275 -7.1275 -7.1275 -7.1275 -0.9859 -0.9859 -0.9859 -0.9859 2.2187 2.2187 2.2187 2.2187 2.6212 2.6212 2.6212 2.6212 2.9863 2.9863 2.9863 2.9863 4.8647 4.8647 4.8647 4.8647 5.2404 5.2404 5.2404 5.2404 5.8176 5.8176 5.8176 5.8176 9.3422 9.3422 9.3422 9.3422 10.9476 10.9476 10.9476 10.9476 11.8401 11.8401 11.8401 11.8401 k = 0.0000 0.5000 0.1442 ( 5336 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8501 -10.8501 -10.8501 -10.8501 -10.8002 -10.8002 -10.8002 -10.8002 -8.3117 -8.3117 -8.3117 -8.3117 -8.2719 -8.2719 -8.2719 -8.2719 -8.2331 -8.2331 -8.2331 -8.2331 -7.1279 -7.1279 -7.1279 -7.1279 -0.9873 -0.9873 -0.9873 -0.9873 2.2298 2.2298 2.2298 2.2298 2.6212 2.6212 2.6212 2.6212 2.9769 2.9769 2.9769 2.9769 4.8711 4.8711 4.8711 4.8711 5.2413 5.2413 5.2413 5.2413 5.8156 5.8156 5.8156 5.8156 9.3305 9.3305 9.3305 9.3305 10.9387 10.9387 10.9387 10.9387 11.8152 11.8152 11.8152 11.8152 k = 0.0000 0.5000 0.1573 ( 5346 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8502 -10.8502 -10.8502 -10.8502 -10.8002 -10.8002 -10.8002 -10.8002 -8.3124 -8.3124 -8.3124 -8.3124 -8.2708 -8.2708 -8.2708 -8.2708 -8.2333 -8.2333 -8.2333 -8.2333 -7.1283 -7.1283 -7.1283 -7.1283 -0.9888 -0.9888 -0.9888 -0.9888 2.2410 2.2410 2.2410 2.2410 2.6213 2.6213 2.6213 2.6213 2.9673 2.9673 2.9673 2.9673 4.8774 4.8774 4.8774 4.8774 5.2424 5.2424 5.2424 5.2424 5.8137 5.8137 5.8137 5.8137 9.3189 9.3189 9.3189 9.3189 10.9297 10.9297 10.9297 10.9297 11.7918 11.7918 11.7918 11.7918 k = 0.0000 0.5000 0.1705 ( 5350 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8503 -10.8503 -10.8503 -10.8503 -10.8001 -10.8001 -10.8001 -10.8001 -8.3130 -8.3130 -8.3130 -8.3130 -8.2697 -8.2697 -8.2697 -8.2697 -8.2336 -8.2336 -8.2336 -8.2336 -7.1288 -7.1288 -7.1288 -7.1288 -0.9901 -0.9901 -0.9901 -0.9901 2.2522 2.2522 2.2522 2.2522 2.6212 2.6212 2.6212 2.6212 2.9579 2.9579 2.9579 2.9579 4.8834 4.8834 4.8834 4.8834 5.2435 5.2435 5.2435 5.2435 5.8118 5.8118 5.8118 5.8118 9.3076 9.3076 9.3076 9.3076 10.9209 10.9209 10.9209 10.9209 11.7703 11.7703 11.7703 11.7703 k = 0.0000 0.5000 0.1836 ( 5356 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8503 -10.8503 -10.8503 -10.8503 -10.8000 -10.8000 -10.8000 -10.8000 -8.3136 -8.3136 -8.3136 -8.3136 -8.2686 -8.2686 -8.2686 -8.2686 -8.2338 -8.2338 -8.2338 -8.2338 -7.1291 -7.1291 -7.1291 -7.1291 -0.9914 -0.9914 -0.9914 -0.9914 2.2629 2.2629 2.2629 2.2629 2.6212 2.6212 2.6212 2.6212 2.9488 2.9488 2.9488 2.9488 4.8891 4.8891 4.8891 4.8891 5.2446 5.2446 5.2446 5.2446 5.8100 5.8100 5.8100 5.8100 9.2969 9.2969 9.2969 9.2969 10.9124 10.9124 10.9124 10.9124 11.7509 11.7509 11.7509 11.7509 k = 0.0000 0.5000 0.1967 ( 5366 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8504 -10.8504 -10.8504 -10.8504 -10.8000 -10.8000 -10.8000 -10.8000 -8.3141 -8.3141 -8.3141 -8.3141 -8.2677 -8.2677 -8.2677 -8.2677 -8.2340 -8.2340 -8.2340 -8.2340 -7.1295 -7.1295 -7.1295 -7.1295 -0.9926 -0.9926 -0.9926 -0.9926 2.2730 2.2730 2.2730 2.2730 2.6211 2.6211 2.6211 2.6211 2.9403 2.9403 2.9403 2.9403 4.8942 4.8942 4.8942 4.8942 5.2457 5.2457 5.2457 5.2457 5.8083 5.8083 5.8083 5.8083 9.2871 9.2871 9.2871 9.2871 10.9044 10.9044 10.9044 10.9044 11.7339 11.7339 11.7339 11.7339 k = 0.0000 0.5000 0.2098 ( 5358 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8504 -10.8504 -10.8504 -10.8504 -10.7999 -10.7999 -10.7999 -10.7999 -8.3146 -8.3146 -8.3146 -8.3146 -8.2669 -8.2669 -8.2669 -8.2669 -8.2342 -8.2342 -8.2342 -8.2342 -7.1298 -7.1298 -7.1298 -7.1298 -0.9936 -0.9936 -0.9936 -0.9936 2.2822 2.2822 2.2822 2.2822 2.6210 2.6210 2.6210 2.6210 2.9325 2.9325 2.9325 2.9325 4.8986 4.8986 4.8986 4.8986 5.2468 5.2468 5.2468 5.2468 5.8067 5.8067 5.8067 5.8067 9.2782 9.2782 9.2782 9.2782 10.8972 10.8972 10.8972 10.8972 11.7194 11.7194 11.7194 11.7194 k = 0.0000 0.5000 0.2229 ( 5342 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8505 -10.8505 -10.8505 -10.8505 -10.7998 -10.7998 -10.7998 -10.7998 -8.3149 -8.3149 -8.3149 -8.3149 -8.2662 -8.2662 -8.2662 -8.2662 -8.2344 -8.2344 -8.2344 -8.2344 -7.1301 -7.1301 -7.1301 -7.1301 -0.9945 -0.9945 -0.9945 -0.9945 2.2902 2.2902 2.2902 2.2902 2.6208 2.6208 2.6208 2.6208 2.9258 2.9258 2.9258 2.9258 4.9024 4.9024 4.9024 4.9024 5.2478 5.2478 5.2478 5.2478 5.8054 5.8054 5.8054 5.8054 9.2707 9.2707 9.2707 9.2707 10.8910 10.8910 10.8910 10.8910 11.7075 11.7075 11.7075 11.7075 k = 0.0000 0.5000 0.2360 ( 5346 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8505 -10.8505 -10.8505 -10.8505 -10.7998 -10.7998 -10.7998 -10.7998 -8.3152 -8.3152 -8.3152 -8.3152 -8.2656 -8.2656 -8.2656 -8.2656 -8.2346 -8.2346 -8.2346 -8.2346 -7.1303 -7.1303 -7.1303 -7.1303 -0.9952 -0.9952 -0.9952 -0.9952 2.2968 2.2968 2.2968 2.2968 2.6207 2.6207 2.6207 2.6207 2.9203 2.9203 2.9203 2.9203 4.9054 4.9054 4.9054 4.9054 5.2486 5.2486 5.2486 5.2486 5.8043 5.8043 5.8043 5.8043 9.2647 9.2647 9.2647 9.2647 10.8860 10.8860 10.8860 10.8860 11.6982 11.6982 11.6982 11.6982 k = 0.0000 0.5000 0.2491 ( 5358 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8505 -10.8505 -10.8505 -10.8505 -10.7998 -10.7998 -10.7998 -10.7998 -8.3154 -8.3154 -8.3154 -8.3154 -8.2652 -8.2652 -8.2652 -8.2652 -8.2347 -8.2347 -8.2347 -8.2347 -7.1304 -7.1304 -7.1304 -7.1304 -0.9958 -0.9958 -0.9958 -0.9958 2.3016 2.3016 2.3016 2.3016 2.6206 2.6206 2.6206 2.6206 2.9163 2.9163 2.9163 2.9163 4.9076 4.9076 4.9076 4.9076 5.2492 5.2492 5.2492 5.2492 5.8035 5.8035 5.8035 5.8035 9.2602 9.2602 9.2602 9.2602 10.8823 10.8823 10.8823 10.8823 11.6916 11.6916 11.6916 11.6916 k = 0.0000 0.5000 0.2622 ( 5354 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8505 -10.8505 -10.8505 -10.8505 -10.7997 -10.7997 -10.7997 -10.7997 -8.3155 -8.3155 -8.3155 -8.3155 -8.2650 -8.2650 -8.2650 -8.2650 -8.2348 -8.2348 -8.2348 -8.2348 -7.1305 -7.1305 -7.1305 -7.1305 -0.9961 -0.9961 -0.9961 -0.9961 2.3046 2.3046 2.3046 2.3046 2.6205 2.6205 2.6205 2.6205 2.9138 2.9138 2.9138 2.9138 4.9089 4.9089 4.9089 4.9089 5.2495 5.2495 5.2495 5.2495 5.8030 5.8030 5.8030 5.8030 9.2575 9.2575 9.2575 9.2575 10.8800 10.8800 10.8800 10.8800 11.6876 11.6876 11.6876 11.6876 k = 0.0000 0.5000 0.2754 ( 5344 PWs) bands (ev): -15.7034 -15.7034 -15.7034 -15.7034 -10.8505 -10.8505 -10.8505 -10.8505 -10.7997 -10.7997 -10.7997 -10.7997 -8.3156 -8.3156 -8.3156 -8.3156 -8.2649 -8.2649 -8.2649 -8.2649 -8.2348 -8.2348 -8.2348 -8.2348 -7.1306 -7.1306 -7.1306 -7.1306 -0.9962 -0.9962 -0.9962 -0.9962 2.3056 2.3056 2.3056 2.3056 2.6205 2.6205 2.6205 2.6205 2.9130 2.9130 2.9130 2.9130 4.9094 4.9094 4.9094 4.9094 5.2497 5.2497 5.2497 5.2497 5.8029 5.8029 5.8029 5.8029 9.2566 9.2566 9.2566 9.2566 10.8793 10.8793 10.8793 10.8793 11.6863 11.6863 11.6863 11.6863 k = 0.5000 0.5000-0.0000 ( 5328 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8408 -10.8408 -10.8408 -10.8408 -10.7983 -10.7983 -10.7983 -10.7983 -8.3619 -8.3619 -8.3619 -8.3619 -8.2516 -8.2516 -8.2516 -8.2516 -8.2180 -8.2180 -8.2180 -8.2180 -6.9216 -6.9216 -6.9216 -6.9216 -0.8404 -0.8404 -0.8404 -0.8404 1.9267 1.9267 1.9267 1.9267 2.8294 2.8294 2.8294 2.8294 2.9949 2.9949 2.9949 2.9949 3.5337 3.5337 3.5337 3.5337 4.7502 4.7502 4.7502 4.7502 5.3932 5.3932 5.3932 5.3932 9.9081 9.9081 9.9081 9.9081 11.4344 11.4344 11.4345 11.4345 12.5523 12.5523 12.5523 12.5523 k = 0.5000 0.5000 0.0131 ( 5336 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8408 -10.8408 -10.8408 -10.8408 -10.7983 -10.7983 -10.7983 -10.7983 -8.3618 -8.3618 -8.3618 -8.3618 -8.2517 -8.2517 -8.2517 -8.2517 -8.2180 -8.2180 -8.2180 -8.2180 -6.9216 -6.9216 -6.9216 -6.9216 -0.8408 -0.8408 -0.8408 -0.8408 1.9255 1.9255 1.9255 1.9255 2.8310 2.8310 2.8310 2.8310 2.9981 2.9981 2.9981 2.9981 3.5337 3.5337 3.5337 3.5337 4.7477 4.7477 4.7477 4.7477 5.3913 5.3913 5.3913 5.3913 9.9092 9.9092 9.9092 9.9092 11.4342 11.4342 11.4342 11.4342 12.5508 12.5508 12.5508 12.5508 k = 0.5000 0.5000 0.0262 ( 5344 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8407 -10.8407 -10.8407 -10.8407 -10.7984 -10.7984 -10.7984 -10.7984 -8.3616 -8.3616 -8.3616 -8.3616 -8.2518 -8.2518 -8.2518 -8.2518 -8.2180 -8.2180 -8.2180 -8.2180 -6.9217 -6.9217 -6.9217 -6.9217 -0.8417 -0.8417 -0.8417 -0.8417 1.9219 1.9219 1.9219 1.9219 2.8357 2.8357 2.8357 2.8357 3.0075 3.0075 3.0075 3.0075 3.5337 3.5337 3.5337 3.5337 4.7402 4.7402 4.7402 4.7402 5.3857 5.3857 5.3857 5.3857 9.9126 9.9126 9.9126 9.9126 11.4334 11.4334 11.4334 11.4334 12.5462 12.5462 12.5462 12.5462 k = 0.5000 0.5000 0.0393 ( 5344 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8406 -10.8406 -10.8406 -10.8406 -10.7984 -10.7984 -10.7984 -10.7984 -8.3614 -8.3614 -8.3614 -8.3614 -8.2521 -8.2521 -8.2521 -8.2521 -8.2180 -8.2180 -8.2180 -8.2180 -6.9217 -6.9217 -6.9217 -6.9217 -0.8433 -0.8433 -0.8433 -0.8433 1.9160 1.9160 1.9160 1.9160 2.8436 2.8436 2.8436 2.8436 3.0230 3.0230 3.0230 3.0230 3.5337 3.5337 3.5337 3.5337 4.7278 4.7278 4.7278 4.7278 5.3766 5.3766 5.3766 5.3766 9.9181 9.9181 9.9181 9.9181 11.4322 11.4322 11.4322 11.4322 12.5387 12.5387 12.5387 12.5387 k = 0.5000 0.5000 0.0524 ( 5340 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8405 -10.8405 -10.8405 -10.8405 -10.7985 -10.7985 -10.7985 -10.7985 -8.3610 -8.3610 -8.3610 -8.3610 -8.2524 -8.2524 -8.2524 -8.2524 -8.2180 -8.2180 -8.2180 -8.2180 -6.9218 -6.9218 -6.9218 -6.9218 -0.8455 -0.8455 -0.8455 -0.8455 1.9081 1.9081 1.9081 1.9081 2.8546 2.8546 2.8546 2.8546 3.0442 3.0442 3.0442 3.0442 3.5338 3.5338 3.5338 3.5338 4.7106 4.7106 4.7106 4.7106 5.3639 5.3639 5.3639 5.3639 9.9257 9.9257 9.9257 9.9257 11.4308 11.4308 11.4308 11.4308 12.5284 12.5284 12.5284 12.5284 k = 0.5000 0.5000 0.0656 ( 5372 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8404 -10.8404 -10.8404 -10.8404 -10.7987 -10.7987 -10.7987 -10.7987 -8.3605 -8.3605 -8.3605 -8.3605 -8.2529 -8.2529 -8.2529 -8.2529 -8.2180 -8.2180 -8.2180 -8.2180 -6.9219 -6.9219 -6.9219 -6.9219 -0.8482 -0.8482 -0.8482 -0.8482 1.8986 1.8986 1.8986 1.8986 2.8687 2.8687 2.8687 2.8687 3.0705 3.0705 3.0705 3.0705 3.5338 3.5338 3.5338 3.5338 4.6888 4.6888 4.6888 4.6888 5.3479 5.3479 5.3479 5.3479 9.9349 9.9349 9.9349 9.9349 11.4293 11.4293 11.4293 11.4293 12.5156 12.5156 12.5156 12.5156 k = 0.5000 0.5000 0.0787 ( 5372 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8403 -10.8403 -10.8403 -10.8403 -10.7988 -10.7988 -10.7988 -10.7988 -8.3600 -8.3600 -8.3600 -8.3600 -8.2534 -8.2534 -8.2534 -8.2534 -8.2179 -8.2179 -8.2179 -8.2179 -6.9220 -6.9220 -6.9220 -6.9220 -0.8513 -0.8513 -0.8513 -0.8513 1.8877 1.8877 1.8877 1.8877 2.8856 2.8856 2.8856 2.8856 3.1016 3.1016 3.1016 3.1016 3.5338 3.5338 3.5338 3.5338 4.6626 4.6626 4.6626 4.6626 5.3289 5.3289 5.3289 5.3289 9.9457 9.9457 9.9457 9.9457 11.4280 11.4280 11.4280 11.4280 12.5005 12.5005 12.5005 12.5005 k = 0.5000 0.5000 0.0918 ( 5372 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8401 -10.8401 -10.8401 -10.8401 -10.7990 -10.7990 -10.7990 -10.7990 -8.3593 -8.3593 -8.3593 -8.3593 -8.2540 -8.2540 -8.2540 -8.2540 -8.2179 -8.2179 -8.2179 -8.2179 -6.9221 -6.9221 -6.9221 -6.9221 -0.8548 -0.8548 -0.8548 -0.8548 1.8759 1.8759 1.8759 1.8759 2.9052 2.9052 2.9052 2.9052 3.1369 3.1369 3.1369 3.1369 3.5338 3.5338 3.5338 3.5338 4.6321 4.6321 4.6321 4.6321 5.3072 5.3072 5.3072 5.3072 9.9577 9.9577 9.9577 9.9577 11.4272 11.4272 11.4272 11.4272 12.4834 12.4834 12.4834 12.4834 k = 0.5000 0.5000 0.1049 ( 5388 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8399 -10.8399 -10.8399 -10.8399 -10.7992 -10.7992 -10.7992 -10.7992 -8.3586 -8.3586 -8.3586 -8.3586 -8.2547 -8.2547 -8.2547 -8.2547 -8.2179 -8.2179 -8.2179 -8.2179 -6.9222 -6.9222 -6.9222 -6.9222 -0.8587 -0.8587 -0.8587 -0.8587 1.8634 1.8634 1.8634 1.8634 2.9271 2.9271 2.9271 2.9271 3.1761 3.1761 3.1761 3.1761 3.5339 3.5339 3.5339 3.5339 4.5977 4.5977 4.5977 4.5977 5.2832 5.2832 5.2832 5.2832 9.9705 9.9705 9.9705 9.9705 11.4270 11.4270 11.4270 11.4270 12.4646 12.4646 12.4646 12.4646 k = 0.5000 0.5000 0.1180 ( 5388 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8397 -10.8397 -10.8397 -10.8397 -10.7994 -10.7994 -10.7994 -10.7994 -8.3579 -8.3579 -8.3579 -8.3579 -8.2554 -8.2554 -8.2554 -8.2554 -8.2178 -8.2178 -8.2178 -8.2178 -6.9224 -6.9224 -6.9224 -6.9224 -0.8627 -0.8627 -0.8627 -0.8627 1.8507 1.8507 1.8507 1.8507 2.9510 2.9510 2.9510 2.9510 3.2185 3.2185 3.2185 3.2185 3.5340 3.5340 3.5340 3.5340 4.5596 4.5596 4.5596 4.5596 5.2572 5.2572 5.2572 5.2572 9.9839 9.9839 9.9839 9.9839 11.4278 11.4278 11.4278 11.4278 12.4445 12.4445 12.4445 12.4445 k = 0.5000 0.5000 0.1311 ( 5380 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8395 -10.8395 -10.8395 -10.8395 -10.7996 -10.7996 -10.7996 -10.7996 -8.3571 -8.3571 -8.3571 -8.3571 -8.2561 -8.2561 -8.2561 -8.2561 -8.2178 -8.2178 -8.2178 -8.2178 -6.9225 -6.9225 -6.9225 -6.9225 -0.8669 -0.8669 -0.8669 -0.8669 1.8379 1.8379 1.8379 1.8379 2.9764 2.9764 2.9764 2.9764 3.2640 3.2640 3.2640 3.2640 3.5341 3.5341 3.5341 3.5341 4.5181 4.5181 4.5181 4.5181 5.2297 5.2297 5.2297 5.2297 9.9974 9.9974 9.9974 9.9974 11.4296 11.4296 11.4296 11.4296 12.4233 12.4233 12.4233 12.4233 k = 0.5000 0.5000 0.1442 ( 5372 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8393 -10.8393 -10.8393 -10.8393 -10.7998 -10.7998 -10.7998 -10.7998 -8.3562 -8.3562 -8.3562 -8.3562 -8.2568 -8.2568 -8.2568 -8.2568 -8.2178 -8.2178 -8.2178 -8.2178 -6.9226 -6.9226 -6.9226 -6.9226 -0.8711 -0.8711 -0.8711 -0.8711 1.8255 1.8255 1.8255 1.8255 3.0028 3.0028 3.0028 3.0028 3.3119 3.3119 3.3119 3.3119 3.5342 3.5342 3.5342 3.5342 4.4736 4.4736 4.4736 4.4736 5.2013 5.2013 5.2013 5.2013 10.0107 10.0107 10.0107 10.0107 11.4325 11.4325 11.4325 11.4325 12.4016 12.4016 12.4016 12.4016 k = 0.5000 0.5000 0.1573 ( 5368 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8391 -10.8391 -10.8391 -10.8391 -10.8000 -10.8000 -10.8000 -10.8000 -8.3554 -8.3554 -8.3554 -8.3554 -8.2576 -8.2576 -8.2576 -8.2576 -8.2177 -8.2177 -8.2177 -8.2177 -6.9228 -6.9228 -6.9228 -6.9228 -0.8752 -0.8752 -0.8752 -0.8752 1.8137 1.8137 1.8137 1.8137 3.0297 3.0297 3.0297 3.0297 3.3619 3.3619 3.3619 3.3619 3.5345 3.5345 3.5345 3.5345 4.4265 4.4265 4.4265 4.4265 5.1726 5.1726 5.1726 5.1726 10.0236 10.0236 10.0236 10.0236 11.4366 11.4366 11.4366 11.4366 12.3796 12.3796 12.3796 12.3796 k = 0.5000 0.5000 0.1705 ( 5376 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8389 -10.8389 -10.8389 -10.8389 -10.8002 -10.8002 -10.8002 -10.8002 -8.3546 -8.3546 -8.3546 -8.3546 -8.2583 -8.2583 -8.2583 -8.2583 -8.2177 -8.2177 -8.2177 -8.2177 -6.9229 -6.9229 -6.9229 -6.9229 -0.8791 -0.8791 -0.8791 -0.8791 1.8025 1.8025 1.8025 1.8025 3.0564 3.0564 3.0564 3.0564 3.4136 3.4136 3.4136 3.4136 3.5349 3.5349 3.5349 3.5349 4.3770 4.3770 4.3770 4.3770 5.1442 5.1442 5.1442 5.1442 10.0356 10.0356 10.0356 10.0356 11.4417 11.4417 11.4417 11.4417 12.3579 12.3579 12.3579 12.3579 k = 0.5000 0.5000 0.1836 ( 5380 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8387 -10.8387 -10.8387 -10.8387 -10.8004 -10.8004 -10.8004 -10.8004 -8.3538 -8.3538 -8.3538 -8.3538 -8.2590 -8.2590 -8.2590 -8.2590 -8.2177 -8.2177 -8.2177 -8.2177 -6.9230 -6.9230 -6.9230 -6.9230 -0.8828 -0.8828 -0.8828 -0.8828 1.7923 1.7923 1.7923 1.7923 3.0822 3.0822 3.0822 3.0822 3.4660 3.4660 3.4660 3.4660 3.5360 3.5360 3.5360 3.5360 4.3257 4.3257 4.3257 4.3257 5.1167 5.1167 5.1167 5.1167 10.0467 10.0467 10.0467 10.0467 11.4478 11.4478 11.4478 11.4478 12.3368 12.3368 12.3368 12.3368 k = 0.5000 0.5000 0.1967 ( 5396 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8385 -10.8385 -10.8385 -10.8385 -10.8006 -10.8006 -10.8006 -10.8006 -8.3531 -8.3531 -8.3531 -8.3531 -8.2597 -8.2597 -8.2597 -8.2597 -8.2177 -8.2177 -8.2177 -8.2177 -6.9231 -6.9231 -6.9231 -6.9231 -0.8862 -0.8862 -0.8862 -0.8862 1.7832 1.7832 1.7832 1.7832 3.1066 3.1066 3.1066 3.1066 3.5143 3.5143 3.5143 3.5143 3.5423 3.5423 3.5423 3.5423 4.2729 4.2729 4.2729 4.2729 5.0909 5.0909 5.0909 5.0909 10.0566 10.0566 10.0567 10.0567 11.4544 11.4544 11.4544 11.4544 12.3169 12.3169 12.3169 12.3169 k = 0.5000 0.5000 0.2098 ( 5412 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8383 -10.8383 -10.8383 -10.8383 -10.8008 -10.8008 -10.8008 -10.8008 -8.3525 -8.3525 -8.3525 -8.3525 -8.2603 -8.2603 -8.2603 -8.2603 -8.2176 -8.2176 -8.2176 -8.2176 -6.9232 -6.9232 -6.9232 -6.9232 -0.8892 -0.8892 -0.8892 -0.8892 1.7753 1.7753 1.7753 1.7753 3.1287 3.1287 3.1287 3.1287 3.5301 3.5301 3.5301 3.5301 3.5814 3.5814 3.5814 3.5814 4.2193 4.2193 4.2193 4.2193 5.0675 5.0675 5.0675 5.0675 10.0652 10.0652 10.0652 10.0652 11.4612 11.4612 11.4612 11.4612 12.2987 12.2987 12.2987 12.2987 k = 0.5000 0.5000 0.2229 ( 5388 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8382 -10.8382 -10.8382 -10.8382 -10.8009 -10.8009 -10.8009 -10.8009 -8.3519 -8.3519 -8.3519 -8.3519 -8.2608 -8.2608 -8.2608 -8.2608 -8.2176 -8.2176 -8.2176 -8.2176 -6.9233 -6.9233 -6.9233 -6.9233 -0.8918 -0.8918 -0.8918 -0.8918 1.7687 1.7687 1.7687 1.7687 3.1480 3.1480 3.1480 3.1480 3.5319 3.5319 3.5319 3.5319 3.6341 3.6341 3.6341 3.6341 4.1657 4.1657 4.1657 4.1657 5.0472 5.0472 5.0472 5.0472 10.0724 10.0724 10.0724 10.0724 11.4677 11.4677 11.4677 11.4677 12.2828 12.2828 12.2828 12.2828 k = 0.5000 0.5000 0.2360 ( 5392 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8381 -10.8381 -10.8381 -10.8381 -10.8010 -10.8010 -10.8010 -10.8010 -8.3514 -8.3514 -8.3514 -8.3514 -8.2612 -8.2612 -8.2612 -8.2612 -8.2176 -8.2176 -8.2176 -8.2176 -6.9234 -6.9234 -6.9234 -6.9234 -0.8938 -0.8938 -0.8938 -0.8938 1.7635 1.7635 1.7635 1.7635 3.1638 3.1638 3.1638 3.1638 3.5325 3.5325 3.5325 3.5325 3.6864 3.6864 3.6864 3.6864 4.1136 4.1136 4.1136 4.1136 5.0307 5.0307 5.0307 5.0307 10.0780 10.0780 10.0780 10.0780 11.4734 11.4734 11.4734 11.4734 12.2697 12.2697 12.2697 12.2697 k = 0.5000 0.5000 0.2491 ( 5392 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8380 -10.8380 -10.8380 -10.8380 -10.8011 -10.8011 -10.8011 -10.8011 -8.3511 -8.3511 -8.3511 -8.3511 -8.2615 -8.2615 -8.2615 -8.2615 -8.2176 -8.2176 -8.2176 -8.2176 -6.9234 -6.9234 -6.9234 -6.9234 -0.8953 -0.8953 -0.8953 -0.8953 1.7597 1.7597 1.7597 1.7597 3.1755 3.1755 3.1755 3.1755 3.5328 3.5328 3.5328 3.5328 3.7346 3.7346 3.7346 3.7346 4.0656 4.0656 4.0656 4.0656 5.0184 5.0184 5.0184 5.0184 10.0820 10.0820 10.0820 10.0820 11.4779 11.4779 11.4779 11.4779 12.2600 12.2600 12.2600 12.2600 k = 0.5000 0.5000 0.2622 ( 5384 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8379 -10.8379 -10.8379 -10.8379 -10.8011 -10.8011 -10.8011 -10.8011 -8.3509 -8.3509 -8.3509 -8.3509 -8.2617 -8.2617 -8.2617 -8.2617 -8.2176 -8.2176 -8.2176 -8.2176 -6.9235 -6.9235 -6.9235 -6.9235 -0.8962 -0.8962 -0.8962 -0.8962 1.7575 1.7575 1.7575 1.7575 3.1827 3.1827 3.1827 3.1827 3.5329 3.5329 3.5329 3.5329 3.7725 3.7725 3.7725 3.7725 4.0280 4.0280 4.0280 4.0280 5.0109 5.0109 5.0109 5.0109 10.0844 10.0844 10.0844 10.0844 11.4808 11.4808 11.4808 11.4808 12.2539 12.2539 12.2539 12.2539 k = 0.5000 0.5000 0.2754 ( 5384 PWs) bands (ev): -15.6938 -15.6938 -15.6938 -15.6938 -10.8379 -10.8379 -10.8379 -10.8379 -10.8011 -10.8011 -10.8011 -10.8011 -8.3508 -8.3508 -8.3508 -8.3508 -8.2618 -8.2618 -8.2618 -8.2618 -8.2176 -8.2176 -8.2176 -8.2176 -6.9235 -6.9235 -6.9235 -6.9235 -0.8965 -0.8965 -0.8965 -0.8965 1.7567 1.7567 1.7567 1.7567 3.1851 3.1851 3.1851 3.1851 3.5330 3.5330 3.5330 3.5330 3.7879 3.7879 3.7879 3.7879 4.0125 4.0125 4.0125 4.0125 5.0083 5.0083 5.0083 5.0083 10.0852 10.0852 10.0852 10.0852 11.4818 11.4818 11.4818 11.4818 12.2519 12.2519 12.2519 12.2519 Writing output data file PbBrF.save init_run : 0.36s CPU 0.97s WALL ( 1 calls) electrons : 151.59s CPU 155.99s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.26s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 151.58s CPU 155.98s 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 : 0.04s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.09s WALL ( 332 calls) cegterg : 139.27s CPU 141.49s WALL ( 362 calls) Called by sum_band: Called by *egterg: h_psi : 75.77s CPU 77.76s WALL ( 5214 calls) s_psi : 4.41s CPU 4.45s WALL ( 5214 calls) g_psi : 0.31s CPU 0.31s WALL ( 4520 calls) cdiaghg : 45.32s CPU 45.93s WALL ( 4852 calls) cegterg:over : 8.96s CPU 8.93s WALL ( 4520 calls) cegterg:upda : 6.76s CPU 6.79s WALL ( 4520 calls) cegterg:last : 4.52s CPU 4.48s WALL ( 1026 calls) cdiaghg:chol : 2.70s CPU 2.69s WALL ( 4852 calls) cdiaghg:inve : 1.96s CPU 1.91s WALL ( 4852 calls) cdiaghg:para : 3.02s CPU 3.10s WALL ( 9704 calls) Called by h_psi: h_psi:vloc : 64.81s CPU 66.62s WALL ( 5214 calls) h_psi:vnl : 10.64s CPU 10.79s WALL ( 5214 calls) add_vuspsi : 5.09s CPU 5.25s WALL ( 5214 calls) General routines calbec : 5.54s CPU 5.53s WALL ( 5214 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 60.05s CPU 61.98s WALL ( 834848 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.30s CPU 0.37s WALL ( 664 calls) Parallel routines fft_scatter : 25.60s CPU 26.30s WALL ( 834871 calls) PWSCF : 2m54.86s CPU 3m34.58s WALL This run was terminated on: 16: 7: 4 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=