Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 18:17:44 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: ./BaAgSF.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 44 28 8 2980 1490 236 Max 45 29 9 2991 1505 247 Sum 1617 1033 293 107563 53967 8583 bravais-lattice index = 14 lattice parameter (alat) = 8.0136 a.u. unit-cell volume = 1128.9364 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 4 number of electrons = 68.00 number of Kohn-Sham states= 82 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)= 8.013572 celldm(2)= 1.000000 celldm(3)= 2.193770 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 2.193770 ) 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 0.455836 ) PseudoPot. # 1 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 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. # 4 for Ag read from file: /users/gautes/Pseudo/Ag.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 30ab375624a706b88a092e30a79375fd Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1237 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential S 6.00 32.06500 S( 1.00) Ba 10.00 137.32700 Ba( 1.00) F 7.00 18.99840 F( 1.00) Ag 11.00 107.86820 Ag( 1.00) 4 Sym. Ops., with inversion, found (note: 12 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,1,0] cryst. s( 2) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 2) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s( 4) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 4) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [1,1,0] -C2 -2 180 deg rotation - cart. axis [1,1,0] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [1,1,0] -s_h -4 inv. 180 deg rotation - cart. axis [1,1,0] E Cartesian axes number of k points= 318 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031447 k( 2) = ( 0.0000000 0.0131579 -0.0000000), wk = 0.0031447 k( 3) = ( 0.0000000 0.0263158 -0.0000000), wk = 0.0031447 k( 4) = ( 0.0000000 0.0394737 -0.0000000), wk = 0.0031447 k( 5) = ( 0.0000000 0.0526316 -0.0000000), wk = 0.0031447 k( 6) = ( 0.0000000 0.0657895 -0.0000000), wk = 0.0031447 k( 7) = ( 0.0000000 0.0789474 -0.0000000), wk = 0.0031447 k( 8) = ( 0.0000000 0.0921053 -0.0000000), wk = 0.0031447 k( 9) = ( 0.0000000 0.1052632 -0.0000000), wk = 0.0031447 k( 10) = ( 0.0000000 0.1184210 -0.0000000), wk = 0.0031447 k( 11) = ( 0.0000000 0.1315790 -0.0000000), wk = 0.0031447 k( 12) = ( 0.0000000 0.1447368 -0.0000000), wk = 0.0031447 k( 13) = ( 0.0000000 0.1578947 -0.0000000), wk = 0.0031447 k( 14) = ( 0.0000000 0.1710526 -0.0000000), wk = 0.0031447 k( 15) = ( 0.0000000 0.1842105 -0.0000000), wk = 0.0031447 k( 16) = ( 0.0000000 0.1973684 -0.0000000), wk = 0.0031447 k( 17) = ( 0.0000000 0.2105263 -0.0000000), wk = 0.0031447 k( 18) = ( 0.0000000 0.2236842 -0.0000000), wk = 0.0031447 k( 19) = ( 0.0000000 0.2368421 -0.0000000), wk = 0.0031447 k( 20) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0031447 k( 21) = ( 0.0000000 0.2631579 -0.0000000), wk = 0.0031447 k( 22) = ( 0.0000000 0.2763158 -0.0000000), wk = 0.0031447 k( 23) = ( 0.0000000 0.2894737 -0.0000000), wk = 0.0031447 k( 24) = ( 0.0000000 0.3026316 -0.0000000), wk = 0.0031447 k( 25) = ( 0.0000000 0.3157895 -0.0000000), wk = 0.0031447 k( 26) = ( 0.0000000 0.3289474 -0.0000000), wk = 0.0031447 k( 27) = ( 0.0000000 0.3421053 -0.0000000), wk = 0.0031447 k( 28) = ( 0.0000000 0.3552632 -0.0000000), wk = 0.0031447 k( 29) = ( 0.0000000 0.3684211 -0.0000000), wk = 0.0031447 k( 30) = ( 0.0000000 0.3815789 -0.0000000), wk = 0.0031447 k( 31) = ( 0.0000000 0.3947368 -0.0000000), wk = 0.0031447 k( 32) = ( 0.0000000 0.4078947 -0.0000000), wk = 0.0031447 k( 33) = ( 0.0000000 0.4210526 -0.0000000), wk = 0.0031447 k( 34) = ( 0.0000000 0.4342105 -0.0000000), wk = 0.0031447 k( 35) = ( 0.0000000 0.4473684 -0.0000000), wk = 0.0031447 k( 36) = ( 0.0000000 0.4605263 -0.0000000), wk = 0.0031447 k( 37) = ( 0.0000000 0.4736842 -0.0000000), wk = 0.0031447 k( 38) = ( 0.0000000 0.4868421 -0.0000000), wk = 0.0031447 k( 39) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031447 k( 40) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031447 k( 41) = ( 0.0131579 0.5000000 -0.0000000), wk = 0.0031447 k( 42) = ( 0.0263158 0.5000000 -0.0000000), wk = 0.0031447 k( 43) = ( 0.0394737 0.5000000 -0.0000000), wk = 0.0031447 k( 44) = ( 0.0526316 0.5000000 -0.0000000), wk = 0.0031447 k( 45) = ( 0.0657895 0.5000000 -0.0000000), wk = 0.0031447 k( 46) = ( 0.0789474 0.5000000 -0.0000000), wk = 0.0031447 k( 47) = ( 0.0921053 0.5000000 -0.0000000), wk = 0.0031447 k( 48) = ( 0.1052632 0.5000000 -0.0000000), wk = 0.0031447 k( 49) = ( 0.1184210 0.5000000 -0.0000000), wk = 0.0031447 k( 50) = ( 0.1315790 0.5000000 -0.0000000), wk = 0.0031447 k( 51) = ( 0.1447368 0.5000000 -0.0000000), wk = 0.0031447 k( 52) = ( 0.1578947 0.5000000 -0.0000000), wk = 0.0031447 k( 53) = ( 0.1710526 0.5000000 -0.0000000), wk = 0.0031447 k( 54) = ( 0.1842105 0.5000000 -0.0000000), wk = 0.0031447 k( 55) = ( 0.1973684 0.5000000 -0.0000000), wk = 0.0031447 k( 56) = ( 0.2105263 0.5000000 -0.0000000), wk = 0.0031447 k( 57) = ( 0.2236842 0.5000000 -0.0000000), wk = 0.0031447 k( 58) = ( 0.2368421 0.5000000 -0.0000000), wk = 0.0031447 k( 59) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0031447 k( 60) = ( 0.2631579 0.5000000 -0.0000000), wk = 0.0031447 k( 61) = ( 0.2763158 0.5000000 -0.0000000), wk = 0.0031447 k( 62) = ( 0.2894737 0.5000000 -0.0000000), wk = 0.0031447 k( 63) = ( 0.3026316 0.5000000 -0.0000000), wk = 0.0031447 k( 64) = ( 0.3157895 0.5000000 -0.0000000), wk = 0.0031447 k( 65) = ( 0.3289474 0.5000000 -0.0000000), wk = 0.0031447 k( 66) = ( 0.3421053 0.5000000 -0.0000000), wk = 0.0031447 k( 67) = ( 0.3552632 0.5000000 -0.0000000), wk = 0.0031447 k( 68) = ( 0.3684211 0.5000000 -0.0000000), wk = 0.0031447 k( 69) = ( 0.3815789 0.5000000 -0.0000000), wk = 0.0031447 k( 70) = ( 0.3947368 0.5000000 -0.0000000), wk = 0.0031447 k( 71) = ( 0.4078947 0.5000000 -0.0000000), wk = 0.0031447 k( 72) = ( 0.4210526 0.5000000 -0.0000000), wk = 0.0031447 k( 73) = ( 0.4342105 0.5000000 -0.0000000), wk = 0.0031447 k( 74) = ( 0.4473684 0.5000000 -0.0000000), wk = 0.0031447 k( 75) = ( 0.4605263 0.5000000 -0.0000000), wk = 0.0031447 k( 76) = ( 0.4736842 0.5000000 -0.0000000), wk = 0.0031447 k( 77) = ( 0.4868421 0.5000000 -0.0000000), wk = 0.0031447 k( 78) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031447 k( 79) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031447 k( 80) = ( 0.4905660 0.4905660 -0.0000000), wk = 0.0031447 k( 81) = ( 0.4811321 0.4811321 -0.0000000), wk = 0.0031447 k( 82) = ( 0.4716981 0.4716981 -0.0000000), wk = 0.0031447 k( 83) = ( 0.4622641 0.4622641 -0.0000000), wk = 0.0031447 k( 84) = ( 0.4528302 0.4528302 -0.0000000), wk = 0.0031447 k( 85) = ( 0.4433962 0.4433962 -0.0000000), wk = 0.0031447 k( 86) = ( 0.4339623 0.4339623 -0.0000000), wk = 0.0031447 k( 87) = ( 0.4245283 0.4245283 -0.0000000), wk = 0.0031447 k( 88) = ( 0.4150943 0.4150943 -0.0000000), wk = 0.0031447 k( 89) = ( 0.4056604 0.4056604 -0.0000000), wk = 0.0031447 k( 90) = ( 0.3962264 0.3962264 -0.0000000), wk = 0.0031447 k( 91) = ( 0.3867925 0.3867924 -0.0000000), wk = 0.0031447 k( 92) = ( 0.3773585 0.3773585 -0.0000000), wk = 0.0031447 k( 93) = ( 0.3679245 0.3679245 -0.0000000), wk = 0.0031447 k( 94) = ( 0.3584906 0.3584906 -0.0000000), wk = 0.0031447 k( 95) = ( 0.3490566 0.3490566 -0.0000000), wk = 0.0031447 k( 96) = ( 0.3396226 0.3396226 -0.0000000), wk = 0.0031447 k( 97) = ( 0.3301887 0.3301887 -0.0000000), wk = 0.0031447 k( 98) = ( 0.3207547 0.3207547 -0.0000000), wk = 0.0031447 k( 99) = ( 0.3113207 0.3113207 -0.0000000), wk = 0.0031447 k( 100) = ( 0.3018868 0.3018868 -0.0000000), wk = 0.0031447 k( 101) = ( 0.2924528 0.2924528 -0.0000000), wk = 0.0031447 k( 102) = ( 0.2830189 0.2830189 -0.0000000), wk = 0.0031447 k( 103) = ( 0.2735849 0.2735849 -0.0000000), wk = 0.0031447 k( 104) = ( 0.2641509 0.2641509 -0.0000000), wk = 0.0031447 k( 105) = ( 0.2547170 0.2547170 -0.0000000), wk = 0.0031447 k( 106) = ( 0.2452830 0.2452830 -0.0000000), wk = 0.0031447 k( 107) = ( 0.2358491 0.2358491 -0.0000000), wk = 0.0031447 k( 108) = ( 0.2264151 0.2264151 -0.0000000), wk = 0.0031447 k( 109) = ( 0.2169811 0.2169811 -0.0000000), wk = 0.0031447 k( 110) = ( 0.2075472 0.2075472 -0.0000000), wk = 0.0031447 k( 111) = ( 0.1981132 0.1981132 -0.0000000), wk = 0.0031447 k( 112) = ( 0.1886792 0.1886792 -0.0000000), wk = 0.0031447 k( 113) = ( 0.1792453 0.1792453 -0.0000000), wk = 0.0031447 k( 114) = ( 0.1698113 0.1698113 -0.0000000), wk = 0.0031447 k( 115) = ( 0.1603774 0.1603774 -0.0000000), wk = 0.0031447 k( 116) = ( 0.1509434 0.1509434 -0.0000000), wk = 0.0031447 k( 117) = ( 0.1415094 0.1415094 -0.0000000), wk = 0.0031447 k( 118) = ( 0.1320755 0.1320755 -0.0000000), wk = 0.0031447 k( 119) = ( 0.1226415 0.1226415 -0.0000000), wk = 0.0031447 k( 120) = ( 0.1132076 0.1132075 -0.0000000), wk = 0.0031447 k( 121) = ( 0.1037736 0.1037736 -0.0000000), wk = 0.0031447 k( 122) = ( 0.0943396 0.0943396 -0.0000000), wk = 0.0031447 k( 123) = ( 0.0849057 0.0849057 -0.0000000), wk = 0.0031447 k( 124) = ( 0.0754717 0.0754717 -0.0000000), wk = 0.0031447 k( 125) = ( 0.0660377 0.0660377 -0.0000000), wk = 0.0031447 k( 126) = ( 0.0566038 0.0566038 -0.0000000), wk = 0.0031447 k( 127) = ( 0.0471698 0.0471698 -0.0000000), wk = 0.0031447 k( 128) = ( 0.0377359 0.0377358 -0.0000000), wk = 0.0031447 k( 129) = ( 0.0283019 0.0283019 -0.0000000), wk = 0.0031447 k( 130) = ( 0.0188679 0.0188679 -0.0000000), wk = 0.0031447 k( 131) = ( 0.0094340 0.0094340 -0.0000000), wk = 0.0031447 k( 132) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031447 k( 133) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031447 k( 134) = ( 0.0000000 0.0000000 0.0134069), wk = 0.0031447 k( 135) = ( 0.0000000 0.0000000 0.0268139), wk = 0.0031447 k( 136) = ( 0.0000000 0.0000000 0.0402209), wk = 0.0031447 k( 137) = ( 0.0000000 0.0000000 0.0536278), wk = 0.0031447 k( 138) = ( 0.0000000 0.0000000 0.0670348), wk = 0.0031447 k( 139) = ( 0.0000000 0.0000000 0.0804417), wk = 0.0031447 k( 140) = ( 0.0000000 0.0000000 0.0938487), wk = 0.0031447 k( 141) = ( 0.0000000 0.0000000 0.1072556), wk = 0.0031447 k( 142) = ( 0.0000000 0.0000000 0.1206626), wk = 0.0031447 k( 143) = ( 0.0000000 0.0000000 0.1340695), wk = 0.0031447 k( 144) = ( 0.0000000 0.0000000 0.1474765), wk = 0.0031447 k( 145) = ( 0.0000000 0.0000000 0.1608834), wk = 0.0031447 k( 146) = ( 0.0000000 0.0000000 0.1742904), wk = 0.0031447 k( 147) = ( 0.0000000 0.0000000 0.1876973), wk = 0.0031447 k( 148) = ( 0.0000000 0.0000000 0.2011043), wk = 0.0031447 k( 149) = ( 0.0000000 0.0000000 0.2145112), wk = 0.0031447 k( 150) = ( 0.0000000 0.0000000 0.2279182), wk = 0.0031447 k( 151) = ( 0.0000000 0.0000000 0.2279182), wk = 0.0031447 k( 152) = ( 0.0000000 0.0131579 0.2279182), wk = 0.0031447 k( 153) = ( 0.0000000 0.0263158 0.2279182), wk = 0.0031447 k( 154) = ( 0.0000000 0.0394737 0.2279182), wk = 0.0031447 k( 155) = ( 0.0000000 0.0526316 0.2279182), wk = 0.0031447 k( 156) = ( 0.0000000 0.0657895 0.2279182), wk = 0.0031447 k( 157) = ( 0.0000000 0.0789474 0.2279182), wk = 0.0031447 k( 158) = ( 0.0000000 0.0921053 0.2279182), wk = 0.0031447 k( 159) = ( 0.0000000 0.1052632 0.2279182), wk = 0.0031447 k( 160) = ( 0.0000000 0.1184210 0.2279182), wk = 0.0031447 k( 161) = ( 0.0000000 0.1315790 0.2279182), wk = 0.0031447 k( 162) = ( 0.0000000 0.1447368 0.2279182), wk = 0.0031447 k( 163) = ( 0.0000000 0.1578947 0.2279182), wk = 0.0031447 k( 164) = ( 0.0000000 0.1710526 0.2279182), wk = 0.0031447 k( 165) = ( 0.0000000 0.1842105 0.2279182), wk = 0.0031447 k( 166) = ( 0.0000000 0.1973684 0.2279182), wk = 0.0031447 k( 167) = ( 0.0000000 0.2105263 0.2279182), wk = 0.0031447 k( 168) = ( 0.0000000 0.2236842 0.2279182), wk = 0.0031447 k( 169) = ( 0.0000000 0.2368421 0.2279182), wk = 0.0031447 k( 170) = ( 0.0000000 0.2500000 0.2279182), wk = 0.0031447 k( 171) = ( 0.0000000 0.2631579 0.2279182), wk = 0.0031447 k( 172) = ( 0.0000000 0.2763158 0.2279182), wk = 0.0031447 k( 173) = ( 0.0000000 0.2894737 0.2279182), wk = 0.0031447 k( 174) = ( 0.0000000 0.3026316 0.2279182), wk = 0.0031447 k( 175) = ( 0.0000000 0.3157895 0.2279182), wk = 0.0031447 k( 176) = ( 0.0000000 0.3289474 0.2279182), wk = 0.0031447 k( 177) = ( 0.0000000 0.3421053 0.2279182), wk = 0.0031447 k( 178) = ( 0.0000000 0.3552632 0.2279182), wk = 0.0031447 k( 179) = ( 0.0000000 0.3684211 0.2279182), wk = 0.0031447 k( 180) = ( 0.0000000 0.3815789 0.2279182), wk = 0.0031447 k( 181) = ( 0.0000000 0.3947368 0.2279182), wk = 0.0031447 k( 182) = ( 0.0000000 0.4078947 0.2279182), wk = 0.0031447 k( 183) = ( 0.0000000 0.4210526 0.2279182), wk = 0.0031447 k( 184) = ( 0.0000000 0.4342105 0.2279182), wk = 0.0031447 k( 185) = ( 0.0000000 0.4473684 0.2279182), wk = 0.0031447 k( 186) = ( 0.0000000 0.4605263 0.2279182), wk = 0.0031447 k( 187) = ( 0.0000000 0.4736842 0.2279182), wk = 0.0031447 k( 188) = ( 0.0000000 0.4868421 0.2279182), wk = 0.0031447 k( 189) = ( 0.0000000 0.5000000 0.2279182), wk = 0.0031447 k( 190) = ( 0.0000000 0.5000000 0.2279182), wk = 0.0031447 k( 191) = ( 0.0131579 0.5000000 0.2279182), wk = 0.0031447 k( 192) = ( 0.0263158 0.5000000 0.2279182), wk = 0.0031447 k( 193) = ( 0.0394737 0.5000000 0.2279182), wk = 0.0031447 k( 194) = ( 0.0526316 0.5000000 0.2279182), wk = 0.0031447 k( 195) = ( 0.0657895 0.5000000 0.2279182), wk = 0.0031447 k( 196) = ( 0.0789474 0.5000000 0.2279182), wk = 0.0031447 k( 197) = ( 0.0921053 0.5000000 0.2279182), wk = 0.0031447 k( 198) = ( 0.1052632 0.5000000 0.2279182), wk = 0.0031447 k( 199) = ( 0.1184210 0.5000000 0.2279182), wk = 0.0031447 k( 200) = ( 0.1315790 0.5000000 0.2279182), wk = 0.0031447 k( 201) = ( 0.1447368 0.5000000 0.2279182), wk = 0.0031447 k( 202) = ( 0.1578947 0.5000000 0.2279182), wk = 0.0031447 k( 203) = ( 0.1710526 0.5000000 0.2279182), wk = 0.0031447 k( 204) = ( 0.1842105 0.5000000 0.2279182), wk = 0.0031447 k( 205) = ( 0.1973684 0.5000000 0.2279182), wk = 0.0031447 k( 206) = ( 0.2105263 0.5000000 0.2279182), wk = 0.0031447 k( 207) = ( 0.2236842 0.5000000 0.2279182), wk = 0.0031447 k( 208) = ( 0.2368421 0.5000000 0.2279182), wk = 0.0031447 k( 209) = ( 0.2500000 0.5000000 0.2279182), wk = 0.0031447 k( 210) = ( 0.2631579 0.5000000 0.2279182), wk = 0.0031447 k( 211) = ( 0.2763158 0.5000000 0.2279182), wk = 0.0031447 k( 212) = ( 0.2894737 0.5000000 0.2279182), wk = 0.0031447 k( 213) = ( 0.3026316 0.5000000 0.2279182), wk = 0.0031447 k( 214) = ( 0.3157895 0.5000000 0.2279182), wk = 0.0031447 k( 215) = ( 0.3289474 0.5000000 0.2279182), wk = 0.0031447 k( 216) = ( 0.3421053 0.5000000 0.2279182), wk = 0.0031447 k( 217) = ( 0.3552632 0.5000000 0.2279182), wk = 0.0031447 k( 218) = ( 0.3684211 0.5000000 0.2279182), wk = 0.0031447 k( 219) = ( 0.3815789 0.5000000 0.2279182), wk = 0.0031447 k( 220) = ( 0.3947368 0.5000000 0.2279182), wk = 0.0031447 k( 221) = ( 0.4078947 0.5000000 0.2279182), wk = 0.0031447 k( 222) = ( 0.4210526 0.5000000 0.2279182), wk = 0.0031447 k( 223) = ( 0.4342105 0.5000000 0.2279182), wk = 0.0031447 k( 224) = ( 0.4473684 0.5000000 0.2279182), wk = 0.0031447 k( 225) = ( 0.4605263 0.5000000 0.2279182), wk = 0.0031447 k( 226) = ( 0.4736842 0.5000000 0.2279182), wk = 0.0031447 k( 227) = ( 0.4868421 0.5000000 0.2279182), wk = 0.0031447 k( 228) = ( 0.5000000 0.5000000 0.2279182), wk = 0.0031447 k( 229) = ( 0.5000000 0.5000000 0.2279182), wk = 0.0031447 k( 230) = ( 0.4905660 0.4905660 0.2279182), wk = 0.0031447 k( 231) = ( 0.4811321 0.4811321 0.2279182), wk = 0.0031447 k( 232) = ( 0.4716981 0.4716981 0.2279182), wk = 0.0031447 k( 233) = ( 0.4622641 0.4622641 0.2279182), wk = 0.0031447 k( 234) = ( 0.4528302 0.4528302 0.2279182), wk = 0.0031447 k( 235) = ( 0.4433962 0.4433962 0.2279182), wk = 0.0031447 k( 236) = ( 0.4339623 0.4339623 0.2279182), wk = 0.0031447 k( 237) = ( 0.4245283 0.4245283 0.2279182), wk = 0.0031447 k( 238) = ( 0.4150943 0.4150943 0.2279182), wk = 0.0031447 k( 239) = ( 0.4056604 0.4056604 0.2279182), wk = 0.0031447 k( 240) = ( 0.3962264 0.3962264 0.2279182), wk = 0.0031447 k( 241) = ( 0.3867925 0.3867924 0.2279182), wk = 0.0031447 k( 242) = ( 0.3773585 0.3773585 0.2279182), wk = 0.0031447 k( 243) = ( 0.3679245 0.3679245 0.2279182), wk = 0.0031447 k( 244) = ( 0.3584906 0.3584906 0.2279182), wk = 0.0031447 k( 245) = ( 0.3490566 0.3490566 0.2279182), wk = 0.0031447 k( 246) = ( 0.3396226 0.3396226 0.2279182), wk = 0.0031447 k( 247) = ( 0.3301887 0.3301887 0.2279182), wk = 0.0031447 k( 248) = ( 0.3207547 0.3207547 0.2279182), wk = 0.0031447 k( 249) = ( 0.3113207 0.3113207 0.2279182), wk = 0.0031447 k( 250) = ( 0.3018868 0.3018868 0.2279182), wk = 0.0031447 k( 251) = ( 0.2924528 0.2924528 0.2279182), wk = 0.0031447 k( 252) = ( 0.2830189 0.2830189 0.2279182), wk = 0.0031447 k( 253) = ( 0.2735849 0.2735849 0.2279182), wk = 0.0031447 k( 254) = ( 0.2641509 0.2641509 0.2279182), wk = 0.0031447 k( 255) = ( 0.2547170 0.2547170 0.2279182), wk = 0.0031447 k( 256) = ( 0.2452830 0.2452830 0.2279182), wk = 0.0031447 k( 257) = ( 0.2358491 0.2358491 0.2279182), wk = 0.0031447 k( 258) = ( 0.2264151 0.2264151 0.2279182), wk = 0.0031447 k( 259) = ( 0.2169811 0.2169811 0.2279182), wk = 0.0031447 k( 260) = ( 0.2075472 0.2075472 0.2279182), wk = 0.0031447 k( 261) = ( 0.1981132 0.1981132 0.2279182), wk = 0.0031447 k( 262) = ( 0.1886792 0.1886792 0.2279182), wk = 0.0031447 k( 263) = ( 0.1792453 0.1792453 0.2279182), wk = 0.0031447 k( 264) = ( 0.1698113 0.1698113 0.2279182), wk = 0.0031447 k( 265) = ( 0.1603774 0.1603774 0.2279182), wk = 0.0031447 k( 266) = ( 0.1509434 0.1509434 0.2279182), wk = 0.0031447 k( 267) = ( 0.1415094 0.1415094 0.2279182), wk = 0.0031447 k( 268) = ( 0.1320755 0.1320755 0.2279182), wk = 0.0031447 k( 269) = ( 0.1226415 0.1226415 0.2279182), wk = 0.0031447 k( 270) = ( 0.1132076 0.1132075 0.2279182), wk = 0.0031447 k( 271) = ( 0.1037736 0.1037736 0.2279182), wk = 0.0031447 k( 272) = ( 0.0943396 0.0943396 0.2279182), wk = 0.0031447 k( 273) = ( 0.0849057 0.0849057 0.2279182), wk = 0.0031447 k( 274) = ( 0.0754717 0.0754717 0.2279182), wk = 0.0031447 k( 275) = ( 0.0660377 0.0660377 0.2279182), wk = 0.0031447 k( 276) = ( 0.0566038 0.0566038 0.2279182), wk = 0.0031447 k( 277) = ( 0.0471698 0.0471698 0.2279182), wk = 0.0031447 k( 278) = ( 0.0377359 0.0377358 0.2279182), wk = 0.0031447 k( 279) = ( 0.0283019 0.0283019 0.2279182), wk = 0.0031447 k( 280) = ( 0.0188679 0.0188679 0.2279182), wk = 0.0031447 k( 281) = ( 0.0094340 0.0094340 0.2279182), wk = 0.0031447 k( 282) = ( 0.0000000 0.0000000 0.2279182), wk = 0.0031447 k( 283) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031447 k( 284) = ( 0.0000000 0.5000000 0.0134069), wk = 0.0031447 k( 285) = ( 0.0000000 0.5000000 0.0268139), wk = 0.0031447 k( 286) = ( 0.0000000 0.5000000 0.0402209), wk = 0.0031447 k( 287) = ( 0.0000000 0.5000000 0.0536278), wk = 0.0031447 k( 288) = ( 0.0000000 0.5000000 0.0670348), wk = 0.0031447 k( 289) = ( 0.0000000 0.5000000 0.0804417), wk = 0.0031447 k( 290) = ( 0.0000000 0.5000000 0.0938487), wk = 0.0031447 k( 291) = ( 0.0000000 0.5000000 0.1072556), wk = 0.0031447 k( 292) = ( 0.0000000 0.5000000 0.1206626), wk = 0.0031447 k( 293) = ( 0.0000000 0.5000000 0.1340695), wk = 0.0031447 k( 294) = ( 0.0000000 0.5000000 0.1474765), wk = 0.0031447 k( 295) = ( 0.0000000 0.5000000 0.1608834), wk = 0.0031447 k( 296) = ( 0.0000000 0.5000000 0.1742904), wk = 0.0031447 k( 297) = ( 0.0000000 0.5000000 0.1876973), wk = 0.0031447 k( 298) = ( 0.0000000 0.5000000 0.2011043), wk = 0.0031447 k( 299) = ( 0.0000000 0.5000000 0.2145112), wk = 0.0031447 k( 300) = ( 0.0000000 0.5000000 0.2279182), wk = 0.0031447 k( 301) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031447 k( 302) = ( 0.5000000 0.5000000 0.0134069), wk = 0.0031447 k( 303) = ( 0.5000000 0.5000000 0.0268139), wk = 0.0031447 k( 304) = ( 0.5000000 0.5000000 0.0402209), wk = 0.0031447 k( 305) = ( 0.5000000 0.5000000 0.0536278), wk = 0.0031447 k( 306) = ( 0.5000000 0.5000000 0.0670348), wk = 0.0031447 k( 307) = ( 0.5000000 0.5000000 0.0804417), wk = 0.0031447 k( 308) = ( 0.5000000 0.5000000 0.0938487), wk = 0.0031447 k( 309) = ( 0.5000000 0.5000000 0.1072556), wk = 0.0031447 k( 310) = ( 0.5000000 0.5000000 0.1206626), wk = 0.0031447 k( 311) = ( 0.5000000 0.5000000 0.1340695), wk = 0.0031447 k( 312) = ( 0.5000000 0.5000000 0.1474765), wk = 0.0031447 k( 313) = ( 0.5000000 0.5000000 0.1608834), wk = 0.0031447 k( 314) = ( 0.5000000 0.5000000 0.1742904), wk = 0.0031447 k( 315) = ( 0.5000000 0.5000000 0.1876973), wk = 0.0031447 k( 316) = ( 0.5000000 0.5000000 0.2011043), wk = 0.0031447 k( 317) = ( 0.5000000 0.5000000 0.2145112), wk = 0.0031447 k( 318) = ( 0.5000000 0.5000000 0.2279182), wk = 0.0031447 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031447 k( 2) = ( 0.0000000 0.0131579 0.0000000), wk = 0.0031447 k( 3) = ( 0.0000000 0.0263158 -0.0000000), wk = 0.0031447 k( 4) = ( 0.0000000 0.0394737 -0.0000000), wk = 0.0031447 k( 5) = ( 0.0000000 0.0526316 -0.0000000), wk = 0.0031447 k( 6) = ( 0.0000000 0.0657895 -0.0000000), wk = 0.0031447 k( 7) = ( 0.0000000 0.0789474 -0.0000000), wk = 0.0031447 k( 8) = ( 0.0000000 0.0921053 0.0000000), wk = 0.0031447 k( 9) = ( 0.0000000 0.1052632 -0.0000000), wk = 0.0031447 k( 10) = ( 0.0000000 0.1184210 -0.0000000), wk = 0.0031447 k( 11) = ( 0.0000000 0.1315790 -0.0000000), wk = 0.0031447 k( 12) = ( 0.0000000 0.1447368 0.0000000), wk = 0.0031447 k( 13) = ( 0.0000000 0.1578947 -0.0000000), wk = 0.0031447 k( 14) = ( 0.0000000 0.1710526 -0.0000000), wk = 0.0031447 k( 15) = ( 0.0000000 0.1842105 0.0000000), wk = 0.0031447 k( 16) = ( 0.0000000 0.1973684 0.0000000), wk = 0.0031447 k( 17) = ( 0.0000000 0.2105263 -0.0000000), wk = 0.0031447 k( 18) = ( 0.0000000 0.2236842 -0.0000000), wk = 0.0031447 k( 19) = ( 0.0000000 0.2368421 0.0000000), wk = 0.0031447 k( 20) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0031447 k( 21) = ( 0.0000000 0.2631579 0.0000000), wk = 0.0031447 k( 22) = ( 0.0000000 0.2763158 -0.0000000), wk = 0.0031447 k( 23) = ( 0.0000000 0.2894737 0.0000000), wk = 0.0031447 k( 24) = ( 0.0000000 0.3026316 0.0000000), wk = 0.0031447 k( 25) = ( 0.0000000 0.3157895 0.0000000), wk = 0.0031447 k( 26) = ( 0.0000000 0.3289474 -0.0000000), wk = 0.0031447 k( 27) = ( 0.0000000 0.3421053 -0.0000000), wk = 0.0031447 k( 28) = ( 0.0000000 0.3552632 0.0000000), wk = 0.0031447 k( 29) = ( 0.0000000 0.3684211 0.0000000), wk = 0.0031447 k( 30) = ( 0.0000000 0.3815789 0.0000000), wk = 0.0031447 k( 31) = ( 0.0000000 0.3947368 0.0000000), wk = 0.0031447 k( 32) = ( 0.0000000 0.4078947 0.0000000), wk = 0.0031447 k( 33) = ( 0.0000000 0.4210526 0.0000000), wk = 0.0031447 k( 34) = ( 0.0000000 0.4342105 -0.0000000), wk = 0.0031447 k( 35) = ( 0.0000000 0.4473684 -0.0000000), wk = 0.0031447 k( 36) = ( 0.0000000 0.4605263 0.0000000), wk = 0.0031447 k( 37) = ( 0.0000000 0.4736842 0.0000000), wk = 0.0031447 k( 38) = ( 0.0000000 0.4868421 0.0000000), wk = 0.0031447 k( 39) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031447 k( 40) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031447 k( 41) = ( 0.0131579 0.5000000 0.0000000), wk = 0.0031447 k( 42) = ( 0.0263158 0.5000000 0.0000000), wk = 0.0031447 k( 43) = ( 0.0394737 0.5000000 0.0000000), wk = 0.0031447 k( 44) = ( 0.0526316 0.5000000 -0.0000000), wk = 0.0031447 k( 45) = ( 0.0657895 0.5000000 0.0000000), wk = 0.0031447 k( 46) = ( 0.0789474 0.5000000 -0.0000000), wk = 0.0031447 k( 47) = ( 0.0921053 0.5000000 0.0000000), wk = 0.0031447 k( 48) = ( 0.1052632 0.5000000 -0.0000000), wk = 0.0031447 k( 49) = ( 0.1184210 0.5000000 -0.0000000), wk = 0.0031447 k( 50) = ( 0.1315790 0.5000000 0.0000000), wk = 0.0031447 k( 51) = ( 0.1447368 0.5000000 0.0000000), wk = 0.0031447 k( 52) = ( 0.1578947 0.5000000 0.0000000), wk = 0.0031447 k( 53) = ( 0.1710526 0.5000000 0.0000000), wk = 0.0031447 k( 54) = ( 0.1842105 0.5000000 0.0000000), wk = 0.0031447 k( 55) = ( 0.1973684 0.5000000 0.0000000), wk = 0.0031447 k( 56) = ( 0.2105263 0.5000000 0.0000000), wk = 0.0031447 k( 57) = ( 0.2236842 0.5000000 0.0000000), wk = 0.0031447 k( 58) = ( 0.2368421 0.5000000 0.0000000), wk = 0.0031447 k( 59) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0031447 k( 60) = ( 0.2631579 0.5000000 0.0000000), wk = 0.0031447 k( 61) = ( 0.2763158 0.5000000 0.0000000), wk = 0.0031447 k( 62) = ( 0.2894737 0.5000000 0.0000000), wk = 0.0031447 k( 63) = ( 0.3026316 0.5000000 0.0000000), wk = 0.0031447 k( 64) = ( 0.3157895 0.5000000 0.0000000), wk = 0.0031447 k( 65) = ( 0.3289474 0.5000000 -0.0000000), wk = 0.0031447 k( 66) = ( 0.3421053 0.5000000 0.0000000), wk = 0.0031447 k( 67) = ( 0.3552632 0.5000000 -0.0000000), wk = 0.0031447 k( 68) = ( 0.3684211 0.5000000 -0.0000000), wk = 0.0031447 k( 69) = ( 0.3815789 0.5000000 -0.0000000), wk = 0.0031447 k( 70) = ( 0.3947368 0.5000000 0.0000000), wk = 0.0031447 k( 71) = ( 0.4078947 0.5000000 0.0000000), wk = 0.0031447 k( 72) = ( 0.4210526 0.5000000 0.0000000), wk = 0.0031447 k( 73) = ( 0.4342105 0.5000000 0.0000000), wk = 0.0031447 k( 74) = ( 0.4473684 0.5000000 0.0000000), wk = 0.0031447 k( 75) = ( 0.4605263 0.5000000 0.0000000), wk = 0.0031447 k( 76) = ( 0.4736842 0.5000000 0.0000000), wk = 0.0031447 k( 77) = ( 0.4868421 0.5000000 0.0000000), wk = 0.0031447 k( 78) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0031447 k( 79) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0031447 k( 80) = ( 0.4905660 0.4905660 -0.0000000), wk = 0.0031447 k( 81) = ( 0.4811321 0.4811321 -0.0000000), wk = 0.0031447 k( 82) = ( 0.4716981 0.4716981 0.0000000), wk = 0.0031447 k( 83) = ( 0.4622641 0.4622641 0.0000000), wk = 0.0031447 k( 84) = ( 0.4528302 0.4528302 0.0000000), wk = 0.0031447 k( 85) = ( 0.4433962 0.4433962 0.0000000), wk = 0.0031447 k( 86) = ( 0.4339623 0.4339623 -0.0000000), wk = 0.0031447 k( 87) = ( 0.4245283 0.4245283 -0.0000000), wk = 0.0031447 k( 88) = ( 0.4150943 0.4150943 -0.0000000), wk = 0.0031447 k( 89) = ( 0.4056604 0.4056604 0.0000000), wk = 0.0031447 k( 90) = ( 0.3962264 0.3962264 0.0000000), wk = 0.0031447 k( 91) = ( 0.3867925 0.3867925 -0.0000000), wk = 0.0031447 k( 92) = ( 0.3773585 0.3773585 0.0000000), wk = 0.0031447 k( 93) = ( 0.3679245 0.3679245 0.0000000), wk = 0.0031447 k( 94) = ( 0.3584906 0.3584906 0.0000000), wk = 0.0031447 k( 95) = ( 0.3490566 0.3490566 0.0000000), wk = 0.0031447 k( 96) = ( 0.3396226 0.3396226 0.0000000), wk = 0.0031447 k( 97) = ( 0.3301887 0.3301887 -0.0000000), wk = 0.0031447 k( 98) = ( 0.3207547 0.3207547 -0.0000000), wk = 0.0031447 k( 99) = ( 0.3113207 0.3113207 0.0000000), wk = 0.0031447 k( 100) = ( 0.3018868 0.3018868 0.0000000), wk = 0.0031447 k( 101) = ( 0.2924528 0.2924528 0.0000000), wk = 0.0031447 k( 102) = ( 0.2830189 0.2830189 0.0000000), wk = 0.0031447 k( 103) = ( 0.2735849 0.2735849 0.0000000), wk = 0.0031447 k( 104) = ( 0.2641509 0.2641509 0.0000000), wk = 0.0031447 k( 105) = ( 0.2547170 0.2547170 0.0000000), wk = 0.0031447 k( 106) = ( 0.2452830 0.2452830 -0.0000000), wk = 0.0031447 k( 107) = ( 0.2358491 0.2358491 -0.0000000), wk = 0.0031447 k( 108) = ( 0.2264151 0.2264151 -0.0000000), wk = 0.0031447 k( 109) = ( 0.2169811 0.2169811 -0.0000000), wk = 0.0031447 k( 110) = ( 0.2075472 0.2075472 -0.0000000), wk = 0.0031447 k( 111) = ( 0.1981132 0.1981132 0.0000000), wk = 0.0031447 k( 112) = ( 0.1886792 0.1886792 0.0000000), wk = 0.0031447 k( 113) = ( 0.1792453 0.1792453 -0.0000000), wk = 0.0031447 k( 114) = ( 0.1698113 0.1698113 0.0000000), wk = 0.0031447 k( 115) = ( 0.1603774 0.1603774 -0.0000000), wk = 0.0031447 k( 116) = ( 0.1509434 0.1509434 -0.0000000), wk = 0.0031447 k( 117) = ( 0.1415094 0.1415094 -0.0000000), wk = 0.0031447 k( 118) = ( 0.1320755 0.1320755 0.0000000), wk = 0.0031447 k( 119) = ( 0.1226415 0.1226415 -0.0000000), wk = 0.0031447 k( 120) = ( 0.1132076 0.1132076 -0.0000000), wk = 0.0031447 k( 121) = ( 0.1037736 0.1037736 -0.0000000), wk = 0.0031447 k( 122) = ( 0.0943396 0.0943396 -0.0000000), wk = 0.0031447 k( 123) = ( 0.0849057 0.0849057 0.0000000), wk = 0.0031447 k( 124) = ( 0.0754717 0.0754717 -0.0000000), wk = 0.0031447 k( 125) = ( 0.0660377 0.0660377 0.0000000), wk = 0.0031447 k( 126) = ( 0.0566038 0.0566038 0.0000000), wk = 0.0031447 k( 127) = ( 0.0471698 0.0471698 -0.0000000), wk = 0.0031447 k( 128) = ( 0.0377359 0.0377359 -0.0000000), wk = 0.0031447 k( 129) = ( 0.0283019 0.0283019 0.0000000), wk = 0.0031447 k( 130) = ( 0.0188679 0.0188679 -0.0000000), wk = 0.0031447 k( 131) = ( 0.0094340 0.0094340 -0.0000000), wk = 0.0031447 k( 132) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031447 k( 133) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031447 k( 134) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0031447 k( 135) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0031447 k( 136) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0031447 k( 137) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0031447 k( 138) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0031447 k( 139) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0031447 k( 140) = ( 0.0000000 0.0000000 0.2058824), wk = 0.0031447 k( 141) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0031447 k( 142) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0031447 k( 143) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0031447 k( 144) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0031447 k( 145) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0031447 k( 146) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0031447 k( 147) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0031447 k( 148) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0031447 k( 149) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0031447 k( 150) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031447 k( 151) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031447 k( 152) = ( 0.0000000 0.0131579 0.5000000), wk = 0.0031447 k( 153) = ( 0.0000000 0.0263158 0.5000000), wk = 0.0031447 k( 154) = ( 0.0000000 0.0394737 0.5000000), wk = 0.0031447 k( 155) = ( 0.0000000 0.0526316 0.5000000), wk = 0.0031447 k( 156) = ( 0.0000000 0.0657895 0.5000000), wk = 0.0031447 k( 157) = ( 0.0000000 0.0789474 0.5000000), wk = 0.0031447 k( 158) = ( 0.0000000 0.0921053 0.5000000), wk = 0.0031447 k( 159) = ( 0.0000000 0.1052632 0.5000000), wk = 0.0031447 k( 160) = ( 0.0000000 0.1184210 0.5000000), wk = 0.0031447 k( 161) = ( 0.0000000 0.1315790 0.5000000), wk = 0.0031447 k( 162) = ( 0.0000000 0.1447368 0.5000000), wk = 0.0031447 k( 163) = ( 0.0000000 0.1578947 0.5000000), wk = 0.0031447 k( 164) = ( 0.0000000 0.1710526 0.5000000), wk = 0.0031447 k( 165) = ( 0.0000000 0.1842105 0.5000000), wk = 0.0031447 k( 166) = ( 0.0000000 0.1973684 0.5000000), wk = 0.0031447 k( 167) = ( 0.0000000 0.2105263 0.5000000), wk = 0.0031447 k( 168) = ( 0.0000000 0.2236842 0.5000000), wk = 0.0031447 k( 169) = ( 0.0000000 0.2368421 0.5000000), wk = 0.0031447 k( 170) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0031447 k( 171) = ( 0.0000000 0.2631579 0.5000000), wk = 0.0031447 k( 172) = ( 0.0000000 0.2763158 0.5000000), wk = 0.0031447 k( 173) = ( 0.0000000 0.2894737 0.5000000), wk = 0.0031447 k( 174) = ( 0.0000000 0.3026316 0.5000000), wk = 0.0031447 k( 175) = ( 0.0000000 0.3157895 0.5000000), wk = 0.0031447 k( 176) = ( 0.0000000 0.3289474 0.5000000), wk = 0.0031447 k( 177) = ( 0.0000000 0.3421053 0.5000000), wk = 0.0031447 k( 178) = ( 0.0000000 0.3552632 0.5000000), wk = 0.0031447 k( 179) = ( 0.0000000 0.3684211 0.5000000), wk = 0.0031447 k( 180) = ( 0.0000000 0.3815789 0.5000000), wk = 0.0031447 k( 181) = ( 0.0000000 0.3947368 0.5000000), wk = 0.0031447 k( 182) = ( 0.0000000 0.4078947 0.5000000), wk = 0.0031447 k( 183) = ( 0.0000000 0.4210526 0.5000000), wk = 0.0031447 k( 184) = ( 0.0000000 0.4342105 0.5000000), wk = 0.0031447 k( 185) = ( 0.0000000 0.4473684 0.5000000), wk = 0.0031447 k( 186) = ( 0.0000000 0.4605263 0.5000000), wk = 0.0031447 k( 187) = ( 0.0000000 0.4736842 0.5000000), wk = 0.0031447 k( 188) = ( 0.0000000 0.4868421 0.5000000), wk = 0.0031447 k( 189) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0031447 k( 190) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0031447 k( 191) = ( 0.0131579 0.5000000 0.5000000), wk = 0.0031447 k( 192) = ( 0.0263158 0.5000000 0.5000000), wk = 0.0031447 k( 193) = ( 0.0394737 0.5000000 0.5000000), wk = 0.0031447 k( 194) = ( 0.0526316 0.5000000 0.5000000), wk = 0.0031447 k( 195) = ( 0.0657895 0.5000000 0.5000000), wk = 0.0031447 k( 196) = ( 0.0789474 0.5000000 0.5000000), wk = 0.0031447 k( 197) = ( 0.0921053 0.5000000 0.5000000), wk = 0.0031447 k( 198) = ( 0.1052632 0.5000000 0.5000000), wk = 0.0031447 k( 199) = ( 0.1184210 0.5000000 0.5000000), wk = 0.0031447 k( 200) = ( 0.1315790 0.5000000 0.5000000), wk = 0.0031447 k( 201) = ( 0.1447368 0.5000000 0.5000000), wk = 0.0031447 k( 202) = ( 0.1578947 0.5000000 0.5000000), wk = 0.0031447 k( 203) = ( 0.1710526 0.5000000 0.5000000), wk = 0.0031447 k( 204) = ( 0.1842105 0.5000000 0.5000000), wk = 0.0031447 k( 205) = ( 0.1973684 0.5000000 0.5000000), wk = 0.0031447 k( 206) = ( 0.2105263 0.5000000 0.5000000), wk = 0.0031447 k( 207) = ( 0.2236842 0.5000000 0.5000000), wk = 0.0031447 k( 208) = ( 0.2368421 0.5000000 0.5000000), wk = 0.0031447 k( 209) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0031447 k( 210) = ( 0.2631579 0.5000000 0.5000000), wk = 0.0031447 k( 211) = ( 0.2763158 0.5000000 0.5000000), wk = 0.0031447 k( 212) = ( 0.2894737 0.5000000 0.5000000), wk = 0.0031447 k( 213) = ( 0.3026316 0.5000000 0.5000000), wk = 0.0031447 k( 214) = ( 0.3157895 0.5000000 0.5000000), wk = 0.0031447 k( 215) = ( 0.3289474 0.5000000 0.5000000), wk = 0.0031447 k( 216) = ( 0.3421053 0.5000000 0.5000000), wk = 0.0031447 k( 217) = ( 0.3552632 0.5000000 0.5000000), wk = 0.0031447 k( 218) = ( 0.3684211 0.5000000 0.5000000), wk = 0.0031447 k( 219) = ( 0.3815789 0.5000000 0.5000000), wk = 0.0031447 k( 220) = ( 0.3947368 0.5000000 0.5000000), wk = 0.0031447 k( 221) = ( 0.4078947 0.5000000 0.5000000), wk = 0.0031447 k( 222) = ( 0.4210526 0.5000000 0.5000000), wk = 0.0031447 k( 223) = ( 0.4342105 0.5000000 0.5000000), wk = 0.0031447 k( 224) = ( 0.4473684 0.5000000 0.5000000), wk = 0.0031447 k( 225) = ( 0.4605263 0.5000000 0.5000000), wk = 0.0031447 k( 226) = ( 0.4736842 0.5000000 0.5000000), wk = 0.0031447 k( 227) = ( 0.4868421 0.5000000 0.5000000), wk = 0.0031447 k( 228) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031447 k( 229) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031447 k( 230) = ( 0.4905660 0.4905660 0.5000000), wk = 0.0031447 k( 231) = ( 0.4811321 0.4811321 0.5000000), wk = 0.0031447 k( 232) = ( 0.4716981 0.4716981 0.5000000), wk = 0.0031447 k( 233) = ( 0.4622641 0.4622641 0.5000000), wk = 0.0031447 k( 234) = ( 0.4528302 0.4528302 0.5000000), wk = 0.0031447 k( 235) = ( 0.4433962 0.4433962 0.5000000), wk = 0.0031447 k( 236) = ( 0.4339623 0.4339623 0.5000000), wk = 0.0031447 k( 237) = ( 0.4245283 0.4245283 0.5000000), wk = 0.0031447 k( 238) = ( 0.4150943 0.4150943 0.5000000), wk = 0.0031447 k( 239) = ( 0.4056604 0.4056604 0.5000000), wk = 0.0031447 k( 240) = ( 0.3962264 0.3962264 0.5000000), wk = 0.0031447 k( 241) = ( 0.3867925 0.3867925 0.5000000), wk = 0.0031447 k( 242) = ( 0.3773585 0.3773585 0.5000000), wk = 0.0031447 k( 243) = ( 0.3679245 0.3679245 0.5000000), wk = 0.0031447 k( 244) = ( 0.3584906 0.3584906 0.5000000), wk = 0.0031447 k( 245) = ( 0.3490566 0.3490566 0.5000000), wk = 0.0031447 k( 246) = ( 0.3396226 0.3396226 0.5000000), wk = 0.0031447 k( 247) = ( 0.3301887 0.3301887 0.5000000), wk = 0.0031447 k( 248) = ( 0.3207547 0.3207547 0.5000000), wk = 0.0031447 k( 249) = ( 0.3113207 0.3113207 0.5000000), wk = 0.0031447 k( 250) = ( 0.3018868 0.3018868 0.5000000), wk = 0.0031447 k( 251) = ( 0.2924528 0.2924528 0.5000000), wk = 0.0031447 k( 252) = ( 0.2830189 0.2830189 0.5000000), wk = 0.0031447 k( 253) = ( 0.2735849 0.2735849 0.5000000), wk = 0.0031447 k( 254) = ( 0.2641509 0.2641509 0.5000000), wk = 0.0031447 k( 255) = ( 0.2547170 0.2547170 0.5000000), wk = 0.0031447 k( 256) = ( 0.2452830 0.2452830 0.5000000), wk = 0.0031447 k( 257) = ( 0.2358491 0.2358491 0.5000000), wk = 0.0031447 k( 258) = ( 0.2264151 0.2264151 0.5000000), wk = 0.0031447 k( 259) = ( 0.2169811 0.2169811 0.5000000), wk = 0.0031447 k( 260) = ( 0.2075472 0.2075472 0.5000000), wk = 0.0031447 k( 261) = ( 0.1981132 0.1981132 0.5000000), wk = 0.0031447 k( 262) = ( 0.1886792 0.1886792 0.5000000), wk = 0.0031447 k( 263) = ( 0.1792453 0.1792453 0.5000000), wk = 0.0031447 k( 264) = ( 0.1698113 0.1698113 0.5000000), wk = 0.0031447 k( 265) = ( 0.1603774 0.1603774 0.5000000), wk = 0.0031447 k( 266) = ( 0.1509434 0.1509434 0.5000000), wk = 0.0031447 k( 267) = ( 0.1415094 0.1415094 0.5000000), wk = 0.0031447 k( 268) = ( 0.1320755 0.1320755 0.5000000), wk = 0.0031447 k( 269) = ( 0.1226415 0.1226415 0.5000000), wk = 0.0031447 k( 270) = ( 0.1132076 0.1132076 0.5000000), wk = 0.0031447 k( 271) = ( 0.1037736 0.1037736 0.5000000), wk = 0.0031447 k( 272) = ( 0.0943396 0.0943396 0.5000000), wk = 0.0031447 k( 273) = ( 0.0849057 0.0849057 0.5000000), wk = 0.0031447 k( 274) = ( 0.0754717 0.0754717 0.5000000), wk = 0.0031447 k( 275) = ( 0.0660377 0.0660377 0.5000000), wk = 0.0031447 k( 276) = ( 0.0566038 0.0566038 0.5000000), wk = 0.0031447 k( 277) = ( 0.0471698 0.0471698 0.5000000), wk = 0.0031447 k( 278) = ( 0.0377359 0.0377359 0.5000000), wk = 0.0031447 k( 279) = ( 0.0283019 0.0283019 0.5000000), wk = 0.0031447 k( 280) = ( 0.0188679 0.0188679 0.5000000), wk = 0.0031447 k( 281) = ( 0.0094340 0.0094340 0.5000000), wk = 0.0031447 k( 282) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031447 k( 283) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031447 k( 284) = ( 0.0000000 0.5000000 0.0294118), wk = 0.0031447 k( 285) = ( 0.0000000 0.5000000 0.0588235), wk = 0.0031447 k( 286) = ( 0.0000000 0.5000000 0.0882353), wk = 0.0031447 k( 287) = ( 0.0000000 0.5000000 0.1176471), wk = 0.0031447 k( 288) = ( 0.0000000 0.5000000 0.1470588), wk = 0.0031447 k( 289) = ( 0.0000000 0.5000000 0.1764706), wk = 0.0031447 k( 290) = ( 0.0000000 0.5000000 0.2058823), wk = 0.0031447 k( 291) = ( 0.0000000 0.5000000 0.2352941), wk = 0.0031447 k( 292) = ( 0.0000000 0.5000000 0.2647059), wk = 0.0031447 k( 293) = ( 0.0000000 0.5000000 0.2941177), wk = 0.0031447 k( 294) = ( 0.0000000 0.5000000 0.3235294), wk = 0.0031447 k( 295) = ( 0.0000000 0.5000000 0.3529412), wk = 0.0031447 k( 296) = ( 0.0000000 0.5000000 0.3823529), wk = 0.0031447 k( 297) = ( 0.0000000 0.5000000 0.4117647), wk = 0.0031447 k( 298) = ( 0.0000000 0.5000000 0.4411765), wk = 0.0031447 k( 299) = ( 0.0000000 0.5000000 0.4705882), wk = 0.0031447 k( 300) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0031447 k( 301) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0031447 k( 302) = ( 0.5000000 0.5000000 0.0294118), wk = 0.0031447 k( 303) = ( 0.5000000 0.5000000 0.0588235), wk = 0.0031447 k( 304) = ( 0.5000000 0.5000000 0.0882353), wk = 0.0031447 k( 305) = ( 0.5000000 0.5000000 0.1176471), wk = 0.0031447 k( 306) = ( 0.5000000 0.5000000 0.1470588), wk = 0.0031447 k( 307) = ( 0.5000000 0.5000000 0.1764706), wk = 0.0031447 k( 308) = ( 0.5000000 0.5000000 0.2058824), wk = 0.0031447 k( 309) = ( 0.5000000 0.5000000 0.2352941), wk = 0.0031447 k( 310) = ( 0.5000000 0.5000000 0.2647059), wk = 0.0031447 k( 311) = ( 0.5000000 0.5000000 0.2941177), wk = 0.0031447 k( 312) = ( 0.5000000 0.5000000 0.3235294), wk = 0.0031447 k( 313) = ( 0.5000000 0.5000000 0.3529412), wk = 0.0031447 k( 314) = ( 0.5000000 0.5000000 0.3823529), wk = 0.0031447 k( 315) = ( 0.5000000 0.5000000 0.4117647), wk = 0.0031447 k( 316) = ( 0.5000000 0.5000000 0.4411765), wk = 0.0031447 k( 317) = ( 0.5000000 0.5000000 0.4705882), wk = 0.0031447 k( 318) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031447 Dense grid: 107563 G-vectors FFT dimensions: ( 45, 45, 100) Smooth grid: 53967 G-vectors FFT dimensions: ( 40, 40, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.55 Mb ( 436, 82) NL pseudopotentials 0.78 Mb ( 218, 234) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.02 Mb ( 2989) G-vector shells 0.01 Mb ( 1478) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.18 Mb ( 436, 328) Each subspace H/S matrix 0.10 Mb ( 82, 82) Each matrix 0.59 Mb ( 234, 2, 82) The potential is recalculated from file : ./BaAgSF.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.6 secs Computing kpt #: 2 total cpu time spent up to now is 5.9 secs Computing kpt #: 3 total cpu time spent up to now is 7.2 secs Computing kpt #: 4 total cpu time spent up to now is 8.5 secs Computing kpt #: 5 total cpu time spent up to now is 9.7 secs Computing kpt #: 6 total cpu time spent up to now is 11.0 secs Computing kpt #: 7 total cpu time spent up to now is 12.2 secs Computing kpt #: 8 total cpu time spent up to now is 13.3 secs Computing kpt #: 9 total cpu time spent up to now is 14.4 secs Computing kpt #: 10 total cpu time spent up to now is 15.5 secs Computing kpt #: 11 total cpu time spent up to now is 16.6 secs Computing kpt #: 12 total cpu time spent up to now is 17.7 secs Computing kpt #: 13 total cpu time spent up to now is 18.8 secs Computing kpt #: 14 total cpu time spent up to now is 19.9 secs Computing kpt #: 15 total cpu time spent up to now is 21.0 secs Computing kpt #: 16 total cpu time spent up to now is 22.1 secs Computing kpt #: 17 total cpu time spent up to now is 23.3 secs Computing kpt #: 18 total cpu time spent up to now is 24.4 secs Computing kpt #: 19 total cpu time spent up to now is 25.5 secs Computing kpt #: 20 total cpu time spent up to now is 26.5 secs Computing kpt #: 21 total cpu time spent up to now is 27.6 secs Computing kpt #: 22 total cpu time spent up to now is 28.7 secs Computing kpt #: 23 total cpu time spent up to now is 29.7 secs Computing kpt #: 24 total cpu time spent up to now is 30.7 secs Computing kpt #: 25 total cpu time spent up to now is 31.7 secs Computing kpt #: 26 total cpu time spent up to now is 32.8 secs Computing kpt #: 27 total cpu time spent up to now is 33.8 secs Computing kpt #: 28 total cpu time spent up to now is 34.8 secs Computing kpt #: 29 total cpu time spent up to now is 35.8 secs Computing kpt #: 30 total cpu time spent up to now is 36.9 secs Computing kpt #: 31 total cpu time spent up to now is 37.9 secs Computing kpt #: 32 total cpu time spent up to now is 38.9 secs Computing kpt #: 33 total cpu time spent up to now is 40.0 secs Computing kpt #: 34 total cpu time spent up to now is 41.0 secs Computing kpt #: 35 total cpu time spent up to now is 42.1 secs Computing kpt #: 36 total cpu time spent up to now is 43.2 secs Computing kpt #: 37 total cpu time spent up to now is 44.4 secs Computing kpt #: 38 total cpu time spent up to now is 45.5 secs Computing kpt #: 39 total cpu time spent up to now is 46.6 secs Computing kpt #: 40 total cpu time spent up to now is 47.7 secs Computing kpt #: 41 total cpu time spent up to now is 48.8 secs Computing kpt #: 42 total cpu time spent up to now is 49.9 secs Computing kpt #: 43 total cpu time spent up to now is 51.1 secs Computing kpt #: 44 total cpu time spent up to now is 52.2 secs Computing kpt #: 45 total cpu time spent up to now is 53.3 secs Computing kpt #: 46 total cpu time spent up to now is 54.4 secs Computing kpt #: 47 total cpu time spent up to now is 55.6 secs Computing kpt #: 48 total cpu time spent up to now is 56.7 secs Computing kpt #: 49 total cpu time spent up to now is 57.8 secs Computing kpt #: 50 total cpu time spent up to now is 58.9 secs Computing kpt #: 51 total cpu time spent up to now is 60.0 secs Computing kpt #: 52 total cpu time spent up to now is 61.1 secs Computing kpt #: 53 total cpu time spent up to now is 62.3 secs Computing kpt #: 54 total cpu time spent up to now is 63.4 secs Computing kpt #: 55 total cpu time spent up to now is 64.5 secs Computing kpt #: 56 total cpu time spent up to now is 65.7 secs Computing kpt #: 57 total cpu time spent up to now is 66.8 secs Computing kpt #: 58 total cpu time spent up to now is 68.0 secs Computing kpt #: 59 total cpu time spent up to now is 69.1 secs Computing kpt #: 60 total cpu time spent up to now is 70.3 secs Computing kpt #: 61 total cpu time spent up to now is 71.5 secs Computing kpt #: 62 total cpu time spent up to now is 72.7 secs Computing kpt #: 63 total cpu time spent up to now is 73.9 secs Computing kpt #: 64 total cpu time spent up to now is 75.1 secs Computing kpt #: 65 total cpu time spent up to now is 76.2 secs Computing kpt #: 66 total cpu time spent up to now is 77.4 secs Computing kpt #: 67 total cpu time spent up to now is 78.5 secs Computing kpt #: 68 total cpu time spent up to now is 79.6 secs Computing kpt #: 69 total cpu time spent up to now is 80.7 secs Computing kpt #: 70 total cpu time spent up to now is 81.9 secs Computing kpt #: 71 total cpu time spent up to now is 83.0 secs Computing kpt #: 72 total cpu time spent up to now is 84.2 secs Computing kpt #: 73 total cpu time spent up to now is 85.3 secs Computing kpt #: 74 total cpu time spent up to now is 86.5 secs Computing kpt #: 75 total cpu time spent up to now is 87.6 secs Computing kpt #: 76 total cpu time spent up to now is 88.8 secs Computing kpt #: 77 total cpu time spent up to now is 89.9 secs Computing kpt #: 78 total cpu time spent up to now is 91.0 secs Computing kpt #: 79 total cpu time spent up to now is 92.1 secs Computing kpt #: 80 total cpu time spent up to now is 93.3 secs Computing kpt #: 81 total cpu time spent up to now is 94.4 secs Computing kpt #: 82 total cpu time spent up to now is 95.5 secs Computing kpt #: 83 total cpu time spent up to now is 96.7 secs Computing kpt #: 84 total cpu time spent up to now is 97.8 secs Computing kpt #: 85 total cpu time spent up to now is 99.0 secs Computing kpt #: 86 total cpu time spent up to now is 100.1 secs Computing kpt #: 87 total cpu time spent up to now is 101.3 secs Computing kpt #: 88 total cpu time spent up to now is 102.4 secs Computing kpt #: 89 total cpu time spent up to now is 103.6 secs Computing kpt #: 90 total cpu time spent up to now is 104.7 secs Computing kpt #: 91 total cpu time spent up to now is 106.0 secs Computing kpt #: 92 total cpu time spent up to now is 107.2 secs Computing kpt #: 93 total cpu time spent up to now is 108.4 secs Computing kpt #: 94 total cpu time spent up to now is 109.5 secs Computing kpt #: 95 total cpu time spent up to now is 110.8 secs Computing kpt #: 96 total cpu time spent up to now is 112.0 secs Computing kpt #: 97 total cpu time spent up to now is 113.1 secs Computing kpt #: 98 total cpu time spent up to now is 114.3 secs Computing kpt #: 99 total cpu time spent up to now is 115.4 secs Computing kpt #: 100 total cpu time spent up to now is 116.6 secs Computing kpt #: 101 total cpu time spent up to now is 117.7 secs Computing kpt #: 102 total cpu time spent up to now is 118.9 secs Computing kpt #: 103 total cpu time spent up to now is 120.0 secs Computing kpt #: 104 total cpu time spent up to now is 121.1 secs Computing kpt #: 105 total cpu time spent up to now is 122.3 secs Computing kpt #: 106 total cpu time spent up to now is 123.4 secs Computing kpt #: 107 total cpu time spent up to now is 124.5 secs Computing kpt #: 108 total cpu time spent up to now is 125.5 secs Computing kpt #: 109 total cpu time spent up to now is 126.6 secs Computing kpt #: 110 total cpu time spent up to now is 127.7 secs Computing kpt #: 111 total cpu time spent up to now is 128.8 secs Computing kpt #: 112 total cpu time spent up to now is 129.9 secs Computing kpt #: 113 total cpu time spent up to now is 131.0 secs Computing kpt #: 114 total cpu time spent up to now is 132.1 secs Computing kpt #: 115 total cpu time spent up to now is 133.2 secs Computing kpt #: 116 total cpu time spent up to now is 134.4 secs Computing kpt #: 117 total cpu time spent up to now is 135.5 secs Computing kpt #: 118 total cpu time spent up to now is 136.6 secs Computing kpt #: 119 total cpu time spent up to now is 137.8 secs Computing kpt #: 120 total cpu time spent up to now is 138.9 secs Computing kpt #: 121 total cpu time spent up to now is 140.0 secs Computing kpt #: 122 total cpu time spent up to now is 141.1 secs Computing kpt #: 123 total cpu time spent up to now is 142.3 secs Computing kpt #: 124 total cpu time spent up to now is 143.4 secs Computing kpt #: 125 total cpu time spent up to now is 144.5 secs Computing kpt #: 126 total cpu time spent up to now is 145.7 secs Computing kpt #: 127 total cpu time spent up to now is 146.8 secs Computing kpt #: 128 total cpu time spent up to now is 148.1 secs Computing kpt #: 129 total cpu time spent up to now is 149.4 secs Computing kpt #: 130 total cpu time spent up to now is 150.7 secs Computing kpt #: 131 total cpu time spent up to now is 152.0 secs Computing kpt #: 132 total cpu time spent up to now is 153.3 secs Computing kpt #: 133 total cpu time spent up to now is 154.5 secs Computing kpt #: 134 total cpu time spent up to now is 155.8 secs Computing kpt #: 135 total cpu time spent up to now is 157.1 secs Computing kpt #: 136 total cpu time spent up to now is 158.4 secs Computing kpt #: 137 total cpu time spent up to now is 159.7 secs Computing kpt #: 138 total cpu time spent up to now is 161.0 secs Computing kpt #: 139 total cpu time spent up to now is 162.3 secs Computing kpt #: 140 total cpu time spent up to now is 163.5 secs Computing kpt #: 141 total cpu time spent up to now is 164.8 secs Computing kpt #: 142 total cpu time spent up to now is 166.1 secs Computing kpt #: 143 total cpu time spent up to now is 167.4 secs Computing kpt #: 144 total cpu time spent up to now is 168.7 secs Computing kpt #: 145 total cpu time spent up to now is 170.0 secs Computing kpt #: 146 total cpu time spent up to now is 171.2 secs Computing kpt #: 147 total cpu time spent up to now is 172.5 secs Computing kpt #: 148 total cpu time spent up to now is 173.8 secs Computing kpt #: 149 total cpu time spent up to now is 175.0 secs Computing kpt #: 150 total cpu time spent up to now is 176.3 secs Computing kpt #: 151 total cpu time spent up to now is 177.6 secs Computing kpt #: 152 total cpu time spent up to now is 178.7 secs Computing kpt #: 153 total cpu time spent up to now is 179.8 secs Computing kpt #: 154 total cpu time spent up to now is 181.0 secs Computing kpt #: 155 total cpu time spent up to now is 182.1 secs Computing kpt #: 156 total cpu time spent up to now is 183.2 secs Computing kpt #: 157 total cpu time spent up to now is 184.3 secs Computing kpt #: 158 total cpu time spent up to now is 185.3 secs Computing kpt #: 159 total cpu time spent up to now is 186.4 secs Computing kpt #: 160 total cpu time spent up to now is 187.5 secs Computing kpt #: 161 total cpu time spent up to now is 188.5 secs Computing kpt #: 162 total cpu time spent up to now is 189.6 secs Computing kpt #: 163 total cpu time spent up to now is 190.6 secs Computing kpt #: 164 total cpu time spent up to now is 191.6 secs Computing kpt #: 165 total cpu time spent up to now is 192.7 secs Computing kpt #: 166 total cpu time spent up to now is 193.7 secs Computing kpt #: 167 total cpu time spent up to now is 194.7 secs Computing kpt #: 168 total cpu time spent up to now is 195.7 secs Computing kpt #: 169 total cpu time spent up to now is 196.7 secs Computing kpt #: 170 total cpu time spent up to now is 197.8 secs Computing kpt #: 171 total cpu time spent up to now is 198.8 secs Computing kpt #: 172 total cpu time spent up to now is 199.8 secs Computing kpt #: 173 total cpu time spent up to now is 200.8 secs Computing kpt #: 174 total cpu time spent up to now is 201.8 secs Computing kpt #: 175 total cpu time spent up to now is 202.9 secs Computing kpt #: 176 total cpu time spent up to now is 203.9 secs Computing kpt #: 177 total cpu time spent up to now is 205.0 secs Computing kpt #: 178 total cpu time spent up to now is 206.0 secs Computing kpt #: 179 total cpu time spent up to now is 207.1 secs Computing kpt #: 180 total cpu time spent up to now is 208.1 secs Computing kpt #: 181 total cpu time spent up to now is 209.2 secs Computing kpt #: 182 total cpu time spent up to now is 210.3 secs Computing kpt #: 183 total cpu time spent up to now is 211.4 secs Computing kpt #: 184 total cpu time spent up to now is 212.5 secs Computing kpt #: 185 total cpu time spent up to now is 213.8 secs Computing kpt #: 186 total cpu time spent up to now is 214.9 secs Computing kpt #: 187 total cpu time spent up to now is 216.1 secs Computing kpt #: 188 total cpu time spent up to now is 217.2 secs Computing kpt #: 189 total cpu time spent up to now is 218.3 secs Computing kpt #: 190 total cpu time spent up to now is 219.4 secs Computing kpt #: 191 total cpu time spent up to now is 220.6 secs Computing kpt #: 192 total cpu time spent up to now is 221.7 secs Computing kpt #: 193 total cpu time spent up to now is 222.8 secs Computing kpt #: 194 total cpu time spent up to now is 224.0 secs Computing kpt #: 195 total cpu time spent up to now is 225.1 secs Computing kpt #: 196 total cpu time spent up to now is 226.2 secs Computing kpt #: 197 total cpu time spent up to now is 227.3 secs Computing kpt #: 198 total cpu time spent up to now is 228.5 secs Computing kpt #: 199 total cpu time spent up to now is 229.6 secs Computing kpt #: 200 total cpu time spent up to now is 230.7 secs Computing kpt #: 201 total cpu time spent up to now is 231.8 secs Computing kpt #: 202 total cpu time spent up to now is 232.9 secs Computing kpt #: 203 total cpu time spent up to now is 234.0 secs Computing kpt #: 204 total cpu time spent up to now is 235.1 secs Computing kpt #: 205 total cpu time spent up to now is 236.2 secs Computing kpt #: 206 total cpu time spent up to now is 237.3 secs Computing kpt #: 207 total cpu time spent up to now is 238.4 secs Computing kpt #: 208 total cpu time spent up to now is 239.5 secs Computing kpt #: 209 total cpu time spent up to now is 240.7 secs Computing kpt #: 210 total cpu time spent up to now is 241.9 secs Computing kpt #: 211 total cpu time spent up to now is 243.0 secs Computing kpt #: 212 total cpu time spent up to now is 244.2 secs Computing kpt #: 213 total cpu time spent up to now is 245.4 secs Computing kpt #: 214 total cpu time spent up to now is 246.5 secs Computing kpt #: 215 total cpu time spent up to now is 247.7 secs Computing kpt #: 216 total cpu time spent up to now is 248.9 secs Computing kpt #: 217 total cpu time spent up to now is 250.0 secs Computing kpt #: 218 total cpu time spent up to now is 251.1 secs Computing kpt #: 219 total cpu time spent up to now is 252.3 secs Computing kpt #: 220 total cpu time spent up to now is 253.4 secs Computing kpt #: 221 total cpu time spent up to now is 254.6 secs Computing kpt #: 222 total cpu time spent up to now is 255.7 secs Computing kpt #: 223 total cpu time spent up to now is 256.9 secs Computing kpt #: 224 total cpu time spent up to now is 258.0 secs Computing kpt #: 225 total cpu time spent up to now is 259.2 secs Computing kpt #: 226 total cpu time spent up to now is 260.5 secs Computing kpt #: 227 total cpu time spent up to now is 261.9 secs Computing kpt #: 228 total cpu time spent up to now is 262.9 secs Computing kpt #: 229 total cpu time spent up to now is 263.9 secs Computing kpt #: 230 total cpu time spent up to now is 265.5 secs Computing kpt #: 231 total cpu time spent up to now is 266.7 secs Computing kpt #: 232 total cpu time spent up to now is 267.8 secs Computing kpt #: 233 total cpu time spent up to now is 269.0 secs Computing kpt #: 234 total cpu time spent up to now is 270.1 secs Computing kpt #: 235 total cpu time spent up to now is 271.2 secs Computing kpt #: 236 total cpu time spent up to now is 272.4 secs Computing kpt #: 237 total cpu time spent up to now is 273.5 secs Computing kpt #: 238 total cpu time spent up to now is 274.6 secs Computing kpt #: 239 total cpu time spent up to now is 275.7 secs Computing kpt #: 240 total cpu time spent up to now is 276.8 secs Computing kpt #: 241 total cpu time spent up to now is 277.9 secs Computing kpt #: 242 total cpu time spent up to now is 279.0 secs Computing kpt #: 243 total cpu time spent up to now is 280.1 secs Computing kpt #: 244 total cpu time spent up to now is 281.3 secs Computing kpt #: 245 total cpu time spent up to now is 282.4 secs Computing kpt #: 246 total cpu time spent up to now is 283.5 secs Computing kpt #: 247 total cpu time spent up to now is 284.6 secs Computing kpt #: 248 total cpu time spent up to now is 285.7 secs Computing kpt #: 249 total cpu time spent up to now is 286.9 secs Computing kpt #: 250 total cpu time spent up to now is 288.0 secs Computing kpt #: 251 total cpu time spent up to now is 289.1 secs Computing kpt #: 252 total cpu time spent up to now is 290.2 secs Computing kpt #: 253 total cpu time spent up to now is 291.3 secs Computing kpt #: 254 total cpu time spent up to now is 292.5 secs Computing kpt #: 255 total cpu time spent up to now is 293.6 secs Computing kpt #: 256 total cpu time spent up to now is 294.7 secs Computing kpt #: 257 total cpu time spent up to now is 295.8 secs Computing kpt #: 258 total cpu time spent up to now is 296.9 secs Computing kpt #: 259 total cpu time spent up to now is 298.0 secs Computing kpt #: 260 total cpu time spent up to now is 299.2 secs Computing kpt #: 261 total cpu time spent up to now is 300.3 secs Computing kpt #: 262 total cpu time spent up to now is 301.4 secs Computing kpt #: 263 total cpu time spent up to now is 302.5 secs Computing kpt #: 264 total cpu time spent up to now is 303.6 secs Computing kpt #: 265 total cpu time spent up to now is 304.8 secs Computing kpt #: 266 total cpu time spent up to now is 305.9 secs Computing kpt #: 267 total cpu time spent up to now is 307.0 secs Computing kpt #: 268 total cpu time spent up to now is 308.1 secs Computing kpt #: 269 total cpu time spent up to now is 309.1 secs Computing kpt #: 270 total cpu time spent up to now is 310.2 secs Computing kpt #: 271 total cpu time spent up to now is 311.4 secs Computing kpt #: 272 total cpu time spent up to now is 312.5 secs Computing kpt #: 273 total cpu time spent up to now is 313.6 secs Computing kpt #: 274 total cpu time spent up to now is 314.8 secs Computing kpt #: 275 total cpu time spent up to now is 316.1 secs Computing kpt #: 276 total cpu time spent up to now is 317.3 secs Computing kpt #: 277 total cpu time spent up to now is 318.5 secs Computing kpt #: 278 total cpu time spent up to now is 319.7 secs Computing kpt #: 279 total cpu time spent up to now is 320.9 secs Computing kpt #: 280 total cpu time spent up to now is 322.0 secs Computing kpt #: 281 total cpu time spent up to now is 323.2 secs Computing kpt #: 282 total cpu time spent up to now is 324.4 secs Computing kpt #: 283 total cpu time spent up to now is 325.5 secs Computing kpt #: 284 total cpu time spent up to now is 326.6 secs Computing kpt #: 285 total cpu time spent up to now is 327.7 secs Computing kpt #: 286 total cpu time spent up to now is 328.8 secs Computing kpt #: 287 total cpu time spent up to now is 329.9 secs Computing kpt #: 288 total cpu time spent up to now is 331.0 secs Computing kpt #: 289 total cpu time spent up to now is 332.1 secs Computing kpt #: 290 total cpu time spent up to now is 333.2 secs Computing kpt #: 291 total cpu time spent up to now is 334.3 secs Computing kpt #: 292 total cpu time spent up to now is 335.4 secs Computing kpt #: 293 total cpu time spent up to now is 336.5 secs Computing kpt #: 294 total cpu time spent up to now is 337.6 secs Computing kpt #: 295 total cpu time spent up to now is 338.8 secs Computing kpt #: 296 total cpu time spent up to now is 339.9 secs Computing kpt #: 297 total cpu time spent up to now is 341.0 secs Computing kpt #: 298 total cpu time spent up to now is 342.1 secs Computing kpt #: 299 total cpu time spent up to now is 343.2 secs Computing kpt #: 300 total cpu time spent up to now is 344.3 secs Computing kpt #: 301 total cpu time spent up to now is 345.4 secs Computing kpt #: 302 total cpu time spent up to now is 346.6 secs Computing kpt #: 303 total cpu time spent up to now is 347.7 secs Computing kpt #: 304 total cpu time spent up to now is 348.8 secs Computing kpt #: 305 total cpu time spent up to now is 350.0 secs Computing kpt #: 306 total cpu time spent up to now is 351.3 secs Computing kpt #: 307 total cpu time spent up to now is 352.5 secs Computing kpt #: 308 total cpu time spent up to now is 353.5 secs Computing kpt #: 309 total cpu time spent up to now is 354.6 secs Computing kpt #: 310 total cpu time spent up to now is 355.7 secs Computing kpt #: 311 total cpu time spent up to now is 356.7 secs Computing kpt #: 312 total cpu time spent up to now is 357.7 secs Computing kpt #: 313 total cpu time spent up to now is 358.8 secs Computing kpt #: 314 total cpu time spent up to now is 359.8 secs Computing kpt #: 315 total cpu time spent up to now is 360.8 secs Computing kpt #: 316 total cpu time spent up to now is 361.8 secs Computing kpt #: 317 total cpu time spent up to now is 362.8 secs Computing kpt #: 318 total cpu time spent up to now is 363.8 secs ethr = 1.47E-08, avg # of iterations = 18.5 total cpu time spent up to now is 363.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6707 PWs) bands (ev): -18.3591 -18.3591 -18.1552 -18.1552 -14.4995 -14.4995 -14.4267 -14.4267 -4.8602 -4.8602 -4.7804 -4.7804 -3.8172 -3.8172 -3.5293 -3.5293 -2.9211 -2.9211 -2.6445 -2.6445 -2.4861 -2.4861 -2.4536 -2.4536 3.3262 3.3262 3.4987 3.4987 3.5651 3.5651 3.5714 3.5714 3.6497 3.6497 3.8128 3.8128 3.9083 3.9083 4.0266 4.0266 4.0836 4.0836 4.4334 4.4334 4.4782 4.4782 4.9629 4.9629 5.1608 5.1608 5.4641 5.4641 5.8508 5.8508 5.9699 5.9699 6.5114 6.5114 6.9548 6.9548 7.0409 7.0409 7.6438 7.6438 8.4269 8.4269 8.4305 8.4305 9.9002 9.9002 11.2982 11.2982 11.8899 11.8899 11.9783 11.9783 13.6387 13.6387 13.6889 13.6889 14.0598 14.0598 k = 0.0000 0.0132-0.0000 ( 6701 PWs) bands (ev): -18.3589 -18.3589 -18.1552 -18.1552 -14.4996 -14.4996 -14.4268 -14.4268 -4.8615 -4.8615 -4.7793 -4.7793 -3.8180 -3.8180 -3.5287 -3.5287 -2.9204 -2.9204 -2.6445 -2.6445 -2.4875 -2.4875 -2.4528 -2.4528 3.3272 3.3272 3.4997 3.4997 3.5656 3.5656 3.5716 3.5716 3.6499 3.6499 3.8131 3.8131 3.9085 3.9085 4.0273 4.0273 4.0842 4.0842 4.4330 4.4330 4.4779 4.4779 4.9626 4.9626 5.1602 5.1602 5.4638 5.4638 5.8506 5.8506 5.9692 5.9692 6.5078 6.5078 6.9544 6.9544 7.0403 7.0403 7.6449 7.6449 8.4236 8.4236 8.4288 8.4288 9.9045 9.9045 11.3016 11.3016 11.8933 11.8933 11.9798 11.9798 13.6333 13.6333 13.6892 13.6892 14.0593 14.0593 k = 0.0000 0.0263-0.0000 ( 6704 PWs) bands (ev): -18.3584 -18.3584 -18.1551 -18.1551 -14.4999 -14.4999 -14.4274 -14.4274 -4.8653 -4.8653 -4.7763 -4.7763 -3.8204 -3.8204 -3.5269 -3.5269 -2.9186 -2.9186 -2.6447 -2.6447 -2.4915 -2.4915 -2.4508 -2.4508 3.3301 3.3301 3.5027 3.5027 3.5670 3.5670 3.5722 3.5722 3.6504 3.6504 3.8137 3.8137 3.9093 3.9093 4.0294 4.0294 4.0860 4.0860 4.4318 4.4318 4.4767 4.4767 4.9617 4.9617 5.1584 5.1584 5.4631 5.4631 5.8501 5.8501 5.9668 5.9668 6.4971 6.4971 6.9514 6.9514 7.0401 7.0401 7.6481 7.6481 8.4115 8.4115 8.4261 8.4261 9.9174 9.9174 11.3119 11.3119 11.9033 11.9033 11.9841 11.9841 13.6162 13.6162 13.6898 13.6898 14.0579 14.0579 k = 0.0000 0.0395-0.0000 ( 6718 PWs) bands (ev): -18.3574 -18.3574 -18.1549 -18.1549 -14.5004 -14.5004 -14.4283 -14.4283 -4.8711 -4.8711 -4.7718 -4.7718 -3.8243 -3.8243 -3.5240 -3.5240 -2.9155 -2.9155 -2.6450 -2.6450 -2.4972 -2.4972 -2.4482 -2.4482 3.3350 3.3350 3.5075 3.5075 3.5694 3.5694 3.5732 3.5732 3.6513 3.6513 3.8147 3.8147 3.9105 3.9105 4.0330 4.0330 4.0890 4.0890 4.4298 4.4298 4.4749 4.4749 4.9601 4.9601 5.1554 5.1554 5.4617 5.4617 5.8492 5.8492 5.9629 5.9629 6.4800 6.4800 6.9415 6.9415 7.0443 7.0443 7.6531 7.6531 8.3911 8.3911 8.4223 8.4223 9.9382 9.9382 11.3287 11.3287 11.9198 11.9198 11.9912 11.9912 13.5860 13.5860 13.6908 13.6908 14.0555 14.0555 k = 0.0000 0.0526-0.0000 ( 6734 PWs) bands (ev): -18.3560 -18.3560 -18.1547 -18.1547 -14.5011 -14.5011 -14.4296 -14.4296 -4.8782 -4.8782 -4.7665 -4.7665 -3.8294 -3.8294 -3.5201 -3.5201 -2.9113 -2.9113 -2.6454 -2.6454 -2.5042 -2.5042 -2.4456 -2.4456 3.3418 3.3418 3.5143 3.5143 3.5726 3.5726 3.5747 3.5747 3.6525 3.6525 3.8160 3.8160 3.9123 3.9123 4.0377 4.0377 4.0932 4.0932 4.4270 4.4270 4.4724 4.4724 4.9579 4.9579 5.1513 5.1513 5.4597 5.4597 5.8480 5.8480 5.9573 5.9573 6.4578 6.4578 6.9218 6.9218 7.0551 7.0551 7.6597 7.6597 8.3638 8.3638 8.4172 8.4172 9.9662 9.9662 11.3518 11.3518 11.9426 11.9426 12.0012 12.0012 13.5409 13.5409 13.6919 13.6919 14.0522 14.0522 k = 0.0000 0.0658-0.0000 ( 6726 PWs) bands (ev): -18.3543 -18.3543 -18.1544 -18.1544 -14.5020 -14.5020 -14.4312 -14.4312 -4.8861 -4.8861 -4.7609 -4.7609 -3.8356 -3.8356 -3.5155 -3.5155 -2.9059 -2.9059 -2.6460 -2.6460 -2.5120 -2.5120 -2.4431 -2.4431 3.3506 3.3506 3.5231 3.5231 3.5762 3.5762 3.5772 3.5772 3.6541 3.6541 3.8177 3.8177 3.9149 3.9149 4.0435 4.0435 4.0987 4.0987 4.4235 4.4235 4.4692 4.4692 4.9551 4.9551 5.1463 5.1463 5.4570 5.4570 5.8464 5.8464 5.9502 5.9502 6.4314 6.4314 6.8928 6.8928 7.0719 7.0719 7.6677 7.6677 8.3306 8.3306 8.4106 8.4106 10.0003 10.0003 11.3807 11.3807 11.9715 11.9715 12.0138 12.0138 13.4801 13.4801 13.6930 13.6930 14.0478 14.0478 k = 0.0000 0.0789-0.0000 ( 6734 PWs) bands (ev): -18.3522 -18.3522 -18.1541 -18.1541 -14.5030 -14.5030 -14.4331 -14.4331 -4.8947 -4.8947 -4.7552 -4.7552 -3.8426 -3.8426 -3.5104 -3.5104 -2.8995 -2.8995 -2.6469 -2.6469 -2.5204 -2.5204 -2.4409 -2.4409 3.3611 3.3611 3.5338 3.5338 3.5787 3.5787 3.5821 3.5821 3.6561 3.6561 3.8197 3.8197 3.9182 3.9182 4.0501 4.0501 4.1054 4.1054 4.4193 4.4193 4.4655 4.4655 4.9514 4.9514 5.1402 5.1402 5.4535 5.4535 5.8443 5.8443 5.9415 5.9415 6.4018 6.4018 6.8561 6.8561 7.0926 7.0926 7.6765 7.6765 8.2925 8.2925 8.4027 8.4027 10.0397 10.0397 11.4148 11.4148 12.0059 12.0059 12.0291 12.0291 13.4053 13.4053 13.6938 13.6938 14.0345 14.0345 k = 0.0000 0.0921-0.0000 ( 6742 PWs) bands (ev): -18.3498 -18.3498 -18.1537 -18.1537 -14.5043 -14.5043 -14.4354 -14.4354 -4.9035 -4.9035 -4.7499 -4.7499 -3.8501 -3.8501 -3.5049 -3.5049 -2.8922 -2.8922 -2.6482 -2.6482 -2.5292 -2.5292 -2.4391 -2.4391 3.3735 3.3735 3.5463 3.5463 3.5815 3.5815 3.5881 3.5881 3.6585 3.6585 3.8220 3.8220 3.9222 3.9222 4.0574 4.0574 4.1135 4.1135 4.4146 4.4146 4.4613 4.4613 4.9471 4.9471 5.1335 5.1335 5.4491 5.4491 5.8417 5.8417 5.9311 5.9311 6.3697 6.3697 6.8133 6.8133 7.1159 7.1159 7.6860 7.6860 8.2507 8.2507 8.3935 8.3935 10.0833 10.0833 11.4534 11.4534 12.0425 12.0425 12.0498 12.0498 13.3194 13.3194 13.6942 13.6942 13.9793 13.9793 k = 0.0000 0.1053-0.0000 ( 6730 PWs) bands (ev): -18.3469 -18.3469 -18.1533 -18.1533 -14.5057 -14.5057 -14.4379 -14.4379 -4.9125 -4.9125 -4.7449 -4.7449 -3.8579 -3.8579 -3.4992 -3.4992 -2.8840 -2.8840 -2.6500 -2.6500 -2.5381 -2.5381 -2.4375 -2.4375 3.3876 3.3876 3.5606 3.5606 3.5848 3.5848 3.5950 3.5950 3.6613 3.6613 3.8244 3.8244 3.9270 3.9270 4.0653 4.0653 4.1228 4.1228 4.4094 4.4094 4.4568 4.4568 4.9421 4.9421 5.1262 5.1262 5.4436 5.4436 5.8385 5.8385 5.9194 5.9194 6.3358 6.3358 6.7656 6.7656 7.1407 7.1407 7.6959 7.6959 8.2063 8.2063 8.3830 8.3830 10.1302 10.1302 11.4955 11.4955 12.0647 12.0647 12.0917 12.0917 13.2265 13.2265 13.6937 13.6937 13.9198 13.9198 k = 0.0000 0.1184-0.0000 ( 6738 PWs) bands (ev): -18.3438 -18.3438 -18.1529 -18.1529 -14.5073 -14.5073 -14.4408 -14.4408 -4.9214 -4.9214 -4.7405 -4.7405 -3.8657 -3.8657 -3.4935 -3.4935 -2.8752 -2.8752 -2.6524 -2.6524 -2.5469 -2.5469 -2.4363 -2.4363 3.4033 3.4033 3.5763 3.5763 3.5887 3.5887 3.6029 3.6029 3.6645 3.6645 3.8271 3.8271 3.9324 3.9324 4.0735 4.0735 4.1333 4.1333 4.4038 4.4038 4.4521 4.4521 4.9361 4.9361 5.1184 5.1184 5.4369 5.4369 5.8347 5.8347 5.9060 5.9060 6.3005 6.3005 6.7137 6.7137 7.1663 7.1663 7.7061 7.7061 8.1600 8.1600 8.3712 8.3712 10.1796 10.1796 11.5405 11.5405 12.0857 12.0857 12.1404 12.1404 13.1302 13.1302 13.6919 13.6919 13.8624 13.8624 k = 0.0000 0.1316-0.0000 ( 6748 PWs) bands (ev): -18.3403 -18.3403 -18.1525 -18.1525 -14.5090 -14.5090 -14.4440 -14.4440 -4.9302 -4.9302 -4.7369 -4.7369 -3.8734 -3.8734 -3.4880 -3.4880 -2.8657 -2.8657 -2.6556 -2.6556 -2.5552 -2.5552 -2.4354 -2.4354 3.4205 3.4205 3.5913 3.5913 3.5948 3.5948 3.6125 3.6125 3.6682 3.6682 3.8299 3.8299 3.9383 3.9383 4.0819 4.0819 4.1449 4.1449 4.3978 4.3978 4.4472 4.4472 4.9291 4.9291 5.1104 5.1104 5.4290 5.4290 5.8301 5.8301 5.8909 5.8909 6.2642 6.2642 6.6584 6.6584 7.1923 7.1923 7.7163 7.7163 8.1129 8.1129 8.3582 8.3582 10.2307 10.2307 11.5871 11.5871 12.1072 12.1072 12.1928 12.1928 13.0343 13.0343 13.6880 13.6880 13.8084 13.8084 k = 0.0000 0.1447-0.0000 ( 6740 PWs) bands (ev): -18.3365 -18.3365 -18.1521 -18.1521 -14.5109 -14.5109 -14.4474 -14.4474 -4.9388 -4.9388 -4.7341 -4.7341 -3.8807 -3.8807 -3.4828 -3.4828 -2.8559 -2.8559 -2.6599 -2.6599 -2.5628 -2.5628 -2.4346 -2.4346 3.4391 3.4391 3.5975 3.5975 3.6093 3.6093 3.6256 3.6256 3.6724 3.6724 3.8331 3.8331 3.9446 3.9446 4.0906 4.0906 4.1576 4.1576 4.3917 4.3917 4.4425 4.4425 4.9212 4.9212 5.1025 5.1025 5.4197 5.4197 5.8247 5.8247 5.8744 5.8744 6.2273 6.2273 6.6005 6.6005 7.2183 7.2183 7.7266 7.7266 8.0656 8.0656 8.3441 8.3441 10.2828 10.2828 11.6345 11.6345 12.1277 12.1277 12.2479 12.2479 12.9424 12.9424 13.6810 13.6810 13.7592 13.7592 k = 0.0000 0.1579-0.0000 ( 6724 PWs) bands (ev): -18.3324 -18.3324 -18.1516 -18.1516 -14.5128 -14.5128 -14.4510 -14.4510 -4.9470 -4.9470 -4.7322 -4.7322 -3.8875 -3.8875 -3.4781 -3.4781 -2.8458 -2.8458 -2.6653 -2.6653 -2.5692 -2.5692 -2.4341 -2.4341 3.4590 3.4590 3.6032 3.6032 3.6217 3.6217 3.6443 3.6443 3.6770 3.6770 3.8365 3.8365 3.9512 3.9512 4.0995 4.0995 4.1710 4.1710 4.3857 4.3857 4.4381 4.4381 4.9122 4.9122 5.0948 5.0948 5.4089 5.4089 5.8184 5.8184 5.8565 5.8565 6.1900 6.1900 6.5405 6.5405 7.2440 7.2440 7.7368 7.7368 8.0189 8.0189 8.3289 8.3289 10.3353 10.3353 11.6814 11.6814 12.1447 12.1447 12.3050 12.3050 12.8591 12.8591 13.6679 13.6679 13.7176 13.7176 k = 0.0000 0.1711-0.0000 ( 6718 PWs) bands (ev): -18.3280 -18.3280 -18.1512 -18.1512 -14.5149 -14.5149 -14.4549 -14.4549 -4.9549 -4.9549 -4.7312 -4.7312 -3.8935 -3.8935 -3.4739 -3.4739 -2.8356 -2.8356 -2.6721 -2.6721 -2.5744 -2.5744 -2.4336 -2.4336 3.4798 3.4798 3.6097 3.6097 3.6323 3.6323 3.6669 3.6669 3.6821 3.6821 3.8402 3.8402 3.9579 3.9579 4.1083 4.1083 4.1847 4.1847 4.3799 4.3799 4.4343 4.4343 4.9019 4.9019 5.0875 5.0875 5.3966 5.3966 5.8110 5.8110 5.8372 5.8372 6.1525 6.1525 6.4790 6.4790 7.2693 7.2693 7.7467 7.7467 7.9732 7.9732 8.3127 8.3127 10.3878 10.3878 11.7268 11.7268 12.1540 12.1540 12.3628 12.3628 12.7900 12.7900 13.6436 13.6436 13.6890 13.6890 k = 0.0000 0.1842-0.0000 ( 6714 PWs) bands (ev): -18.3234 -18.3234 -18.1509 -18.1509 -14.5171 -14.5171 -14.4589 -14.4589 -4.9624 -4.9624 -4.7312 -4.7312 -3.8987 -3.8987 -3.4704 -3.4704 -2.8255 -2.8255 -2.6801 -2.6801 -2.5781 -2.5781 -2.4332 -2.4332 3.5013 3.5013 3.6171 3.6171 3.6425 3.6425 3.6876 3.6876 3.6923 3.6923 3.8441 3.8441 3.9644 3.9644 4.1173 4.1173 4.1985 4.1985 4.3747 4.3747 4.4311 4.4311 4.8904 4.8904 5.0807 5.0807 5.3827 5.3827 5.8018 5.8018 5.8169 5.8169 6.1149 6.1149 6.4165 6.4165 7.2941 7.2941 7.7563 7.7563 7.9291 7.9291 8.2956 8.2956 10.4397 10.4397 11.7697 11.7697 12.1501 12.1501 12.4205 12.4205 12.7419 12.7419 13.6109 13.6109 13.6705 13.6705 k = 0.0000 0.1974-0.0000 ( 6698 PWs) bands (ev): -18.3185 -18.3185 -18.1506 -18.1506 -14.5194 -14.5194 -14.4632 -14.4632 -4.9693 -4.9693 -4.7323 -4.7323 -3.9028 -3.9028 -3.4677 -3.4677 -2.8157 -2.8157 -2.6891 -2.6891 -2.5803 -2.5803 -2.4328 -2.4328 3.5232 3.5232 3.6258 3.6258 3.6527 3.6527 3.6937 3.6937 3.7195 3.7195 3.8484 3.8484 3.9707 3.9707 4.1263 4.1263 4.2116 4.2116 4.3705 4.3705 4.4289 4.4289 4.8776 4.8776 5.0746 5.0746 5.3672 5.3672 5.7882 5.7882 5.7986 5.7986 6.0775 6.0775 6.3534 6.3534 7.3182 7.3182 7.7655 7.7655 7.8872 7.8872 8.2777 8.2777 10.4906 10.4906 11.8089 11.8089 12.1285 12.1285 12.4769 12.4769 12.7204 12.7204 13.5779 13.5779 13.6546 13.6546 k = 0.0000 0.2105-0.0000 ( 6702 PWs) bands (ev): -18.3134 -18.3134 -18.1503 -18.1503 -14.5217 -14.5217 -14.4675 -14.4675 -4.9758 -4.9758 -4.7344 -4.7344 -3.9059 -3.9059 -3.4658 -3.4658 -2.8065 -2.8065 -2.6989 -2.6989 -2.5812 -2.5812 -2.4323 -2.4323 3.5447 3.5447 3.6361 3.6361 3.6629 3.6629 3.7001 3.7001 3.7486 3.7486 3.8530 3.8530 3.9765 3.9765 4.1353 4.1353 4.2233 4.2233 4.3682 4.3682 4.4279 4.4279 4.8635 4.8635 5.0693 5.0693 5.3502 5.3502 5.7667 5.7667 5.7854 5.7854 6.0402 6.0402 6.2901 6.2901 7.3417 7.3417 7.7739 7.7739 7.8479 7.8479 8.2590 8.2590 10.5401 10.5401 11.8430 11.8430 12.0897 12.0897 12.5308 12.5308 12.7264 12.7264 13.5477 13.5477 13.6392 13.6392 k = 0.0000 0.2237-0.0000 ( 6708 PWs) bands (ev): -18.3081 -18.3081 -18.1502 -18.1502 -14.5240 -14.5240 -14.4720 -14.4720 -4.9816 -4.9816 -4.7376 -4.7376 -3.9079 -3.9079 -3.4649 -3.4649 -2.7980 -2.7980 -2.7092 -2.7092 -2.5807 -2.5807 -2.4318 -2.4318 3.5652 3.5652 3.6487 3.6487 3.6731 3.6731 3.7070 3.7070 3.7794 3.7794 3.8578 3.8578 3.9818 3.9818 4.1444 4.1444 4.2326 4.2326 4.3686 4.3686 4.4283 4.4283 4.8483 4.8483 5.0646 5.0646 5.3317 5.3317 5.7418 5.7418 5.7728 5.7728 6.0033 6.0033 6.2269 6.2269 7.3643 7.3643 7.7804 7.7804 7.8127 7.8127 8.2395 8.2395 10.5878 10.5878 11.8679 11.8679 12.0416 12.0416 12.5813 12.5813 12.7556 12.7556 13.5211 13.5211 13.6243 13.6243 k = 0.0000 0.2368-0.0000 ( 6712 PWs) bands (ev): -18.3026 -18.3026 -18.1501 -18.1501 -14.5264 -14.5264 -14.4766 -14.4766 -4.9869 -4.9869 -4.7418 -4.7418 -3.9086 -3.9086 -3.4651 -3.4651 -2.7904 -2.7904 -2.7196 -2.7196 -2.5789 -2.5789 -2.4312 -2.4312 3.5840 3.5840 3.6642 3.6642 3.6833 3.6833 3.7143 3.7143 3.8118 3.8118 3.8630 3.8630 3.9864 3.9864 4.1536 4.1536 4.2386 4.2386 4.3724 4.3724 4.4301 4.4301 4.8321 4.8321 5.0606 5.0606 5.3119 5.3119 5.7151 5.7151 5.7593 5.7593 5.9667 5.9667 6.1643 6.1643 7.3862 7.3862 7.7711 7.7711 7.7956 7.7956 8.2195 8.2195 10.6333 10.6333 11.8714 11.8714 12.0024 12.0024 12.6268 12.6268 12.8020 12.8020 13.4985 13.4985 13.6107 13.6107 k = 0.0000 0.2500-0.0000 ( 6710 PWs) bands (ev): -18.2969 -18.2969 -18.1502 -18.1502 -14.5288 -14.5288 -14.4812 -14.4812 -4.9914 -4.9914 -4.7470 -4.7470 -3.9081 -3.9081 -3.4663 -3.4663 -2.7841 -2.7841 -2.7297 -2.7297 -2.5759 -2.5759 -2.4305 -2.4305 3.6005 3.6005 3.6827 3.6827 3.6934 3.6934 3.7219 3.7219 3.8457 3.8457 3.8684 3.8684 3.9904 3.9904 4.1630 4.1630 4.2408 4.2408 4.3800 4.3800 4.4337 4.4337 4.8150 4.8150 5.0572 5.0572 5.2911 5.2911 5.6871 5.6871 5.7446 5.7446 5.9306 5.9306 6.1027 6.1027 7.4073 7.4073 7.7432 7.7432 7.7997 7.7997 8.1989 8.1989 10.6763 10.6763 11.8362 11.8362 11.9945 11.9945 12.6662 12.6662 12.8608 12.8608 13.4799 13.4799 13.5994 13.5994 k = 0.0000 0.2632-0.0000 ( 6720 PWs) bands (ev): -18.2911 -18.2911 -18.1503 -18.1503 -14.5311 -14.5311 -14.4859 -14.4859 -4.9953 -4.9953 -4.7532 -4.7532 -3.9064 -3.9064 -3.4688 -3.4688 -2.7793 -2.7793 -2.7391 -2.7391 -2.5719 -2.5719 -2.4297 -2.4297 3.6148 3.6148 3.7034 3.7034 3.7042 3.7042 3.7297 3.7297 3.8733 3.8733 3.8816 3.8816 3.9936 3.9936 4.1725 4.1725 4.2394 4.2394 4.3908 4.3908 4.4393 4.4393 4.7974 4.7974 5.0540 5.0540 5.2694 5.2694 5.6577 5.6577 5.7285 5.7285 5.8948 5.8948 6.0423 6.0423 7.4274 7.4274 7.7165 7.7165 7.8050 7.8050 8.1779 8.1779 10.7166 10.7166 11.7758 11.7758 12.0078 12.0078 12.6983 12.6983 12.9281 12.9281 13.4656 13.4656 13.5911 13.5911 k = 0.0000 0.2763-0.0000 ( 6728 PWs) bands (ev): -18.2852 -18.2852 -18.1507 -18.1507 -14.5335 -14.5335 -14.4906 -14.4906 -4.9985 -4.9985 -4.7603 -4.7603 -3.9033 -3.9033 -3.4726 -3.4726 -2.7766 -2.7766 -2.7473 -2.7473 -2.5667 -2.5667 -2.4288 -2.4288 3.6273 3.6273 3.7134 3.7134 3.7275 3.7275 3.7377 3.7377 3.8794 3.8794 3.9176 3.9176 3.9963 3.9963 4.1823 4.1823 4.2353 4.2353 4.4034 4.4034 4.4474 4.4474 4.7794 4.7794 5.0507 5.0507 5.2474 5.2474 5.6271 5.6271 5.7110 5.7110 5.8594 5.8594 5.9835 5.9835 7.4467 7.4467 7.6931 7.6931 7.8097 7.8097 8.1565 8.1565 10.7540 10.7540 11.7080 11.7080 12.0272 12.0272 12.7225 12.7225 13.0014 13.0014 13.4554 13.4554 13.5867 13.5867 k = 0.0000 0.2895-0.0000 ( 6728 PWs) bands (ev): -18.2791 -18.2791 -18.1511 -18.1511 -14.5357 -14.5357 -14.4952 -14.4952 -5.0009 -5.0009 -4.7682 -4.7682 -3.8990 -3.8990 -3.4776 -3.4776 -2.7767 -2.7767 -2.7531 -2.7531 -2.5607 -2.5607 -2.4279 -2.4279 3.6387 3.6387 3.7231 3.7231 3.7458 3.7458 3.7522 3.7522 3.8853 3.8853 3.9545 3.9545 3.9990 3.9990 4.1922 4.1922 4.2295 4.2295 4.4160 4.4160 4.4588 4.4588 4.7613 4.7613 5.0468 5.0468 5.2257 5.2257 5.5954 5.5954 5.6923 5.6923 5.8243 5.8243 5.9267 5.9267 7.4650 7.4650 7.6734 7.6734 7.8133 7.8133 8.1349 8.1349 10.7883 10.7883 11.6395 11.6395 12.0476 12.0476 12.7384 12.7384 13.0784 13.0784 13.4495 13.4495 13.5867 13.5867 k = 0.0000 0.3026-0.0000 ( 6728 PWs) bands (ev): -18.2731 -18.2731 -18.1518 -18.1518 -14.5379 -14.5379 -14.4999 -14.4999 -5.0026 -5.0026 -4.7768 -4.7768 -3.8934 -3.8934 -3.4840 -3.4840 -2.7799 -2.7799 -2.7563 -2.7563 -2.5538 -2.5538 -2.4269 -2.4269 3.6493 3.6493 3.7325 3.7325 3.7540 3.7540 3.7774 3.7774 3.8913 3.8913 3.9867 3.9867 4.0069 4.0069 4.2016 4.2016 4.2236 4.2236 4.4275 4.4275 4.4736 4.4736 4.7436 4.7436 5.0416 5.0416 5.2051 5.2051 5.5626 5.5626 5.6723 5.6723 5.7891 5.7891 5.8727 5.8727 7.4823 7.4823 7.6576 7.6576 7.8157 7.8157 8.1131 8.1131 10.8195 10.8195 11.5727 11.5727 12.0679 12.0679 12.7463 12.7463 13.1572 13.1572 13.4480 13.4480 13.5913 13.5913 k = 0.0000 0.3158-0.0000 ( 6720 PWs) bands (ev): -18.2669 -18.2669 -18.1526 -18.1526 -14.5399 -14.5399 -14.5044 -14.5044 -5.0035 -5.0035 -4.7861 -4.7861 -3.8867 -3.8867 -3.4916 -3.4916 -2.7850 -2.7850 -2.7579 -2.7579 -2.5462 -2.5462 -2.4259 -2.4259 3.6594 3.6594 3.7416 3.7416 3.7623 3.7623 3.8023 3.8023 3.8974 3.8974 3.9956 3.9956 4.0384 4.0384 4.2057 4.2057 4.2227 4.2227 4.4374 4.4374 4.4915 4.4915 4.7266 4.7266 5.0342 5.0342 5.1867 5.1867 5.5288 5.5288 5.6513 5.6513 5.7533 5.7533 5.8221 5.8221 7.4983 7.4983 7.6458 7.6458 7.8168 7.8168 8.0912 8.0912 10.8475 10.8475 11.5089 11.5089 12.0876 12.0876 12.7466 12.7466 13.2360 13.2360 13.4512 13.4512 13.6006 13.6006 k = 0.0000 0.3289-0.0000 ( 6736 PWs) bands (ev): -18.2608 -18.2608 -18.1537 -18.1537 -14.5419 -14.5419 -14.5088 -14.5088 -5.0037 -5.0037 -4.7960 -4.7960 -3.8787 -3.8787 -3.5006 -3.5006 -2.7906 -2.7906 -2.7591 -2.7591 -2.5381 -2.5381 -2.4250 -2.4250 3.6692 3.6692 3.7501 3.7501 3.7708 3.7708 3.8265 3.8265 3.9036 3.9036 3.9967 3.9967 4.0777 4.0777 4.2008 4.2008 4.2314 4.2314 4.4461 4.4461 4.5110 4.5110 4.7110 4.7110 5.0235 5.0235 5.1714 5.1714 5.4940 5.4940 5.6293 5.6293 5.7159 5.7159 5.7761 5.7761 7.5129 7.5129 7.6383 7.6383 7.8164 7.8164 8.0692 8.0692 10.8724 10.8724 11.4488 11.4488 12.1069 12.1069 12.7401 12.7401 13.3123 13.3123 13.4604 13.4604 13.6144 13.6144 k = 0.0000 0.3421-0.0000 ( 6740 PWs) bands (ev): -18.2546 -18.2546 -18.1549 -18.1549 -14.5437 -14.5437 -14.5132 -14.5132 -5.0030 -5.0030 -4.8064 -4.8064 -3.8697 -3.8697 -3.5108 -3.5108 -2.7957 -2.7957 -2.7606 -2.7606 -2.5296 -2.5296 -2.4241 -2.4241 3.6788 3.6788 3.7578 3.7578 3.7796 3.7796 3.8491 3.8491 3.9102 3.9102 3.9967 3.9967 4.1180 4.1180 4.1937 4.1937 4.2433 4.2433 4.4540 4.4540 4.5310 4.5310 4.6978 4.6978 5.0089 5.0089 5.1600 5.1600 5.4585 5.4585 5.6067 5.6067 5.6765 5.6765 5.7355 5.7355 7.5261 7.5261 7.6350 7.6350 7.8146 7.8146 8.0473 8.0473 10.8944 10.8944 11.3928 11.3928 12.1259 12.1259 12.7276 12.7276 13.3808 13.3808 13.4793 13.4793 13.6323 13.6323 k = 0.0000 0.3553-0.0000 ( 6736 PWs) bands (ev): -18.2485 -18.2485 -18.1564 -18.1564 -14.5453 -14.5453 -14.5173 -14.5173 -5.0016 -5.0016 -4.8172 -4.8172 -3.8596 -3.8596 -3.5222 -3.5222 -2.8003 -2.8003 -2.7625 -2.7625 -2.5209 -2.5209 -2.4234 -2.4234 3.6882 3.6882 3.7645 3.7645 3.7888 3.7888 3.8693 3.8693 3.9174 3.9174 3.9962 3.9962 4.1573 4.1573 4.1877 4.1877 4.2566 4.2566 4.4613 4.4613 4.5497 4.5497 4.6881 4.6881 4.9904 4.9904 5.1524 5.1524 5.4225 5.4225 5.5840 5.5840 5.6357 5.6357 5.7000 5.7000 7.5377 7.5377 7.6360 7.6360 7.8113 7.8113 8.0255 8.0255 10.9136 10.9136 11.3412 11.3412 12.1448 12.1448 12.7101 12.7101 13.4311 13.4311 13.5172 13.5172 13.6540 13.6540 k = 0.0000 0.3684-0.0000 ( 6728 PWs) bands (ev): -18.2425 -18.2425 -18.1581 -18.1581 -14.5468 -14.5468 -14.5213 -14.5213 -4.9993 -4.9993 -4.8282 -4.8282 -3.8484 -3.8484 -3.5347 -3.5347 -2.8040 -2.8040 -2.7650 -2.7650 -2.5121 -2.5121 -2.4230 -2.4230 3.6974 3.6974 3.7700 3.7700 3.7985 3.7985 3.8861 3.8861 3.9258 3.9258 3.9953 3.9953 4.1767 4.1767 4.2012 4.2012 4.2712 4.2712 4.4683 4.4683 4.5654 4.5654 4.6839 4.6839 4.9687 4.9687 5.1477 5.1477 5.3863 5.3863 5.5616 5.5616 5.5948 5.5948 5.6683 5.6683 7.5480 7.5480 7.6408 7.6408 7.8065 7.8065 8.0039 8.0039 10.9302 10.9302 11.2939 11.2939 12.1638 12.1638 12.6884 12.6884 13.4621 13.4621 13.5738 13.5738 13.6787 13.6787 k = 0.0000 0.3816-0.0000 ( 6718 PWs) bands (ev): -18.2365 -18.2365 -18.1600 -18.1600 -14.5480 -14.5480 -14.5251 -14.5251 -4.9963 -4.9963 -4.8395 -4.8395 -3.8364 -3.8364 -3.5483 -3.5483 -2.8068 -2.8068 -2.7678 -2.7678 -2.5034 -2.5034 -2.4228 -2.4228 3.7063 3.7063 3.7745 3.7745 3.8085 3.8085 3.8987 3.8987 3.9356 3.9356 3.9942 3.9942 4.1736 4.1736 4.2345 4.2345 4.2890 4.2890 4.4755 4.4755 4.5758 4.5758 4.6873 4.6873 4.9447 4.9447 5.1446 5.1446 5.3508 5.3508 5.5396 5.5396 5.5555 5.5555 5.6394 5.6394 7.5576 7.5576 7.6486 7.6486 7.8004 7.8004 7.9826 7.9826 10.9446 10.9446 11.2511 11.2511 12.1830 12.1830 12.6635 12.6635 13.4865 13.4865 13.6353 13.6353 13.7059 13.7059 k = 0.0000 0.3947-0.0000 ( 6728 PWs) bands (ev): -18.2306 -18.2306 -18.1622 -18.1622 -14.5491 -14.5491 -14.5287 -14.5287 -4.9925 -4.9925 -4.8509 -4.8509 -3.8234 -3.8234 -3.5628 -3.5628 -2.8088 -2.8088 -2.7710 -2.7710 -2.4948 -2.4948 -2.4229 -2.4229 3.7150 3.7150 3.7778 3.7778 3.8189 3.8189 3.9073 3.9073 3.9460 3.9460 3.9929 3.9929 4.1712 4.1712 4.2595 4.2595 4.3140 4.3140 4.4833 4.4833 4.5803 4.5803 4.6987 4.6987 4.9192 4.9192 5.1410 5.1410 5.3172 5.3172 5.5138 5.5138 5.5229 5.5229 5.6126 5.6126 7.5671 7.5671 7.6585 7.6585 7.7932 7.7932 7.9615 7.9615 10.9571 10.9571 11.2126 11.2126 12.2027 12.2027 12.6361 12.6361 13.5106 13.5106 13.6937 13.6937 13.7350 13.7350 k = 0.0000 0.4079-0.0000 ( 6734 PWs) bands (ev): -18.2248 -18.2248 -18.1647 -18.1647 -14.5499 -14.5499 -14.5321 -14.5321 -4.9880 -4.9880 -4.8623 -4.8623 -3.8097 -3.8097 -3.5780 -3.5780 -2.8100 -2.8100 -2.7745 -2.7745 -2.4865 -2.4865 -2.4234 -2.4234 3.7234 3.7234 3.7800 3.7800 3.8294 3.8294 3.9129 3.9129 3.9554 3.9554 3.9916 3.9916 4.1710 4.1710 4.2734 4.2734 4.3467 4.3467 4.4930 4.4930 4.5804 4.5804 4.7162 4.7162 4.8930 4.8930 5.1345 5.1345 5.2879 5.2879 5.4793 5.4793 5.5033 5.5033 5.5875 5.5875 7.5769 7.5769 7.6696 7.6696 7.7852 7.7852 7.9408 7.9408 10.9680 10.9680 11.1784 11.1784 12.2230 12.2230 12.6068 12.6068 13.5364 13.5364 13.7448 13.7448 13.7667 13.7667 k = 0.0000 0.4211-0.0000 ( 6738 PWs) bands (ev): -18.2191 -18.2191 -18.1674 -18.1674 -14.5505 -14.5505 -14.5352 -14.5352 -4.9827 -4.9827 -4.8737 -4.8737 -3.7952 -3.7952 -3.5940 -3.5940 -2.8104 -2.8104 -2.7781 -2.7781 -2.4785 -2.4785 -2.4243 -2.4243 3.7315 3.7315 3.7812 3.7812 3.8401 3.8401 3.9165 3.9165 3.9628 3.9628 3.9904 3.9904 4.1737 4.1737 4.2794 4.2794 4.3818 4.3818 4.5055 4.5055 4.5780 4.5780 4.7370 4.7370 4.8671 4.8671 5.1217 5.1217 5.2662 5.2662 5.4457 5.4457 5.4876 5.4876 5.5642 5.5642 7.5874 7.5874 7.6807 7.6807 7.7772 7.7772 7.9204 7.9204 10.9778 10.9778 11.1481 11.1481 12.2442 12.2442 12.5765 12.5765 13.5643 13.5643 13.7834 13.7834 13.8035 13.8035 k = 0.0000 0.4342-0.0000 ( 6732 PWs) bands (ev): -18.2136 -18.2136 -18.1703 -18.1703 -14.5508 -14.5508 -14.5380 -14.5380 -4.9767 -4.9767 -4.8849 -4.8849 -3.7800 -3.7800 -3.6105 -3.6105 -2.8100 -2.8100 -2.7819 -2.7819 -2.4710 -2.4710 -2.4258 -2.4258 3.7391 3.7391 3.7814 3.7814 3.8508 3.8508 3.9182 3.9182 3.9680 3.9680 3.9893 3.9893 4.1792 4.1792 4.2800 4.2800 4.4155 4.4155 4.5220 4.5220 4.5743 4.5743 4.7570 4.7570 4.8442 4.8442 5.1007 5.1007 5.2544 5.2544 5.4144 5.4144 5.4752 5.4752 5.5427 5.5427 7.5988 7.5988 7.6902 7.6902 7.7706 7.7706 7.9005 7.9005 10.9868 10.9868 11.1215 11.1215 12.2663 12.2663 12.5454 12.5454 13.5946 13.5946 13.8126 13.8126 13.8403 13.8403 k = 0.0000 0.4474-0.0000 ( 6738 PWs) bands (ev): -18.2083 -18.2083 -18.1736 -18.1736 -14.5508 -14.5508 -14.5406 -14.5406 -4.9700 -4.9700 -4.8960 -4.8960 -3.7643 -3.7643 -3.6274 -3.6274 -2.8090 -2.8090 -2.7857 -2.7857 -2.4639 -2.4639 -2.4277 -2.4277 3.7463 3.7463 3.7807 3.7807 3.8613 3.8613 3.9180 3.9180 3.9713 3.9713 3.9881 3.9881 4.1873 4.1873 4.2762 4.2762 4.4457 4.4457 4.5419 4.5419 4.5707 4.5707 4.7665 4.7665 4.8331 4.8331 5.0722 5.0722 5.2518 5.2518 5.3853 5.3853 5.4663 5.4663 5.5230 5.5230 7.6110 7.6110 7.6957 7.6957 7.7677 7.7677 7.8809 7.8809 10.9953 10.9953 11.0985 11.0985 12.2895 12.2895 12.5142 12.5142 13.6272 13.6272 13.8362 13.8362 13.8707 13.8707 k = 0.0000 0.4605-0.0000 ( 6726 PWs) bands (ev): -18.2032 -18.2032 -18.1771 -18.1771 -14.5505 -14.5505 -14.5429 -14.5429 -4.9626 -4.9626 -4.9068 -4.9068 -3.7480 -3.7480 -3.6446 -3.6446 -2.8074 -2.8074 -2.7895 -2.7895 -2.4573 -2.4573 -2.4302 -2.4302 3.7530 3.7530 3.7791 3.7791 3.8716 3.8716 3.9159 3.9159 3.9737 3.9737 3.9866 3.9866 4.1976 4.1976 4.2690 4.2690 4.4715 4.4715 4.5542 4.5542 4.5782 4.5782 4.7539 4.7539 4.8453 4.8453 5.0393 5.0393 5.2561 5.2561 5.3587 5.3587 5.4613 5.4613 5.5056 5.5056 7.6240 7.6240 7.6949 7.6949 7.7710 7.7710 7.8619 7.8619 11.0039 11.0039 11.0785 11.0785 12.3138 12.3138 12.4832 12.4832 13.6620 13.6620 13.8514 13.8514 13.8931 13.8931 k = 0.0000 0.4737-0.0000 ( 6734 PWs) bands (ev): -18.1983 -18.1983 -18.1808 -18.1808 -14.5500 -14.5500 -14.5449 -14.5449 -4.9546 -4.9546 -4.9172 -4.9172 -3.7313 -3.7313 -3.6620 -3.6620 -2.8053 -2.8053 -2.7931 -2.7931 -2.4513 -2.4513 -2.4332 -2.4332 3.7590 3.7590 3.7766 3.7766 3.8814 3.8814 3.9119 3.9119 3.9757 3.9757 3.9847 3.9847 4.2093 4.2093 4.2592 4.2592 4.4931 4.4931 4.5490 4.5490 4.6049 4.6049 4.7286 4.7286 4.8709 4.8709 5.0043 5.0043 5.2652 5.2652 5.3345 5.3345 5.4599 5.4599 5.4904 5.4904 7.6375 7.6375 7.6880 7.6880 7.7802 7.7802 7.8435 7.8435 11.0129 11.0129 11.0613 11.0613 12.3394 12.3394 12.4526 12.4526 13.6989 13.6989 13.8460 13.8460 13.9069 13.9069 k = 0.0000 0.4868-0.0000 ( 6736 PWs) bands (ev): -18.1935 -18.1935 -18.1848 -18.1848 -14.5492 -14.5492 -14.5466 -14.5466 -4.9461 -4.9461 -4.9273 -4.9273 -3.7142 -3.7142 -3.6795 -3.6795 -2.8028 -2.8028 -2.7966 -2.7966 -2.4459 -2.4459 -2.4368 -2.4368 3.7645 3.7645 3.7733 3.7733 3.8907 3.8907 3.9062 3.9062 3.9779 3.9779 3.9825 3.9825 4.2221 4.2221 4.2476 4.2476 4.5112 4.5112 4.5391 4.5391 4.6360 4.6360 4.6992 4.6992 4.9014 4.9014 4.9690 4.9690 5.2780 5.2780 5.3129 5.3129 5.4624 5.4624 5.4780 5.4780 7.6512 7.6512 7.6773 7.6773 7.7934 7.7934 7.8257 7.8257 11.0228 11.0228 11.0466 11.0466 12.3660 12.3660 12.4228 12.4228 13.7374 13.7374 13.8156 13.8156 13.9138 13.9138 k = 0.0000 0.5000-0.0000 ( 6726 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6970 -3.6970 -3.6970 -3.6970 -2.7999 -2.7999 -2.7999 -2.7999 -2.4411 -2.4411 -2.4411 -2.4411 3.7693 3.7693 3.7693 3.7693 3.8990 3.8990 3.8990 3.8990 3.9802 3.9802 3.9802 3.9802 4.2350 4.2350 4.2350 4.2350 4.5265 4.5265 4.5265 4.5265 4.6679 4.6679 4.6679 4.6679 4.9344 4.9344 4.9344 4.9344 5.2941 5.2941 5.2941 5.2941 5.4686 5.4686 5.4686 5.4686 7.6647 7.6647 7.6647 7.6647 7.8089 7.8089 7.8089 7.8089 11.0339 11.0339 11.0339 11.0339 12.3939 12.3939 12.3939 12.3939 13.7770 13.7770 13.7770 13.7770 13.9182 13.9182 k = 0.0000 0.5000-0.0000 ( 6726 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6970 -3.6970 -3.6970 -3.6970 -2.7999 -2.7999 -2.7999 -2.7999 -2.4411 -2.4411 -2.4411 -2.4411 3.7693 3.7693 3.7693 3.7693 3.8990 3.8990 3.8990 3.8990 3.9802 3.9802 3.9802 3.9802 4.2350 4.2350 4.2350 4.2350 4.5265 4.5265 4.5265 4.5265 4.6679 4.6679 4.6679 4.6679 4.9344 4.9344 4.9344 4.9344 5.2941 5.2941 5.2941 5.2941 5.4686 5.4686 5.4686 5.4686 7.6647 7.6647 7.6647 7.6647 7.8089 7.8089 7.8089 7.8089 11.0339 11.0339 11.0339 11.0339 12.3939 12.3939 12.3939 12.3939 13.7770 13.7770 13.7770 13.7770 13.9182 13.9182 k = 0.0132 0.5000-0.0000 ( 6738 PWs) bands (ev): -18.1889 -18.1889 -18.1889 -18.1889 -14.5483 -14.5483 -14.5481 -14.5481 -4.9406 -4.9406 -4.9331 -4.9331 -3.6999 -3.6999 -3.6934 -3.6934 -2.8113 -2.8113 -2.7892 -2.7892 -2.4435 -2.4435 -2.4396 -2.4396 3.7687 3.7687 3.7708 3.7708 3.8819 3.8819 3.9092 3.9092 3.9663 3.9663 4.0000 4.0000 4.2289 4.2289 4.2410 4.2410 4.5187 4.5187 4.5314 4.5314 4.6670 4.6670 4.6732 4.6732 4.9202 4.9202 4.9472 4.9472 5.2944 5.2944 5.2946 5.2946 5.4656 5.4656 5.4734 5.4734 7.6433 7.6433 7.6759 7.6759 7.7932 7.7932 7.8293 7.8293 11.0339 11.0339 11.0366 11.0366 12.3957 12.3957 12.3975 12.3975 13.7715 13.7715 13.7812 13.7812 13.9185 13.9185 k = 0.0263 0.5000-0.0000 ( 6732 PWs) bands (ev): -18.1886 -18.1886 -18.1886 -18.1886 -14.5489 -14.5489 -14.5484 -14.5484 -4.9441 -4.9441 -4.9292 -4.9292 -3.7022 -3.7022 -3.6893 -3.6893 -2.8235 -2.8235 -2.7794 -2.7794 -2.4468 -2.4468 -2.4390 -2.4390 3.7689 3.7689 3.7733 3.7733 3.8628 3.8628 3.9036 3.9036 3.9676 3.9676 4.0208 4.0208 4.2232 4.2232 4.2464 4.2464 4.5090 4.5090 4.5335 4.5335 4.6699 4.6699 4.6830 4.6830 4.9049 4.9049 4.9584 4.9584 5.2955 5.2955 5.2957 5.2957 5.4647 5.4647 5.4802 5.4802 7.6160 7.6160 7.6717 7.6717 7.7877 7.7877 7.8504 7.8504 11.0366 11.0366 11.0420 11.0420 12.4030 12.4030 12.4066 12.4066 13.7650 13.7650 13.7840 13.7840 13.9202 13.9202 k = 0.0395 0.5000-0.0000 ( 6732 PWs) bands (ev): -18.1880 -18.1880 -18.1880 -18.1880 -14.5497 -14.5497 -14.5490 -14.5490 -4.9474 -4.9474 -4.9251 -4.9251 -3.7039 -3.7039 -3.6847 -3.6847 -2.8362 -2.8362 -2.7706 -2.7706 -2.4510 -2.4510 -2.4394 -2.4394 3.7697 3.7697 3.7767 3.7767 3.8433 3.8433 3.8857 3.8857 3.9805 3.9805 4.0406 4.0406 4.2185 4.2185 4.2511 4.2511 4.4983 4.4983 4.5331 4.5331 4.6755 4.6755 4.6966 4.6966 4.8890 4.8890 4.9682 4.9682 5.2963 5.2963 5.2979 5.2979 5.4658 5.4658 5.4891 5.4891 7.5848 7.5848 7.6523 7.6523 7.7922 7.7922 7.8701 7.8701 11.0420 11.0420 11.0500 11.0500 12.4157 12.4157 12.4211 12.4211 13.7578 13.7578 13.7857 13.7857 13.9233 13.9233 k = 0.0526 0.5000-0.0000 ( 6740 PWs) bands (ev): -18.1872 -18.1872 -18.1872 -18.1872 -14.5507 -14.5507 -14.5498 -14.5498 -4.9506 -4.9506 -4.9210 -4.9210 -3.7048 -3.7048 -3.6797 -3.6797 -2.8495 -2.8495 -2.7629 -2.7629 -2.4560 -2.4560 -2.4409 -2.4409 3.7703 3.7703 3.7808 3.7808 3.8248 3.8248 3.8640 3.8640 3.9969 3.9969 4.0580 4.0580 4.2156 4.2156 4.2547 4.2547 4.4876 4.4876 4.5310 4.5310 4.6827 4.6827 4.7127 4.7127 4.8732 4.8732 4.9768 4.9768 5.2965 5.2965 5.3005 5.3005 5.4695 5.4695 5.5002 5.5002 7.5508 7.5508 7.6232 7.6232 7.8012 7.8012 7.8874 7.8874 11.0501 11.0501 11.0606 11.0606 12.4334 12.4334 12.4409 12.4409 13.7505 13.7505 13.7865 13.7865 13.9281 13.9281 k = 0.0658 0.5000-0.0000 ( 6736 PWs) bands (ev): -18.1862 -18.1862 -18.1862 -18.1862 -14.5521 -14.5521 -14.5510 -14.5510 -4.9535 -4.9535 -4.9168 -4.9168 -3.7050 -3.7050 -3.6741 -3.6741 -2.8630 -2.8630 -2.7563 -2.7563 -2.4618 -2.4618 -2.4434 -2.4434 3.7688 3.7688 3.7854 3.7854 3.8095 3.8095 3.8417 3.8417 4.0138 4.0138 4.0719 4.0719 4.2156 4.2156 4.2571 4.2571 4.4777 4.4777 4.5280 4.5280 4.6907 4.6907 4.7298 4.7298 4.8587 4.8587 4.9848 4.9848 5.2958 5.2958 5.3030 5.3030 5.4761 5.4761 5.5135 5.5135 7.5146 7.5146 7.5888 7.5888 7.8103 7.8103 7.9017 7.9017 11.0607 11.0607 11.0737 11.0737 12.4560 12.4560 12.4657 12.4657 13.7436 13.7436 13.7870 13.7870 13.9345 13.9345 k = 0.0789 0.5000-0.0000 ( 6728 PWs) bands (ev): -18.1850 -18.1850 -18.1849 -18.1849 -14.5537 -14.5537 -14.5523 -14.5523 -4.9563 -4.9563 -4.9125 -4.9125 -3.7043 -3.7043 -3.6682 -3.6682 -2.8769 -2.8769 -2.7511 -2.7511 -2.4683 -2.4683 -2.4469 -2.4469 3.7611 3.7611 3.7885 3.7885 3.8015 3.8015 3.8214 3.8214 4.0301 4.0301 4.0812 4.0812 4.2195 4.2195 4.2582 4.2582 4.4690 4.4690 4.5246 4.5246 4.6989 4.6989 4.7452 4.7452 4.8477 4.8477 4.9926 4.9926 5.2940 5.2940 5.3047 5.3047 5.4861 5.4861 5.5290 5.5290 7.4768 7.4768 7.5514 7.5514 7.8175 7.8175 7.9126 7.9126 11.0739 11.0739 11.0892 11.0892 12.4832 12.4832 12.4952 12.4952 13.7377 13.7377 13.7879 13.7879 13.9413 13.9413 k = 0.0921 0.5000-0.0000 ( 6724 PWs) bands (ev): -18.1835 -18.1835 -18.1835 -18.1835 -14.5555 -14.5555 -14.5540 -14.5540 -4.9589 -4.9589 -4.9082 -4.9082 -3.7028 -3.7028 -3.6618 -3.6618 -2.8908 -2.8908 -2.7471 -2.7471 -2.4755 -2.4755 -2.4515 -2.4515 3.7467 3.7467 3.7826 3.7826 3.8013 3.8013 3.8113 3.8113 4.0453 4.0453 4.0857 4.0857 4.2274 4.2274 4.2583 4.2583 4.4620 4.4620 4.5212 4.5212 4.7067 4.7067 4.7550 4.7550 4.8440 4.8440 5.0010 5.0010 5.2910 5.2910 5.3050 5.3050 5.4995 5.4995 5.5464 5.5464 7.4377 7.4377 7.5119 7.5119 7.8219 7.8219 7.9199 7.9199 11.0895 11.0895 11.1070 11.1070 12.5145 12.5145 12.5290 12.5290 13.7336 13.7336 13.7900 13.7900 13.9494 13.9494 k = 0.1053 0.5000-0.0000 ( 6716 PWs) bands (ev): -18.1819 -18.1819 -18.1819 -18.1819 -14.5576 -14.5576 -14.5559 -14.5559 -4.9613 -4.9613 -4.9039 -4.9039 -3.7003 -3.7003 -3.6550 -3.6550 -2.9049 -2.9049 -2.7446 -2.7446 -2.4834 -2.4834 -2.4571 -2.4571 3.7295 3.7295 3.7646 3.7646 3.8052 3.8052 3.8144 3.8144 4.0590 4.0590 4.0859 4.0859 4.2387 4.2387 4.2574 4.2574 4.4567 4.4567 4.5183 4.5183 4.7138 4.7138 4.7555 4.7555 4.8510 4.8510 5.0102 5.0102 5.2872 5.2872 5.3039 5.3039 5.5162 5.5162 5.5656 5.5656 7.3975 7.3975 7.4710 7.4710 7.8230 7.8230 7.9235 7.9235 11.1073 11.1073 11.1269 11.1269 12.5495 12.5495 12.5667 12.5667 13.7320 13.7320 13.7941 13.7941 13.9590 13.9590 k = 0.1184 0.5000-0.0000 ( 6714 PWs) bands (ev): -18.1800 -18.1800 -18.1800 -18.1800 -14.5599 -14.5599 -14.5580 -14.5580 -4.9634 -4.9634 -4.8996 -4.8996 -3.6970 -3.6970 -3.6478 -3.6478 -2.9188 -2.9188 -2.7435 -2.7435 -2.4919 -2.4919 -2.4639 -2.4639 3.7117 3.7117 3.7439 3.7439 3.8109 3.8109 3.8214 3.8214 4.0708 4.0708 4.0832 4.0832 4.2521 4.2521 4.2562 4.2562 4.4532 4.4532 4.5160 4.5160 4.7199 4.7199 4.7481 4.7481 4.8670 4.8670 5.0206 5.0206 5.2826 5.2826 5.3014 5.3014 5.5360 5.5360 5.5862 5.5862 7.3566 7.3566 7.4292 7.4292 7.8205 7.8205 7.9231 7.9231 11.1272 11.1272 11.1488 11.1488 12.5876 12.5876 12.6076 12.6076 13.7336 13.7336 13.8012 13.8012 13.9702 13.9702 k = 0.1316 0.5000-0.0000 ( 6730 PWs) bands (ev): -18.1780 -18.1780 -18.1780 -18.1780 -14.5624 -14.5624 -14.5603 -14.5603 -4.9654 -4.9654 -4.8954 -4.8954 -3.6926 -3.6926 -3.6403 -3.6403 -2.9326 -2.9326 -2.7440 -2.7440 -2.5010 -2.5010 -2.4717 -2.4717 3.6941 3.6941 3.7231 3.7231 3.8174 3.8174 3.8297 3.8297 4.0786 4.0786 4.0804 4.0804 4.2552 4.2552 4.2664 4.2664 4.4513 4.4513 4.5147 4.5147 4.7250 4.7250 4.7369 4.7369 4.8877 4.8877 5.0320 5.0320 5.2776 5.2776 5.2978 5.2978 5.5583 5.5583 5.6078 5.6078 7.3152 7.3152 7.3867 7.3867 7.8144 7.8144 7.9189 7.9189 11.1491 11.1491 11.1725 11.1725 12.6282 12.6282 12.6510 12.6510 13.7394 13.7394 13.8119 13.8119 13.9832 13.9832 k = 0.1447 0.5000-0.0000 ( 6738 PWs) bands (ev): -18.1759 -18.1759 -18.1759 -18.1759 -14.5651 -14.5651 -14.5628 -14.5628 -4.9671 -4.9671 -4.8914 -4.8914 -3.6872 -3.6872 -3.6323 -3.6323 -2.9462 -2.9462 -2.7459 -2.7459 -2.5106 -2.5106 -2.4807 -2.4807 3.6770 3.6770 3.7029 3.7029 3.8242 3.8242 3.8383 3.8383 4.0732 4.0732 4.0875 4.0875 4.2550 4.2550 4.2806 4.2806 4.4507 4.4507 4.5145 4.5145 4.7245 4.7245 4.7292 4.7292 4.9103 4.9103 5.0442 5.0442 5.2729 5.2729 5.2939 5.2939 5.5827 5.5827 5.6304 5.6304 7.2734 7.2734 7.3437 7.3437 7.8045 7.8045 7.9108 7.9108 11.1728 11.1728 11.1979 11.1979 12.6707 12.6707 12.6963 12.6963 13.7500 13.7500 13.8272 13.8272 13.9981 13.9981 k = 0.1579 0.5000-0.0000 ( 6740 PWs) bands (ev): -18.1736 -18.1736 -18.1736 -18.1736 -14.5679 -14.5679 -14.5656 -14.5656 -4.9686 -4.9686 -4.8874 -4.8874 -3.6808 -3.6808 -3.6240 -3.6240 -2.9594 -2.9594 -2.7494 -2.7494 -2.5208 -2.5208 -2.4907 -2.4907 3.6608 3.6608 3.6835 3.6835 3.8308 3.8308 3.8471 3.8471 4.0678 4.0678 4.0920 4.0920 4.2561 4.2561 4.2939 4.2939 4.4512 4.4512 4.5156 4.5156 4.7120 4.7120 4.7328 4.7328 4.9329 4.9329 5.0565 5.0565 5.2690 5.2690 5.2903 5.2903 5.6089 5.6089 5.6537 5.6537 7.2315 7.2315 7.3006 7.3006 7.7911 7.7911 7.8989 7.8989 11.1980 11.1980 11.2247 11.2247 12.7144 12.7144 12.7424 12.7424 13.7663 13.7663 13.8477 13.8477 14.0149 14.0149 k = 0.1711 0.5000-0.0000 ( 6740 PWs) bands (ev): -18.1711 -18.1711 -18.1711 -18.1711 -14.5709 -14.5709 -14.5685 -14.5685 -4.9699 -4.9699 -4.8837 -4.8837 -3.6733 -3.6733 -3.6152 -3.6152 -2.9722 -2.9722 -2.7545 -2.7545 -2.5315 -2.5315 -2.5019 -2.5019 3.6454 3.6454 3.6651 3.6651 3.8368 3.8368 3.8554 3.8554 4.0630 4.0630 4.0941 4.0941 4.2589 4.2589 4.3060 4.3060 4.4526 4.4526 4.5184 4.5184 4.7001 4.7001 4.7360 4.7360 4.9543 4.9543 5.0682 5.0682 5.2668 5.2668 5.2880 5.2880 5.6364 5.6364 5.6775 5.6775 7.1897 7.1897 7.2575 7.2575 7.7742 7.7742 7.8833 7.8833 11.2245 11.2245 11.2527 11.2527 12.7586 12.7586 12.7887 12.7887 13.7891 13.7891 13.8739 13.8739 14.0337 14.0337 k = 0.1842 0.5000-0.0000 ( 6756 PWs) bands (ev): -18.1686 -18.1686 -18.1686 -18.1686 -14.5741 -14.5741 -14.5715 -14.5715 -4.9709 -4.9709 -4.8802 -4.8802 -3.6648 -3.6648 -3.6060 -3.6060 -2.9844 -2.9844 -2.7610 -2.7610 -2.5428 -2.5428 -2.5141 -2.5141 3.6309 3.6309 3.6477 3.6477 3.8417 3.8417 3.8631 3.8631 4.0593 4.0593 4.0942 4.0942 4.2633 4.2633 4.3165 4.3165 4.4547 4.4547 4.5229 4.5229 4.6891 4.6891 4.7391 4.7391 4.9732 4.9732 5.0780 5.0780 5.2671 5.2671 5.2878 5.2878 5.6648 5.6648 5.7015 5.7015 7.1480 7.1480 7.2145 7.2145 7.7538 7.7538 7.8642 7.8642 11.2523 11.2523 11.2818 11.2818 12.8027 12.8027 12.8342 12.8342 13.8188 13.8188 13.9061 13.9061 14.0545 14.0545 k = 0.1974 0.5000-0.0000 ( 6750 PWs) bands (ev): -18.1659 -18.1659 -18.1659 -18.1659 -14.5773 -14.5773 -14.5747 -14.5747 -4.9717 -4.9717 -4.8769 -4.8769 -3.6551 -3.6551 -3.5963 -3.5963 -2.9961 -2.9961 -2.7690 -2.7690 -2.5545 -2.5545 -2.5273 -2.5273 3.6175 3.6175 3.6315 3.6315 3.8450 3.8450 3.8696 3.8696 4.0573 4.0573 4.0933 4.0933 4.2691 4.2691 4.3252 4.3252 4.4573 4.4573 4.5291 4.5291 4.6793 4.6793 4.7422 4.7422 4.9888 4.9888 5.0851 5.0851 5.2711 5.2711 5.2909 5.2909 5.6941 5.6941 5.7257 5.7257 7.1066 7.1066 7.1718 7.1718 7.7304 7.7304 7.8417 7.8417 11.2809 11.2809 11.3118 11.3118 12.8461 12.8461 12.8781 12.8781 13.8558 13.8558 13.9443 13.9443 14.0773 14.0773 k = 0.2105 0.5000-0.0000 ( 6750 PWs) bands (ev): -18.1632 -18.1632 -18.1631 -18.1631 -14.5807 -14.5807 -14.5779 -14.5779 -4.9722 -4.9722 -4.8740 -4.8740 -3.6443 -3.6443 -3.5862 -3.5862 -3.0071 -3.0071 -2.7784 -2.7784 -2.5667 -2.5667 -2.5416 -2.5416 3.6052 3.6052 3.6163 3.6163 3.8464 3.8464 3.8745 3.8745 4.0573 4.0573 4.0921 4.0921 4.2761 4.2761 4.3323 4.3323 4.4602 4.4602 4.5369 4.5369 4.6705 4.6705 4.7457 4.7457 5.0000 5.0000 5.0886 5.0886 5.2794 5.2794 5.2979 5.2979 5.7239 5.7239 5.7498 5.7498 7.0657 7.0657 7.1294 7.1294 7.7039 7.7039 7.8161 7.8161 11.3103 11.3103 11.3424 11.3424 12.8883 12.8883 12.9198 12.9198 13.9002 13.9002 13.9880 13.9880 14.1022 14.1022 k = 0.2237 0.5000-0.0000 ( 6758 PWs) bands (ev): -18.1604 -18.1604 -18.1603 -18.1603 -14.5841 -14.5841 -14.5813 -14.5813 -4.9725 -4.9725 -4.8713 -4.8713 -3.6325 -3.6325 -3.5755 -3.5755 -3.0174 -3.0174 -2.7891 -2.7891 -2.5793 -2.5793 -2.5569 -2.5569 3.5939 3.5939 3.6023 3.6023 3.8456 3.8456 3.8775 3.8775 4.0595 4.0595 4.0913 4.0913 4.2838 4.2838 4.3380 4.3380 4.4634 4.4634 4.5461 4.5461 4.6630 4.6630 4.7495 4.7495 5.0065 5.0065 5.0881 5.0881 5.2925 5.2925 5.3090 5.3090 5.7540 5.7540 5.7738 5.7738 7.0253 7.0253 7.0875 7.0875 7.6748 7.6748 7.7876 7.7876 11.3404 11.3404 11.3735 11.3735 12.9289 12.9289 12.9588 12.9588 13.9515 13.9515 14.0362 14.0362 14.1290 14.1290 k = 0.2368 0.5000-0.0000 ( 6754 PWs) bands (ev): -18.1575 -18.1575 -18.1575 -18.1575 -14.5875 -14.5875 -14.5847 -14.5847 -4.9725 -4.9725 -4.8691 -4.8691 -3.6196 -3.6196 -3.5644 -3.5644 -3.0269 -3.0269 -2.8012 -2.8012 -2.5925 -2.5925 -2.5732 -2.5732 3.5837 3.5837 3.5894 3.5894 3.8426 3.8426 3.8781 3.8781 4.0638 4.0638 4.0917 4.0917 4.2921 4.2921 4.3426 4.3426 4.4668 4.4668 4.5563 4.5563 4.6567 4.6567 4.7537 4.7537 5.0084 5.0084 5.0840 5.0840 5.3103 5.3103 5.3238 5.3238 5.7844 5.7844 5.7975 5.7975 6.9855 6.9855 7.0462 7.0462 7.6433 7.6433 7.7564 7.7564 11.3708 11.3708 11.4050 11.4050 12.9676 12.9676 12.9948 12.9948 14.0086 14.0086 14.0867 14.0867 14.1579 14.1579 k = 0.2500 0.5000-0.0000 ( 6758 PWs) bands (ev): -18.1546 -18.1546 -18.1546 -18.1546 -14.5910 -14.5910 -14.5882 -14.5882 -4.9722 -4.9722 -4.8673 -4.8673 -3.6056 -3.6056 -3.5528 -3.5528 -3.0356 -3.0356 -2.8143 -2.8143 -2.6061 -2.6061 -2.5903 -2.5903 3.5746 3.5746 3.5777 3.5777 3.8376 3.8376 3.8762 3.8762 4.0701 4.0701 4.0937 4.0937 4.3006 4.3006 4.3464 4.3464 4.4705 4.4705 4.5671 4.5671 4.6517 4.6517 4.7585 4.7585 5.0064 5.0064 5.0770 5.0770 5.3320 5.3320 5.3417 5.3417 5.8149 5.8149 5.8209 5.8209 6.9465 6.9465 7.0054 7.0054 7.6096 7.6096 7.7229 7.7229 11.4015 11.4015 11.4367 11.4367 13.0042 13.0042 13.0276 13.0276 14.0696 14.0696 14.1361 14.1361 14.1893 14.1893 k = 0.2632 0.5000-0.0000 ( 6748 PWs) bands (ev): -18.1518 -18.1518 -18.1517 -18.1517 -14.5945 -14.5945 -14.5917 -14.5917 -4.9715 -4.9715 -4.8659 -4.8659 -3.5905 -3.5905 -3.5406 -3.5406 -3.0434 -3.0434 -2.8286 -2.8286 -2.6203 -2.6203 -2.6084 -2.6084 3.5666 3.5666 3.5672 3.5672 3.8307 3.8307 3.8719 3.8719 4.0780 4.0780 4.0974 4.0974 4.3092 4.3092 4.3498 4.3498 4.4744 4.4744 4.5780 4.5780 4.6482 4.6482 4.7636 4.7636 5.0013 5.0013 5.0678 5.0678 5.3570 5.3570 5.3619 5.3619 5.8440 5.8440 5.8455 5.8455 6.9083 6.9083 6.9654 6.9654 7.5741 7.5741 7.6872 7.6872 11.4324 11.4324 11.4685 11.4685 13.0384 13.0384 13.0571 13.0571 14.1306 14.1306 14.1808 14.1808 14.2246 14.2246 k = 0.2763 0.5000-0.0000 ( 6748 PWs) bands (ev): -18.1489 -18.1489 -18.1489 -18.1489 -14.5979 -14.5979 -14.5952 -14.5952 -4.9706 -4.9706 -4.8649 -4.8649 -3.5745 -3.5745 -3.5278 -3.5278 -3.0503 -3.0503 -2.8438 -2.8438 -2.6348 -2.6348 -2.6272 -2.6272 3.5578 3.5578 3.5596 3.5596 3.8223 3.8223 3.8654 3.8654 4.0870 4.0870 4.1027 4.1027 4.3177 4.3177 4.3530 4.3530 4.4785 4.4785 4.5884 4.5884 4.6464 4.6464 4.7689 4.7689 4.9940 4.9940 5.0570 5.0570 5.3835 5.3835 5.3842 5.3842 5.8666 5.8666 5.8759 5.8759 6.8710 6.8710 6.9261 6.9261 7.5371 7.5371 7.6498 7.6498 11.4634 11.4634 11.5002 11.5002 13.0700 13.0700 13.0832 13.0832 14.1852 14.1852 14.2189 14.2189 14.2670 14.2670 k = 0.2895 0.5000-0.0000 ( 6752 PWs) bands (ev): -18.1460 -18.1460 -18.1460 -18.1460 -14.6014 -14.6014 -14.5986 -14.5986 -4.9694 -4.9694 -4.8644 -4.8644 -3.5575 -3.5575 -3.5145 -3.5145 -3.0563 -3.0563 -2.8598 -2.8598 -2.6498 -2.6498 -2.6467 -2.6467 3.5495 3.5495 3.5537 3.5537 3.8128 3.8128 3.8570 3.8570 4.0968 4.0968 4.1093 4.1093 4.3261 4.3261 4.3563 4.3563 4.4829 4.4829 4.5976 4.5976 4.6466 4.6466 4.7744 4.7744 4.9852 4.9852 5.0454 5.0454 5.4062 5.4062 5.4130 5.4130 5.8888 5.8888 5.9063 5.9063 6.8347 6.8347 6.8876 6.8876 7.4989 7.4989 7.6108 7.6108 11.4943 11.4943 11.5317 11.5317 13.0987 13.0987 13.1059 13.1059 14.2273 14.2273 14.2505 14.2505 14.3171 14.3171 k = 0.3026 0.5000-0.0000 ( 6752 PWs) bands (ev): -18.1433 -18.1433 -18.1432 -18.1432 -14.6047 -14.6047 -14.6020 -14.6020 -4.9679 -4.9679 -4.8644 -4.8644 -3.5396 -3.5396 -3.5007 -3.5007 -3.0614 -3.0614 -2.8766 -2.8766 -2.6668 -2.6668 -2.6652 -2.6652 3.5424 3.5424 3.5487 3.5487 3.8025 3.8025 3.8471 3.8471 4.1071 4.1071 4.1169 4.1169 4.3343 4.3343 4.3599 4.3599 4.4877 4.4877 4.6049 4.6049 4.6492 4.6492 4.7797 4.7797 4.9755 4.9755 5.0333 5.0333 5.4294 5.4294 5.4427 5.4427 5.9107 5.9107 5.9366 5.9366 6.7995 6.7995 6.8499 6.8499 7.4600 7.4600 7.5707 7.5707 11.5252 11.5252 11.5630 11.5630 13.1241 13.1241 13.1250 13.1250 14.2574 14.2574 14.2751 14.2751 14.3669 14.3669 k = 0.3158 0.5000-0.0000 ( 6762 PWs) bands (ev): -18.1405 -18.1405 -18.1405 -18.1405 -14.6079 -14.6079 -14.6054 -14.6054 -4.9660 -4.9660 -4.8649 -4.8649 -3.5209 -3.5209 -3.4863 -3.4863 -3.0656 -3.0656 -2.8941 -2.8941 -2.6875 -2.6875 -2.6809 -2.6809 3.5363 3.5363 3.5446 3.5446 3.7916 3.7916 3.8361 3.8361 4.1174 4.1174 4.1252 4.1252 4.3422 4.3422 4.3637 4.3637 4.4927 4.4927 4.6100 4.6100 4.6542 4.6542 4.7846 4.7846 4.9656 4.9656 5.0211 5.0211 5.4527 5.4527 5.4726 5.4726 5.9322 5.9322 5.9667 5.9667 6.7654 6.7654 6.8130 6.8130 7.4207 7.4207 7.5298 7.5298 11.5559 11.5559 11.5939 11.5939 13.1403 13.1403 13.1458 13.1458 14.2778 14.2778 14.2902 14.2902 14.4035 14.4035 k = 0.3289 0.5000-0.0000 ( 6750 PWs) bands (ev): -18.1379 -18.1379 -18.1379 -18.1379 -14.6110 -14.6110 -14.6086 -14.6086 -4.9639 -4.9639 -4.8658 -4.8658 -3.5015 -3.5015 -3.4714 -3.4714 -3.0689 -3.0689 -2.9120 -2.9120 -2.7085 -2.7085 -2.6970 -2.6970 3.5312 3.5312 3.5414 3.5414 3.7804 3.7804 3.8245 3.8245 4.1276 4.1276 4.1339 4.1339 4.3498 4.3498 4.3680 4.3680 4.4983 4.4983 4.6135 4.6135 4.6609 4.6609 4.7890 4.7890 4.9559 4.9559 5.0094 5.0094 5.4759 5.4759 5.5023 5.5023 5.9537 5.9537 5.9967 5.9967 6.7325 6.7325 6.7769 6.7769 7.3815 7.3815 7.4884 7.4884 11.5863 11.5863 11.6243 11.6243 13.1516 13.1516 13.1633 13.1633 14.2888 14.2888 14.2935 14.2935 14.4174 14.4174 k = 0.3421 0.5000-0.0000 ( 6756 PWs) bands (ev): -18.1354 -18.1354 -18.1354 -18.1354 -14.6140 -14.6140 -14.6117 -14.6117 -4.9614 -4.9614 -4.8673 -4.8673 -3.4813 -3.4813 -3.4561 -3.4561 -3.0715 -3.0715 -2.9304 -2.9304 -2.7297 -2.7297 -2.7132 -2.7132 3.5272 3.5272 3.5390 3.5390 3.7692 3.7692 3.8123 3.8123 4.1374 4.1374 4.1426 4.1426 4.3570 4.3570 4.3726 4.3726 4.5043 4.5043 4.6158 4.6158 4.6682 4.6682 4.7923 4.7923 4.9468 4.9468 4.9983 4.9983 5.4987 5.4987 5.5313 5.5313 5.9752 5.9752 6.0264 6.0264 6.7009 6.7009 6.7416 6.7416 7.3427 7.3427 7.4469 7.4469 11.6163 11.6163 11.6540 11.6540 13.1587 13.1587 13.1763 13.1763 14.2866 14.2866 14.2911 14.2911 14.4326 14.4326 k = 0.3553 0.5000-0.0000 ( 6752 PWs) bands (ev): -18.1330 -18.1330 -18.1330 -18.1330 -14.6168 -14.6168 -14.6146 -14.6146 -4.9586 -4.9586 -4.8692 -4.8692 -3.4607 -3.4607 -3.4403 -3.4403 -3.0733 -3.0733 -2.9491 -2.9491 -2.7509 -2.7509 -2.7295 -2.7295 3.5241 3.5241 3.5373 3.5373 3.7581 3.7581 3.7999 3.7999 4.1467 4.1467 4.1511 4.1511 4.3639 4.3639 4.3774 4.3774 4.5107 4.5107 4.6176 4.6176 4.6755 4.6755 4.7945 4.7945 4.9387 4.9387 4.9882 4.9882 5.5208 5.5208 5.5589 5.5589 5.9969 5.9969 6.0560 6.0560 6.6704 6.6704 6.7069 6.7069 7.3048 7.3048 7.4056 7.4056 11.6459 11.6459 11.6830 11.6830 13.1617 13.1617 13.1843 13.1843 14.2748 14.2748 14.2876 14.2876 14.4491 14.4491 k = 0.3684 0.5000-0.0000 ( 6752 PWs) bands (ev): -18.1308 -18.1308 -18.1308 -18.1308 -14.6195 -14.6195 -14.6174 -14.6174 -4.9555 -4.9555 -4.8715 -4.8715 -3.4396 -3.4396 -3.4241 -3.4241 -3.0746 -3.0746 -2.9679 -2.9679 -2.7719 -2.7719 -2.7459 -2.7459 3.5219 3.5219 3.5362 3.5362 3.7474 3.7474 3.7876 3.7876 4.1554 4.1554 4.1593 4.1593 4.3704 4.3704 4.3824 4.3824 4.5174 4.5174 4.6190 4.6190 4.6823 4.6823 4.7951 4.7951 4.9319 4.9319 4.9792 4.9792 5.5422 5.5422 5.5849 5.5849 6.0192 6.0192 6.0854 6.0854 6.6413 6.6413 6.6729 6.6729 7.2685 7.2685 7.3651 7.3651 11.6748 11.6748 11.7109 11.7109 13.1606 13.1606 13.1872 13.1872 14.2632 14.2632 14.2819 14.2819 14.4650 14.4650 k = 0.3816 0.5000-0.0000 ( 6756 PWs) bands (ev): -18.1287 -18.1287 -18.1287 -18.1287 -14.6219 -14.6219 -14.6200 -14.6200 -4.9521 -4.9521 -4.8743 -4.8743 -3.4184 -3.4184 -3.4076 -3.4076 -3.0756 -3.0756 -2.9867 -2.9867 -2.7923 -2.7923 -2.7622 -2.7622 3.5205 3.5205 3.5356 3.5356 3.7372 3.7372 3.7754 3.7754 4.1633 4.1633 4.1670 4.1670 4.3766 4.3766 4.3875 4.3875 4.5244 4.5244 4.6201 4.6201 4.6883 4.6883 4.7942 4.7942 4.9266 4.9266 4.9715 4.9715 5.5626 5.5626 5.6085 5.6085 6.0423 6.0423 6.1146 6.1146 6.6133 6.6133 6.6393 6.6393 7.2341 7.2341 7.3256 7.3256 11.7028 11.7028 11.7376 11.7376 13.1559 13.1559 13.1853 13.1853 14.2547 14.2547 14.2771 14.2771 14.4790 14.4790 k = 0.3947 0.5000-0.0000 ( 6760 PWs) bands (ev): -18.1268 -18.1268 -18.1268 -18.1268 -14.6241 -14.6241 -14.6224 -14.6224 -4.9485 -4.9485 -4.8775 -4.8775 -3.3971 -3.3971 -3.3909 -3.3909 -3.0764 -3.0764 -3.0053 -3.0053 -2.8118 -2.8118 -2.7783 -2.7783 3.5199 3.5199 3.5353 3.5353 3.7277 3.7277 3.7636 3.7636 4.1705 4.1705 4.1740 4.1740 4.3825 4.3825 4.3926 4.3926 4.5317 4.5317 4.6207 4.6207 4.6934 4.6934 4.7915 4.7915 4.9229 4.9229 4.9651 4.9651 5.5820 5.5820 5.6296 5.6296 6.0664 6.0664 6.1434 6.1434 6.5864 6.5864 6.6062 6.6062 7.2022 7.2022 7.2876 7.2876 11.7298 11.7298 11.7627 11.7627 13.1481 13.1481 13.1789 13.1789 14.2506 14.2506 14.2748 14.2748 14.4903 14.4903 k = 0.4079 0.5000-0.0000 ( 6768 PWs) bands (ev): -18.1251 -18.1251 -18.1251 -18.1251 -14.6261 -14.6261 -14.6246 -14.6246 -4.9445 -4.9445 -4.8810 -4.8810 -3.3761 -3.3761 -3.3742 -3.3742 -3.0775 -3.0775 -3.0235 -3.0235 -2.8299 -2.8299 -2.7941 -2.7941 3.5201 3.5201 3.5354 3.5354 3.7191 3.7191 3.7522 3.7522 4.1769 4.1769 4.1802 4.1802 4.3880 4.3880 4.3973 4.3973 4.5392 4.5392 4.6206 4.6206 4.6979 4.6979 4.7873 4.7873 4.9210 4.9210 4.9599 4.9599 5.6001 5.6001 5.6476 5.6476 6.0918 6.0918 6.1717 6.1717 6.5606 6.5606 6.5733 6.5733 7.1734 7.1734 7.2516 7.2516 11.7554 11.7554 11.7859 11.7859 13.1381 13.1381 13.1689 13.1689 14.2514 14.2514 14.2758 14.2758 14.4984 14.4984 k = 0.4211 0.5000-0.0000 ( 6776 PWs) bands (ev): -18.1236 -18.1236 -18.1236 -18.1236 -14.6278 -14.6278 -14.6265 -14.6265 -4.9404 -4.9404 -4.8849 -4.8849 -3.3576 -3.3576 -3.3557 -3.3557 -3.0790 -3.0790 -3.0411 -3.0411 -2.8460 -2.8460 -2.8092 -2.8092 3.5208 3.5208 3.5355 3.5355 3.7117 3.7117 3.7415 3.7415 4.1825 4.1825 4.1856 4.1856 4.3933 4.3933 4.4017 4.4017 4.5468 4.5468 4.6196 4.6196 4.7022 4.7022 4.7818 4.7818 4.9206 4.9206 4.9557 4.9557 5.6168 5.6168 5.6623 5.6623 6.1186 6.1186 6.1995 6.1995 6.5358 6.5358 6.5408 6.5408 7.1482 7.1482 7.2181 7.2181 11.7792 11.7792 11.8069 11.8069 13.1269 13.1269 13.1563 13.1563 14.2565 14.2565 14.2798 14.2798 14.5034 14.5034 k = 0.4342 0.5000-0.0000 ( 6768 PWs) bands (ev): -18.1223 -18.1223 -18.1223 -18.1223 -14.6293 -14.6293 -14.6282 -14.6282 -4.9361 -4.9361 -4.8890 -4.8890 -3.3415 -3.3415 -3.3364 -3.3364 -3.0815 -3.0815 -3.0575 -3.0575 -2.8595 -2.8595 -2.8237 -2.8237 3.5220 3.5220 3.5356 3.5356 3.7056 3.7056 3.7316 3.7316 4.1873 4.1873 4.1902 4.1902 4.3981 4.3981 4.4056 4.4056 4.5545 4.5545 4.6176 4.6176 4.7065 4.7065 4.7751 4.7751 4.9215 4.9215 4.9522 4.9522 5.6322 5.6322 5.6737 5.6737 6.1467 6.1467 6.2263 6.2263 6.5088 6.5088 6.5117 6.5117 7.1270 7.1270 7.1875 7.1875 11.8010 11.8010 11.8251 11.8251 13.1157 13.1157 13.1423 13.1423 14.2651 14.2651 14.2863 14.2863 14.5053 14.5053 k = 0.4474 0.5000-0.0000 ( 6772 PWs) bands (ev): -18.1212 -18.1212 -18.1212 -18.1212 -14.6305 -14.6305 -14.6296 -14.6296 -4.9315 -4.9315 -4.8934 -4.8934 -3.3261 -3.3261 -3.3190 -3.3190 -3.0850 -3.0850 -3.0724 -3.0724 -2.8699 -2.8699 -2.8372 -2.8372 3.5236 3.5236 3.5354 3.5354 3.7009 3.7009 3.7227 3.7227 4.1913 4.1913 4.1938 4.1938 4.4024 4.4024 4.4088 4.4088 4.5621 4.5621 4.6144 4.6144 4.7112 4.7112 4.7677 4.7677 4.9235 4.9235 4.9491 4.9491 5.6460 5.6460 5.6817 5.6817 6.1759 6.1759 6.2515 6.2515 6.4777 6.4777 6.4884 6.4884 7.1104 7.1104 7.1603 7.1603 11.8201 11.8201 11.8403 11.8403 13.1053 13.1053 13.1282 13.1282 14.2759 14.2759 14.2941 14.2941 14.5049 14.5049 k = 0.4605 0.5000-0.0000 ( 6768 PWs) bands (ev): -18.1204 -18.1204 -18.1204 -18.1204 -14.6314 -14.6314 -14.6307 -14.6307 -4.9268 -4.9268 -4.8979 -4.8979 -3.3121 -3.3121 -3.3043 -3.3043 -3.0896 -3.0896 -3.0849 -3.0849 -2.8768 -2.8768 -2.8495 -2.8495 3.5255 3.5255 3.5350 3.5350 3.6979 3.6979 3.7148 3.7148 4.1945 4.1945 4.1965 4.1965 4.4062 4.4062 4.4112 4.4112 4.5698 4.5698 4.6101 4.6101 4.7164 4.7164 4.7598 4.7598 4.9263 4.9263 4.9461 4.9461 5.6582 5.6582 5.6865 5.6865 6.2058 6.2058 6.2740 6.2740 6.4486 6.4486 6.4660 6.4660 7.0986 7.0986 7.1370 7.1370 11.8362 11.8362 11.8519 11.8519 13.0969 13.0969 13.1149 13.1149 14.2875 14.2875 14.3020 14.3020 14.5028 14.5028 k = 0.4737 0.5000-0.0000 ( 6752 PWs) bands (ev): -18.1197 -18.1197 -18.1197 -18.1197 -14.6320 -14.6320 -14.6316 -14.6316 -4.9221 -4.9221 -4.9026 -4.9026 -3.3002 -3.3002 -3.2934 -3.2934 -3.0945 -3.0945 -3.0942 -3.0942 -2.8799 -2.8799 -2.8603 -2.8603 3.5276 3.5276 3.5342 3.5342 3.6966 3.6966 3.7081 3.7081 4.1970 4.1970 4.1983 4.1983 4.4093 4.4093 4.4127 4.4127 4.5774 4.5774 4.6047 4.6047 4.7224 4.7224 4.7519 4.7519 4.9296 4.9296 4.9431 4.9431 5.6685 5.6685 5.6881 5.6881 6.2355 6.2355 6.2908 6.2908 6.4244 6.4244 6.4447 6.4447 7.0921 7.0921 7.1182 7.1182 11.8490 11.8490 11.8597 11.8597 13.0913 13.0913 13.1037 13.1037 14.2984 14.2984 14.3085 14.3085 14.5000 14.5000 k = 0.4868 0.5000-0.0000 ( 6744 PWs) bands (ev): -18.1194 -18.1194 -18.1194 -18.1194 -14.6324 -14.6324 -14.6321 -14.6321 -4.9172 -4.9172 -4.9074 -4.9074 -3.2914 -3.2914 -3.2874 -3.2874 -3.0997 -3.0997 -3.0988 -3.0988 -2.8794 -2.8794 -2.8691 -2.8691 3.5296 3.5296 3.5330 3.5330 3.6970 3.6970 3.7029 3.7029 4.1986 4.1986 4.1993 4.1993 4.4115 4.4115 4.4133 4.4133 4.5848 4.5848 4.5986 4.5986 4.7291 4.7291 4.7439 4.7439 4.9331 4.9331 4.9399 4.9399 5.6769 5.6769 5.6870 5.6870 6.2633 6.2633 6.2963 6.2963 6.4107 6.4107 6.4258 6.4258 7.0908 7.0908 7.1039 7.1039 11.8579 11.8579 11.8633 11.8633 13.0890 13.0890 13.0953 13.0953 14.3068 14.3068 14.3120 14.3120 14.4979 14.4979 k = 0.5000 0.5000-0.0000 ( 6752 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9123 -4.9123 -4.9123 -4.9123 -3.2868 -3.2868 -3.2868 -3.2868 -3.1010 -3.1010 -3.1010 -3.1010 -2.8757 -2.8757 -2.8757 -2.8757 3.5314 3.5314 3.5314 3.5314 3.6991 3.6991 3.6991 3.6991 4.1993 4.1993 4.1993 4.1993 4.4129 4.4129 4.4129 4.4129 4.5919 4.5919 4.5919 4.5919 4.7363 4.7363 4.7363 4.7363 4.9366 4.9366 4.9366 4.9366 5.6831 5.6831 5.6831 5.6831 6.2857 6.2857 6.2857 6.2857 6.4124 6.4124 6.4124 6.4124 7.0947 7.0947 7.0947 7.0947 11.8627 11.8627 11.8627 11.8627 13.0903 13.0903 13.0903 13.0903 14.3116 14.3116 14.3116 14.3116 14.4974 14.4974 k = 0.5000 0.5000-0.0000 ( 6752 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9123 -4.9123 -4.9123 -4.9123 -3.2868 -3.2868 -3.2868 -3.2868 -3.1010 -3.1010 -3.1010 -3.1010 -2.8757 -2.8757 -2.8757 -2.8757 3.5314 3.5314 3.5314 3.5314 3.6991 3.6991 3.6991 3.6991 4.1993 4.1993 4.1993 4.1993 4.4129 4.4129 4.4129 4.4129 4.5919 4.5919 4.5919 4.5919 4.7363 4.7363 4.7363 4.7363 4.9366 4.9366 4.9366 4.9366 5.6831 5.6831 5.6831 5.6831 6.2857 6.2857 6.2857 6.2857 6.4124 6.4124 6.4124 6.4124 7.0947 7.0947 7.0947 7.0947 11.8627 11.8627 11.8627 11.8627 13.0903 13.0903 13.0903 13.0903 14.3116 14.3116 14.3116 14.3116 14.4974 14.4974 k = 0.4906 0.4906-0.0000 ( 6748 PWs) bands (ev): -18.1195 -18.1195 -18.1193 -18.1193 -14.6324 -14.6324 -14.6321 -14.6321 -4.9173 -4.9173 -4.9074 -4.9074 -3.2915 -3.2915 -3.2874 -3.2874 -3.1005 -3.1005 -3.0978 -3.0978 -2.8796 -2.8796 -2.8689 -2.8689 3.5296 3.5296 3.5331 3.5331 3.6969 3.6969 3.7029 3.7029 4.1984 4.1984 4.1994 4.1994 4.4113 4.4113 4.4135 4.4135 4.5846 4.5846 4.5987 4.5987 4.7290 4.7290 4.7440 4.7440 4.9330 4.9330 4.9400 4.9400 5.6767 5.6767 5.6872 5.6872 6.2629 6.2629 6.2964 6.2964 6.4097 6.4097 6.4272 6.4272 7.0903 7.0903 7.1045 7.1045 11.8566 11.8566 11.8645 11.8645 13.0884 13.0884 13.0961 13.0961 14.3053 14.3053 14.3136 14.3136 14.4937 14.4937 k = 0.4811 0.4811-0.0000 ( 6752 PWs) bands (ev): -18.1201 -18.1201 -18.1194 -18.1194 -14.6320 -14.6320 -14.6315 -14.6315 -4.9223 -4.9223 -4.9024 -4.9024 -3.3010 -3.3010 -3.2932 -3.2932 -3.0989 -3.0989 -3.0893 -3.0893 -2.8813 -2.8813 -2.8588 -2.8588 3.5275 3.5275 3.5343 3.5343 3.6965 3.6965 3.7084 3.7084 4.1961 4.1961 4.1991 4.1991 4.4080 4.4080 4.4139 4.4139 4.5769 4.5769 4.6052 4.6052 4.7222 4.7222 4.7521 4.7521 4.9293 4.9293 4.9434 4.9434 5.6673 5.6673 5.6894 5.6894 6.2341 6.2341 6.2904 6.2904 6.4184 6.4184 6.4526 6.4526 7.0888 7.0888 7.1215 7.1215 11.8420 11.8420 11.8664 11.8664 13.0873 13.0873 13.1079 13.1079 14.2914 14.2914 14.3169 14.3169 14.4828 14.4828 k = 0.4717 0.4717-0.0000 ( 6768 PWs) bands (ev): -18.1213 -18.1213 -18.1195 -18.1195 -14.6314 -14.6314 -14.6306 -14.6306 -4.9273 -4.9273 -4.8975 -4.8975 -3.3143 -3.3143 -3.3033 -3.3033 -3.0962 -3.0962 -3.0764 -3.0764 -2.8812 -2.8812 -2.8456 -2.8456 3.5252 3.5252 3.5352 3.5352 3.6977 3.6977 3.7156 3.7156 4.1923 4.1923 4.1986 4.1986 4.4027 4.4027 4.4144 4.4144 4.5687 4.5687 4.6111 4.6111 4.7161 4.7161 4.7600 4.7600 4.9254 4.9254 4.9469 4.9469 5.6548 5.6548 5.6905 5.6905 6.2031 6.2031 6.2708 6.2708 6.4354 6.4354 6.4863 6.4863 7.0888 7.0888 7.1460 7.1460 11.8188 11.8188 11.8693 11.8693 13.0861 13.0861 13.1253 13.1253 14.2738 14.2738 14.3222 14.3222 14.4652 14.4652 k = 0.4623 0.4623-0.0000 ( 6776 PWs) bands (ev): -18.1228 -18.1228 -18.1197 -18.1197 -14.6306 -14.6306 -14.6294 -14.6294 -4.9323 -4.9323 -4.8925 -4.8925 -3.3309 -3.3309 -3.3162 -3.3162 -3.0927 -3.0927 -3.0603 -3.0603 -2.8797 -2.8797 -2.8295 -2.8295 3.5229 3.5229 3.5356 3.5356 3.7004 3.7004 3.7245 3.7245 4.1871 4.1871 4.1979 4.1979 4.3956 4.3956 4.4150 4.4150 4.5599 4.5599 4.6166 4.6166 4.7106 4.7106 4.7676 4.7676 4.9216 4.9216 4.9508 4.9508 5.6394 5.6394 5.6908 5.6908 6.1707 6.1707 6.2429 6.2429 6.4582 6.4582 6.5253 6.5253 7.0897 7.0897 7.1770 7.1770 11.7883 11.7883 11.8732 11.8732 13.0846 13.0846 13.1463 13.1463 14.2569 14.2569 14.3297 14.3297 14.4417 14.4417 k = 0.4528 0.4528-0.0000 ( 6780 PWs) bands (ev): -18.1248 -18.1248 -18.1200 -18.1200 -14.6294 -14.6294 -14.6278 -14.6278 -4.9374 -4.9374 -4.8875 -4.8875 -3.3503 -3.3503 -3.3305 -3.3305 -3.0884 -3.0884 -3.0422 -3.0422 -2.8770 -2.8770 -2.8112 -2.8112 3.5206 3.5206 3.5357 3.5357 3.7046 3.7046 3.7351 3.7351 4.1805 4.1805 4.1969 4.1969 4.3869 4.3869 4.4157 4.4157 4.5505 4.5505 4.6214 4.6214 4.7055 4.7055 4.7743 4.7743 4.9181 4.9181 4.9552 4.9552 5.6218 5.6218 5.6907 5.6907 6.1363 6.1363 6.2115 6.2115 6.4856 6.4856 6.5678 6.5678 7.0911 7.0911 7.2132 7.2132 11.7519 11.7519 11.8779 11.8779 13.0827 13.0827 13.1682 13.1682 14.2440 14.2440 14.3393 14.3393 14.4130 14.4130 k = 0.4434 0.4434-0.0000 ( 6784 PWs) bands (ev): -18.1272 -18.1272 -18.1203 -18.1203 -14.6280 -14.6280 -14.6259 -14.6259 -4.9424 -4.9424 -4.8825 -4.8825 -3.3720 -3.3720 -3.3453 -3.3453 -3.0834 -3.0834 -3.0229 -3.0229 -2.8731 -2.8731 -2.7912 -2.7912 3.5185 3.5185 3.5355 3.5355 3.7099 3.7099 3.7476 3.7476 4.1727 4.1727 4.1955 4.1955 4.3768 4.3768 4.4163 4.4163 4.5406 4.5406 4.6255 4.6255 4.7007 4.7007 4.7795 4.7795 4.9152 4.9152 4.9605 4.9605 5.6024 5.6024 5.6902 5.6902 6.0984 6.0984 6.1807 6.1807 6.5168 6.5168 6.6124 6.6124 7.0932 7.0932 7.2530 7.2530 11.7110 11.7110 11.8833 11.8833 13.0805 13.0805 13.1882 13.1882 14.2379 14.2379 14.3510 14.3510 14.3804 14.3804 k = 0.4340 0.4340-0.0000 ( 6788 PWs) bands (ev): -18.1300 -18.1300 -18.1207 -18.1207 -14.6264 -14.6264 -14.6237 -14.6237 -4.9475 -4.9475 -4.8775 -4.8775 -3.3954 -3.3954 -3.3599 -3.3599 -3.0778 -3.0778 -3.0031 -3.0031 -2.8680 -2.8680 -2.7702 -2.7702 3.5166 3.5166 3.5350 3.5350 3.7160 3.7160 3.7619 3.7619 4.1637 4.1637 4.1937 4.1937 4.3657 4.3657 4.4167 4.4167 4.5301 4.5301 4.6286 4.6286 4.6959 4.6959 4.7829 4.7829 4.9134 4.9134 4.9670 4.9670 5.5818 5.5818 5.6895 5.6895 6.0556 6.0556 6.1535 6.1535 6.5515 6.5515 6.6585 6.6585 7.0958 7.0958 7.2952 7.2952 11.6670 11.6670 11.8891 11.8891 13.0778 13.0778 13.2038 13.2038 14.2401 14.2401 14.3453 14.3453 14.3650 14.3650 k = 0.4245 0.4245-0.0000 ( 6784 PWs) bands (ev): -18.1332 -18.1332 -18.1211 -18.1211 -14.6245 -14.6245 -14.6212 -14.6212 -4.9526 -4.9526 -4.8724 -4.8724 -3.4201 -3.4201 -3.3740 -3.3740 -3.0715 -3.0715 -2.9834 -2.9834 -2.8617 -2.8617 -2.7485 -2.7485 3.5152 3.5152 3.5344 3.5344 3.7228 3.7228 3.7781 3.7781 4.1536 4.1536 4.1913 4.1913 4.3539 4.3539 4.4169 4.4169 4.5192 4.5192 4.6308 4.6308 4.6906 4.6906 4.7840 4.7840 4.9130 4.9130 4.9750 4.9750 5.5608 5.5608 5.6888 5.6888 6.0081 6.0081 6.1312 6.1312 6.5889 6.5889 6.7056 6.7056 7.0991 7.0991 7.3389 7.3389 11.6209 11.6209 11.8950 11.8950 13.0749 13.0749 13.2130 13.2130 14.2487 14.2487 14.3124 14.3124 14.3809 14.3809 k = 0.4151 0.4151-0.0000 ( 6768 PWs) bands (ev): -18.1368 -18.1368 -18.1216 -18.1216 -14.6224 -14.6224 -14.6183 -14.6183 -4.9577 -4.9577 -4.8672 -4.8672 -3.4455 -3.4455 -3.3874 -3.3874 -3.0645 -3.0645 -2.9644 -2.9644 -2.8537 -2.8537 -2.7267 -2.7267 3.5143 3.5143 3.5337 3.5337 3.7299 3.7299 3.7960 3.7960 4.1425 4.1425 4.1883 4.1883 4.3416 4.3416 4.4168 4.4168 4.5078 4.5078 4.6320 4.6320 4.6844 4.6844 4.7830 4.7830 4.9140 4.9140 4.9849 4.9849 5.5397 5.5397 5.6880 5.6880 5.9571 5.9571 6.1136 6.1136 6.6288 6.6288 6.7532 6.7532 7.1033 7.1033 7.3832 7.3832 11.5738 11.5738 11.9008 11.9008 13.0717 13.0717 13.2149 13.2149 14.2432 14.2432 14.3028 14.3028 14.3989 14.3989 k = 0.4057 0.4057-0.0000 ( 6768 PWs) bands (ev): -18.1407 -18.1407 -18.1222 -18.1222 -14.6201 -14.6201 -14.6151 -14.6151 -4.9627 -4.9627 -4.8620 -4.8620 -3.4713 -3.4713 -3.3999 -3.3999 -3.0568 -3.0568 -2.9466 -2.9466 -2.8441 -2.8441 -2.7051 -2.7051 3.5139 3.5139 3.5331 3.5331 3.7373 3.7373 3.8155 3.8155 4.1306 4.1306 4.1844 4.1844 4.3291 4.3291 4.4162 4.4162 4.4960 4.4960 4.6321 4.6321 4.6767 4.6767 4.7799 4.7799 4.9164 4.9164 4.9967 4.9967 5.5189 5.5189 5.6872 5.6872 5.9040 5.9040 6.1001 6.1001 6.6707 6.6707 6.8007 6.8007 7.1084 7.1084 7.4274 7.4274 11.5264 11.5264 11.9062 11.9062 13.0682 13.0682 13.2095 13.2095 14.2102 14.2102 14.3297 14.3297 14.4189 14.4189 k = 0.3962 0.3962-0.0000 ( 6768 PWs) bands (ev): -18.1451 -18.1451 -18.1228 -18.1228 -14.6176 -14.6176 -14.6117 -14.6117 -4.9678 -4.9678 -4.8567 -4.8567 -3.4973 -3.4973 -3.4116 -3.4116 -3.0486 -3.0486 -2.9303 -2.9303 -2.8326 -2.8326 -2.6839 -2.6839 3.5143 3.5143 3.5326 3.5326 3.7447 3.7447 3.8361 3.8361 4.1178 4.1178 4.1795 4.1795 4.3169 4.3169 4.4151 4.4151 4.4839 4.4839 4.6308 4.6308 4.6678 4.6678 4.7753 4.7753 4.9200 4.9200 5.0105 5.0105 5.4987 5.4987 5.6865 5.6865 5.8500 5.8500 6.0903 6.0903 6.7143 6.7143 6.8475 6.8475 7.1149 7.1149 7.4709 7.4709 11.4794 11.4794 11.9108 11.9108 13.0645 13.0645 13.1978 13.1978 14.1705 14.1705 14.3706 14.3706 14.4407 14.4407 k = 0.3868 0.3868-0.0000 ( 6772 PWs) bands (ev): -18.1497 -18.1497 -18.1234 -18.1234 -14.6149 -14.6149 -14.6079 -14.6079 -4.9727 -4.9727 -4.8513 -4.8513 -3.5232 -3.5232 -3.4222 -3.4222 -3.0396 -3.0396 -2.9157 -2.9157 -2.8192 -2.8192 -2.6635 -2.6635 3.5155 3.5155 3.5325 3.5325 3.7521 3.7521 3.8575 3.8575 4.1043 4.1043 4.1734 4.1734 4.3053 4.3053 4.4133 4.4133 4.4714 4.4714 4.6270 4.6270 4.6587 4.6587 4.7695 4.7695 4.9248 4.9248 5.0261 5.0261 5.4789 5.4789 5.6860 5.6860 5.7964 5.7964 6.0837 6.0837 6.7593 6.7593 6.8928 6.8928 7.1234 7.1234 7.5132 7.5132 11.4334 11.4334 11.9143 11.9143 13.0607 13.0607 13.1813 13.1813 14.1297 14.1297 14.4164 14.4164 14.4641 14.4641 k = 0.3774 0.3774-0.0000 ( 6756 PWs) bands (ev): -18.1547 -18.1547 -18.1241 -18.1241 -14.6120 -14.6120 -14.6039 -14.6039 -4.9775 -4.9775 -4.8458 -4.8458 -3.5488 -3.5488 -3.4319 -3.4319 -3.0301 -3.0301 -2.9029 -2.9029 -2.8041 -2.8041 -2.6439 -2.6439 3.5175 3.5175 3.5328 3.5328 3.7595 3.7595 3.8790 3.8790 4.0902 4.0902 4.1659 4.1659 4.2950 4.2950 4.4108 4.4108 4.4588 4.4588 4.6185 4.6185 4.6520 4.6520 4.7624 4.7624 4.9310 4.9310 5.0433 5.0433 5.4593 5.4593 5.6855 5.6855 5.7446 5.7446 6.0803 6.0803 6.8055 6.8055 6.9354 6.9354 7.1350 7.1350 7.5541 7.5541 11.3887 11.3887 11.9164 11.9164 13.0569 13.0569 13.1616 13.1616 14.0893 14.0893 14.4601 14.4601 14.4892 14.4892 k = 0.3679 0.3679-0.0000 ( 6765 PWs) bands (ev): -18.1600 -18.1600 -18.1248 -18.1248 -14.6089 -14.6089 -14.5997 -14.5997 -4.9822 -4.9822 -4.8403 -4.8403 -3.5740 -3.5740 -3.4406 -3.4406 -3.0200 -3.0200 -2.8914 -2.8914 -2.7878 -2.7878 -2.6253 -2.6253 3.5202 3.5202 3.5336 3.5336 3.7666 3.7666 3.8996 3.8996 4.0755 4.0755 4.1570 4.1570 4.2863 4.2863 4.4074 4.4074 4.4459 4.4459 4.6046 4.6046 4.6488 4.6488 4.7539 4.7539 4.9384 4.9384 5.0616 5.0616 5.4392 5.4392 5.6839 5.6839 5.6974 5.6974 6.0795 6.0795 6.8527 6.8527 6.9736 6.9736 7.1511 7.1511 7.5930 7.5930 11.3458 11.3458 11.9169 11.9169 13.0531 13.0531 13.1404 13.1404 14.0496 14.0496 14.4822 14.4822 14.5151 14.5151 k = 0.3585 0.3585-0.0000 ( 6771 PWs) bands (ev): -18.1656 -18.1656 -18.1256 -18.1256 -14.6057 -14.6057 -14.5952 -14.5952 -4.9867 -4.9867 -4.8347 -4.8347 -3.5987 -3.5987 -3.4483 -3.4483 -3.0094 -3.0094 -2.8810 -2.8810 -2.7709 -2.7709 -2.6079 -2.6079 3.5238 3.5238 3.5352 3.5352 3.7737 3.7737 3.9185 3.9185 4.0604 4.0604 4.1466 4.1466 4.2798 4.2798 4.4031 4.4031 4.4329 4.4329 4.5870 4.5870 4.6482 4.6482 4.7440 4.7440 4.9473 4.9473 5.0806 5.0806 5.4173 5.4173 5.6510 5.6510 5.6869 5.6869 6.0813 6.0813 6.9007 6.9007 7.0055 7.0055 7.1734 7.1734 7.6297 7.6297 11.3048 11.3048 11.9157 11.9157 13.0493 13.0493 13.1190 13.1190 14.0108 14.0108 14.4322 14.4322 14.5344 14.5344 k = 0.3491 0.3491-0.0000 ( 6765 PWs) bands (ev): -18.1714 -18.1714 -18.1264 -18.1264 -14.6024 -14.6024 -14.5904 -14.5904 -4.9911 -4.9911 -4.8290 -4.8290 -3.6227 -3.6227 -3.4550 -3.4550 -2.9982 -2.9982 -2.8714 -2.8714 -2.7537 -2.7537 -2.5917 -2.5917 3.5277 3.5277 3.5378 3.5378 3.7805 3.7805 3.9344 3.9344 4.0449 4.0449 4.1349 4.1349 4.2759 4.2759 4.3979 4.3979 4.4200 4.4200 4.5676 4.5676 4.6493 4.6493 4.7328 4.7328 4.9576 4.9576 5.0996 5.0996 5.3927 5.3927 5.6149 5.6149 5.6874 5.6874 6.0855 6.0855 6.9494 6.9494 7.0301 7.0301 7.2026 7.2026 7.6641 7.6641 11.2659 11.2659 11.9126 11.9126 13.0457 13.0457 13.0988 13.0988 13.9724 13.9724 14.3659 14.3659 14.5505 14.5505 k = 0.3396 0.3396-0.0000 ( 6767 PWs) bands (ev): -18.1775 -18.1775 -18.1273 -18.1273 -14.5989 -14.5989 -14.5855 -14.5855 -4.9952 -4.9952 -4.8232 -4.8232 -3.6460 -3.6460 -3.4607 -3.4607 -2.9866 -2.9866 -2.8623 -2.8623 -2.7366 -2.7366 -2.5768 -2.5768 3.5316 3.5316 3.5420 3.5420 3.7872 3.7872 3.9460 3.9460 4.0293 4.0293 4.1218 4.1218 4.2746 4.2746 4.3914 4.3914 4.4079 4.4079 4.5477 4.5477 4.6513 4.6513 4.7202 4.7202 4.9692 4.9692 5.1176 5.1176 5.3651 5.3651 5.5871 5.5871 5.6887 5.6887 6.0919 6.0919 6.9984 6.9984 7.0483 7.0483 7.2379 7.2379 7.6960 7.6960 11.2292 11.2292 11.9077 11.9077 13.0420 13.0420 13.0811 13.0811 13.9339 13.9339 14.3042 14.3042 14.5514 14.5514 k = 0.3302 0.3302-0.0000 ( 6755 PWs) bands (ev): -18.1837 -18.1837 -18.1282 -18.1282 -14.5953 -14.5953 -14.5803 -14.5803 -4.9990 -4.9990 -4.8173 -4.8173 -3.6685 -3.6685 -3.4656 -3.4656 -2.9745 -2.9745 -2.8534 -2.8534 -2.7200 -2.7200 -2.5631 -2.5631 3.5354 3.5354 3.5480 3.5480 3.7937 3.7937 3.9523 3.9523 4.0137 4.0137 4.1074 4.1074 4.2752 4.2752 4.3828 4.3828 4.3983 4.3983 4.5286 4.5286 4.6540 4.6540 4.7067 4.7067 4.9818 4.9818 5.1327 5.1327 5.3365 5.3365 5.5684 5.5684 5.6908 5.6908 6.1004 6.1004 7.0458 7.0458 7.0637 7.0637 7.2774 7.2774 7.7252 7.7252 11.1948 11.1948 11.9012 11.9012 13.0381 13.0381 13.0669 13.0669 13.8943 13.8943 14.2492 14.2492 14.4882 14.4882 k = 0.3208 0.3208-0.0000 ( 6753 PWs) bands (ev): -18.1902 -18.1902 -18.1291 -18.1291 -14.5916 -14.5916 -14.5750 -14.5750 -5.0025 -5.0025 -4.8114 -4.8114 -3.6901 -3.6901 -3.4695 -3.4695 -2.9621 -2.9621 -2.8447 -2.8447 -2.7042 -2.7042 -2.5508 -2.5508 3.5390 3.5390 3.5555 3.5555 3.8001 3.8001 3.9527 3.9527 3.9983 3.9983 4.0918 4.0918 4.2759 4.2759 4.3709 4.3709 4.3932 4.3932 4.5116 4.5116 4.6569 4.6569 4.6925 4.6925 4.9945 4.9945 5.1419 5.1419 5.3116 5.3116 5.5576 5.5576 5.6936 5.6936 6.1108 6.1108 7.0681 7.0681 7.1012 7.1012 7.3191 7.3191 7.7519 7.7519 11.1626 11.1626 11.8933 11.8933 13.0337 13.0337 13.0572 13.0572 13.8526 13.8526 14.2004 14.2004 14.3719 14.3719 k = 0.3113 0.3113-0.0000 ( 6753 PWs) bands (ev): -18.1968 -18.1968 -18.1300 -18.1300 -14.5878 -14.5878 -14.5695 -14.5695 -5.0056 -5.0056 -4.8054 -4.8054 -3.7108 -3.7108 -3.4727 -3.4727 -2.9494 -2.9494 -2.8361 -2.8361 -2.6894 -2.6894 -2.5397 -2.5397 3.5428 3.5428 3.5641 3.5641 3.8063 3.8063 3.9474 3.9474 3.9832 3.9832 4.0748 4.0748 4.2739 4.2739 4.3569 4.3569 4.3924 4.3924 4.4988 4.4988 4.6592 4.6592 4.6784 4.6784 5.0058 5.0058 5.1419 5.1419 5.2970 5.2970 5.5532 5.5532 5.6972 5.6972 6.1229 6.1229 7.0763 7.0763 7.1509 7.1509 7.3617 7.3617 7.7759 7.7759 11.1323 11.1323 11.8845 11.8845 13.0294 13.0294 13.0522 13.0522 13.8084 13.8084 14.1501 14.1501 14.2547 14.2547 k = 0.3019 0.3019-0.0000 ( 6745 PWs) bands (ev): -18.2036 -18.2036 -18.1310 -18.1310 -14.5840 -14.5840 -14.5639 -14.5639 -5.0084 -5.0084 -4.7994 -4.7994 -3.7305 -3.7305 -3.4752 -3.4752 -2.9364 -2.9364 -2.8274 -2.8274 -2.6757 -2.6757 -2.5297 -2.5297 3.5468 3.5468 3.5736 3.5736 3.8125 3.8125 3.9374 3.9374 3.9684 3.9684 4.0563 4.0563 4.2673 4.2673 4.3418 4.3418 4.3930 4.3930 4.4935 4.4935 4.6576 4.6576 4.6676 4.6676 5.0125 5.0125 5.1343 5.1343 5.2961 5.2961 5.5540 5.5540 5.7019 5.7019 6.1369 6.1369 7.0824 7.0824 7.2016 7.2016 7.4040 7.4040 7.7974 7.7974 11.1039 11.1039 11.8752 11.8752 13.0269 13.0269 13.0505 13.0505 13.7615 13.7615 14.0650 14.0650 14.1788 14.1788 k = 0.2925 0.2925-0.0000 ( 6761 PWs) bands (ev): -18.2105 -18.2105 -18.1320 -18.1320 -14.5801 -14.5801 -14.5581 -14.5581 -5.0107 -5.0107 -4.7934 -4.7934 -3.7493 -3.7493 -3.4770 -3.4770 -2.9234 -2.9234 -2.8187 -2.8187 -2.6633 -2.6633 -2.5209 -2.5209 3.5511 3.5511 3.5836 3.5836 3.8186 3.8186 3.9239 3.9239 3.9533 3.9533 4.0363 4.0363 4.2560 4.2560 4.3260 4.3260 4.3906 4.3906 4.4991 4.4991 4.6462 4.6462 4.6651 4.6651 5.0092 5.0092 5.1290 5.1290 5.3057 5.3057 5.5586 5.5586 5.7075 5.7075 6.1525 6.1525 7.0873 7.0873 7.2525 7.2525 7.4455 7.4455 7.8166 7.8166 11.0770 11.0770 11.8660 11.8660 13.0276 13.0276 13.0509 13.0509 13.7122 13.7122 13.9432 13.9432 14.1473 14.1473 k = 0.2830 0.2830-0.0000 ( 6769 PWs) bands (ev): -18.2175 -18.2175 -18.1330 -18.1330 -14.5761 -14.5761 -14.5523 -14.5523 -5.0126 -5.0126 -4.7873 -4.7873 -3.7670 -3.7670 -3.4781 -3.4781 -2.9103 -2.9103 -2.8098 -2.8098 -2.6525 -2.6525 -2.5130 -2.5130 3.5555 3.5555 3.5941 3.5941 3.8246 3.8246 3.9085 3.9085 3.9375 3.9375 4.0148 4.0148 4.2410 4.2410 4.3100 4.3100 4.3830 4.3830 4.5158 4.5158 4.6328 4.6328 4.6627 4.6627 4.9939 4.9939 5.1342 5.1342 5.3212 5.3212 5.5663 5.5663 5.7144 5.7144 6.1697 6.1697 7.0915 7.0915 7.3037 7.3037 7.4855 7.4855 7.8337 7.8337 11.0512 11.0512 11.8575 11.8575 13.0323 13.0323 13.0531 13.0531 13.6613 13.6613 13.8134 13.8134 14.0668 14.0668 k = 0.2736 0.2736-0.0000 ( 6765 PWs) bands (ev): -18.2245 -18.2245 -18.1341 -18.1341 -14.5722 -14.5722 -14.5463 -14.5463 -5.0140 -5.0140 -4.7813 -4.7813 -3.7836 -3.7836 -3.4788 -3.4788 -2.8973 -2.8973 -2.8008 -2.8008 -2.6432 -2.6432 -2.5059 -2.5059 3.5601 3.5601 3.6048 3.6048 3.8307 3.8307 3.8918 3.8918 3.9209 3.9209 3.9919 3.9919 4.2237 4.2237 4.2939 4.2939 4.3714 4.3714 4.5400 4.5400 4.6200 4.6200 4.6568 4.6568 4.9723 4.9723 5.1493 5.1493 5.3396 5.3396 5.5767 5.5767 5.7227 5.7227 6.1886 6.1886 7.0950 7.0950 7.3549 7.3549 7.5237 7.5237 7.8490 7.8490 11.0262 11.0262 11.8504 11.8504 13.0414 13.0414 13.0566 13.0566 13.6089 13.6089 13.6836 13.6836 13.9625 13.9625 k = 0.2642 0.2642-0.0000 ( 6759 PWs) bands (ev): -18.2316 -18.2316 -18.1351 -18.1351 -14.5682 -14.5682 -14.5403 -14.5403 -5.0148 -5.0148 -4.7754 -4.7754 -3.7992 -3.7992 -3.4790 -3.4790 -2.8846 -2.8846 -2.7915 -2.7915 -2.6356 -2.6356 -2.4994 -2.4994 3.5646 3.5646 3.6153 3.6153 3.8368 3.8368 3.8745 3.8745 3.9034 3.9034 3.9677 3.9677 4.2051 4.2051 4.2781 4.2781 4.3576 4.3576 4.5670 4.5670 4.6091 4.6091 4.6463 4.6463 4.9510 4.9510 5.1701 5.1701 5.3593 5.3593 5.5892 5.5892 5.7324 5.7324 6.2092 6.2092 7.0981 7.0981 7.4061 7.4061 7.5597 7.5597 7.8628 7.8628 11.0015 11.0015 11.8453 11.8453 13.0542 13.0542 13.0617 13.0617 13.5443 13.5443 13.5676 13.5676 13.8576 13.8576 k = 0.2547 0.2547-0.0000 ( 6745 PWs) bands (ev): -18.2387 -18.2387 -18.1362 -18.1362 -14.5642 -14.5642 -14.5342 -14.5342 -5.0151 -5.0151 -4.7696 -4.7696 -3.8136 -3.8136 -3.4789 -3.4789 -2.8723 -2.8723 -2.7820 -2.7820 -2.6298 -2.6298 -2.4935 -2.4935 3.5691 3.5691 3.6254 3.6254 3.8425 3.8425 3.8569 3.8569 3.8853 3.8853 3.9426 3.9426 4.1862 4.1862 4.2626 4.2626 4.3426 4.3426 4.5834 4.5834 4.6081 4.6081 4.6335 4.6335 4.9343 4.9343 5.1945 5.1945 5.3797 5.3797 5.6035 5.6035 5.7435 5.7435 6.2313 6.2313 7.1007 7.1007 7.4573 7.4573 7.5933 7.5933 7.8754 7.8754 10.9766 10.9766 11.8426 11.8426 13.0622 13.0622 13.0755 13.0755 13.4264 13.4264 13.5092 13.5092 13.7526 13.7526 k = 0.2453 0.2453-0.0000 ( 6745 PWs) bands (ev): -18.2458 -18.2458 -18.1373 -18.1373 -14.5603 -14.5603 -14.5281 -14.5281 -5.0149 -5.0149 -4.7639 -4.7639 -3.8269 -3.8269 -3.4784 -3.4784 -2.8606 -2.8606 -2.7720 -2.7720 -2.6257 -2.6257 -2.4879 -2.4879 3.5733 3.5733 3.6347 3.6347 3.8377 3.8377 3.8493 3.8493 3.8666 3.8666 3.9171 3.9171 4.1674 4.1674 4.2476 4.2476 4.3272 4.3272 4.5765 4.5765 4.6012 4.6012 4.6452 4.6452 4.9237 4.9237 5.2207 5.2207 5.4007 5.4007 5.6191 5.6191 5.7561 5.7561 6.2551 6.2551 7.1029 7.1029 7.5083 7.5083 7.6241 7.6241 7.8873 7.8873 10.9510 10.9510 11.8430 11.8430 13.0612 13.0612 13.0982 13.0982 13.3104 13.3104 13.4582 13.4582 13.6479 13.6479 k = 0.2358 0.2358-0.0000 ( 6741 PWs) bands (ev): -18.2529 -18.2529 -18.1383 -18.1383 -14.5564 -14.5564 -14.5221 -14.5221 -5.0140 -5.0140 -4.7584 -4.7584 -3.8389 -3.8389 -3.4778 -3.4778 -2.8498 -2.8498 -2.7616 -2.7616 -2.6233 -2.6233 -2.4826 -2.4826 3.5772 3.5772 3.6429 3.6429 3.8196 3.8196 3.8456 3.8456 3.8560 3.8560 3.8919 3.8919 4.1492 4.1492 4.2334 4.2334 4.3118 4.3118 4.5609 4.5609 4.5807 4.5807 4.6748 4.6748 4.9191 4.9191 5.2478 5.2478 5.4227 5.4227 5.6358 5.6358 5.7704 5.7704 6.2806 6.2806 7.1047 7.1047 7.5592 7.5592 7.6520 7.6520 7.8987 7.8987 10.9242 10.9242 11.8468 11.8468 13.0410 13.0410 13.1257 13.1257 13.2165 13.2165 13.4091 13.4091 13.5439 13.5439 k = 0.2264 0.2264-0.0000 ( 6737 PWs) bands (ev): -18.2599 -18.2599 -18.1394 -18.1394 -14.5525 -14.5525 -14.5160 -14.5160 -5.0126 -5.0126 -4.7531 -4.7531 -3.8498 -3.8498 -3.4770 -3.4770 -2.8402 -2.8402 -2.7507 -2.7507 -2.6225 -2.6225 -2.4776 -2.4776 3.5806 3.5806 3.6496 3.6496 3.8007 3.8007 3.8256 3.8256 3.8603 3.8603 3.8680 3.8680 4.1316 4.1316 4.2203 4.2203 4.2968 4.2968 4.5341 4.5341 4.5663 4.5663 4.7055 4.7055 4.9196 4.9196 5.2746 5.2746 5.4463 5.4463 5.6533 5.6533 5.7861 5.7861 6.3077 6.3077 7.1061 7.1061 7.6097 7.6097 7.6768 7.6768 7.9102 7.9102 10.8959 10.8959 11.8543 11.8543 12.9753 12.9753 13.1576 13.1576 13.1713 13.1713 13.3624 13.3624 13.4416 13.4416 k = 0.2170 0.2170-0.0000 ( 6739 PWs) bands (ev): -18.2668 -18.2668 -18.1404 -18.1404 -14.5487 -14.5487 -14.5100 -14.5100 -5.0105 -5.0105 -4.7482 -4.7482 -3.8594 -3.8594 -3.4762 -3.4762 -2.8318 -2.8318 -2.7391 -2.7391 -2.6230 -2.6230 -2.4727 -2.4727 3.5834 3.5834 3.6545 3.6545 3.7808 3.7808 3.8047 3.8047 3.8451 3.8451 3.8652 3.8652 4.1147 4.1147 4.2083 4.2083 4.2829 4.2829 4.5012 4.5012 4.5561 4.5561 4.7351 4.7351 4.9242 4.9242 5.3000 5.3000 5.4721 5.4721 5.6713 5.6713 5.8034 5.8034 6.3363 6.3363 7.1072 7.1072 7.6596 7.6596 7.6987 7.6987 7.9220 7.9220 10.8655 10.8655 11.8655 11.8655 12.8748 12.8748 13.1624 13.1624 13.1931 13.1931 13.3190 13.3190 13.3432 13.3432 k = 0.2075 0.2075-0.0000 ( 6735 PWs) bands (ev): -18.2737 -18.2737 -18.1415 -18.1415 -14.5450 -14.5450 -14.5040 -14.5040 -5.0078 -5.0078 -4.7436 -4.7436 -3.8678 -3.8678 -3.4754 -3.4754 -2.8249 -2.8249 -2.7270 -2.7270 -2.6247 -2.6247 -2.4681 -2.4681 3.5855 3.5855 3.6570 3.6570 3.7598 3.7598 3.7841 3.7841 3.8248 3.8248 3.8684 3.8684 4.0986 4.0986 4.1975 4.1975 4.2705 4.2705 4.4667 4.4667 4.5473 4.5473 4.7629 4.7629 4.9318 4.9318 5.3232 5.3232 5.5009 5.5009 5.6895 5.6895 5.8222 5.8222 6.3665 6.3665 7.1078 7.1078 7.7071 7.7071 7.7194 7.7194 7.9345 7.9345 10.8327 10.8327 11.8805 11.8805 12.7642 12.7642 13.1570 13.1570 13.2248 13.2248 13.2557 13.2557 13.2884 13.2884 k = 0.1981 0.1981-0.0000 ( 6731 PWs) bands (ev): -18.2804 -18.2804 -18.1425 -18.1425 -14.5413 -14.5413 -14.4981 -14.4981 -5.0045 -5.0045 -4.7394 -4.7394 -3.8749 -3.8749 -3.4747 -3.4747 -2.8197 -2.8197 -2.7143 -2.7143 -2.6272 -2.6272 -2.4636 -2.4636 3.5866 3.5866 3.6566 3.6566 3.7381 3.7381 3.7647 3.7647 3.8062 3.8062 3.8702 3.8702 4.0832 4.0832 4.1878 4.1878 4.2604 4.2604 4.4321 4.4321 4.5393 4.5393 4.7882 4.7882 4.9419 4.9419 5.3432 5.3432 5.5327 5.5327 5.7078 5.7078 5.8427 5.8427 6.3982 6.3982 7.1081 7.1081 7.7306 7.7306 7.7603 7.7603 7.9481 7.9481 10.7972 10.7972 11.8989 11.8989 12.6522 12.6522 13.1107 13.1107 13.1888 13.1888 13.2621 13.2621 13.2877 13.2877 k = 0.1887 0.1887-0.0000 ( 6729 PWs) bands (ev): -18.2869 -18.2869 -18.1435 -18.1435 -14.5378 -14.5378 -14.4923 -14.4923 -5.0006 -5.0006 -4.7356 -4.7356 -3.8807 -3.8807 -3.4742 -3.4742 -2.8162 -2.8162 -2.7013 -2.7013 -2.6301 -2.6301 -2.4595 -2.4595 3.5866 3.5866 3.6520 3.6520 3.7174 3.7174 3.7467 3.7467 3.7891 3.7891 3.8703 3.8703 4.0683 4.0683 4.1786 4.1786 4.2535 4.2535 4.3984 4.3984 4.5319 4.5319 4.8111 4.8111 4.9540 4.9540 5.3602 5.3602 5.5672 5.5672 5.7258 5.7258 5.8649 5.8649 6.4312 6.4312 7.1079 7.1079 7.7432 7.7432 7.8083 7.8083 7.9631 7.9631 10.7590 10.7590 11.9202 11.9202 12.5417 12.5417 13.0239 13.0239 13.1604 13.1604 13.2720 13.2720 13.3302 13.3302 k = 0.1792 0.1792-0.0000 ( 6729 PWs) bands (ev): -18.2933 -18.2933 -18.1445 -18.1445 -14.5344 -14.5344 -14.4867 -14.4867 -4.9960 -4.9960 -4.7325 -4.7325 -3.8852 -3.8852 -3.4739 -3.4739 -2.8145 -2.8145 -2.6879 -2.6879 -2.6332 -2.6332 -2.4556 -2.4556 3.5847 3.5847 3.6424 3.6424 3.7001 3.7001 3.7298 3.7298 3.7732 3.7732 3.8687 3.8687 4.0540 4.0540 4.1694 4.1694 4.2501 4.2501 4.3666 4.3666 4.5249 4.5249 4.8313 4.8313 4.9677 4.9677 5.3744 5.3744 5.6033 5.6033 5.7433 5.7433 5.8892 5.8892 6.4655 6.4655 7.1072 7.1072 7.7522 7.7522 7.8558 7.8558 7.9800 7.9800 10.7178 10.7178 11.9438 11.9438 12.4336 12.4336 12.9313 12.9313 13.1322 13.1322 13.2945 13.2945 13.3790 13.3790 k = 0.1698 0.1698-0.0000 ( 6723 PWs) bands (ev): -18.2994 -18.2994 -18.1455 -18.1455 -14.5310 -14.5310 -14.4812 -14.4812 -4.9909 -4.9909 -4.7299 -4.7299 -3.8883 -3.8883 -3.4740 -3.4740 -2.8147 -2.8147 -2.6744 -2.6744 -2.6361 -2.6361 -2.4520 -2.4520 3.5798 3.5798 3.6290 3.6290 3.6870 3.6870 3.7139 3.7139 3.7583 3.7583 3.8657 3.8657 4.0401 4.0401 4.1600 4.1600 4.2501 4.2501 4.3372 4.3372 4.5184 4.5184 4.8490 4.8490 4.9824 4.9824 5.3864 5.3864 5.6400 5.6400 5.7604 5.7604 5.9160 5.9160 6.5009 6.5009 7.1060 7.1060 7.7581 7.7581 7.9023 7.9023 7.9989 7.9989 10.6737 10.6737 11.9686 11.9686 12.3287 12.3287 12.8393 12.8393 13.1065 13.1065 13.3252 13.3252 13.4299 13.4299 k = 0.1604 0.1604-0.0000 ( 6715 PWs) bands (ev): -18.3054 -18.3054 -18.1465 -18.1465 -14.5278 -14.5278 -14.4759 -14.4759 -4.9852 -4.9852 -4.7279 -4.7279 -3.8902 -3.8902 -3.4745 -3.4745 -2.8167 -2.8167 -2.6613 -2.6613 -2.6382 -2.6382 -2.4488 -2.4488 3.5694 3.5694 3.6163 3.6163 3.6763 3.6763 3.6987 3.6987 3.7443 3.7443 3.8614 3.8614 4.0266 4.0266 4.1503 4.1503 4.2517 4.2517 4.3123 4.3123 4.5123 4.5123 4.8644 4.8644 4.9979 4.9979 5.3965 5.3965 5.6757 5.6757 5.7770 5.7770 5.9455 5.9455 6.5371 6.5371 7.1042 7.1042 7.7611 7.7611 7.9474 7.9474 8.0203 8.0203 10.6268 10.6268 11.9934 11.9934 12.2275 12.2275 12.7494 12.7494 13.0861 13.0861 13.3616 13.3616 13.4814 13.4814 k = 0.1509 0.1509-0.0000 ( 6719 PWs) bands (ev): -18.3111 -18.3111 -18.1474 -18.1474 -14.5248 -14.5248 -14.4707 -14.4707 -4.9789 -4.9789 -4.7267 -4.7267 -3.8907 -3.8907 -3.4753 -3.4753 -2.8204 -2.8204 -2.6507 -2.6507 -2.6374 -2.6374 -2.4459 -2.4459 3.5525 3.5525 3.6077 3.6077 3.6661 3.6661 3.6843 3.6843 3.7312 3.7312 3.8565 3.8565 4.0134 4.0134 4.1404 4.1404 4.2493 4.2493 4.2966 4.2966 4.5065 4.5065 4.8778 4.8778 5.0137 5.0137 5.4052 5.4052 5.7090 5.7090 5.7930 5.7930 5.9781 5.9781 6.5740 6.5740 7.1018 7.1018 7.7615 7.7615 7.9906 7.9906 8.0447 8.0447 10.5774 10.5774 12.0161 12.0161 12.1309 12.1309 12.6622 12.6622 13.0729 13.0729 13.4029 13.4029 13.5316 13.5316 k = 0.1415 0.1415-0.0000 ( 6713 PWs) bands (ev): -18.3166 -18.3166 -18.1482 -18.1482 -14.5218 -14.5218 -14.4658 -14.4658 -4.9721 -4.9721 -4.7261 -4.7261 -3.8900 -3.8900 -3.4767 -3.4767 -2.8256 -2.8256 -2.6473 -2.6473 -2.6288 -2.6288 -2.4434 -2.4434 3.5315 3.5315 3.6024 3.6024 3.6552 3.6552 3.6707 3.6707 3.7191 3.7191 3.8513 3.8513 4.0006 4.0006 4.1306 4.1306 4.2366 4.2366 4.2959 4.2959 4.5012 4.5012 4.8896 4.8896 5.0295 5.0295 5.4128 5.4128 5.7390 5.7390 5.8088 5.8088 6.0140 6.0140 6.6113 6.6113 7.0988 7.0988 7.7593 7.7593 8.0311 8.0311 8.0727 8.0727 10.5257 10.5257 12.0223 12.0223 12.0522 12.0522 12.5780 12.5780 13.0686 13.0686 13.4486 13.4486 13.5780 13.5780 k = 0.1321 0.1321-0.0000 ( 6729 PWs) bands (ev): -18.3218 -18.3218 -18.1491 -18.1491 -14.5191 -14.5191 -14.4611 -14.4611 -4.9649 -4.9649 -4.7264 -4.7264 -3.8881 -3.8881 -3.4786 -3.4786 -2.8322 -2.8322 -2.6474 -2.6474 -2.6164 -2.6164 -2.4413 -2.4413 3.5090 3.5090 3.5986 3.5986 3.6432 3.6432 3.6577 3.6577 3.7079 3.7079 3.8462 3.8462 3.9883 3.9883 4.1210 4.1210 4.2180 4.2180 4.3050 4.3050 4.4962 4.4962 4.8999 4.8999 5.0449 5.0449 5.4195 5.4195 5.7644 5.7644 5.8247 5.8247 6.0529 6.0529 6.6487 6.6487 7.0950 7.0950 7.7550 7.7550 8.0682 8.0682 8.1046 8.1046 10.4721 10.4721 11.9445 11.9445 12.0578 12.0578 12.4973 12.4973 13.0745 13.0745 13.4986 13.4986 13.6177 13.6177 k = 0.1226 0.1226-0.0000 ( 6729 PWs) bands (ev): -18.3267 -18.3267 -18.1499 -18.1499 -14.5165 -14.5165 -14.4566 -14.4566 -4.9571 -4.9571 -4.7274 -4.7274 -3.8850 -3.8850 -3.4810 -3.4810 -2.8398 -2.8398 -2.6479 -2.6479 -2.6034 -2.6034 -2.4396 -2.4396 3.4864 3.4864 3.5953 3.5953 3.6303 3.6303 3.6455 3.6455 3.6979 3.6979 3.8415 3.8415 3.9765 3.9765 4.1116 4.1116 4.1988 4.1988 4.3178 4.3178 4.4915 4.4915 4.9091 4.9091 5.0598 5.0598 5.4255 5.4255 5.7851 5.7851 5.8411 5.8411 6.0944 6.0944 6.6859 6.6859 7.0906 7.0906 7.7487 7.7487 8.1025 8.1025 8.1397 8.1397 10.4171 10.4171 11.8611 11.8611 12.0685 12.0685 12.4203 12.4203 13.0914 13.0914 13.5529 13.5529 13.6483 13.6483 k = 0.1132 0.1132-0.0000 ( 6725 PWs) bands (ev): -18.3313 -18.3313 -18.1506 -18.1506 -14.5140 -14.5140 -14.4524 -14.4524 -4.9490 -4.9490 -4.7292 -4.7292 -3.8809 -3.8809 -3.4840 -3.4840 -2.8482 -2.8482 -2.6481 -2.6481 -2.5905 -2.5905 -2.4384 -2.4384 3.4645 3.4645 3.5922 3.5922 3.6166 3.6166 3.6340 3.6340 3.6891 3.6891 3.8373 3.8373 3.9655 3.9655 4.1024 4.1024 4.1807 4.1807 4.3322 4.3322 4.4873 4.4873 4.9174 4.9174 5.0741 5.0741 5.4309 5.4309 5.8012 5.8012 5.8578 5.8578 6.1377 6.1377 6.7226 6.7226 7.0854 7.0854 7.7409 7.7409 8.1356 8.1356 8.1759 8.1759 10.3612 10.3612 11.7821 11.7821 12.0741 12.0741 12.3474 12.3474 13.1195 13.1195 13.6112 13.6112 13.6694 13.6694 k = 0.1038 0.1038-0.0000 ( 6729 PWs) bands (ev): -18.3356 -18.3356 -18.1513 -18.1513 -14.5118 -14.5118 -14.4484 -14.4484 -4.9405 -4.9405 -4.7318 -4.7318 -3.8758 -3.8758 -3.4875 -3.4875 -2.8571 -2.8571 -2.6481 -2.6481 -2.5779 -2.5779 -2.4376 -2.4376 3.4436 3.4436 3.5887 3.5887 3.6028 3.6028 3.6233 3.6233 3.6813 3.6813 3.8335 3.8335 3.9552 3.9552 4.0933 4.0933 4.1641 4.1641 4.3471 4.3471 4.4836 4.4836 4.9248 4.9248 5.0874 5.0874 5.4359 5.4359 5.8134 5.8134 5.8744 5.8744 6.1821 6.1821 6.7584 6.7584 7.0795 7.0795 7.7318 7.7318 8.1685 8.1685 8.2115 8.2115 10.3050 10.3050 11.7081 11.7081 12.0743 12.0743 12.2788 12.2788 13.1582 13.1582 13.6724 13.6724 13.6839 13.6839 k = 0.0943 0.0943-0.0000 ( 6729 PWs) bands (ev): -18.3396 -18.3396 -18.1520 -18.1520 -14.5097 -14.5097 -14.4448 -14.4448 -4.9317 -4.9317 -4.7352 -4.7352 -3.8700 -3.8700 -3.4916 -3.4916 -2.8661 -2.8661 -2.6479 -2.6479 -2.5657 -2.5657 -2.4373 -2.4373 3.4241 3.4241 3.5826 3.5826 3.5915 3.5915 3.6135 3.6135 3.6746 3.6746 3.8302 3.8302 3.9459 3.9459 4.0844 4.0844 4.1491 4.1491 4.3619 4.3619 4.4802 4.4802 4.9315 4.9315 5.0997 5.0997 5.4405 5.4405 5.8227 5.8227 5.8904 5.8904 6.2267 6.2267 6.7928 6.7928 7.0730 7.0730 7.7218 7.7218 8.2016 8.2016 8.2457 8.2457 10.2492 10.2492 11.6395 11.6395 12.0697 12.0697 12.2149 12.2149 13.2060 13.2060 13.6895 13.6895 13.7408 13.7408 k = 0.0849 0.0849-0.0000 ( 6721 PWs) bands (ev): -18.3432 -18.3432 -18.1526 -18.1526 -14.5078 -14.5078 -14.4414 -14.4414 -4.9227 -4.9227 -4.7392 -4.7392 -3.8635 -3.8635 -3.4960 -3.4960 -2.8751 -2.8751 -2.6476 -2.6476 -2.5539 -2.5539 -2.4375 -2.4375 3.4061 3.4061 3.5707 3.5707 3.5863 3.5863 3.6045 3.6045 3.6689 3.6689 3.8273 3.8273 3.9376 3.9376 4.0756 4.0756 4.1359 4.1359 4.3761 4.3761 4.4775 4.4775 4.9374 4.9374 5.1111 5.1111 5.4447 5.4447 5.8300 5.8300 5.9051 5.9051 6.2707 6.2707 6.8255 6.8255 7.0660 7.0660 7.7111 7.7111 8.2347 8.2347 8.2780 8.2780 10.1946 10.1946 11.5766 11.5766 12.0612 12.0612 12.1559 12.1559 13.2611 13.2611 13.6936 13.6936 13.8106 13.8106 k = 0.0755 0.0755-0.0000 ( 6715 PWs) bands (ev): -18.3465 -18.3465 -18.1531 -18.1531 -14.5060 -14.5060 -14.4384 -14.4384 -4.9136 -4.9136 -4.7438 -4.7438 -3.8565 -3.8565 -3.5008 -3.5008 -2.8837 -2.8837 -2.6471 -2.6471 -2.5428 -2.5428 -2.4382 -2.4382 3.3897 3.3897 3.5575 3.5575 3.5831 3.5831 3.5964 3.5964 3.6642 3.6642 3.8246 3.8246 3.9304 3.9304 4.0671 4.0671 4.1244 4.1244 4.3892 4.3892 4.4753 4.4753 4.9428 4.9428 5.1214 5.1214 5.4485 5.4485 5.8356 5.8356 5.9186 5.9186 6.3132 6.3132 6.8559 6.8559 7.0588 7.0588 7.7002 7.7002 8.2674 8.2674 8.3079 8.3079 10.1419 10.1419 11.5195 11.5195 12.0500 12.0500 12.1022 12.1022 13.3210 13.3210 13.6952 13.6952 13.8835 13.8835 k = 0.0660 0.0660-0.0000 ( 6721 PWs) bands (ev): -18.3494 -18.3494 -18.1536 -18.1536 -14.5045 -14.5045 -14.4357 -14.4357 -4.9045 -4.9045 -4.7490 -4.7490 -3.8494 -3.8494 -3.5058 -3.5058 -2.8917 -2.8917 -2.6466 -2.6466 -2.5322 -2.5322 -2.4393 -2.4393 3.3751 3.3751 3.5448 3.5448 3.5805 3.5805 3.5892 3.5892 3.6603 3.6603 3.8221 3.8221 3.9244 3.9244 4.0589 4.0589 4.1144 4.1144 4.4009 4.4009 4.4738 4.4738 4.9475 4.9475 5.1305 5.1305 5.4520 5.4520 5.8400 5.8400 5.9305 5.9305 6.3536 6.3536 6.8834 6.8834 7.0516 7.0516 7.6893 7.6893 8.2991 8.2991 8.3350 8.3350 10.0920 10.0920 11.4686 11.4686 12.0371 12.0371 12.0542 12.0542 13.3829 13.3829 13.6954 13.6954 13.9580 13.9580 k = 0.0566 0.0566-0.0000 ( 6721 PWs) bands (ev): -18.3520 -18.3520 -18.1540 -18.1540 -14.5032 -14.5032 -14.4333 -14.4333 -4.8955 -4.8955 -4.7546 -4.7546 -3.8424 -3.8424 -3.5108 -3.5108 -2.8991 -2.8991 -2.6461 -2.6461 -2.5223 -2.5223 -2.4410 -2.4410 3.3623 3.3623 3.5333 3.5333 3.5781 3.5781 3.5830 3.5830 3.6571 3.6571 3.8199 3.8199 3.9194 3.9194 4.0511 4.0511 4.1060 4.1060 4.4109 4.4109 4.4731 4.4731 4.9515 4.9515 5.1384 5.1384 5.4551 5.4551 5.8433 5.8433 5.9408 5.9408 6.3911 6.3911 6.9072 6.9072 7.0451 7.0451 7.6789 7.6789 8.3291 8.3291 8.3591 8.3591 10.0458 10.0458 11.4240 11.4240 12.0106 12.0106 12.0251 12.0251 13.4437 13.4437 13.6947 13.6947 14.0298 14.0298 k = 0.0472 0.0472-0.0000 ( 6719 PWs) bands (ev): -18.3542 -18.3542 -18.1544 -18.1544 -14.5020 -14.5020 -14.4313 -14.4313 -4.8868 -4.8868 -4.7604 -4.7604 -3.8356 -3.8356 -3.5157 -3.5157 -2.9056 -2.9056 -2.6457 -2.6457 -2.5131 -2.5131 -2.4430 -2.4430 3.3513 3.3513 3.5231 3.5231 3.5759 3.5759 3.5778 3.5778 3.6546 3.6546 3.8179 3.8179 3.9156 3.9156 4.0441 4.0441 4.0991 4.0991 4.4189 4.4189 4.4732 4.4732 4.9550 4.9550 5.1453 5.1453 5.4578 5.4578 5.8459 5.8459 5.9497 5.9497 6.4249 6.4249 6.9265 6.9265 7.0400 7.0400 7.6692 7.6692 8.3566 8.3566 8.3801 8.3801 10.0043 10.0043 11.3859 11.3859 11.9745 11.9745 12.0121 12.0121 13.5001 13.5001 13.6935 13.6935 14.0467 14.0467 k = 0.0377 0.0377-0.0000 ( 6717 PWs) bands (ev): -18.3559 -18.3559 -18.1547 -18.1547 -14.5011 -14.5011 -14.4296 -14.4296 -4.8786 -4.8786 -4.7662 -4.7662 -3.8295 -3.8295 -3.5201 -3.5201 -2.9110 -2.9110 -2.6453 -2.6453 -2.5048 -2.5048 -2.4455 -2.4455 3.3423 3.3423 3.5145 3.5145 3.5728 3.5728 3.5748 3.5748 3.6527 3.6527 3.8161 3.8161 3.9126 3.9126 4.0381 4.0381 4.0934 4.0934 4.4249 4.4249 4.4741 4.4741 4.9579 4.9579 5.1509 5.1509 5.4600 5.4600 5.8478 5.8478 5.9571 5.9571 6.4543 6.4543 6.9405 6.9405 7.0372 7.0372 7.6606 7.6606 8.3807 8.3807 8.3975 8.3975 9.9685 9.9685 11.3545 11.3545 11.9444 11.9444 12.0007 12.0007 13.5490 13.5490 13.6922 13.6922 14.0516 14.0516 k = 0.0283 0.0283-0.0000 ( 6717 PWs) bands (ev): -18.3573 -18.3573 -18.1549 -18.1549 -14.5004 -14.5004 -14.4283 -14.4283 -4.8713 -4.8713 -4.7716 -4.7716 -3.8244 -3.8244 -3.5239 -3.5239 -2.9154 -2.9154 -2.6449 -2.6449 -2.4976 -2.4976 -2.4481 -2.4481 3.3353 3.3353 3.5077 3.5077 3.5695 3.5695 3.5732 3.5732 3.6514 3.6514 3.8147 3.8147 3.9106 3.9106 4.0332 4.0332 4.0891 4.0891 4.4290 4.4290 4.4754 4.4754 4.9601 4.9601 5.1552 5.1552 5.4618 5.4618 5.8492 5.8492 5.9627 5.9627 6.4784 6.4784 6.9490 6.9490 7.0369 7.0369 7.6535 7.6535 8.4006 8.4006 8.4114 8.4114 9.9394 9.9394 11.3300 11.3300 11.9207 11.9207 11.9913 11.9913 13.5882 13.5882 13.6909 13.6909 14.0553 14.0553 k = 0.0189 0.0189-0.0000 ( 6697 PWs) bands (ev): -18.3583 -18.3583 -18.1551 -18.1551 -14.4999 -14.4999 -14.4274 -14.4274 -4.8655 -4.8655 -4.7762 -4.7762 -3.8205 -3.8205 -3.5269 -3.5269 -2.9185 -2.9185 -2.6447 -2.6447 -2.4916 -2.4916 -2.4508 -2.4508 3.3303 3.3303 3.5028 3.5028 3.5671 3.5671 3.5722 3.5722 3.6504 3.6504 3.8137 3.8137 3.9093 3.9093 4.0296 4.0296 4.0861 4.0861 4.4316 4.4316 4.4768 4.4768 4.9617 4.9617 5.1583 5.1583 5.4631 5.4631 5.8501 5.8501 5.9668 5.9668 6.4965 6.4965 6.9531 6.9531 7.0384 7.0384 7.6482 7.6482 8.4154 8.4154 8.4216 8.4216 9.9179 9.9179 11.3123 11.3123 11.9037 11.9037 11.9842 11.9842 13.6163 13.6163 13.6899 13.6899 14.0578 14.0578 k = 0.0094 0.0094-0.0000 ( 6699 PWs) bands (ev): -18.3589 -18.3589 -18.1552 -18.1552 -14.4996 -14.4996 -14.4268 -14.4268 -4.8616 -4.8616 -4.7793 -4.7793 -3.8180 -3.8180 -3.5287 -3.5287 -2.9204 -2.9204 -2.6445 -2.6445 -2.4876 -2.4876 -2.4528 -2.4528 3.3272 3.3272 3.4998 3.4998 3.5656 3.5656 3.5716 3.5716 3.6499 3.6499 3.8131 3.8131 3.9085 3.9085 4.0274 4.0274 4.0843 4.0843 4.4330 4.4330 4.4779 4.4779 4.9626 4.9626 5.1602 5.1602 5.4638 5.4638 5.8506 5.8506 5.9692 5.9692 6.5077 6.5077 6.9545 6.9545 7.0402 7.0402 7.6449 7.6449 8.4241 8.4241 8.4281 8.4281 9.9046 9.9046 11.3017 11.3017 11.8934 11.8934 11.9798 11.9798 13.6331 13.6331 13.6892 13.6892 14.0593 14.0593 k = 0.0000 0.0000 0.0000 ( 6707 PWs) bands (ev): -18.3591 -18.3591 -18.1552 -18.1552 -14.4995 -14.4995 -14.4267 -14.4267 -4.8602 -4.8602 -4.7804 -4.7804 -3.8172 -3.8172 -3.5293 -3.5293 -2.9211 -2.9211 -2.6445 -2.6445 -2.4861 -2.4861 -2.4536 -2.4536 3.3262 3.3262 3.4987 3.4987 3.5651 3.5651 3.5714 3.5714 3.6497 3.6497 3.8128 3.8128 3.9083 3.9083 4.0266 4.0266 4.0836 4.0836 4.4334 4.4334 4.4782 4.4782 4.9629 4.9629 5.1608 5.1608 5.4641 5.4641 5.8508 5.8508 5.9699 5.9699 6.5114 6.5114 6.9548 6.9548 7.0409 7.0409 7.6438 7.6438 8.4269 8.4269 8.4305 8.4305 9.9002 9.9002 11.2982 11.2982 11.8899 11.8899 11.9783 11.9783 13.6387 13.6387 13.6889 13.6889 14.0598 14.0598 k = 0.0000 0.0000 0.0000 ( 6707 PWs) bands (ev): -18.3591 -18.3591 -18.1552 -18.1552 -14.4995 -14.4995 -14.4267 -14.4267 -4.8602 -4.8602 -4.7804 -4.7804 -3.8172 -3.8172 -3.5293 -3.5293 -2.9211 -2.9211 -2.6445 -2.6445 -2.4861 -2.4861 -2.4536 -2.4536 3.3262 3.3262 3.4987 3.4987 3.5651 3.5651 3.5714 3.5714 3.6497 3.6497 3.8128 3.8128 3.9083 3.9083 4.0266 4.0266 4.0836 4.0836 4.4334 4.4334 4.4782 4.4782 4.9629 4.9629 5.1608 5.1608 5.4641 5.4641 5.8508 5.8508 5.9699 5.9699 6.5114 6.5114 6.9548 6.9548 7.0409 7.0409 7.6438 7.6438 8.4269 8.4269 8.4305 8.4305 9.9002 9.9002 11.2982 11.2982 11.8899 11.8899 11.9783 11.9783 13.6387 13.6387 13.6889 13.6889 14.0598 14.0598 k = 0.0000 0.0000 0.0134 ( 6699 PWs) bands (ev): -18.3591 -18.3591 -18.1552 -18.1552 -14.4995 -14.4995 -14.4267 -14.4267 -4.8601 -4.8601 -4.7806 -4.7806 -3.8169 -3.8169 -3.5295 -3.5295 -2.9211 -2.9211 -2.6444 -2.6444 -2.4860 -2.4860 -2.4537 -2.4537 3.3246 3.3246 3.5007 3.5007 3.5650 3.5650 3.5709 3.5709 3.6482 3.6482 3.8149 3.8149 3.9091 3.9091 4.0267 4.0267 4.0831 4.0831 4.4329 4.4329 4.4777 4.4777 4.9631 4.9631 5.1610 5.1610 5.4642 5.4642 5.8511 5.8511 5.9700 5.9700 6.5114 6.5114 6.9549 6.9549 7.0410 7.0410 7.6428 7.6428 8.4268 8.4268 8.4304 8.4304 9.9034 9.9034 11.2976 11.2976 11.8895 11.8895 11.9777 11.9777 13.6247 13.6247 13.6976 13.6976 14.0594 14.0594 k = 0.0000 0.0000 0.0268 ( 6699 PWs) bands (ev): -18.3591 -18.3591 -18.1552 -18.1552 -14.4995 -14.4995 -14.4267 -14.4267 -4.8597 -4.8597 -4.7813 -4.7813 -3.8160 -3.8160 -3.5300 -3.5300 -2.9211 -2.9211 -2.6444 -2.6444 -2.4859 -2.4859 -2.4539 -2.4539 3.3200 3.3200 3.5061 3.5061 3.5646 3.5646 3.5698 3.5698 3.6440 3.6440 3.8207 3.8207 3.9115 3.9115 4.0267 4.0267 4.0816 4.0816 4.4312 4.4312 4.4762 4.4762 4.9636 4.9636 5.1613 5.1613 5.4645 5.4645 5.8522 5.8522 5.9700 5.9700 6.5113 6.5113 6.9552 6.9552 7.0412 7.0412 7.6399 7.6399 8.4263 8.4263 8.4299 8.4299 9.9131 9.9131 11.2959 11.2959 11.8882 11.8882 11.9756 11.9756 13.5948 13.5948 13.7118 13.7118 14.0581 14.0581 k = 0.0000 0.0000 0.0402 ( 6715 PWs) bands (ev): -18.3591 -18.3591 -18.1552 -18.1552 -14.4995 -14.4995 -14.4267 -14.4267 -4.8591 -4.8591 -4.7823 -4.7823 -3.8146 -3.8146 -3.5308 -3.5308 -2.9212 -2.9212 -2.6443 -2.6443 -2.4856 -2.4856 -2.4543 -2.4543 3.3132 3.3132 3.5141 3.5141 3.5638 3.5638 3.5681 3.5681 3.6377 3.6377 3.8295 3.8295 3.9153 3.9153 4.0265 4.0265 4.0792 4.0792 4.4284 4.4284 4.4736 4.4736 4.9644 4.9644 5.1619 5.1619 5.4650 5.4650 5.8540 5.8540 5.9700 5.9700 6.5111 6.5111 6.9556 6.9556 7.0416 7.0416 7.6351 7.6351 8.4256 8.4256 8.4292 8.4292 9.9290 9.9290 11.2930 11.2930 11.8861 11.8861 11.9722 11.9722 13.5577 13.5577 13.7237 13.7237 14.0561 14.0561 k = 0.0000 0.0000 0.0536 ( 6707 PWs) bands (ev): -18.3591 -18.3591 -18.1552 -18.1552 -14.4994 -14.4994 -14.4267 -14.4267 -4.8582 -4.8582 -4.7838 -4.7838 -3.8127 -3.8127 -3.5320 -3.5320 -2.9213 -2.9213 -2.6442 -2.6442 -2.4852 -2.4852 -2.4548 -2.4548 3.3047 3.3047 3.5235 3.5235 3.5627 3.5627 3.5668 3.5668 3.6301 3.6301 3.8408 3.8408 3.9203 3.9203 4.0266 4.0266 4.0761 4.0761 4.4247 4.4247 4.4701 4.4701 4.9656 4.9656 5.1628 5.1628 5.4657 5.4657 5.8564 5.8564 5.9701 5.9701 6.5108 6.5108 6.9563 6.9563 7.0421 7.0421 7.6288 7.6288 8.4246 8.4246 8.4282 8.4282 9.9506 9.9506 11.2892 11.2892 11.8833 11.8833 11.9672 11.9672 13.5159 13.5159 13.7319 13.7319 14.0533 14.0533 k = 0.0000 0.0000 0.0670 ( 6727 PWs) bands (ev): -18.3591 -18.3591 -18.1552 -18.1552 -14.4994 -14.4994 -14.4267 -14.4267 -4.8571 -4.8571 -4.7856 -4.7856 -3.8103 -3.8103 -3.5334 -3.5334 -2.9214 -2.9214 -2.6440 -2.6440 -2.4847 -2.4847 -2.4555 -2.4555 3.2953 3.2953 3.5320 3.5320 3.5612 3.5612 3.5675 3.5675 3.6219 3.6219 3.8536 3.8536 3.9260 3.9260 4.0265 4.0265 4.0723 4.0723 4.4200 4.4200 4.4657 4.4657 4.9669 4.9669 5.1637 5.1637 5.4667 5.4667 5.8593 5.8593 5.9702 5.9702 6.5104 6.5104 6.9570 6.9570 7.0426 7.0426 7.6211 7.6211 8.4234 8.4234 8.4270 8.4270 9.9775 9.9775 11.2846 11.2846 11.8800 11.8800 11.9604 11.9604 13.4709 13.4709 13.7367 13.7367 14.0501 14.0501 k = 0.0000 0.0000 0.0804 ( 6719 PWs) bands (ev): -18.3591 -18.3591 -18.1553 -18.1553 -14.4994 -14.4994 -14.4267 -14.4267 -4.8558 -4.8558 -4.7878 -4.7878 -3.8075 -3.8075 -3.5350 -3.5350 -2.9216 -2.9216 -2.6439 -2.6439 -2.4841 -2.4841 -2.4563 -2.4563 3.2854 3.2854 3.5365 3.5365 3.5593 3.5593 3.5730 3.5730 3.6139 3.6139 3.8675 3.8675 3.9323 3.9323 4.0265 4.0265 4.0682 4.0682 4.4145 4.4145 4.4606 4.4606 4.9684 4.9684 5.1648 5.1648 5.4679 5.4679 5.8627 5.8627 5.9702 5.9702 6.5101 6.5101 6.9579 6.9579 7.0433 7.0433 7.6124 7.6124 8.4220 8.4220 8.4256 8.4256 10.0089 10.0089 11.2791 11.2791 11.8762 11.8762 11.9518 11.9518 13.4242 13.4242 13.7383 13.7383 14.0464 14.0464 k = 0.0000 0.0000 0.0938 ( 6711 PWs) bands (ev): -18.3591 -18.3591 -18.1553 -18.1553 -14.4994 -14.4994 -14.4267 -14.4267 -4.8542 -4.8542 -4.7903 -4.7903 -3.8044 -3.8044 -3.5368 -3.5368 -2.9217 -2.9217 -2.6437 -2.6437 -2.4834 -2.4834 -2.4572 -2.4572 3.2756 3.2756 3.5363 3.5363 3.5568 3.5568 3.5836 3.5836 3.6064 3.6064 3.8819 3.8819 3.9383 3.9383 4.0265 4.0265 4.0643 4.0643 4.4083 4.4083 4.4549 4.4549 4.9700 4.9700 5.1660 5.1660 5.4690 5.4690 5.8664 5.8664 5.9703 5.9703 6.5097 6.5097 6.9589 6.9589 7.0440 7.0440 7.6030 7.6030 8.4205 8.4205 8.4242 8.4242 10.0440 10.0440 11.2732 11.2732 11.8723 11.8723 11.9413 11.9413 13.3771 13.3771 13.7373 13.7373 14.0424 14.0424 k = 0.0000 0.0000 0.1073 ( 6712 PWs) bands (ev): -18.3591 -18.3591 -18.1553 -18.1553 -14.4994 -14.4994 -14.4267 -14.4267 -4.8524 -4.8524 -4.7931 -4.7931 -3.8012 -3.8012 -3.5388 -3.5388 -2.9219 -2.9219 -2.6435 -2.6435 -2.4826 -2.4826 -2.4582 -2.4582 3.2661 3.2661 3.5335 3.5335 3.5537 3.5537 3.5970 3.5970 3.5998 3.5998 3.8964 3.8964 3.9437 3.9437 4.0265 4.0265 4.0610 4.0610 4.4016 4.4016 4.4487 4.4487 4.9717 4.9717 5.1672 5.1672 5.4701 5.4701 5.8702 5.8702 5.9703 5.9703 6.5094 6.5094 6.9599 6.9599 7.0448 7.0448 7.5932 7.5932 8.4189 8.4189 8.4226 8.4226 10.0818 10.0818 11.2669 11.2669 11.8682 11.8682 11.9287 11.9287 13.3309 13.3309 13.7343 13.7343 14.0383 14.0383 k = 0.0000 0.0000 0.1207 ( 6708 PWs) bands (ev): -18.3590 -18.3590 -18.1553 -18.1553 -14.4994 -14.4994 -14.4267 -14.4267 -4.8504 -4.8504 -4.7961 -4.7961 -3.7978 -3.7978 -3.5408 -3.5408 -2.9220 -2.9220 -2.6433 -2.6433 -2.4817 -2.4817 -2.4592 -2.4592 3.2571 3.2571 3.5296 3.5296 3.5500 3.5500 3.5943 3.5943 3.6116 3.6116 3.9106 3.9106 3.9476 3.9476 4.0265 4.0265 4.0587 4.0587 4.3945 4.3945 4.4422 4.4422 4.9733 4.9733 5.1684 5.1684 5.4713 5.4713 5.8742 5.8742 5.9704 5.9704 6.5090 6.5090 6.9609 6.9609 7.0455 7.0455 7.5835 7.5835 8.4173 8.4173 8.4211 8.4211 10.1213 10.1213 11.2604 11.2604 11.8642 11.8642 11.9142 11.9142 13.2869 13.2869 13.7298 13.7298 14.0343 14.0343 k = 0.0000 0.0000 0.1341 ( 6696 PWs) bands (ev): -18.3590 -18.3590 -18.1553 -18.1553 -14.4994 -14.4994 -14.4267 -14.4267 -4.8482 -4.8482 -4.7993 -4.7993 -3.7944 -3.7944 -3.5429 -3.5429 -2.9222 -2.9222 -2.6431 -2.6431 -2.4808 -2.4808 -2.4604 -2.4604 3.2489 3.2489 3.5255 3.5255 3.5460 3.5460 3.5900 3.5900 3.6264 3.6264 3.9242 3.9242 3.9497 3.9497 4.0265 4.0265 4.0579 4.0579 4.3873 4.3873 4.4356 4.4356 4.9751 4.9751 5.1697 5.1697 5.4725 5.4725 5.8781 5.8781 5.9705 5.9705 6.5086 6.5086 6.9620 6.9620 7.0463 7.0463 7.5741 7.5741 8.4157 8.4157 8.4195 8.4195 10.1613 10.1613 11.2541 11.2541 11.8604 11.8604 11.8981 11.8981 13.2463 13.2463 13.7243 13.7243 14.0304 14.0304 k = 0.0000 0.0000 0.1475 ( 6700 PWs) bands (ev): -18.3590 -18.3590 -18.1554 -18.1554 -14.4994 -14.4994 -14.4267 -14.4267 -4.8458 -4.8458 -4.8026 -4.8026 -3.7911 -3.7911 -3.5449 -3.5449 -2.9224 -2.9224 -2.6429 -2.6429 -2.4798 -2.4798 -2.4616 -2.4616 3.2415 3.2415 3.5215 3.5215 3.5418 3.5418 3.5866 3.5866 3.6407 3.6407 3.9369 3.9369 3.9498 3.9498 4.0264 4.0264 4.0586 4.0586 4.3802 4.3802 4.4292 4.4292 4.9766 4.9766 5.1709 5.1709 5.4736 5.4736 5.8818 5.8818 5.9705 5.9705 6.5082 6.5082 6.9630 6.9630 7.0471 7.0471 7.5653 7.5653 8.4142 8.4142 8.4180 8.4180 10.2004 10.2004 11.2480 11.2480 11.8570 11.8570 11.8809 11.8809 13.2099 13.2099 13.7183 13.7183 14.0267 14.0267 k = 0.0000 0.0000 0.1609 ( 6700 PWs) bands (ev): -18.3590 -18.3590 -18.1554 -18.1554 -14.4994 -14.4994 -14.4267 -14.4267 -4.8433 -4.8433 -4.8060 -4.8060 -3.7881 -3.7881 -3.5468 -3.5468 -2.9225 -2.9225 -2.6427 -2.6427 -2.4787 -2.4787 -2.4628 -2.4628 3.2350 3.2350 3.5178 3.5178 3.5377 3.5377 3.5841 3.5841 3.6541 3.6541 3.9481 3.9481 3.9483 3.9483 4.0264 4.0264 4.0608 4.0608 4.3735 4.3735 4.4232 4.4232 4.9780 4.9780 5.1719 5.1719 5.4744 5.4744 5.8851 5.8851 5.9706 5.9706 6.5079 6.5079 6.9639 6.9639 7.0478 7.0478 7.5574 7.5574 8.4128 8.4128 8.4167 8.4167 10.2372 10.2372 11.2425 11.2425 11.8539 11.8539 11.8634 11.8634 13.1784 13.1784 13.7122 13.7122 14.0235 14.0235 k = 0.0000 0.0000 0.1743 ( 6700 PWs) bands (ev): -18.3590 -18.3590 -18.1554 -18.1554 -14.4994 -14.4994 -14.4267 -14.4267 -4.8407 -4.8407 -4.8093 -4.8093 -3.7855 -3.7855 -3.5485 -3.5485 -2.9226 -2.9226 -2.6426 -2.6426 -2.4777 -2.4777 -2.4640 -2.4640 3.2296 3.2296 3.5146 3.5146 3.5341 3.5341 3.5823 3.5823 3.6661 3.6661 3.9451 3.9451 3.9581 3.9581 4.0264 4.0264 4.0639 4.0639 4.3674 4.3674 4.4178 4.4178 4.9792 4.9792 5.1728 5.1728 5.4753 5.4753 5.8880 5.8880 5.9706 5.9706 6.5076 6.5076 6.9647 6.9647 7.0483 7.0483 7.5506 7.5506 8.4116 8.4116 8.4155 8.4155 10.2702 10.2702 11.2377 11.2377 11.8466 11.8466 11.8513 11.8513 13.1524 13.1524 13.7066 13.7066 14.0207 14.0207 k = 0.0000 0.0000 0.1877 ( 6720 PWs) bands (ev): -18.3590 -18.3590 -18.1554 -18.1554 -14.4994 -14.4994 -14.4267 -14.4267 -4.8380 -4.8380 -4.8125 -4.8125 -3.7833 -3.7833 -3.5499 -3.5499 -2.9227 -2.9227 -2.6424 -2.6424 -2.4766 -2.4766 -2.4652 -2.4652 3.2254 3.2254 3.5120 3.5120 3.5310 3.5310 3.5809 3.5809 3.6761 3.6761 3.9416 3.9416 3.9660 3.9660 4.0263 4.0263 4.0670 4.0670 4.3622 4.3622 4.4133 4.4133 4.9802 4.9802 5.1736 5.1736 5.4758 5.4758 5.8904 5.8904 5.9706 5.9706 6.5073 6.5073 6.9653 6.9653 7.0488 7.0488 7.5451 7.5451 8.4106 8.4106 8.4145 8.4145 10.2979 10.2979 11.2337 11.2337 11.8318 11.8318 11.8492 11.8492 13.1320 13.1320 13.7018 13.7018 14.0185 14.0185 k = 0.0000 0.0000 0.2011 ( 6720 PWs) bands (ev): -18.3590 -18.3590 -18.1554 -18.1554 -14.4994 -14.4994 -14.4267 -14.4267 -4.8355 -4.8355 -4.8154 -4.8154 -3.7817 -3.7817 -3.5509 -3.5509 -2.9228 -2.9228 -2.6424 -2.6424 -2.4757 -2.4757 -2.4662 -2.4662 3.2223 3.2223 3.5101 3.5101 3.5288 3.5288 3.5801 3.5801 3.6838 3.6838 3.9384 3.9384 3.9719 3.9719 4.0263 4.0263 4.0698 4.0698 4.3583 4.3583 4.4099 4.4099 4.9809 4.9809 5.1741 5.1741 5.4764 5.4764 5.8922 5.8922 5.9706 5.9706 6.5071 6.5071 6.9658 6.9658 7.0491 7.0491 7.5411 7.5411 8.4099 8.4099 8.4138 8.4138 10.3189 10.3189 11.2308 11.2308 11.8200 11.8200 11.8477 11.8477 13.1174 13.1174 13.6982 13.6982 14.0168 14.0168 k = 0.0000 0.0000 0.2145 ( 6716 PWs) bands (ev): -18.3589 -18.3589 -18.1554 -18.1554 -14.4994 -14.4994 -14.4267 -14.4267 -4.8336 -4.8336 -4.8176 -4.8176 -3.7806 -3.7806 -3.5516 -3.5516 -2.9228 -2.9228 -2.6423 -2.6423 -2.4750 -2.4750 -2.4670 -2.4670 3.2204 3.2204 3.5090 3.5090 3.5274 3.5274 3.5796 3.5796 3.6886 3.6886 3.9362 3.9362 3.9757 3.9757 4.0262 4.0262 4.0718 4.0718 4.3558 4.3558 4.4077 4.4077 4.9813 4.9813 5.1744 5.1744 5.4768 5.4768 5.8932 5.8932 5.9706 5.9706 6.5070 6.5070 6.9660 6.9660 7.0494 7.0494 7.5386 7.5386 8.4094 8.4094 8.4134 8.4134 10.3320 10.3320 11.2291 11.2291 11.8125 11.8125 11.8467 11.8467 13.1086 13.1086 13.6958 13.6958 14.0158 14.0158 k = 0.0000 0.0000 0.2279 ( 6720 PWs) bands (ev): -18.3589 -18.3589 -18.1554 -18.1554 -14.4994 -14.4994 -14.4267 -14.4267 -4.8328 -4.8328 -4.8185 -4.8185 -3.7803 -3.7803 -3.5518 -3.5518 -2.9228 -2.9228 -2.6423 -2.6423 -2.4748 -2.4748 -2.4672 -2.4672 3.2198 3.2198 3.5086 3.5086 3.5269 3.5269 3.5794 3.5794 3.6903 3.6903 3.9354 3.9354 3.9770 3.9770 4.0262 4.0262 4.0725 4.0725 4.3550 4.3550 4.4070 4.4070 4.9814 4.9814 5.1745 5.1745 5.4769 5.4769 5.8934 5.8934 5.9706 5.9706 6.5070 6.5070 6.9661 6.9661 7.0494 7.0494 7.5378 7.5378 8.4093 8.4093 8.4133 8.4133 10.3364 10.3364 11.2285 11.2285 11.8099 11.8099 11.8464 11.8464 13.1057 13.1057 13.6951 13.6951 14.0155 14.0155 k = 0.0000 0.0000 0.2279 ( 6720 PWs) bands (ev): -18.3589 -18.3589 -18.1554 -18.1554 -14.4994 -14.4994 -14.4267 -14.4267 -4.8328 -4.8328 -4.8185 -4.8185 -3.7803 -3.7803 -3.5518 -3.5518 -2.9228 -2.9228 -2.6423 -2.6423 -2.4748 -2.4748 -2.4672 -2.4672 3.2198 3.2198 3.5086 3.5086 3.5269 3.5269 3.5794 3.5794 3.6903 3.6903 3.9354 3.9354 3.9770 3.9770 4.0262 4.0262 4.0725 4.0725 4.3550 4.3550 4.4070 4.4070 4.9814 4.9814 5.1745 5.1745 5.4769 5.4769 5.8934 5.8934 5.9706 5.9706 6.5070 6.5070 6.9661 6.9661 7.0494 7.0494 7.5378 7.5378 8.4093 8.4093 8.4133 8.4133 10.3364 10.3364 11.2285 11.2285 11.8099 11.8099 11.8464 11.8464 13.1057 13.1057 13.6951 13.6951 14.0155 14.0155 k = 0.0000 0.0132 0.2279 ( 6716 PWs) bands (ev): -18.3587 -18.3587 -18.1554 -18.1554 -14.4995 -14.4995 -14.4269 -14.4269 -4.8383 -4.8383 -4.8132 -4.8132 -3.7816 -3.7816 -3.5507 -3.5507 -2.9224 -2.9224 -2.6423 -2.6423 -2.4785 -2.4785 -2.4641 -2.4641 3.2212 3.2212 3.5091 3.5091 3.5274 3.5274 3.5798 3.5798 3.6907 3.6907 3.9343 3.9343 3.9772 3.9772 4.0270 4.0270 4.0737 4.0737 4.3550 4.3550 4.4070 4.4070 4.9809 4.9809 5.1737 5.1737 5.4765 5.4765 5.8931 5.8931 5.9698 5.9698 6.5035 6.5035 6.9655 6.9655 7.0490 7.0490 7.5390 7.5390 8.4071 8.4071 8.4118 8.4118 10.3386 10.3386 11.2326 11.2326 11.8133 11.8133 11.8494 11.8494 13.1063 13.1063 13.6831 13.6831 14.0023 14.0023 k = 0.0000 0.0263 0.2279 ( 6716 PWs) bands (ev): -18.3582 -18.3582 -18.1553 -18.1553 -14.4998 -14.4998 -14.4274 -14.4274 -4.8479 -4.8479 -4.8043 -4.8043 -3.7853 -3.7853 -3.5473 -3.5473 -2.9212 -2.9212 -2.6424 -2.6424 -2.4850 -2.4850 -2.4593 -2.4593 3.2251 3.2251 3.5104 3.5104 3.5288 3.5288 3.5811 3.5811 3.6922 3.6922 3.9311 3.9311 3.9776 3.9776 4.0294 4.0294 4.0774 4.0774 4.3549 4.3549 4.4070 4.4070 4.9794 4.9794 5.1712 5.1712 5.4755 5.4755 5.8918 5.8918 5.9674 5.9674 6.4931 6.4931 6.9619 6.9619 7.0494 7.0494 7.5427 7.5427 8.3988 8.3988 8.4088 8.4088 10.3449 10.3449 11.2451 11.2451 11.8220 11.8220 11.8598 11.8598 13.1083 13.1083 13.6483 13.6483 13.9676 13.9676 k = 0.0000 0.0395 0.2279 ( 6716 PWs) bands (ev): -18.3572 -18.3572 -18.1551 -18.1551 -14.5003 -14.5003 -14.4283 -14.4283 -4.8583 -4.8583 -4.7951 -4.7951 -3.7911 -3.7911 -3.5421 -3.5421 -2.9191 -2.9191 -2.6425 -2.6425 -2.4924 -2.4924 -2.4548 -2.4548 3.2316 3.2316 3.5128 3.5128 3.5311 3.5311 3.5833 3.5833 3.6946 3.6946 3.9266 3.9266 3.9777 3.9777 4.0335 4.0335 4.0833 4.0833 4.3545 4.3545 4.4072 4.4072 4.9769 4.9769 5.1670 5.1670 5.4736 5.4736 5.8897 5.8897 5.9633 5.9633 6.4766 6.4766 6.9509 6.9509 7.0544 7.0544 7.5488 7.5488 8.3845 8.3845 8.4047 8.4047 10.3553 10.3553 11.2660 11.2660 11.8324 11.8324 11.8807 11.8807 13.1115 13.1115 13.5934 13.5934 13.9204 13.9204 k = 0.0000 0.0526 0.2279 ( 6724 PWs) bands (ev): -18.3558 -18.3558 -18.1549 -18.1549 -14.5010 -14.5010 -14.4296 -14.4296 -4.8688 -4.8688 -4.7862 -4.7862 -3.7987 -3.7987 -3.5353 -3.5353 -2.9162 -2.9162 -2.6427 -2.6427 -2.5003 -2.5003 -2.4507 -2.4507 3.2407 3.2407 3.5160 3.5160 3.5344 3.5344 3.5862 3.5862 3.6980 3.6980 3.9211 3.9211 3.9773 3.9773 4.0396 4.0396 4.0910 4.0910 4.3537 4.3537 4.4078 4.4078 4.9733 4.9733 5.1613 5.1613 5.4710 5.4710 5.8867 5.8867 5.9576 5.9576 6.4550 6.4550 6.9300 6.9300 7.0661 7.0661 7.5571 7.5571 8.3648 8.3648 8.3993 8.3993 10.3692 10.3692 11.2950 11.2950 11.8428 11.8428 11.9131 11.9131 13.1160 13.1160 13.5222 13.5222 13.8671 13.8671 k = 0.0000 0.0658 0.2279 ( 6718 PWs) bands (ev): -18.3541 -18.3541 -18.1546 -18.1546 -14.5019 -14.5019 -14.4312 -14.4312 -4.8793 -4.8793 -4.7777 -4.7777 -3.8076 -3.8076 -3.5274 -3.5274 -2.9125 -2.9125 -2.6432 -2.6432 -2.5087 -2.5087 -2.4472 -2.4472 3.2523 3.2523 3.5202 3.5202 3.5386 3.5386 3.5900 3.5900 3.7024 3.7024 3.9151 3.9151 3.9765 3.9765 4.0473 4.0473 4.1003 4.1003 4.3521 4.3521 4.4090 4.4090 4.9688 4.9688 5.1540 5.1540 5.4676 5.4676 5.8829 5.8829 5.9502 5.9502 6.4293 6.4293 6.8995 6.8995 7.0836 7.0836 7.5675 7.5675 8.3406 8.3406 8.3924 8.3924 10.3863 10.3863 11.3320 11.3320 11.8537 11.8537 11.9558 11.9558 13.1217 13.1217 13.4391 13.4391 13.8115 13.8115 k = 0.0000 0.0789 0.2279 ( 6722 PWs) bands (ev): -18.3520 -18.3520 -18.1543 -18.1543 -14.5030 -14.5030 -14.4331 -14.4331 -4.8898 -4.8898 -4.7697 -4.7697 -3.8174 -3.8174 -3.5188 -3.5188 -2.9080 -2.9080 -2.6439 -2.6439 -2.5173 -2.5173 -2.4441 -2.4441 3.2662 3.2662 3.5253 3.5253 3.5437 3.5437 3.5946 3.5946 3.7077 3.7077 3.9088 3.9088 3.9754 3.9754 4.0565 4.0565 4.1109 4.1109 4.3495 4.3495 4.4110 4.4110 4.9634 4.9634 5.1453 5.1453 5.4633 5.4633 5.8781 5.8781 5.9413 5.9413 6.4002 6.4002 6.8611 6.8611 7.1051 7.1051 7.5799 7.5799 8.3123 8.3123 8.3841 8.3841 10.4061 10.4061 11.3770 11.3770 11.8655 11.8655 12.0069 12.0069 13.1285 13.1285 13.3481 13.3481 13.7554 13.7554 k = 0.0000 0.0921 0.2279 ( 6716 PWs) bands (ev): -18.3496 -18.3496 -18.1539 -18.1539 -14.5042 -14.5042 -14.4354 -14.4354 -4.9002 -4.9002 -4.7624 -4.7624 -3.8277 -3.8277 -3.5099 -3.5099 -2.9027 -2.9027 -2.6451 -2.6451 -2.5260 -2.5260 -2.4414 -2.4414 3.2825 3.2825 3.5313 3.5313 3.5498 3.5498 3.6000 3.6000 3.7140 3.7140 3.9024 3.9024 3.9744 3.9744 4.0669 4.0669 4.1228 4.1228 4.3457 4.3457 4.4140 4.4140 4.9572 4.9572 5.1352 5.1352 5.4580 5.4580 5.8725 5.8725 5.9308 5.9308 6.3688 6.3688 6.8160 6.8160 7.1292 7.1292 7.5941 7.5941 8.2808 8.2808 8.3745 8.3745 10.4280 10.4280 11.4295 11.4295 11.8785 11.8785 12.0645 12.0645 13.1363 13.1363 13.2529 13.2529 13.7003 13.7003 k = 0.0000 0.1053 0.2279 ( 6704 PWs) bands (ev): -18.3467 -18.3467 -18.1536 -18.1536 -14.5056 -14.5056 -14.4379 -14.4379 -4.9103 -4.9103 -4.7559 -4.7559 -3.8382 -3.8382 -3.5009 -3.5009 -2.8967 -2.8967 -2.6469 -2.6469 -2.5345 -2.5345 -2.4391 -2.4391 3.3008 3.3008 3.5382 3.5382 3.5569 3.5569 3.6061 3.6061 3.7213 3.7213 3.8960 3.8960 3.9736 3.9736 4.0783 4.0783 4.1357 4.1357 4.3407 4.3407 4.4179 4.4179 4.9502 4.9502 5.1239 5.1239 5.4516 5.4516 5.8661 5.8661 5.9187 5.9187 6.3354 6.3354 6.7654 6.7654 7.1549 7.1549 7.6098 7.6098 8.2466 8.2466 8.3635 8.3635 10.4516 10.4516 11.4893 11.4893 11.8926 11.8926 12.1265 12.1265 13.1451 13.1451 13.1570 13.1570 13.6470 13.6470 k = 0.0000 0.1184 0.2279 ( 6712 PWs) bands (ev): -18.3436 -18.3436 -18.1531 -18.1531 -14.5072 -14.5072 -14.4408 -14.4408 -4.9202 -4.9202 -4.7501 -4.7501 -3.8487 -3.8487 -3.4921 -3.4921 -2.8901 -2.8901 -2.6495 -2.6495 -2.5428 -2.5428 -2.4371 -2.4371 3.3211 3.3211 3.5461 3.5461 3.5651 3.5651 3.6130 3.6130 3.7295 3.7295 3.8897 3.8897 3.9732 3.9732 4.0905 4.0905 4.1496 4.1496 4.3346 4.3346 4.4226 4.4226 4.9424 4.9424 5.1115 5.1115 5.4440 5.4440 5.8587 5.8587 5.9049 5.9049 6.3006 6.3006 6.7102 6.7102 7.1816 7.1816 7.6268 7.6268 8.2104 8.2104 8.3513 8.3513 10.4766 10.4766 11.5559 11.5559 11.9077 11.9077 12.1895 12.1895 13.0647 13.0647 13.1547 13.1547 13.5962 13.5962 k = 0.0000 0.1316 0.2279 ( 6714 PWs) bands (ev): -18.3401 -18.3401 -18.1527 -18.1527 -14.5090 -14.5090 -14.4440 -14.4440 -4.9298 -4.9298 -4.7452 -4.7452 -3.8587 -3.8587 -3.4837 -3.4837 -2.8829 -2.8829 -2.6531 -2.6531 -2.5504 -2.5504 -2.4353 -2.4353 3.3430 3.3430 3.5548 3.5548 3.5744 3.5744 3.6204 3.6204 3.7387 3.7387 3.8836 3.8836 3.9733 3.9733 4.1033 4.1033 4.1645 4.1645 4.3275 4.3275 4.4279 4.4279 4.9339 4.9339 5.0982 5.0982 5.4352 5.4352 5.8503 5.8503 5.8896 5.8896 6.2648 6.2648 6.6513 6.6513 7.2088 7.2088 7.6448 7.6448 8.1730 8.1730 8.3380 8.3380 10.5027 10.5027 11.6290 11.6290 11.9234 11.9234 12.2486 12.2486 12.9816 12.9816 13.1648 13.1648 13.5484 13.5484 k = 0.0000 0.1447 0.2279 ( 6710 PWs) bands (ev): -18.3363 -18.3363 -18.1523 -18.1523 -14.5108 -14.5108 -14.4474 -14.4474 -4.9389 -4.9389 -4.7412 -4.7412 -3.8683 -3.8683 -3.4760 -3.4760 -2.8751 -2.8751 -2.6579 -2.6579 -2.5571 -2.5571 -2.4338 -2.4338 3.3663 3.3663 3.5643 3.5643 3.5851 3.5851 3.6285 3.6285 3.7486 3.7486 3.8779 3.8779 3.9740 3.9740 4.1167 4.1167 4.1802 4.1802 4.3195 4.3195 4.4336 4.4336 4.9248 4.9248 5.0841 5.0841 5.4251 5.4251 5.8410 5.8410 5.8728 5.8728 6.2282 6.2282 6.5896 6.5896 7.2360 7.2360 7.6637 7.6637 8.1348 8.1348 8.3235 8.3235 10.5296 10.5296 11.7081 11.7081 11.9394 11.9394 12.2954 12.2954 12.9164 12.9164 13.1754 13.1754 13.5040 13.5040 k = 0.0000 0.1579 0.2279 ( 6706 PWs) bands (ev): -18.3322 -18.3322 -18.1518 -18.1518 -14.5128 -14.5128 -14.4510 -14.4510 -4.9477 -4.9477 -4.7383 -4.7383 -3.8771 -3.8771 -3.4690 -3.4690 -2.8668 -2.8668 -2.6640 -2.6640 -2.5627 -2.5627 -2.4323 -2.4323 3.3907 3.3907 3.5745 3.5745 3.5974 3.5974 3.6372 3.6372 3.7594 3.7594 3.8728 3.8728 3.9754 3.9754 4.1304 4.1304 4.1966 4.1966 4.3110 4.3110 4.4395 4.4395 4.9152 4.9152 5.0693 5.0693 5.4135 5.4135 5.8307 5.8307 5.8546 5.8546 6.1912 6.1912 6.5257 6.5257 7.2632 7.2632 7.6831 7.6831 8.0965 8.0965 8.3079 8.3079 10.5570 10.5570 11.7927 11.7927 11.9554 11.9554 12.3180 12.3180 12.8812 12.8812 13.1861 13.1861 13.4633 13.4633 k = 0.0000 0.1711 0.2279 ( 6702 PWs) bands (ev): -18.3279 -18.3279 -18.1514 -18.1514 -14.5149 -14.5149 -14.4549 -14.4549 -4.9560 -4.9560 -4.7364 -4.7364 -3.8850 -3.8850 -3.4629 -3.4629 -2.8582 -2.8582 -2.6714 -2.6714 -2.5672 -2.5672 -2.4309 -2.4309 3.4155 3.4155 3.5852 3.5852 3.6116 3.6116 3.6464 3.6464 3.7709 3.7709 3.8685 3.8685 3.9776 3.9776 4.1442 4.1442 4.2136 4.2136 4.3023 4.3023 4.4453 4.4453 4.9049 4.9049 5.0542 5.0542 5.4006 5.4006 5.8190 5.8190 5.8352 5.8352 6.1538 6.1538 6.4604 6.4604 7.2900 7.2900 7.7026 7.7026 8.0585 8.0585 8.2915 8.2915 10.5849 10.5849 11.8823 11.8823 11.9708 11.9708 12.3070 12.3070 12.8857 12.8857 13.1966 13.1966 13.4267 13.4267 k = 0.0000 0.1842 0.2279 ( 6714 PWs) bands (ev): -18.3232 -18.3232 -18.1511 -18.1511 -14.5171 -14.5171 -14.4589 -14.4589 -4.9637 -4.9637 -4.7355 -4.7355 -3.8919 -3.8919 -3.4579 -3.4579 -2.8494 -2.8494 -2.6800 -2.6800 -2.5705 -2.5705 -2.4296 -2.4296 3.4404 3.4404 3.5964 3.5964 3.6278 3.6278 3.6561 3.6561 3.7830 3.7830 3.8653 3.8653 3.9807 3.9807 4.1579 4.1579 4.2307 4.2307 4.2939 4.2939 4.4508 4.4508 4.8940 4.8940 5.0389 5.0389 5.3861 5.3861 5.8049 5.8049 5.8156 5.8156 6.1162 6.1162 6.3943 6.3943 7.3164 7.3164 7.7221 7.7221 8.0212 8.0212 8.2742 8.2742 10.6130 10.6130 11.9758 11.9758 11.9852 11.9852 12.2653 12.2653 12.9271 12.9271 13.2066 13.2066 13.3945 13.3945 k = 0.0000 0.1974 0.2279 ( 6712 PWs) bands (ev): -18.3183 -18.3183 -18.1508 -18.1508 -14.5193 -14.5193 -14.4632 -14.4632 -4.9709 -4.9709 -4.7358 -4.7358 -3.8976 -3.8976 -3.4539 -3.4539 -2.8405 -2.8405 -2.6895 -2.6895 -2.5726 -2.5726 -2.4282 -2.4282 3.4648 3.4648 3.6080 3.6080 3.6459 3.6459 3.6666 3.6666 3.7955 3.7955 3.8638 3.8638 3.9847 3.9847 4.1709 4.1709 4.2466 4.2466 4.2878 4.2878 4.4559 4.4559 4.8825 4.8825 5.0238 5.0238 5.3703 5.3703 5.7856 5.7856 5.7989 5.7989 6.0786 6.0786 6.3280 6.3280 7.3421 7.3421 7.7411 7.7411 7.9850 7.9850 8.2561 8.2561 10.6413 10.6413 11.9953 11.9953 12.0741 12.0741 12.2061 12.2061 12.9935 12.9935 13.2154 13.2154 13.3672 13.3672 k = 0.0000 0.2105 0.2279 ( 6718 PWs) bands (ev): -18.3132 -18.3132 -18.1505 -18.1505 -14.5217 -14.5217 -14.4675 -14.4675 -4.9775 -4.9775 -4.7373 -4.7373 -3.9021 -3.9021 -3.4512 -3.4512 -2.8316 -2.8316 -2.6996 -2.6996 -2.5737 -2.5737 -2.4267 -2.4267 3.4883 3.4883 3.6199 3.6199 3.6644 3.6644 3.6789 3.6789 3.8082 3.8082 3.8645 3.8645 3.9896 3.9896 4.1823 4.1823 4.2569 4.2569 4.2891 4.2891 4.4603 4.4603 4.8702 4.8702 5.0091 5.0091 5.3529 5.3529 5.7621 5.7621 5.7840 5.7840 6.0411 6.0411 6.2621 6.2621 7.3672 7.3672 7.7594 7.7594 7.9504 7.9504 8.2374 8.2374 10.6696 10.6696 11.9983 11.9983 12.1376 12.1376 12.1814 12.1814 13.0734 13.0734 13.2226 13.2226 13.3456 13.3456 k = 0.0000 0.2237 0.2279 ( 6724 PWs) bands (ev): -18.3079 -18.3079 -18.1503 -18.1503 -14.5240 -14.5240 -14.4720 -14.4720 -4.9835 -4.9835 -4.7398 -4.7398 -3.9053 -3.9053 -3.4498 -3.4498 -2.8230 -2.8230 -2.7101 -2.7101 -2.5739 -2.5739 -2.4252 -2.4252 3.5105 3.5105 3.6322 3.6322 3.6798 3.6798 3.6959 3.6959 3.8212 3.8212 3.8683 3.8683 3.9956 3.9956 4.1904 4.1904 4.2591 4.2591 4.3018 4.3018 4.4638 4.4638 4.8570 4.8570 4.9952 4.9952 5.3343 5.3343 5.7364 5.7364 5.7690 5.7690 6.0036 6.0036 6.1970 6.1970 7.3915 7.3915 7.7766 7.7766 7.9175 7.9175 8.2181 8.2181 10.6979 10.6979 11.9791 11.9791 12.0948 12.0948 12.2834 12.2834 13.1564 13.1564 13.2288 13.2288 13.3319 13.3319 k = 0.0000 0.2368 0.2279 ( 6720 PWs) bands (ev): -18.3024 -18.3024 -18.1503 -18.1503 -14.5264 -14.5264 -14.4766 -14.4766 -4.9888 -4.9888 -4.7434 -4.7434 -3.9072 -3.9072 -3.4498 -3.4498 -2.8147 -2.8147 -2.7207 -2.7207 -2.5732 -2.5732 -2.4236 -2.4236 3.5313 3.5313 3.6447 3.6447 3.6917 3.6917 3.7165 3.7165 3.8353 3.8353 3.8756 3.8756 4.0027 4.0027 4.1932 4.1932 4.2610 4.2610 4.3201 4.3201 4.4665 4.4665 4.8429 4.8429 4.9826 4.9826 5.3145 5.3145 5.7091 5.7091 5.7533 5.7533 5.9664 5.9664 6.1334 6.1334 7.4150 7.4150 7.7922 7.7922 7.8869 7.8869 8.1984 8.1984 10.7261 10.7261 11.9270 11.9270 12.0804 12.0804 12.3909 12.3909 13.2113 13.2113 13.2508 13.2508 13.3356 13.3356 k = 0.0000 0.2500 0.2279 ( 6712 PWs) bands (ev): -18.2967 -18.2967 -18.1503 -18.1503 -14.5288 -14.5288 -14.4812 -14.4812 -4.9934 -4.9934 -4.7482 -4.7482 -3.9076 -3.9076 -3.4511 -3.4511 -2.8070 -2.8070 -2.7312 -2.7312 -2.5716 -2.5716 -2.4220 -2.4220 3.5508 3.5508 3.6575 3.6575 3.7022 3.7022 3.7364 3.7364 3.8522 3.8522 3.8868 3.8868 4.0109 4.0109 4.1897 4.1897 4.2671 4.2671 4.3400 4.3400 4.4683 4.4683 4.8277 4.8277 4.9713 4.9713 5.2937 5.2937 5.6804 5.6804 5.7369 5.7369 5.9294 5.9294 6.0715 6.0715 7.4377 7.4377 7.8053 7.8053 7.8594 7.8594 8.1783 8.1783 10.7540 10.7540 11.8596 11.8596 12.0816 12.0816 12.5010 12.5010 13.2149 13.2149 13.2775 13.2775 13.3866 13.3866 k = 0.0000 0.2632 0.2279 ( 6708 PWs) bands (ev): -18.2909 -18.2909 -18.1505 -18.1505 -14.5311 -14.5311 -14.4859 -14.4859 -4.9973 -4.9973 -4.7539 -4.7539 -3.9067 -3.9067 -3.4539 -3.4539 -2.8002 -2.8002 -2.7412 -2.7412 -2.5691 -2.5691 -2.4203 -2.4203 3.5690 3.5690 3.6706 3.6706 3.7123 3.7123 3.7526 3.7526 3.8729 3.8729 3.9020 3.9020 4.0202 4.0202 4.1813 4.1813 4.2767 4.2767 4.3600 4.3600 4.4695 4.4695 4.8113 4.8113 4.9617 4.9617 5.2722 5.2722 5.6504 5.6504 5.7197 5.7197 5.8926 5.8926 6.0119 6.0119 7.4596 7.4596 7.8118 7.8118 7.8391 7.8391 8.1579 8.1579 10.7816 10.7816 11.7899 11.7899 12.0869 12.0869 12.6130 12.6130 13.2086 13.2086 13.2805 13.2805 13.4679 13.4679 k = 0.0000 0.2763 0.2279 ( 6728 PWs) bands (ev): -18.2850 -18.2850 -18.1508 -18.1508 -14.5334 -14.5334 -14.4906 -14.4906 -5.0004 -5.0004 -4.7606 -4.7606 -3.9044 -3.9044 -3.4582 -3.4582 -2.7944 -2.7944 -2.7506 -2.7506 -2.5657 -2.5657 -2.4186 -2.4186 3.5863 3.5863 3.6838 3.6838 3.7219 3.7219 3.7644 3.7644 3.8954 3.8954 3.9233 3.9233 4.0305 4.0305 4.1701 4.1701 4.2881 4.2881 4.3789 4.3789 4.4710 4.4710 4.7939 4.7939 4.9535 4.9535 5.2503 5.2503 5.6192 5.6192 5.7016 5.7016 5.8558 5.8558 5.9548 5.9548 7.4805 7.4805 7.7996 7.7996 7.8378 7.8378 8.1373 8.1373 10.8087 10.8087 11.7220 11.7220 12.0930 12.0930 12.7264 12.7264 13.1978 13.1978 13.2788 13.2788 13.5509 13.5509 k = 0.0000 0.2895 0.2279 ( 6716 PWs) bands (ev): -18.2790 -18.2790 -18.1513 -18.1513 -14.5357 -14.5357 -14.4952 -14.4952 -5.0028 -5.0028 -4.7682 -4.7682 -3.9007 -3.9007 -3.4640 -3.4640 -2.7899 -2.7899 -2.7589 -2.7589 -2.5614 -2.5614 -2.4169 -2.4169 3.6028 3.6028 3.6973 3.6973 3.7311 3.7311 3.7730 3.7730 3.9156 3.9156 3.9535 3.9535 4.0419 4.0419 4.1573 4.1573 4.3000 4.3000 4.3951 4.3951 4.4745 4.4745 4.7758 4.7758 4.9468 4.9468 5.2287 5.2287 5.5870 5.5870 5.6829 5.6829 5.8190 5.8190 5.9007 5.9007 7.5006 7.5006 7.7804 7.7804 7.8441 7.8441 8.1167 8.1167 10.8354 10.8354 11.6578 11.6578 12.0988 12.0988 12.8406 12.8406 13.1817 13.1817 13.2775 13.2775 13.6273 13.6273 k = 0.0000 0.3026 0.2279 ( 6724 PWs) bands (ev): -18.2729 -18.2729 -18.1519 -18.1519 -14.5379 -14.5379 -14.4999 -14.4999 -5.0044 -5.0044 -4.7766 -4.7766 -3.8956 -3.8956 -3.4712 -3.4712 -2.7874 -2.7874 -2.7656 -2.7656 -2.5562 -2.5562 -2.4154 -2.4154 3.6186 3.6186 3.7108 3.7108 3.7398 3.7398 3.7795 3.7795 3.9334 3.9334 3.9904 3.9904 4.0541 4.0541 4.1435 4.1435 4.3113 4.3113 4.4062 4.4062 4.4825 4.4825 4.7572 4.7572 4.9410 4.9410 5.2076 5.2076 5.5538 5.5538 5.6634 5.6634 5.7819 5.7819 5.8501 5.8501 7.5197 7.5197 7.7622 7.7622 7.8497 7.8497 8.0961 8.0961 10.8615 10.8615 11.5979 11.5979 12.1042 12.1042 12.9546 12.9546 13.1591 13.1591 13.2785 13.2785 13.6931 13.6931 k = 0.0000 0.3158 0.2279 ( 6720 PWs) bands (ev): -18.2668 -18.2668 -18.1527 -18.1527 -14.5399 -14.5399 -14.5044 -14.5044 -5.0052 -5.0052 -4.7857 -4.7857 -3.8893 -3.8893 -3.4798 -3.4798 -2.7875 -2.7875 -2.7699 -2.7699 -2.5501 -2.5501 -2.4140 -2.4140 3.6340 3.6340 3.7245 3.7245 3.7481 3.7481 3.7851 3.7851 3.9502 3.9502 4.0308 4.0308 4.0671 4.0671 4.1293 4.1293 4.3214 4.3214 4.4117 4.4117 4.4960 4.4960 4.7386 4.7386 4.9357 4.9357 5.1879 5.1879 5.5199 5.5199 5.6433 5.6433 5.7440 5.7440 5.8036 5.8036 7.5379 7.5379 7.7464 7.7464 7.8533 7.8533 8.0755 8.0755 10.8869 10.8869 11.5428 11.5428 12.1094 12.1094 13.0637 13.0637 13.1330 13.1330 13.2835 13.2835 13.7470 13.7470 k = 0.0000 0.3289 0.2279 ( 6720 PWs) bands (ev): -18.2607 -18.2607 -18.1538 -18.1538 -14.5419 -14.5419 -14.5088 -14.5088 -5.0052 -5.0052 -4.7955 -4.7955 -3.8817 -3.8817 -3.4898 -3.4898 -2.7905 -2.7905 -2.7716 -2.7716 -2.5432 -2.5432 -2.4127 -2.4127 3.6490 3.6490 3.7381 3.7381 3.7559 3.7559 3.7906 3.7906 3.9668 3.9668 4.0686 4.0686 4.0842 4.0842 4.1149 4.1149 4.3292 4.3292 4.4136 4.4136 4.5138 4.5138 4.7205 4.7205 4.9300 4.9300 5.1702 5.1702 5.4853 5.4853 5.6226 5.6226 5.7051 5.7051 5.7615 5.7615 7.5551 7.5551 7.7333 7.7333 7.8546 7.8546 8.0552 8.0552 10.9116 10.9116 11.4925 11.4925 12.1146 12.1146 13.0794 13.0794 13.1915 13.1915 13.2930 13.2930 13.7900 13.7900 k = 0.0000 0.3421 0.2279 ( 6716 PWs) bands (ev): -18.2545 -18.2545 -18.1550 -18.1550 -14.5437 -14.5437 -14.5132 -14.5132 -5.0045 -5.0045 -4.8058 -4.8058 -3.8729 -3.8729 -3.5011 -3.5011 -2.7945 -2.7945 -2.7722 -2.7722 -2.5356 -2.5356 -2.4118 -2.4118 3.6637 3.6637 3.7518 3.7518 3.7632 3.7632 3.7963 3.7963 3.9832 3.9832 4.0846 4.0846 4.1023 4.1023 4.1211 4.1211 4.3339 4.3339 4.4155 4.4155 4.5334 4.5334 4.7040 4.7040 4.9235 4.9235 5.1551 5.1551 5.4504 5.4504 5.6015 5.6015 5.6655 5.6655 5.7236 5.7236 7.5712 7.5712 7.7231 7.7231 7.8537 7.8537 8.0351 8.0351 10.9356 10.9356 11.4471 11.4471 12.1202 12.1202 13.0348 13.0348 13.2989 13.2989 13.3099 13.3099 13.8251 13.8251 k = 0.0000 0.3553 0.2279 ( 6722 PWs) bands (ev): -18.2484 -18.2484 -18.1565 -18.1565 -14.5453 -14.5453 -14.5173 -14.5173 -5.0029 -5.0029 -4.8164 -4.8164 -3.8629 -3.8629 -3.5137 -3.5137 -2.7986 -2.7986 -2.7728 -2.7728 -2.5275 -2.5275 -2.4112 -2.4112 3.6780 3.6780 3.7651 3.7651 3.7703 3.7703 3.8025 3.8025 3.9996 3.9996 4.0804 4.0804 4.1025 4.1025 4.1628 4.1628 4.3356 4.3356 4.4198 4.4198 4.5522 4.5522 4.6905 4.6905 4.9154 4.9154 5.1431 5.1431 5.4153 5.4153 5.5802 5.5802 5.6257 5.6257 5.6894 5.6894 7.5861 7.5861 7.7159 7.7159 7.8504 7.8504 8.0153 8.0153 10.9588 10.9588 11.4064 11.4064 12.1267 12.1267 12.9823 12.9823 13.3241 13.3241 13.4138 13.4138 13.8549 13.8549 k = 0.0000 0.3684 0.2279 ( 6728 PWs) bands (ev): -18.2424 -18.2424 -18.1582 -18.1582 -14.5468 -14.5468 -14.5213 -14.5213 -5.0005 -5.0005 -4.8275 -4.8275 -3.8519 -3.8519 -3.5273 -3.5273 -2.8021 -2.8021 -2.7739 -2.7739 -2.5189 -2.5189 -2.4109 -2.4109 3.6920 3.6920 3.7748 3.7748 3.7806 3.7806 3.8094 3.8094 4.0160 4.0160 4.0666 4.0666 4.1095 4.1095 4.2016 4.2016 4.3368 4.3368 4.4273 4.4273 4.5674 4.5674 4.6823 4.6823 4.9054 4.9054 5.1341 5.1341 5.3805 5.3805 5.5589 5.5589 5.5867 5.5867 5.6581 5.6581 7.5997 7.5997 7.7118 7.7118 7.8452 7.8452 7.9959 7.9959 10.9811 10.9811 11.3701 11.3701 12.1345 12.1345 12.9255 12.9255 13.3462 13.3462 13.5229 13.5229 13.8814 13.8814 k = 0.0000 0.3816 0.2279 ( 6720 PWs) bands (ev): -18.2364 -18.2364 -18.1601 -18.1601 -14.5480 -14.5480 -14.5251 -14.5251 -4.9974 -4.9974 -4.8387 -4.8387 -3.8398 -3.8398 -3.5419 -3.5419 -2.8049 -2.8049 -2.7754 -2.7754 -2.5100 -2.5100 -2.4111 -2.4111 3.7056 3.7056 3.7807 3.7807 3.7942 3.7942 3.8170 3.8170 4.0320 4.0320 4.0517 4.0517 4.1144 4.1144 4.2325 4.2325 4.3426 4.3426 4.4379 4.4379 4.5756 4.5756 4.6829 4.6829 4.8936 4.8936 5.1278 5.1278 5.3466 5.3466 5.5376 5.5376 5.5496 5.5496 5.6293 5.6293 7.6120 7.6120 7.7109 7.7109 7.8381 7.8381 7.9769 7.9769 11.0025 11.0025 11.3379 11.3379 12.1441 12.1441 12.8659 12.8659 13.3720 13.3720 13.6293 13.6293 13.9058 13.9058 k = 0.0000 0.3947 0.2279 ( 6720 PWs) bands (ev): -18.2305 -18.2305 -18.1623 -18.1623 -14.5491 -14.5491 -14.5287 -14.5287 -4.9935 -4.9935 -4.8501 -4.8501 -3.8269 -3.8269 -3.5575 -3.5575 -2.8069 -2.8069 -2.7775 -2.7775 -2.5010 -2.5010 -2.4117 -2.4117 3.7185 3.7185 3.7854 3.7854 3.8083 3.8083 3.8257 3.8257 4.0364 4.0364 4.0474 4.0474 4.1159 4.1159 4.2507 4.2507 4.3583 4.3583 4.4518 4.4518 4.5756 4.5756 4.6931 4.6931 4.8802 4.8802 5.1227 5.1227 5.3147 5.3147 5.5099 5.5099 5.5214 5.5214 5.6025 5.6025 7.6231 7.6231 7.7128 7.7128 7.8296 7.8296 7.9583 7.9583 11.0230 11.0230 11.3095 11.3095 12.1560 12.1560 12.8051 12.8051 13.4016 13.4016 13.7319 13.7319 13.9286 13.9286 k = 0.0000 0.4079 0.2279 ( 6728 PWs) bands (ev): -18.2247 -18.2247 -18.1647 -18.1647 -14.5499 -14.5499 -14.5321 -14.5321 -4.9888 -4.9888 -4.8616 -4.8616 -3.8130 -3.8130 -3.5737 -3.5737 -2.8082 -2.8082 -2.7799 -2.7799 -2.4921 -2.4921 -2.4129 -2.4129 3.7308 3.7308 3.7892 3.7892 3.8227 3.8227 3.8355 3.8355 4.0215 4.0215 4.0597 4.0597 4.1153 4.1153 4.2569 4.2569 4.3820 4.3820 4.4696 4.4696 4.5701 4.5701 4.7103 4.7103 4.8659 4.8659 5.1169 5.1169 5.2864 5.2864 5.4761 5.4761 5.5026 5.5026 5.5776 5.5776 7.6331 7.6331 7.7171 7.7171 7.8202 7.8202 7.9402 7.9402 11.0427 11.0427 11.2843 11.2843 12.1705 12.1705 12.7440 12.7440 13.4346 13.4346 13.8292 13.8292 13.9499 13.9499 k = 0.0000 0.4211 0.2279 ( 6724 PWs) bands (ev): -18.2191 -18.2191 -18.1674 -18.1674 -14.5505 -14.5505 -14.5352 -14.5352 -4.9833 -4.9833 -4.8730 -4.8730 -3.7983 -3.7983 -3.5906 -3.5906 -2.8088 -2.8088 -2.7826 -2.7826 -2.4832 -2.4832 -2.4146 -2.4146 3.7422 3.7422 3.7921 3.7921 3.8373 3.8373 3.8467 3.8467 4.0067 4.0067 4.0653 4.0653 4.1166 4.1166 4.2566 4.2566 4.4065 4.4065 4.4918 4.4918 4.5632 4.5632 4.7305 4.7305 4.8520 4.8520 5.1074 5.1074 5.2642 5.2642 5.4433 5.4433 5.4868 5.4868 5.5545 5.5545 7.6424 7.6424 7.7228 7.7228 7.8107 7.8107 7.9225 7.9225 11.0615 11.0615 11.2619 11.2619 12.1880 12.1880 12.6837 12.6837 13.4711 13.4711 13.9168 13.9168 13.9699 13.9699 k = 0.0000 0.4342 0.2279 ( 6724 PWs) bands (ev): -18.2136 -18.2136 -18.1704 -18.1704 -14.5508 -14.5508 -14.5380 -14.5380 -4.9772 -4.9772 -4.8843 -4.8843 -3.7829 -3.7829 -3.6080 -3.6080 -2.8087 -2.8087 -2.7856 -2.7856 -2.4747 -2.4747 -2.4170 -2.4170 3.7526 3.7526 3.7939 3.7939 3.8513 3.8513 3.8601 3.8601 3.9922 3.9922 4.0599 4.0599 4.1248 4.1248 4.2528 4.2528 4.4274 4.4274 4.5149 4.5149 4.5601 4.5601 4.7491 4.7491 4.8413 4.8413 5.0915 5.0915 5.2507 5.2507 5.4123 5.4123 5.4739 5.4739 5.5334 5.5334 7.6517 7.6517 7.7283 7.7283 7.8024 7.8024 7.9052 7.9052 11.0795 11.0795 11.2417 11.2417 12.2090 12.2090 12.6249 12.6249 13.5108 13.5108 13.9754 13.9754 13.9882 13.9882 k = 0.0000 0.4474 0.2279 ( 6732 PWs) bands (ev): -18.2083 -18.2083 -18.1736 -18.1736 -14.5508 -14.5508 -14.5406 -14.5406 -4.9704 -4.9704 -4.8955 -4.8955 -3.7669 -3.7669 -3.6257 -3.6257 -2.8080 -2.8080 -2.7886 -2.7886 -2.4664 -2.4664 -2.4200 -2.4200 3.7618 3.7618 3.7947 3.7947 3.8645 3.8645 3.8760 3.8760 3.9780 3.9780 4.0459 4.0459 4.1382 4.1382 4.2467 4.2467 4.4446 4.4446 4.5251 4.5251 4.5735 4.5735 4.7591 4.7591 4.8399 4.8399 5.0682 5.0682 5.2466 5.2466 5.3833 5.3833 5.4643 5.4643 5.5142 5.5142 7.6611 7.6611 7.7315 7.7315 7.7974 7.7974 7.8883 7.8883 11.0967 11.0967 11.2234 11.2234 12.2336 12.2336 12.5681 12.5681 13.5536 13.5536 13.9799 13.9799 13.9985 13.9985 k = 0.0000 0.4605 0.2279 ( 6736 PWs) bands (ev): -18.2032 -18.2032 -18.1771 -18.1771 -14.5506 -14.5506 -14.5429 -14.5429 -4.9629 -4.9629 -4.9064 -4.9064 -3.7503 -3.7503 -3.6437 -3.6437 -2.8068 -2.8068 -2.7917 -2.7917 -2.4586 -2.4586 -2.4236 -2.4236 3.7699 3.7699 3.7944 3.7944 3.8771 3.8771 3.8933 3.8933 3.9647 3.9647 4.0274 4.0274 4.1539 4.1539 4.2383 4.2383 4.4592 4.4592 4.5212 4.5212 4.6020 4.6020 4.7543 4.7543 4.8535 4.8535 5.0393 5.0393 5.2502 5.2502 5.3563 5.3563 5.4582 5.4582 5.4973 5.4973 7.6710 7.6710 7.7300 7.7300 7.7980 7.7980 7.8720 7.8720 11.1132 11.1132 11.2065 11.2065 12.2620 12.2620 12.5140 12.5140 13.5994 13.5994 13.9255 13.9255 14.0121 14.0121 k = 0.0000 0.4737 0.2279 ( 6744 PWs) bands (ev): -18.1982 -18.1982 -18.1808 -18.1808 -14.5500 -14.5500 -14.5449 -14.5449 -4.9548 -4.9548 -4.9169 -4.9169 -3.7332 -3.7332 -3.6618 -3.6618 -2.8051 -2.8051 -2.7948 -2.7948 -2.4513 -2.4513 -2.4278 -2.4278 3.7768 3.7768 3.7931 3.7931 3.8897 3.8897 3.9102 3.9102 3.9536 3.9536 4.0069 4.0069 4.1701 4.1701 4.2278 4.2278 4.4720 4.4720 4.5134 4.5134 4.6336 4.6336 4.7387 4.7387 4.8779 4.8779 5.0070 5.0070 5.2595 5.2595 5.3317 5.3317 5.4559 5.4559 5.4828 5.4828 7.6814 7.6814 7.7236 7.7236 7.8042 7.8042 7.8562 7.8562 11.1291 11.1291 11.1904 11.1904 12.2944 12.2944 12.4629 12.4629 13.6480 13.6480 13.8666 13.8666 14.0223 14.0223 k = 0.0000 0.4868 0.2279 ( 6760 PWs) bands (ev): -18.1935 -18.1935 -18.1848 -18.1848 -14.5492 -14.5492 -14.5467 -14.5467 -4.9461 -4.9461 -4.9271 -4.9271 -3.7157 -3.7157 -3.6799 -3.6799 -2.8029 -2.8029 -2.7977 -2.7977 -2.4445 -2.4445 -2.4328 -2.4328 3.7825 3.7825 3.7907 3.7907 3.9021 3.9021 3.9193 3.9193 3.9516 3.9516 3.9857 3.9857 4.1860 4.1860 4.2153 4.2153 4.4837 4.4837 4.5043 4.5043 4.6640 4.6640 4.7173 4.7173 4.9075 4.9075 4.9734 4.9734 5.2729 5.2729 5.3094 5.3094 5.4573 5.4573 5.4711 5.4711 7.6923 7.6923 7.7142 7.7142 7.8145 7.8145 7.8412 7.8412 11.1446 11.1446 11.1750 11.1750 12.3307 12.3307 12.4151 12.4151 13.6992 13.6992 13.8088 13.8088 14.0292 14.0292 k = 0.0000 0.5000 0.2279 ( 6768 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9368 -4.9368 -4.9368 -4.9368 -3.6979 -3.6979 -3.6979 -3.6979 -2.8005 -2.8005 -2.8005 -2.8005 -2.4383 -2.4383 -2.4383 -2.4383 3.7872 3.7872 3.7872 3.7872 3.9134 3.9134 3.9134 3.9134 3.9657 3.9657 3.9657 3.9657 4.2012 4.2012 4.2012 4.2012 4.4944 4.4944 4.4944 4.4944 4.6921 4.6921 4.6921 4.6921 4.9398 4.9398 4.9398 4.9398 5.2897 5.2897 5.2897 5.2897 5.4625 5.4625 5.4625 5.4625 7.7034 7.7034 7.7034 7.7034 7.8271 7.8271 7.8271 7.8271 11.1598 11.1598 11.1598 11.1598 12.3710 12.3710 12.3710 12.3710 13.7529 13.7529 13.7529 13.7529 14.0327 14.0327 k = 0.0000 0.5000 0.2279 ( 6768 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9368 -4.9368 -4.9368 -4.9368 -3.6979 -3.6979 -3.6979 -3.6979 -2.8005 -2.8005 -2.8005 -2.8005 -2.4383 -2.4383 -2.4383 -2.4383 3.7872 3.7872 3.7872 3.7872 3.9134 3.9134 3.9134 3.9134 3.9657 3.9657 3.9657 3.9657 4.2012 4.2012 4.2012 4.2012 4.4944 4.4944 4.4944 4.4944 4.6921 4.6921 4.6921 4.6921 4.9398 4.9398 4.9398 4.9398 5.2897 5.2897 5.2897 5.2897 5.4625 5.4625 5.4625 5.4625 7.7034 7.7034 7.7034 7.7034 7.8271 7.8271 7.8271 7.8271 11.1598 11.1598 11.1598 11.1598 12.3710 12.3710 12.3710 12.3710 13.7529 13.7529 13.7529 13.7529 14.0327 14.0327 k = 0.0132 0.5000 0.2279 ( 6752 PWs) bands (ev): -18.1889 -18.1889 -18.1889 -18.1889 -14.5483 -14.5483 -14.5481 -14.5481 -4.9405 -4.9405 -4.9330 -4.9330 -3.7005 -3.7005 -3.6948 -3.6948 -2.8108 -2.8108 -2.7909 -2.7909 -2.4400 -2.4400 -2.4376 -2.4376 3.7862 3.7862 3.7890 3.7890 3.8902 3.8902 3.9146 3.9146 3.9617 3.9617 3.9912 3.9912 4.1992 4.1992 4.2034 4.2034 4.4920 4.4920 4.4955 4.4955 4.6840 4.6840 4.7028 4.7028 4.9247 4.9247 4.9538 4.9538 5.2901 5.2901 5.2903 5.2903 5.4599 5.4599 5.4671 5.4671 7.6796 7.6796 7.7158 7.7158 7.8097 7.8097 7.8495 7.8495 11.1602 11.1602 11.1627 11.1627 12.3734 12.3734 12.3750 12.3750 13.7393 13.7393 13.7450 13.7450 14.0416 14.0416 k = 0.0263 0.5000 0.2279 ( 6748 PWs) bands (ev): -18.1886 -18.1886 -18.1886 -18.1886 -14.5489 -14.5489 -14.5484 -14.5484 -4.9441 -4.9441 -4.9290 -4.9290 -3.7024 -3.7024 -3.6911 -3.6911 -2.8219 -2.8219 -2.7823 -2.7823 -2.4425 -2.4425 -2.4378 -2.4378 3.7857 3.7857 3.7916 3.7916 3.8639 3.8639 3.8905 3.8905 3.9827 3.9827 4.0197 4.0197 4.1974 4.1974 4.2055 4.2055 4.4884 4.4884 4.4950 4.4950 4.6782 4.6782 4.7157 4.7157 4.9087 4.9087 4.9666 4.9666 5.2914 5.2914 5.2916 5.2916 5.4595 5.4595 5.4740 5.4740 7.6495 7.6495 7.7085 7.7085 7.8054 7.8054 7.8716 7.8716 11.1640 11.1640 11.1690 11.1690 12.3823 12.3823 12.3855 12.3855 13.7104 13.7104 13.7193 13.7193 14.0731 14.0731 k = 0.0395 0.5000 0.2279 ( 6752 PWs) bands (ev): -18.1880 -18.1880 -18.1880 -18.1880 -14.5497 -14.5497 -14.5490 -14.5490 -4.9475 -4.9475 -4.9249 -4.9249 -3.7037 -3.7037 -3.6869 -3.6869 -2.8335 -2.8335 -2.7746 -2.7746 -2.4459 -2.4459 -2.4390 -2.4390 3.7845 3.7845 3.7941 3.7941 3.8388 3.8388 3.8630 3.8630 4.0076 4.0076 4.0479 4.0479 4.1959 4.1959 4.2074 4.2074 4.4839 4.4839 4.4930 4.4930 4.6749 4.6749 4.7305 4.7305 4.8923 4.8923 4.9782 4.9782 5.2925 5.2925 5.2941 5.2941 5.4615 5.4615 5.4831 5.4831 7.6153 7.6153 7.6835 7.6835 7.8126 7.8126 7.8914 7.8914 11.1711 11.1711 11.1785 11.1785 12.3975 12.3975 12.4025 12.4025 13.6741 13.6741 13.6842 13.6842 14.1177 14.1177 k = 0.0526 0.5000 0.2279 ( 6752 PWs) bands (ev): -18.1872 -18.1872 -18.1872 -18.1872 -14.5508 -14.5508 -14.5498 -14.5498 -4.9507 -4.9507 -4.9207 -4.9207 -3.7042 -3.7042 -3.6822 -3.6822 -2.8456 -2.8456 -2.7679 -2.7679 -2.4501 -2.4501 -2.4411 -2.4411 3.7780 3.7780 3.7936 3.7936 3.8202 3.8202 3.8391 3.8391 4.0323 4.0323 4.0745 4.0745 4.1954 4.1954 4.2090 4.2090 4.4786 4.4786 4.4898 4.4898 4.6736 4.6736 4.7465 4.7465 4.8762 4.8762 4.9889 4.9889 5.2933 5.2933 5.2973 5.2973 5.4660 5.4660 5.4946 5.4946 7.5780 7.5780 7.6492 7.6492 7.8226 7.8226 7.9080 7.9080 11.1815 11.1815 11.1912 11.1912 12.4190 12.4190 12.4257 12.4257 13.6358 13.6358 13.6457 13.6457 14.1666 14.1666 k = 0.0658 0.5000 0.2279 ( 6748 PWs) bands (ev): -18.1862 -18.1862 -18.1862 -18.1862 -14.5521 -14.5521 -14.5510 -14.5510 -4.9538 -4.9538 -4.9165 -4.9165 -3.7040 -3.7040 -3.6771 -3.6771 -2.8582 -2.8582 -2.7624 -2.7624 -2.4551 -2.4551 -2.4442 -2.4442 3.7604 3.7604 3.7814 3.7814 3.8142 3.8142 3.8284 3.8284 4.0559 4.0559 4.0985 4.0985 4.1967 4.1967 4.2104 4.2104 4.4729 4.4729 4.4854 4.4854 4.6740 4.6740 4.7625 4.7625 4.8618 4.8618 4.9992 4.9992 5.2933 5.2933 5.3005 5.3005 5.4734 5.4734 5.5084 5.5084 7.5384 7.5384 7.6102 7.6102 7.8312 7.8312 7.9208 7.9208 11.1950 11.1950 11.2070 11.2070 12.4465 12.4465 12.4551 12.4551 13.5982 13.5982 13.6072 13.6072 14.2107 14.2107 k = 0.0789 0.5000 0.2279 ( 6756 PWs) bands (ev): -18.1850 -18.1850 -18.1849 -18.1849 -14.5537 -14.5537 -14.5524 -14.5524 -4.9566 -4.9566 -4.9122 -4.9122 -3.7030 -3.7030 -3.6715 -3.6715 -2.8710 -2.8710 -2.7581 -2.7581 -2.4610 -2.4610 -2.4483 -2.4483 3.7360 3.7360 3.7576 3.7576 3.8168 3.8168 3.8309 3.8309 4.0779 4.0779 4.1180 4.1180 4.2011 4.2011 4.2114 4.2114 4.4670 4.4670 4.4803 4.4803 4.6757 4.6757 4.7756 4.7756 4.8519 4.8519 5.0094 5.0094 5.2924 5.2924 5.3032 5.3032 5.4842 5.4842 5.5245 5.5245 7.4968 7.4968 7.5684 7.5684 7.8368 7.8368 7.9297 7.9297 11.2115 11.2115 11.2258 11.2258 12.4798 12.4798 12.4904 12.4904 13.5625 13.5625 13.5702 13.5702 14.2386 14.2386 k = 0.0921 0.5000 0.2279 ( 6756 PWs) bands (ev): -18.1835 -18.1835 -18.1835 -18.1835 -14.5555 -14.5555 -14.5540 -14.5540 -4.9593 -4.9593 -4.9079 -4.9079 -3.7011 -3.7011 -3.6655 -3.6655 -2.8840 -2.8840 -2.7550 -2.7550 -2.4676 -2.4676 -2.4535 -2.4535 3.7100 3.7100 3.7305 3.7305 3.8232 3.8232 3.8387 3.8387 4.0980 4.0980 4.1310 4.1310 4.2104 4.2104 4.2124 4.2124 4.4610 4.4610 4.4747 4.4747 4.6782 4.6782 4.7801 4.7801 4.8523 4.8523 5.0201 5.0201 5.2906 5.2906 5.3049 5.3049 5.4984 5.4984 5.5426 5.5426 7.4537 7.4537 7.5246 7.5246 7.8387 7.8387 7.9344 7.9344 11.2309 11.2309 11.2473 11.2473 12.5187 12.5187 12.5314 12.5314 13.5298 13.5298 13.5358 13.5358 14.2477 14.2477 k = 0.1053 0.5000 0.2279 ( 6760 PWs) bands (ev): -18.1819 -18.1819 -18.1819 -18.1819 -14.5576 -14.5576 -14.5559 -14.5559 -4.9617 -4.9617 -4.9036 -4.9036 -3.6984 -3.6984 -3.6591 -3.6591 -2.8971 -2.8971 -2.7532 -2.7532 -2.4750 -2.4750 -2.4597 -2.4597 3.6838 3.6838 3.7030 3.7030 3.8317 3.8317 3.8488 3.8488 4.1154 4.1154 4.1371 4.1371 4.2137 4.2137 4.2248 4.2248 4.4554 4.4554 4.4689 4.4689 4.6812 4.6812 4.7740 4.7740 4.8650 4.8650 5.0316 5.0316 5.2879 5.2879 5.3052 5.3052 5.5160 5.5160 5.5627 5.5627 7.4094 7.4094 7.4794 7.4794 7.8367 7.8367 7.9350 7.9350 11.2530 11.2530 11.2715 11.2715 12.5627 12.5627 12.5779 12.5779 13.5006 13.5006 13.5044 13.5044 14.2459 14.2459 k = 0.1184 0.5000 0.2279 ( 6756 PWs) bands (ev): -18.1800 -18.1800 -18.1800 -18.1800 -14.5599 -14.5599 -14.5580 -14.5580 -4.9640 -4.9640 -4.8994 -4.8994 -3.6947 -3.6947 -3.6523 -3.6523 -2.9102 -2.9102 -2.7528 -2.7528 -2.4830 -2.4830 -2.4669 -2.4669 3.6583 3.6583 3.6761 3.6761 3.8420 3.8420 3.8606 3.8606 4.1293 4.1293 4.1378 4.1378 4.2159 4.2159 4.2424 4.2424 4.4504 4.4504 4.4632 4.4632 4.6845 4.6845 4.7620 4.7620 4.8849 4.8849 5.0441 5.0441 5.2846 5.2846 5.3042 5.3042 5.5368 5.5368 5.5843 5.5843 7.3643 7.3643 7.4333 7.4333 7.8308 7.8308 7.9315 7.9315 11.2775 11.2775 11.2980 11.2980 12.6114 12.6114 12.6293 12.6293 13.4753 13.4753 13.4764 13.4764 14.2394 14.2394 k = 0.1316 0.5000 0.2279 ( 6752 PWs) bands (ev): -18.1780 -18.1780 -18.1780 -18.1780 -14.5624 -14.5624 -14.5603 -14.5603 -4.9660 -4.9660 -4.8952 -4.8952 -3.6901 -3.6901 -3.6451 -3.6451 -2.9231 -2.9231 -2.7537 -2.7537 -2.4918 -2.4918 -2.4752 -2.4752 3.6338 3.6338 3.6502 3.6502 3.8537 3.8537 3.8737 3.8737 4.1350 4.1350 4.1386 4.1386 4.2201 4.2201 4.2610 4.2610 4.4464 4.4464 4.4577 4.4577 4.6879 4.6879 4.7481 4.7481 4.9080 4.9080 5.0576 5.0576 5.2809 5.2809 5.3021 5.3021 5.5605 5.5605 5.6073 5.6073 7.3187 7.3187 7.3866 7.3866 7.8209 7.8209 7.9239 7.9239 11.3043 11.3043 11.3267 11.3267 12.6643 12.6643 12.6851 12.6851 13.4522 13.4522 13.4542 13.4542 14.2307 14.2307 k = 0.1447 0.5000 0.2279 ( 6756 PWs) bands (ev): -18.1759 -18.1759 -18.1759 -18.1759 -14.5651 -14.5651 -14.5629 -14.5629 -4.9678 -4.9678 -4.8912 -4.8912 -3.6845 -3.6845 -3.6375 -3.6375 -2.9359 -2.9359 -2.7560 -2.7560 -2.5013 -2.5013 -2.4846 -2.4846 3.6104 3.6104 3.6254 3.6254 3.8667 3.8667 3.8879 3.8879 4.1297 4.1297 4.1425 4.1425 4.2269 4.2269 4.2791 4.2791 4.4437 4.4437 4.4526 4.4526 4.6914 4.6914 4.7337 4.7337 4.9322 4.9322 5.0717 5.0717 5.2773 5.2773 5.2993 5.2993 5.5865 5.5865 5.6314 5.6314 7.2728 7.2728 7.3396 7.3396 7.8071 7.8071 7.9123 7.9123 11.3331 11.3331 11.3574 11.3574 12.7206 12.7206 12.7449 12.7449 13.4319 13.4319 13.4379 13.4379 14.2209 14.2209 k = 0.1579 0.5000 0.2279 ( 6748 PWs) bands (ev): -18.1736 -18.1736 -18.1736 -18.1736 -14.5679 -14.5679 -14.5656 -14.5656 -4.9694 -4.9694 -4.8873 -4.8873 -3.6779 -3.6779 -3.6295 -3.6295 -2.9484 -2.9484 -2.7597 -2.7597 -2.5114 -2.5114 -2.4949 -2.4949 3.5883 3.5883 3.6020 3.6020 3.8809 3.8809 3.9029 3.9029 4.1223 4.1223 4.1413 4.1413 4.2362 4.2362 4.2958 4.2958 4.4430 4.4430 4.4481 4.4481 4.6951 4.6951 4.7197 4.7197 4.9562 4.9562 5.0860 5.0860 5.2745 5.2745 5.2965 5.2965 5.6146 5.6146 5.6564 5.6564 7.2269 7.2269 7.2925 7.2925 7.7897 7.7897 7.8969 7.8969 11.3636 11.3636 11.3897 11.3897 12.7795 12.7795 12.8077 12.8077 13.4161 13.4161 13.4267 13.4267 14.2104 14.2104 k = 0.1711 0.5000 0.2279 ( 6744 PWs) bands (ev): -18.1711 -18.1711 -18.1711 -18.1711 -14.5709 -14.5709 -14.5685 -14.5685 -4.9707 -4.9707 -4.8836 -4.8836 -3.6702 -3.6702 -3.6210 -3.6210 -2.9604 -2.9604 -2.7647 -2.7647 -2.5222 -2.5222 -2.5064 -2.5064 3.5677 3.5677 3.5800 3.5800 3.8962 3.8962 3.9188 3.9188 4.1131 4.1131 4.1358 4.1358 4.2471 4.2471 4.3106 4.3106 4.4441 4.4441 4.4445 4.4445 4.6991 4.6991 4.7064 4.7064 4.9788 4.9788 5.0998 5.0998 5.2732 5.2732 5.2943 5.2943 5.6443 5.6443 5.6821 5.6821 7.1813 7.1813 7.2456 7.2456 7.7688 7.7688 7.8779 7.8779 11.3956 11.3956 11.4235 11.4235 12.8399 12.8399 12.8727 12.8727 13.4051 13.4051 13.4213 13.4213 14.1991 14.1991 k = 0.1842 0.5000 0.2279 ( 6744 PWs) bands (ev): -18.1686 -18.1686 -18.1686 -18.1686 -14.5741 -14.5741 -14.5715 -14.5715 -4.9718 -4.9718 -4.8801 -4.8801 -3.6615 -3.6615 -3.6121 -3.6121 -2.9721 -2.9721 -2.7711 -2.7711 -2.5337 -2.5337 -2.5188 -2.5188 3.5487 3.5487 3.5596 3.5596 3.9124 3.9124 3.9353 3.9353 4.1022 4.1022 4.1271 4.1271 4.2587 4.2587 4.3231 4.3231 4.4407 4.4407 4.4486 4.4486 4.6940 4.6940 4.7034 4.7034 4.9989 4.9989 5.1118 5.1118 5.2743 5.2743 5.2938 5.2938 5.6754 5.6754 5.7084 5.7084 7.1360 7.1360 7.1990 7.1990 7.7448 7.7448 7.8556 7.8556 11.4288 11.4288 11.4585 11.4585 12.9004 12.9004 12.9382 12.9382 13.3998 13.3998 13.4226 13.4226 14.1869 14.1869 k = 0.1974 0.5000 0.2279 ( 6748 PWs) bands (ev): -18.1659 -18.1659 -18.1659 -18.1659 -14.5773 -14.5773 -14.5747 -14.5747 -4.9726 -4.9726 -4.8769 -4.8769 -3.6518 -3.6518 -3.6027 -3.6027 -2.9832 -2.9832 -2.7789 -2.7789 -2.5457 -2.5457 -2.5323 -2.5323 3.5313 3.5313 3.5408 3.5408 3.9294 3.9294 3.9522 3.9522 4.0897 4.0897 4.1160 4.1160 4.2705 4.2705 4.3333 4.3333 4.4378 4.4378 4.4553 4.4553 4.6827 4.6827 4.7081 4.7081 5.0151 5.0151 5.1209 5.1209 5.2790 5.2790 5.2962 5.2962 5.7076 5.7076 5.7349 5.7349 7.0913 7.0913 7.1529 7.1529 7.7179 7.7179 7.8302 7.8302 11.4630 11.4630 11.4944 11.4944 12.9591 12.9591 13.0025 13.0025 13.4013 13.4013 13.4315 13.4315 14.1736 14.1736 k = 0.2105 0.5000 0.2279 ( 6752 PWs) bands (ev): -18.1632 -18.1632 -18.1631 -18.1631 -14.5807 -14.5807 -14.5779 -14.5779 -4.9732 -4.9732 -4.8740 -4.8740 -3.6409 -3.6409 -3.5929 -3.5929 -2.9936 -2.9936 -2.7879 -2.7879 -2.5583 -2.5583 -2.5467 -2.5467 3.5157 3.5157 3.5237 3.5237 3.9470 3.9470 3.9692 3.9692 4.0757 4.0757 4.1032 4.1032 4.2820 4.2820 4.3413 4.3413 4.4355 4.4355 4.4643 4.4643 4.6725 4.6725 4.7133 4.7133 5.0266 5.0266 5.1260 5.1260 5.2882 5.2882 5.3024 5.3024 5.7406 5.7406 5.7618 5.7618 7.0473 7.0473 7.1074 7.1074 7.6884 7.6884 7.8021 7.8021 11.4979 11.4979 11.5309 11.5309 13.0142 13.0142 13.0628 13.0628 13.4116 13.4116 13.4495 13.4495 14.1587 14.1587 k = 0.2237 0.5000 0.2279 ( 6752 PWs) bands (ev): -18.1604 -18.1604 -18.1603 -18.1603 -14.5841 -14.5841 -14.5813 -14.5813 -4.9735 -4.9735 -4.8714 -4.8714 -3.6290 -3.6290 -3.5825 -3.5825 -3.0035 -3.0035 -2.7981 -2.7981 -2.5715 -2.5715 -2.5622 -2.5622 3.5018 3.5018 3.5084 3.5084 3.9649 3.9649 3.9856 3.9856 4.0605 4.0605 4.0897 4.0897 4.2932 4.2932 4.3478 4.3478 4.4338 4.4338 4.4750 4.4750 4.6637 4.6637 4.7191 4.7191 5.0327 5.0327 5.1265 5.1265 5.3023 5.3023 5.3128 5.3128 5.7744 5.7744 5.7887 5.7887 7.0042 7.0042 7.0627 7.0627 7.6566 7.6566 7.7714 7.7714 11.5333 11.5333 11.5680 11.5680 13.0635 13.0635 13.1156 13.1156 13.4329 13.4329 13.4776 13.4776 14.1421 14.1421 k = 0.2368 0.5000 0.2279 ( 6752 PWs) bands (ev): -18.1575 -18.1575 -18.1575 -18.1575 -14.5875 -14.5875 -14.5847 -14.5847 -4.9735 -4.9735 -4.8692 -4.8692 -3.6161 -3.6161 -3.5716 -3.5716 -3.0126 -3.0126 -2.8095 -2.8095 -2.5853 -2.5853 -2.5785 -2.5785 3.4897 3.4897 3.4949 3.4949 3.9824 3.9824 3.9999 3.9999 4.0449 4.0449 4.0770 4.0770 4.3038 4.3038 4.3531 4.3531 4.4326 4.4326 4.4865 4.4865 4.6564 4.6564 4.7253 4.7253 5.0337 5.0337 5.1227 5.1227 5.3211 5.3211 5.3273 5.3273 5.8086 5.8086 5.8157 5.8157 6.9621 6.9621 7.0189 7.0189 7.6228 7.6228 7.7385 7.7385 11.5689 11.5689 11.6052 11.6052 13.1057 13.1057 13.1581 13.1581 13.4672 13.4672 13.5160 13.5160 14.1237 14.1237 k = 0.2500 0.5000 0.2279 ( 6752 PWs) bands (ev): -18.1546 -18.1546 -18.1546 -18.1546 -14.5910 -14.5910 -14.5882 -14.5882 -4.9732 -4.9732 -4.8674 -4.8674 -3.6022 -3.6022 -3.5602 -3.5602 -3.0209 -3.0209 -2.8221 -2.8221 -2.5995 -2.5995 -2.5957 -2.5957 3.4795 3.4795 3.4833 3.4833 3.9960 3.9960 4.0083 4.0083 4.0321 4.0321 4.0692 4.0692 4.3139 4.3139 4.3578 4.3578 4.4320 4.4320 4.4982 4.4982 4.6509 4.6509 4.7321 4.7321 5.0302 5.0302 5.1153 5.1153 5.3436 5.3436 5.3448 5.3448 5.8425 5.8425 5.8432 5.8432 6.9211 6.9211 6.9760 6.9760 7.5874 7.5874 7.7037 7.7037 11.6047 11.6047 11.6425 11.6425 13.1407 13.1407 13.1895 13.1895 13.5136 13.5136 13.5636 13.5636 14.1036 14.1036 k = 0.2632 0.5000 0.2279 ( 6764 PWs) bands (ev): -18.1518 -18.1518 -18.1517 -18.1517 -14.5945 -14.5945 -14.5917 -14.5917 -4.9726 -4.9726 -4.8660 -4.8660 -3.5872 -3.5872 -3.5482 -3.5482 -3.0285 -3.0285 -2.8356 -2.8356 -2.6142 -2.6142 -2.6137 -2.6137 3.4712 3.4712 3.4735 3.4735 3.9936 3.9936 4.0051 4.0051 4.0346 4.0346 4.0718 4.0718 4.3233 4.3233 4.3621 4.3621 4.4319 4.4319 4.5094 4.5094 4.6472 4.6472 4.7392 4.7392 5.0232 5.0232 5.1051 5.1051 5.3646 5.3646 5.3691 5.3691 5.8692 5.8692 5.8780 5.8780 6.8812 6.8812 6.9340 6.9340 7.5508 7.5508 7.6673 7.6673 11.6403 11.6403 11.6796 11.6796 13.1691 13.1691 13.2115 13.2115 13.5685 13.5685 13.6178 13.6178 14.0827 14.0827 k = 0.2763 0.5000 0.2279 ( 6768 PWs) bands (ev): -18.1489 -18.1489 -18.1489 -18.1489 -14.5980 -14.5980 -14.5952 -14.5952 -4.9717 -4.9717 -4.8651 -4.8651 -3.5713 -3.5713 -3.5357 -3.5357 -3.0352 -3.0352 -2.8501 -2.8501 -2.6324 -2.6324 -2.6294 -2.6294 3.4648 3.4648 3.4656 3.4656 3.9771 3.9771 3.9919 3.9919 4.0501 4.0501 4.0836 4.0836 4.3320 4.3320 4.3663 4.3663 4.4324 4.4324 4.5196 4.5196 4.6458 4.6458 4.7466 4.7466 5.0137 5.0137 5.0930 5.0930 5.3858 5.3858 5.3965 5.3965 5.8956 5.8956 5.9128 5.9128 6.8426 6.8426 6.8931 6.8931 7.5132 7.5132 7.6296 7.6296 11.6757 11.6757 11.7164 11.7164 13.1924 13.1924 13.2267 13.2267 13.6267 13.6267 13.6745 13.6745 14.0625 14.0625 k = 0.2895 0.5000 0.2279 ( 6764 PWs) bands (ev): -18.1460 -18.1460 -18.1460 -18.1460 -14.6014 -14.6014 -14.5986 -14.5986 -4.9704 -4.9704 -4.8646 -4.8646 -3.5544 -3.5544 -3.5225 -3.5225 -3.0411 -3.0411 -2.8655 -2.8655 -2.6518 -2.6518 -2.6449 -2.6449 3.4595 3.4595 3.4602 3.4602 3.9569 3.9569 3.9738 3.9738 4.0684 4.0684 4.0992 4.0992 4.3400 4.3400 4.3704 4.3704 4.4338 4.4338 4.5283 4.5283 4.6468 4.6468 4.7541 4.7541 5.0025 5.0025 5.0796 5.0796 5.4080 5.4080 5.4250 5.4250 5.9218 5.9218 5.9476 5.9476 6.8054 6.8054 6.8532 6.8532 7.4751 7.4751 7.5909 7.5909 11.7108 11.7108 11.7527 11.7527 13.2116 13.2116 13.2371 13.2371 13.6824 13.6824 13.7285 13.7285 14.0461 14.0461 k = 0.3026 0.5000 0.2279 ( 6756 PWs) bands (ev): -18.1433 -18.1433 -18.1432 -18.1432 -14.6047 -14.6047 -14.6020 -14.6020 -4.9689 -4.9689 -4.8647 -4.8647 -3.5367 -3.5367 -3.5088 -3.5088 -3.0462 -3.0462 -2.8817 -2.8817 -2.6717 -2.6717 -2.6607 -2.6607 3.4554 3.4554 3.4575 3.4575 3.9353 3.9353 3.9535 3.9535 4.0872 4.0872 4.1160 4.1160 4.3473 4.3473 4.3744 4.3744 4.4358 4.4358 4.5352 4.5352 4.6503 4.6503 4.7616 4.7616 4.9902 4.9902 5.0653 5.0653 5.4305 5.4305 5.4540 5.4540 5.9476 5.9476 5.9822 5.9822 6.7697 6.7697 6.8144 6.8144 7.4368 7.4368 7.5516 7.5516 11.7454 11.7454 11.7883 11.7883 13.2274 13.2274 13.2437 13.2437 13.7292 13.7292 13.7721 13.7721 14.0381 14.0381 k = 0.3158 0.5000 0.2279 ( 6752 PWs) bands (ev): -18.1405 -18.1405 -18.1405 -18.1405 -14.6079 -14.6079 -14.6054 -14.6054 -4.9670 -4.9670 -4.8652 -4.8652 -3.5181 -3.5181 -3.4945 -3.4945 -3.0506 -3.0506 -2.8986 -2.8986 -2.6921 -2.6921 -2.6768 -2.6768 3.4531 3.4531 3.4566 3.4566 3.9129 3.9129 3.9319 3.9319 4.1059 4.1059 4.1329 4.1329 4.3538 4.3538 4.3784 4.3784 4.4387 4.4387 4.5403 4.5403 4.6560 4.6560 4.7687 4.7687 4.9774 4.9774 5.0507 5.0507 5.4532 5.4532 5.4830 5.4830 5.9731 5.9731 6.0165 6.0165 6.7354 6.7354 6.7767 6.7767 7.3985 7.3985 7.5119 7.5119 11.7795 11.7795 11.8232 11.8232 13.2400 13.2400 13.2469 13.2469 13.7606 13.7606 13.7962 13.7962 14.0440 14.0440 k = 0.3289 0.5000 0.2279 ( 6752 PWs) bands (ev): -18.1379 -18.1379 -18.1379 -18.1379 -14.6110 -14.6110 -14.6086 -14.6086 -4.9648 -4.9648 -4.8661 -4.8661 -3.4989 -3.4989 -3.4797 -3.4797 -3.0542 -3.0542 -2.9162 -2.9162 -2.7128 -2.7128 -2.6931 -2.6931 3.4526 3.4526 3.4576 3.4576 3.8899 3.8899 3.9095 3.9095 4.1240 4.1240 4.1496 4.1496 4.3598 4.3598 4.3824 4.3824 4.4423 4.4423 4.5438 4.5438 4.6635 4.6635 4.7752 4.7752 4.9645 4.9645 5.0360 5.0360 5.4756 5.4756 5.5113 5.5113 5.9983 5.9983 6.0504 6.0504 6.7027 6.7027 6.7400 6.7400 7.3608 7.3608 7.4720 7.4720 11.8129 11.8129 11.8572 11.8572 13.2465 13.2465 13.2491 13.2491 13.7742 13.7742 13.7980 13.7980 14.0664 14.0664 k = 0.3421 0.5000 0.2279 ( 6744 PWs) bands (ev): -18.1354 -18.1354 -18.1354 -18.1354 -14.6140 -14.6140 -14.6117 -14.6117 -4.9623 -4.9623 -4.8676 -4.8676 -3.4790 -3.4790 -3.4643 -3.4643 -3.0571 -3.0571 -2.9342 -2.9342 -2.7336 -2.7336 -2.7096 -2.7096 3.4539 3.4539 3.4603 3.4603 3.8666 3.8666 3.8866 3.8866 4.1414 4.1414 4.1655 4.1655 4.3652 4.3652 4.3863 4.3863 4.4467 4.4467 4.5463 4.5463 4.6720 4.6720 4.7809 4.7809 4.9521 4.9521 5.0217 5.0217 5.4978 5.4978 5.5387 5.5387 6.0232 6.0232 6.0838 6.0838 6.6716 6.6716 6.7044 6.7044 7.3239 7.3239 7.4324 7.4324 11.8456 11.8456 11.8901 11.8901 13.2423 13.2423 13.2541 13.2541 13.7745 13.7745 13.7853 13.7853 14.1003 14.1003 k = 0.3553 0.5000 0.2279 ( 6748 PWs) bands (ev): -18.1330 -18.1330 -18.1330 -18.1330 -14.6168 -14.6168 -14.6146 -14.6146 -4.9595 -4.9595 -4.8695 -4.8695 -3.4585 -3.4585 -3.4485 -3.4485 -3.0595 -3.0595 -2.9525 -2.9525 -2.7543 -2.7543 -2.7260 -2.7260 3.4570 3.4570 3.4648 3.4648 3.8431 3.8431 3.8634 3.8634 4.1579 4.1579 4.1805 4.1805 4.3703 4.3703 4.3901 4.3901 4.4517 4.4517 4.5479 4.5479 4.6809 4.6809 4.7855 4.7855 4.9405 4.9405 5.0079 5.0079 5.5194 5.5194 5.5647 5.5647 6.0479 6.0479 6.1164 6.1164 6.6422 6.6422 6.6697 6.6697 7.2883 7.2883 7.3933 7.3933 11.8775 11.8775 11.9219 11.9219 13.2338 13.2338 13.2544 13.2544 13.7677 13.7677 13.7684 13.7684 14.1390 14.1390 k = 0.3684 0.5000 0.2279 ( 6756 PWs) bands (ev): -18.1308 -18.1308 -18.1308 -18.1308 -14.6195 -14.6195 -14.6174 -14.6174 -4.9563 -4.9563 -4.8719 -4.8719 -3.4377 -3.4377 -3.4322 -3.4322 -3.0615 -3.0615 -2.9712 -2.9712 -2.7747 -2.7747 -2.7423 -2.7423 3.4618 3.4618 3.4709 3.4709 3.8194 3.8194 3.8400 3.8400 4.1734 4.1734 4.1943 4.1943 4.3752 4.3752 4.3937 4.3937 4.4573 4.4573 4.5490 4.5490 4.6897 4.6897 4.7886 4.7886 4.9302 4.9302 4.9952 4.9952 5.5403 5.5403 5.5890 5.5890 6.0724 6.0724 6.1483 6.1483 6.6144 6.6144 6.6361 6.6361 7.2543 7.2543 7.3550 7.3550 11.9086 11.9086 11.9523 11.9523 13.2211 13.2211 13.2492 13.2492 13.7512 13.7512 13.7612 13.7612 14.1772 14.1772 k = 0.3816 0.5000 0.2279 ( 6756 PWs) bands (ev): -18.1287 -18.1287 -18.1287 -18.1287 -14.6219 -14.6219 -14.6200 -14.6200 -4.9529 -4.9529 -4.8747 -4.8747 -3.4167 -3.4167 -3.4155 -3.4155 -3.0633 -3.0633 -2.9899 -2.9899 -2.7944 -2.7944 -2.7585 -2.7585 3.4682 3.4682 3.4786 3.4786 3.7958 3.7958 3.8166 3.8166 4.1875 4.1875 4.2067 4.2067 4.3799 4.3799 4.3973 4.3973 4.4635 4.4635 4.5497 4.5497 4.6979 4.6979 4.7901 4.7901 4.9216 4.9216 4.9836 4.9836 5.5604 5.5604 5.6112 5.6112 6.0968 6.0968 6.1793 6.1793 6.5885 6.5885 6.6034 6.6034 7.2225 7.2225 7.3178 7.3178 11.9385 11.9385 11.9811 11.9811 13.2047 13.2047 13.2384 13.2384 13.7388 13.7388 13.7558 13.7558 14.2118 14.2118 k = 0.3947 0.5000 0.2279 ( 6748 PWs) bands (ev): -18.1268 -18.1268 -18.1268 -18.1268 -14.6241 -14.6241 -14.6224 -14.6224 -4.9492 -4.9492 -4.8778 -4.8778 -3.3986 -3.3986 -3.3956 -3.3956 -3.0653 -3.0653 -3.0086 -3.0086 -2.8130 -2.8130 -2.7743 -2.7743 3.4763 3.4763 3.4878 3.4878 3.7724 3.7724 3.7932 3.7932 4.2004 4.2004 4.2177 4.2177 4.3847 4.3847 4.4007 4.4007 4.4700 4.4700 4.5500 4.5500 4.7052 4.7052 4.7898 4.7898 4.9150 4.9150 4.9735 4.9735 5.5796 5.5796 5.6310 5.6310 6.1213 6.1213 6.2092 6.2092 6.5642 6.5642 6.5716 6.5716 7.1931 7.1931 7.2822 7.2822 11.9673 11.9673 12.0081 12.0081 13.1853 13.1853 13.2225 13.2225 13.7317 13.7317 13.7532 13.7532 14.2415 14.2415 k = 0.4079 0.5000 0.2279 ( 6740 PWs) bands (ev): -18.1251 -18.1251 -18.1251 -18.1251 -14.6261 -14.6261 -14.6246 -14.6246 -4.9453 -4.9453 -4.8814 -4.8814 -3.3816 -3.3816 -3.3749 -3.3749 -3.0677 -3.0677 -3.0269 -3.0269 -2.8301 -2.8301 -2.7897 -2.7897 3.4858 3.4858 3.4984 3.4984 3.7493 3.7493 3.7700 3.7700 4.2118 4.2118 4.2272 4.2272 4.3894 4.3894 4.4039 4.4039 4.4769 4.4769 4.5500 4.5500 4.7114 4.7114 4.7876 4.7876 4.9107 4.9107 4.9647 4.9647 5.5978 5.5978 5.6482 5.6482 6.1460 6.1460 6.2379 6.2379 6.5405 6.5405 6.5415 6.5415 7.1668 7.1668 7.2485 7.2485 11.9946 11.9946 12.0330 12.0330 13.1641 13.1641 13.2024 13.2024 13.7298 13.7298 13.7534 13.7534 14.2659 14.2659 k = 0.4211 0.5000 0.2279 ( 6744 PWs) bands (ev): -18.1236 -18.1236 -18.1236 -18.1236 -14.6278 -14.6278 -14.6265 -14.6265 -4.9411 -4.9411 -4.8852 -4.8852 -3.3646 -3.3646 -3.3548 -3.3548 -3.0708 -3.0708 -3.0446 -3.0446 -2.8450 -2.8450 -2.8045 -2.8045 3.4967 3.4967 3.5103 3.5103 3.7265 3.7265 3.7471 3.7471 4.2218 4.2218 4.2350 4.2350 4.3942 4.3942 4.4069 4.4069 4.4840 4.4840 4.5493 4.5493 4.7166 4.7166 4.7837 4.7837 4.9085 4.9085 4.9573 4.9573 5.6148 5.6148 5.6624 5.6624 6.1708 6.1708 6.2651 6.2651 6.5103 6.5103 6.5203 6.5203 7.1438 7.1438 7.2169 7.2169 12.0201 12.0201 12.0553 12.0553 13.1427 13.1427 13.1799 13.1799 13.7322 13.7322 13.7558 13.7558 14.2850 14.2850 k = 0.4342 0.5000 0.2279 ( 6760 PWs) bands (ev): -18.1223 -18.1223 -18.1223 -18.1223 -14.6293 -14.6293 -14.6282 -14.6282 -4.9367 -4.9367 -4.8894 -4.8894 -3.3479 -3.3479 -3.3358 -3.3358 -3.0751 -3.0751 -3.0613 -3.0613 -2.8573 -2.8573 -2.8185 -2.8185 3.5090 3.5090 3.5234 3.5234 3.7044 3.7044 3.7247 3.7247 4.2302 4.2302 4.2413 4.2413 4.3987 4.3987 4.4095 4.4095 4.4913 4.4913 4.5478 4.5478 4.7209 4.7209 4.7783 4.7783 4.9083 4.9083 4.9509 4.9509 5.6305 5.6305 5.6736 5.6736 6.1961 6.1961 6.2907 6.2907 6.4810 6.4810 6.5005 6.5005 7.1246 7.1246 7.1880 7.1880 12.0435 12.0435 12.0747 12.0747 13.1223 13.1223 13.1565 13.1565 13.7376 13.7376 13.7596 13.7596 14.2995 14.2995 k = 0.4474 0.5000 0.2279 ( 6760 PWs) bands (ev): -18.1212 -18.1212 -18.1212 -18.1212 -14.6305 -14.6305 -14.6296 -14.6296 -4.9321 -4.9321 -4.8938 -4.8938 -3.3320 -3.3320 -3.3187 -3.3187 -3.0805 -3.0805 -3.0763 -3.0763 -2.8664 -2.8664 -2.8315 -2.8315 3.5223 3.5223 3.5373 3.5373 3.6831 3.6831 3.7028 3.7028 4.2372 4.2372 4.2461 4.2461 4.4030 4.4030 4.4116 4.4116 4.4987 4.4987 4.5456 4.5456 4.7249 4.7249 4.7720 4.7720 4.9099 4.9099 4.9453 4.9453 5.6447 5.6447 5.6816 5.6816 6.2216 6.2216 6.3143 6.3143 6.4527 6.4527 6.4817 6.4817 7.1098 7.1098 7.1622 7.1622 12.0644 12.0644 12.0908 12.0908 13.1044 13.1044 13.1339 13.1339 13.7447 13.7447 13.7638 13.7638 14.3101 14.3101 k = 0.4605 0.5000 0.2279 ( 6764 PWs) bands (ev): -18.1204 -18.1204 -18.1204 -18.1204 -14.6314 -14.6314 -14.6307 -14.6307 -4.9274 -4.9274 -4.8984 -4.8984 -3.3172 -3.3172 -3.3044 -3.3044 -3.0888 -3.0888 -3.0870 -3.0870 -2.8721 -2.8721 -2.8434 -2.8434 3.5365 3.5365 3.5517 3.5517 3.6631 3.6631 3.6818 3.6818 4.2429 4.2429 4.2495 4.2495 4.4067 4.4067 4.4132 4.4132 4.5062 4.5062 4.5424 4.5424 4.7289 4.7289 4.7650 4.7650 4.9129 4.9129 4.9402 4.9402 5.6573 5.6573 5.6865 5.6865 6.2475 6.2475 6.3348 6.3348 6.4265 6.4265 6.4638 6.4638 7.0995 7.0995 7.1399 7.1399 12.0822 12.0822 12.1029 12.1029 13.0902 13.0902 13.1136 13.1136 13.7523 13.7523 13.7675 13.7675 14.3177 14.3177 k = 0.4737 0.5000 0.2279 ( 6776 PWs) bands (ev): -18.1198 -18.1198 -18.1197 -18.1197 -14.6320 -14.6320 -14.6316 -14.6316 -4.9226 -4.9226 -4.9031 -4.9031 -3.3044 -3.3044 -3.2940 -3.2940 -3.0979 -3.0979 -3.0938 -3.0938 -2.8743 -2.8743 -2.8538 -2.8538 3.5512 3.5512 3.5654 3.5654 3.6456 3.6456 3.6622 3.6622 4.2471 4.2471 4.2515 4.2515 4.4098 4.4098 4.4141 4.4141 4.5134 4.5134 4.5382 4.5382 4.7333 4.7333 4.7578 4.7578 4.9167 4.9167 4.9353 4.9353 5.6681 5.6681 5.6882 5.6882 6.2736 6.2736 6.3485 6.3485 6.4060 6.4060 6.4465 6.4465 7.0940 7.0940 7.1215 7.1215 12.0965 12.0965 12.1108 12.1108 13.0806 13.0806 13.0968 13.0968 13.7593 13.7593 13.7698 13.7698 14.3230 14.3230 k = 0.4868 0.5000 0.2279 ( 6780 PWs) bands (ev): -18.1194 -18.1194 -18.1194 -18.1194 -14.6324 -14.6324 -14.6321 -14.6321 -4.9177 -4.9177 -4.9079 -4.9079 -3.2946 -3.2946 -3.2888 -3.2888 -3.1028 -3.1028 -3.0997 -3.0997 -2.8731 -2.8731 -2.8625 -2.8625 3.5651 3.5651 3.5753 3.5753 3.6337 3.6337 3.6450 3.6450 4.2501 4.2501 4.2522 4.2522 4.4121 4.4121 4.4143 4.4143 4.5205 4.5205 4.5331 4.5331 4.7384 4.7384 4.7508 4.7508 4.9211 4.9211 4.9305 4.9305 5.6767 5.6767 5.6870 5.6870 6.2995 6.2995 6.3445 6.3445 6.4022 6.4022 6.4296 6.4296 7.0935 7.0935 7.1075 7.1075 12.1068 12.1068 12.1141 12.1141 13.0763 13.0763 13.0846 13.0846 13.7650 13.7650 13.7704 13.7704 14.3267 14.3267 k = 0.5000 0.5000 0.2279 ( 6800 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9128 -4.9128 -4.9128 -4.9128 -3.2891 -3.2891 -3.2891 -3.2891 -3.1031 -3.1031 -3.1031 -3.1031 -2.8691 -2.8691 -2.8691 -2.8691 3.5752 3.5752 3.5752 3.5752 3.6334 3.6334 3.6334 3.6334 4.2518 4.2518 4.2518 4.2518 4.4136 4.4136 4.4136 4.4136 4.5271 4.5271 4.5271 4.5271 4.7442 4.7442 4.7442 4.7442 4.9258 4.9258 4.9258 4.9258 5.6831 5.6831 5.6831 5.6831 6.3244 6.3244 6.3244 6.3244 6.4137 6.4137 6.4137 6.4137 7.0980 7.0980 7.0980 7.0980 12.1128 12.1128 12.1128 12.1128 13.0777 13.0777 13.0777 13.0777 13.7688 13.7688 13.7688 13.7688 14.3290 14.3290 k = 0.5000 0.5000 0.2279 ( 6800 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9128 -4.9128 -4.9128 -4.9128 -3.2891 -3.2891 -3.2891 -3.2891 -3.1031 -3.1031 -3.1031 -3.1031 -2.8691 -2.8691 -2.8691 -2.8691 3.5752 3.5752 3.5752 3.5752 3.6334 3.6334 3.6334 3.6334 4.2518 4.2518 4.2518 4.2518 4.4136 4.4136 4.4136 4.4136 4.5271 4.5271 4.5271 4.5271 4.7442 4.7442 4.7442 4.7442 4.9258 4.9258 4.9258 4.9258 5.6831 5.6831 5.6831 5.6831 6.3244 6.3244 6.3244 6.3244 6.4137 6.4137 6.4137 6.4137 7.0980 7.0980 7.0980 7.0980 12.1128 12.1128 12.1128 12.1128 13.0777 13.0777 13.0777 13.0777 13.7688 13.7688 13.7688 13.7688 14.3290 14.3290 k = 0.4906 0.4906 0.2279 ( 6784 PWs) bands (ev): -18.1195 -18.1195 -18.1193 -18.1193 -14.6324 -14.6324 -14.6321 -14.6321 -4.9178 -4.9178 -4.9078 -4.9078 -3.2950 -3.2950 -3.2886 -3.2886 -3.1034 -3.1034 -3.0989 -3.0989 -2.8733 -2.8733 -2.8623 -2.8623 3.5628 3.5628 3.5783 3.5783 3.6315 3.6315 3.6466 3.6466 4.2500 4.2500 4.2522 4.2522 4.4119 4.4119 4.4145 4.4145 4.5203 4.5203 4.5332 4.5332 4.7383 4.7383 4.7508 4.7508 4.9211 4.9211 4.9306 4.9306 5.6765 5.6765 5.6873 5.6873 6.2989 6.2989 6.3455 6.3455 6.4004 6.4004 6.4311 6.4311 7.0931 7.0931 7.1080 7.1080 12.1053 12.1053 12.1156 12.1156 13.0754 13.0754 13.0857 13.0857 13.7643 13.7643 13.7711 13.7711 14.3263 14.3263 k = 0.4811 0.4811 0.2279 ( 6778 PWs) bands (ev): -18.1201 -18.1201 -18.1194 -18.1194 -14.6320 -14.6320 -14.6315 -14.6315 -4.9228 -4.9228 -4.9029 -4.9029 -3.3062 -3.3062 -3.2927 -3.2927 -3.1018 -3.1018 -3.0895 -3.0895 -2.8754 -2.8754 -2.8527 -2.8527 3.5415 3.5415 3.5800 3.5800 3.6349 3.6349 3.6682 3.6682 4.2470 4.2470 4.2515 4.2515 4.4084 4.4084 4.4153 4.4153 4.5126 4.5126 4.5390 4.5390 4.7332 4.7332 4.7579 4.7579 4.9165 4.9165 4.9356 4.9356 5.6666 5.6666 5.6896 5.6896 6.2713 6.2713 6.3530 6.3530 6.3956 6.3956 6.4548 6.4548 7.0911 7.0911 7.1245 7.1245 12.0877 12.0877 12.1194 12.1194 13.0748 13.0748 13.1031 13.1031 13.7548 13.7548 13.7741 13.7741 14.3205 14.3205 k = 0.4717 0.4717 0.2279 ( 6754 PWs) bands (ev): -18.1212 -18.1212 -18.1195 -18.1195 -14.6314 -14.6314 -14.6306 -14.6306 -4.9278 -4.9278 -4.8979 -4.8979 -3.3219 -3.3219 -3.3003 -3.3003 -3.0990 -3.0990 -3.0756 -3.0756 -2.8756 -2.8756 -2.8402 -2.8402 3.5175 3.5175 3.5823 3.5823 3.6414 3.6414 3.6924 3.6924 4.2427 4.2427 4.2495 4.2495 4.4028 4.4028 4.4166 4.4166 4.5039 4.5039 4.5448 4.5448 4.7288 4.7288 4.7650 4.7650 4.9122 4.9122 4.9410 4.9410 5.6535 5.6535 5.6909 5.6909 6.2427 6.2427 6.3356 6.3356 6.4106 6.4106 6.4849 6.4849 7.0908 7.0908 7.1477 7.1477 12.0603 12.0603 12.1253 12.1253 13.0744 13.0744 13.1298 13.1298 13.7403 13.7403 13.7788 13.7788 14.3102 14.3102 k = 0.4623 0.4623 0.2279 ( 6758 PWs) bands (ev): -18.1228 -18.1228 -18.1197 -18.1197 -14.6305 -14.6305 -14.6294 -14.6294 -4.9329 -4.9329 -4.8929 -4.8929 -3.3408 -3.3408 -3.3105 -3.3105 -3.0953 -3.0953 -3.0589 -3.0589 -2.8744 -2.8744 -2.8251 -2.8251 3.4930 3.4930 3.5855 3.5855 3.6506 3.6506 3.7171 3.7171 4.2371 4.2371 4.2464 4.2464 4.3951 4.3951 4.4183 4.4183 4.4941 4.4941 4.5507 4.5507 4.7247 4.7247 4.7714 4.7714 4.9086 4.9086 4.9469 4.9469 5.6373 5.6373 5.6914 5.6914 6.2128 6.2128 6.3057 6.3057 6.4354 6.4354 6.5197 6.5197 7.0912 7.0912 7.1766 7.1766 12.0247 12.0247 12.1332 12.1332 13.0740 13.0740 13.1640 13.1640 13.7217 13.7217 13.7852 13.7852 14.2941 14.2941 k = 0.4528 0.4528 0.2279 ( 6754 PWs) bands (ev): -18.1248 -18.1248 -18.1200 -18.1200 -14.6294 -14.6294 -14.6278 -14.6278 -4.9380 -4.9380 -4.8879 -4.8879 -3.3621 -3.3621 -3.3223 -3.3223 -3.0907 -3.0907 -3.0404 -3.0404 -2.8719 -2.8719 -2.8078 -2.8078 3.4689 3.4689 3.5896 3.5896 3.6624 3.6624 3.7413 3.7413 4.2302 4.2302 4.2421 4.2421 4.3853 4.3853 4.4204 4.4204 4.4834 4.4834 4.5570 4.5570 4.7205 4.7205 4.7767 4.7767 4.9061 4.9061 4.9538 4.9538 5.6188 5.6188 5.6916 5.6916 6.1809 6.1809 6.2708 6.2708 6.4653 6.4653 6.5579 6.5579 7.0923 7.0923 7.2100 7.2100 11.9827 11.9827 12.1427 12.1427 13.0736 13.0736 13.2036 13.2036 13.7003 13.7003 13.7934 13.7934 14.2711 14.2711 k = 0.4434 0.4434 0.2279 ( 6746 PWs) bands (ev): -18.1272 -18.1272 -18.1203 -18.1203 -14.6280 -14.6280 -14.6259 -14.6259 -4.9431 -4.9431 -4.8829 -4.8829 -3.3850 -3.3850 -3.3351 -3.3351 -3.0854 -3.0854 -3.0211 -3.0211 -2.8682 -2.8682 -2.7888 -2.7888 3.4456 3.4456 3.5946 3.5946 3.6766 3.6766 3.7648 3.7648 4.2221 4.2221 4.2367 4.2367 4.3735 4.3735 4.4226 4.4226 4.4721 4.4721 4.5638 4.5638 4.7159 4.7159 4.7802 4.7802 4.9050 4.9050 4.9620 4.9620 5.5987 5.5987 5.6916 5.6916 6.1452 6.1452 6.2354 6.2354 6.4992 6.4992 6.5988 6.5988 7.0939 7.0939 7.2467 7.2467 11.9360 11.9360 12.1535 12.1535 13.0733 13.0733 13.2468 13.2468 13.6775 13.6775 13.8035 13.8035 14.2404 14.2404 k = 0.4340 0.4340 0.2279 ( 6758 PWs) bands (ev): -18.1300 -18.1300 -18.1207 -18.1207 -14.6264 -14.6264 -14.6237 -14.6237 -4.9483 -4.9483 -4.8778 -4.8778 -3.4089 -3.4089 -3.3483 -3.3483 -3.0795 -3.0795 -3.0016 -3.0016 -2.8632 -2.8632 -2.7685 -2.7685 3.4235 3.4235 3.6005 3.6005 3.6933 3.6933 3.7870 3.7870 4.2128 4.2128 4.2301 4.2301 4.3598 4.3598 4.4246 4.4246 4.4608 4.4608 4.5710 4.5710 4.7103 4.7103 4.7817 4.7817 4.9055 4.9055 4.9718 4.9718 5.5776 5.5776 5.6913 5.6913 6.1041 6.1041 6.2025 6.2025 6.5363 6.5363 6.6417 6.6417 7.0960 7.0960 7.2854 7.2854 11.8862 11.8862 12.1648 12.1648 13.0729 13.0729 13.2915 13.2915 13.6546 13.6546 13.8152 13.8152 14.2018 14.2018 k = 0.4245 0.4245 0.2279 ( 6750 PWs) bands (ev): -18.1332 -18.1332 -18.1211 -18.1211 -14.6245 -14.6245 -14.6211 -14.6211 -4.9535 -4.9535 -4.8727 -4.8727 -3.4336 -3.4336 -3.3614 -3.3614 -3.0728 -3.0728 -2.9826 -2.9826 -2.8569 -2.8569 -2.7474 -2.7474 3.4027 3.4027 3.6073 3.6073 3.7122 3.7122 3.8077 3.8077 4.2025 4.2025 4.2225 4.2225 4.3444 4.3444 4.4249 4.4249 4.4512 4.4512 4.5787 4.5787 4.7032 4.7032 4.7813 4.7813 4.9074 4.9074 4.9836 4.9836 5.5563 5.5563 5.6911 5.6911 6.0571 6.0571 6.1739 6.1739 6.5763 6.5763 6.6862 6.6862 7.0987 7.0987 7.3255 7.3255 11.8343 11.8343 12.1763 12.1763 13.0726 13.0726 13.3364 13.3364 13.6327 13.6327 13.8284 13.8284 14.1557 14.1557 k = 0.4151 0.4151 0.2279 ( 6754 PWs) bands (ev): -18.1367 -18.1367 -18.1216 -18.1216 -14.6224 -14.6224 -14.6183 -14.6183 -4.9586 -4.9586 -4.8675 -4.8675 -3.4587 -3.4587 -3.3742 -3.3742 -3.0655 -3.0655 -2.9644 -2.9644 -2.8492 -2.8492 -2.7259 -2.7259 3.3836 3.3836 3.6149 3.6149 3.7334 3.7334 3.8267 3.8267 4.1912 4.1912 4.2138 4.2138 4.3273 4.3273 4.4204 4.4204 4.4465 4.4465 4.5866 4.5866 4.6946 4.6946 4.7792 4.7792 4.9106 4.9106 4.9974 4.9974 5.5352 5.5352 5.6907 5.6907 6.0053 6.0053 6.1492 6.1492 6.6185 6.6185 6.7320 6.7320 7.1020 7.1020 7.3661 7.3661 11.7814 11.7814 12.1870 12.1870 13.0724 13.0724 13.3801 13.3801 13.6129 13.6129 13.8428 13.8428 14.1032 14.1032 k = 0.4057 0.4057 0.2279 ( 6748 PWs) bands (ev): -18.1407 -18.1407 -18.1222 -18.1222 -14.6201 -14.6201 -14.6151 -14.6151 -4.9637 -4.9637 -4.8622 -4.8622 -3.4839 -3.4839 -3.3864 -3.3864 -3.0575 -3.0575 -2.9474 -2.9474 -2.8399 -2.8399 -2.7043 -2.7043 3.3663 3.3663 3.6233 3.6233 3.7565 3.7565 3.8437 3.8437 4.1789 4.1789 4.2040 4.2040 4.3087 4.3087 4.4106 4.4106 4.4472 4.4472 4.5947 4.5947 4.6846 4.6846 4.7757 4.7757 4.9148 4.9148 5.0131 5.0131 5.5148 5.5148 5.6904 5.6904 5.9505 5.9505 6.1279 6.1279 6.6626 6.6626 6.7787 6.7787 7.1061 7.1061 7.4068 7.4068 11.7281 11.7281 12.1964 12.1964 13.0723 13.0723 13.4215 13.4215 13.5960 13.5960 13.8578 13.8578 14.0461 14.0461 k = 0.3962 0.3962 0.2279 ( 6754 PWs) bands (ev): -18.1450 -18.1450 -18.1228 -18.1228 -14.6176 -14.6176 -14.6117 -14.6117 -4.9688 -4.9688 -4.8569 -4.8569 -3.5091 -3.5091 -3.3979 -3.3979 -3.0488 -3.0488 -2.9319 -2.9319 -2.8291 -2.8291 -2.6829 -2.6829 3.3510 3.3510 3.6326 3.6326 3.7814 3.7814 3.8587 3.8587 4.1660 4.1660 4.1930 4.1930 4.2887 4.2887 4.3988 4.3988 4.4503 4.4503 4.6021 4.6021 4.6737 4.6737 4.7706 4.7706 4.9199 4.9199 5.0305 5.0305 5.4951 5.4951 5.6901 5.6901 5.8942 5.8942 6.1093 6.1093 6.7083 6.7083 6.8256 6.8256 7.1114 7.1114 7.4471 7.4471 11.6752 11.6752 12.2036 12.2036 13.0724 13.0724 13.4598 13.4598 13.5824 13.5824 13.8720 13.8720 13.9878 13.9878 k = 0.3868 0.3868 0.2279 ( 6754 PWs) bands (ev): -18.1497 -18.1497 -18.1234 -18.1234 -14.6149 -14.6149 -14.6079 -14.6079 -4.9739 -4.9739 -4.8515 -4.8515 -3.5341 -3.5341 -3.4085 -3.4085 -3.0396 -3.0396 -2.9180 -2.9180 -2.8168 -2.8168 -2.6619 -2.6619 3.3377 3.3377 3.6427 3.6427 3.8078 3.8078 3.8713 3.8713 4.1525 4.1525 4.1809 4.1809 4.2676 4.2676 4.3866 4.3866 4.4542 4.4542 4.6080 4.6080 4.6636 4.6636 4.7639 4.7639 4.9261 4.9261 5.0491 5.0491 5.4763 5.4763 5.6898 5.6898 5.8377 5.8377 6.0931 6.0931 6.7552 6.7552 6.8721 6.8721 7.1182 7.1182 7.4868 7.4868 11.6230 11.6230 12.2080 12.2080 13.0726 13.0726 13.4940 13.4940 13.5721 13.5721 13.8784 13.8784 13.9373 13.9373 k = 0.3774 0.3774 0.2279 ( 6758 PWs) bands (ev): -18.1547 -18.1547 -18.1241 -18.1241 -14.6120 -14.6120 -14.6039 -14.6039 -4.9788 -4.9788 -4.8460 -4.8460 -3.5588 -3.5588 -3.4182 -3.4182 -3.0297 -3.0297 -2.9056 -2.9056 -2.8033 -2.8033 -2.6415 -2.6415 3.3266 3.3266 3.6535 3.6535 3.8352 3.8352 3.8815 3.8815 4.1385 4.1385 4.1676 4.1676 4.2454 4.2454 4.3747 4.3747 4.4580 4.4580 4.6100 4.6100 4.6569 4.6569 4.7554 4.7554 4.9333 4.9333 5.0685 5.0685 5.4580 5.4580 5.6897 5.6897 5.7824 5.7824 6.0792 6.0792 6.8031 6.8031 6.9170 6.9170 7.1275 7.1275 7.5256 7.5256 11.5720 11.5720 12.2089 12.2089 13.0731 13.0731 13.5223 13.5223 13.5654 13.5654 13.8510 13.8510 13.9241 13.9241 k = 0.3679 0.3679 0.2279 ( 6752 PWs) bands (ev): -18.1600 -18.1600 -18.1249 -18.1249 -14.6089 -14.6089 -14.5997 -14.5997 -4.9836 -4.9836 -4.8404 -4.8404 -3.5831 -3.5831 -3.4269 -3.4269 -3.0192 -3.0192 -2.8945 -2.8945 -2.7891 -2.7891 -2.6219 -2.6219 3.3178 3.3178 3.6650 3.6650 3.8628 3.8628 3.8896 3.8896 4.1245 4.1245 4.1531 4.1531 4.2224 4.2224 4.3635 4.3635 4.4613 4.4613 4.6061 4.6061 4.6562 4.6562 4.7448 4.7448 4.9417 4.9417 5.0882 5.0882 5.4397 5.4397 5.6896 5.6896 5.7301 5.7301 6.0675 6.0675 6.8518 6.8518 6.9588 6.9588 7.1406 7.1406 7.5634 7.5634 11.5224 11.5224 12.2059 12.2059 13.0739 13.0739 13.5356 13.5356 13.5677 13.5677 13.8079 13.8079 13.9347 13.9347 k = 0.3585 0.3585 0.2279 ( 6750 PWs) bands (ev): -18.1655 -18.1655 -18.1256 -18.1256 -14.6057 -14.6057 -14.5952 -14.5952 -4.9883 -4.9883 -4.8348 -4.8348 -3.6068 -3.6068 -3.4347 -3.4347 -3.0082 -3.0082 -2.8843 -2.8843 -2.7744 -2.7744 -2.6031 -2.6031 3.3113 3.3113 3.6771 3.6771 3.8865 3.8865 3.8989 3.8989 4.1108 4.1108 4.1375 4.1375 4.1988 4.1988 4.3533 4.3533 4.4632 4.4632 4.5981 4.5981 4.6605 4.6605 4.7321 4.7321 4.9514 4.9514 5.1075 5.1075 5.4204 5.4204 5.6791 5.6791 5.6932 5.6932 6.0583 6.0583 6.9011 6.9011 6.9953 6.9953 7.1595 7.1595 7.5999 7.5999 11.4744 11.4744 12.1987 12.1987 13.0748 13.0748 13.5244 13.5244 13.5836 13.5836 13.7757 13.7757 13.9485 13.9485 k = 0.3491 0.3491 0.2279 ( 6750 PWs) bands (ev): -18.1713 -18.1713 -18.1265 -18.1265 -14.6023 -14.6023 -14.5904 -14.5904 -4.9927 -4.9927 -4.8290 -4.8290 -3.6299 -3.6299 -3.4415 -3.4415 -2.9967 -2.9967 -2.8749 -2.8749 -2.7599 -2.7599 -2.5853 -2.5853 3.3072 3.3072 3.6898 3.6898 3.8934 3.8934 3.9209 3.9209 4.0979 4.0979 4.1212 4.1212 4.1747 4.1747 4.3442 4.3442 4.4631 4.4631 4.5897 4.5897 4.6669 4.6669 4.7173 4.7173 4.9623 4.9623 5.1256 5.1256 5.3989 5.3989 5.6396 5.6396 5.6924 5.6924 6.0515 6.0515 6.9507 6.9507 7.0245 7.0245 7.1858 7.1858 7.6350 7.6350 11.4283 11.4283 12.1872 12.1872 13.0761 13.0761 13.4977 13.4977 13.6005 13.6005 13.7617 13.7617 13.9625 13.9625 k = 0.3396 0.3396 0.2279 ( 6754 PWs) bands (ev): -18.1774 -18.1774 -18.1273 -18.1273 -14.5989 -14.5989 -14.5855 -14.5855 -4.9969 -4.9969 -4.8232 -4.8232 -3.6523 -3.6523 -3.4473 -3.4473 -2.9847 -2.9847 -2.8659 -2.8659 -2.7456 -2.7456 -2.5686 -2.5686 3.3055 3.3055 3.7030 3.7030 3.8935 3.8935 3.9435 3.9435 4.0857 4.0857 4.1060 4.1060 4.1504 4.1504 4.3363 4.3363 4.4599 4.4599 4.5835 4.5835 4.6734 4.6734 4.7009 4.7009 4.9743 4.9743 5.1410 5.1410 5.3752 5.3752 5.6073 5.6073 5.6936 5.6936 6.0473 6.0473 7.0003 7.0003 7.0463 7.0463 7.2197 7.2197 7.6687 7.6687 11.3842 11.3842 12.1717 12.1717 13.0775 13.0775 13.4608 13.4608 13.6144 13.6144 13.7654 13.7654 13.9762 13.9762 k = 0.3302 0.3302 0.2279 ( 6762 PWs) bands (ev): -18.1837 -18.1837 -18.1282 -18.1282 -14.5953 -14.5953 -14.5803 -14.5803 -5.0009 -5.0009 -4.8173 -4.8173 -3.6739 -3.6739 -3.4522 -3.4522 -2.9723 -2.9723 -2.8572 -2.8572 -2.7321 -2.7321 -2.5529 -2.5529 3.3062 3.3062 3.7165 3.7165 3.8906 3.8906 3.9599 3.9599 4.0713 4.0713 4.0972 4.0972 4.1265 4.1265 4.3297 4.3297 4.4532 4.4532 4.5809 4.5809 4.6755 4.6755 4.6867 4.6867 4.9870 4.9870 5.1515 5.1515 5.3512 5.3512 5.5844 5.5844 5.6955 5.6955 6.0459 6.0459 7.0466 7.0466 7.0653 7.0653 7.2592 7.2592 7.7010 7.7010 11.3420 11.3420 12.1526 12.1526 13.0790 13.0790 13.4193 13.4193 13.6246 13.6246 13.7821 13.7821 13.9898 13.9898 k = 0.3208 0.3208 0.2279 ( 6756 PWs) bands (ev): -18.1901 -18.1901 -18.1291 -18.1291 -14.5916 -14.5916 -14.5750 -14.5750 -5.0045 -5.0045 -4.8113 -4.8113 -3.6947 -3.6947 -3.4563 -3.4563 -2.9596 -2.9596 -2.8488 -2.8488 -2.7193 -2.7193 -2.5384 -2.5384 3.3094 3.3094 3.7303 3.7303 3.8852 3.8852 3.9664 3.9664 4.0523 4.0523 4.0942 4.0942 4.1090 4.1090 4.3245 4.3245 4.4433 4.4433 4.5825 4.5825 4.6596 4.6596 4.6880 4.6880 4.9999 4.9999 5.1538 5.1538 5.3316 5.3316 5.5704 5.5704 5.6982 5.6982 6.0474 6.0474 7.0680 7.0680 7.1053 7.1053 7.3022 7.3022 7.7317 7.7317 11.3018 11.3018 12.1304 12.1304 13.0806 13.0806 13.3775 13.3775 13.6303 13.6303 13.8074 13.8074 14.0034 14.0034 k = 0.3113 0.3113 0.2279 ( 6744 PWs) bands (ev): -18.1968 -18.1968 -18.1301 -18.1301 -14.5878 -14.5878 -14.5695 -14.5695 -5.0078 -5.0078 -4.8053 -4.8053 -3.7146 -3.7146 -3.4594 -3.4594 -2.9466 -2.9466 -2.8404 -2.8404 -2.7076 -2.7076 -2.5250 -2.5250 3.3149 3.3149 3.7441 3.7441 3.8775 3.8775 3.9631 3.9631 4.0304 4.0304 4.0740 4.0740 4.1185 4.1185 4.3206 4.3206 4.4309 4.4309 4.5879 4.5879 4.6387 4.6387 4.6914 4.6914 5.0113 5.0113 5.1462 5.1462 5.3218 5.3218 5.5638 5.5638 5.7018 5.7018 6.0520 6.0520 7.0772 7.0772 7.1549 7.1549 7.3465 7.3465 7.7610 7.7610 11.2636 11.2636 12.1060 12.1060 13.0821 13.0821 13.3383 13.3383 13.6314 13.6314 13.8379 13.8379 14.0167 14.0167 k = 0.3019 0.3019 0.2279 ( 6736 PWs) bands (ev): -18.2035 -18.2035 -18.1311 -18.1311 -14.5840 -14.5840 -14.5639 -14.5639 -5.0107 -5.0107 -4.7993 -4.7993 -3.7336 -3.7336 -3.4619 -3.4619 -2.9333 -2.9333 -2.8321 -2.8321 -2.6970 -2.6970 -2.5127 -2.5127 3.3227 3.3227 3.7578 3.7578 3.8678 3.8678 3.9529 3.9529 4.0069 4.0069 4.0499 4.0499 4.1369 4.1369 4.3180 4.3180 4.4170 4.4170 4.5958 4.5958 4.6172 4.6172 4.6929 4.6929 5.0174 5.0174 5.1332 5.1332 5.3228 5.3228 5.5628 5.5628 5.7062 5.7062 6.0597 6.0597 7.0839 7.0839 7.2052 7.2052 7.3910 7.3910 7.7889 7.7889 11.2272 11.2272 12.0803 12.0803 13.0833 13.0833 13.3032 13.3032 13.6277 13.6277 13.8709 13.8709 14.0280 14.0280 k = 0.2925 0.2925 0.2279 ( 6736 PWs) bands (ev): -18.2104 -18.2104 -18.1321 -18.1321 -14.5801 -14.5801 -14.5581 -14.5581 -5.0131 -5.0131 -4.7932 -4.7932 -3.7517 -3.7517 -3.4636 -3.4636 -2.9200 -2.9200 -2.8238 -2.8238 -2.6875 -2.6875 -2.5015 -2.5015 3.3327 3.3327 3.7710 3.7710 3.8565 3.8565 3.9386 3.9386 3.9825 3.9825 4.0252 4.0252 4.1567 4.1567 4.3168 4.3168 4.4027 4.4027 4.5904 4.5904 4.6110 4.6110 4.6915 4.6915 5.0119 5.0119 5.1263 5.1263 5.3315 5.3315 5.5661 5.5661 5.7117 5.7117 6.0706 6.0706 7.0892 7.0892 7.2557 7.2557 7.4346 7.4346 7.8153 7.8153 11.1925 11.1925 12.0542 12.0542 13.0838 13.0838 13.2728 13.2728 13.6196 13.6196 13.9039 13.9039 13.9845 13.9845 k = 0.2830 0.2830 0.2279 ( 6736 PWs) bands (ev): -18.2174 -18.2174 -18.1331 -18.1331 -14.5761 -14.5761 -14.5523 -14.5523 -5.0151 -5.0151 -4.7872 -4.7872 -3.7688 -3.7688 -3.4647 -3.4647 -2.9068 -2.9068 -2.8154 -2.8154 -2.6793 -2.6793 -2.4914 -2.4914 3.3448 3.3448 3.7833 3.7833 3.8439 3.8439 3.9221 3.9221 3.9574 3.9574 4.0003 4.0003 4.1748 4.1748 4.3170 4.3170 4.3888 4.3888 4.5674 4.5674 4.6244 4.6244 4.6862 4.6862 4.9932 4.9932 5.1323 5.1323 5.3444 5.3444 5.5729 5.5729 5.7184 5.7184 6.0848 6.0848 7.0937 7.0937 7.3061 7.3061 7.4767 7.4767 7.8404 7.8404 11.1593 11.1593 12.0287 12.0287 13.0832 13.0832 13.2474 13.2474 13.6074 13.6074 13.8577 13.8577 13.9358 13.9358 k = 0.2736 0.2736 0.2279 ( 6730 PWs) bands (ev): -18.2245 -18.2245 -18.1342 -18.1342 -14.5722 -14.5722 -14.5463 -14.5463 -5.0166 -5.0166 -4.7812 -4.7812 -3.7848 -3.7848 -3.4652 -3.4652 -2.8938 -2.8938 -2.8069 -2.8069 -2.6723 -2.6723 -2.4823 -2.4823 3.3589 3.3589 3.7935 3.7935 3.8313 3.8313 3.9043 3.9043 3.9321 3.9321 3.9752 3.9752 4.1894 4.1894 4.3181 4.3181 4.3764 4.3764 4.5433 4.5433 4.6406 4.6406 4.6764 4.6764 4.9682 4.9682 5.1483 5.1483 5.3596 5.3596 5.5823 5.5823 5.7264 5.7264 6.1022 6.1022 7.0976 7.0976 7.3564 7.3564 7.5168 7.5168 7.8643 7.8643 11.1274 11.1274 12.0049 12.0049 13.0808 13.0808 13.2268 13.2268 13.5917 13.5917 13.7285 13.7285 13.9616 13.9616 k = 0.2642 0.2642 0.2279 ( 6730 PWs) bands (ev): -18.2315 -18.2315 -18.1352 -18.1352 -14.5682 -14.5682 -14.5403 -14.5403 -5.0175 -5.0175 -4.7753 -4.7753 -3.7998 -3.7998 -3.4652 -3.4652 -2.8813 -2.8813 -2.7981 -2.7981 -2.6664 -2.6664 -2.4742 -2.4742 3.3749 3.3749 3.7968 3.7968 3.8233 3.8233 3.8856 3.8856 3.9066 3.9066 3.9499 3.9499 4.1997 4.1997 4.3187 4.3187 4.3671 4.3671 4.5189 4.5189 4.6518 4.6518 4.6682 4.6682 4.9439 4.9439 5.1698 5.1698 5.3760 5.3760 5.5938 5.5938 5.7357 5.7357 6.1227 6.1227 7.1010 7.1010 7.4064 7.4064 7.5542 7.5542 7.8872 7.8872 11.0966 11.0966 11.9837 11.9837 13.0758 13.0758 13.2105 13.2105 13.5730 13.5730 13.5989 13.5989 13.9731 13.9731 k = 0.2547 0.2547 0.2279 ( 6736 PWs) bands (ev): -18.2387 -18.2387 -18.1363 -18.1363 -14.5642 -14.5642 -14.5342 -14.5342 -5.0179 -5.0179 -4.7695 -4.7695 -3.8137 -3.8137 -3.4649 -3.4649 -2.8694 -2.8694 -2.7889 -2.7889 -2.6617 -2.6617 -2.4671 -2.4671 3.3925 3.3925 3.7870 3.7870 3.8257 3.8257 3.8664 3.8664 3.8811 3.8811 3.9246 3.9246 4.2058 4.2058 4.3164 4.3164 4.3628 4.3628 4.4947 4.4947 4.6341 4.6341 4.6848 4.6848 4.9238 4.9238 5.1944 5.1944 5.3932 5.3932 5.6070 5.6070 5.7464 5.7464 6.1463 6.1463 7.1039 7.1039 7.4562 7.4562 7.5888 7.5888 7.9091 7.9091 11.0666 11.0666 11.9661 11.9661 13.0672 13.0672 13.1977 13.1977 13.4695 13.4695 13.5521 13.5521 13.9040 13.9040 k = 0.2453 0.2453 0.2279 ( 6740 PWs) bands (ev): -18.2457 -18.2457 -18.1374 -18.1374 -14.5603 -14.5603 -14.5281 -14.5281 -5.0177 -5.0177 -4.7638 -4.7638 -3.8265 -3.8265 -3.4642 -3.4642 -2.8586 -2.8586 -2.7792 -2.7792 -2.6580 -2.6580 -2.4608 -2.4608 3.4117 3.4117 3.7707 3.7707 3.8317 3.8317 3.8470 3.8470 3.8561 3.8561 3.8993 3.8993 4.2082 4.2082 4.3105 4.3105 4.3637 4.3637 4.4709 4.4709 4.6066 4.6066 4.7072 4.7072 4.9092 4.9092 5.2207 5.2207 5.4114 5.4114 5.6217 5.6217 5.7586 5.7586 6.1729 6.1729 7.1064 7.1064 7.5056 7.5056 7.6201 7.6201 7.9303 7.9303 11.0372 11.0372 11.9529 11.9529 13.0533 13.0533 13.1874 13.1874 13.3413 13.3413 13.5292 13.5292 13.8334 13.8334 k = 0.2358 0.2358 0.2279 ( 6734 PWs) bands (ev): -18.2528 -18.2528 -18.1384 -18.1384 -14.5564 -14.5564 -14.5221 -14.5221 -5.0169 -5.0169 -4.7584 -4.7584 -3.8381 -3.8381 -3.4633 -3.4633 -2.8491 -2.8491 -2.7688 -2.7688 -2.6552 -2.6552 -2.4553 -2.4553 3.4322 3.4322 3.7520 3.7520 3.8255 3.8255 3.8305 3.8305 3.8399 3.8399 3.8745 3.8745 4.2078 4.2078 4.3025 4.3025 4.3673 4.3673 4.4480 4.4480 4.5746 4.5746 4.7310 4.7310 4.8999 4.8999 5.2477 5.2477 5.4310 5.4310 5.6373 5.6373 5.7722 5.7722 6.2023 6.2023 7.1086 7.1086 7.5546 7.5546 7.6479 7.6479 7.9509 7.9509 11.0080 11.0080 11.9447 11.9447 13.0326 13.0326 13.1774 13.1774 13.2153 13.2153 13.5050 13.5050 13.7723 13.7723 k = 0.2264 0.2264 0.2279 ( 6738 PWs) bands (ev): -18.2598 -18.2598 -18.1395 -18.1395 -14.5525 -14.5525 -14.5160 -14.5160 -5.0155 -5.0155 -4.7533 -4.7533 -3.8485 -3.8485 -3.4624 -3.4624 -2.8412 -2.8412 -2.7577 -2.7577 -2.6531 -2.6531 -2.4505 -2.4505 3.4539 3.4539 3.7316 3.7316 3.8037 3.8037 3.8088 3.8088 3.8433 3.8433 3.8503 3.8503 4.2050 4.2050 4.2938 4.2938 4.3712 4.3712 4.4266 4.4266 4.5399 4.5399 4.7550 4.7550 4.8954 4.8954 5.2742 5.2742 5.4527 5.4527 5.6537 5.6537 5.7873 5.7873 6.2342 6.2342 7.1104 7.1104 7.6030 7.6030 7.6722 7.6722 7.9711 7.9711 10.9789 10.9789 11.9420 11.9420 13.0031 13.0031 13.0877 13.0877 13.1704 13.1704 13.4798 13.4798 13.7232 13.7232 k = 0.2170 0.2170 0.2279 ( 6746 PWs) bands (ev): -18.2667 -18.2667 -18.1406 -18.1406 -14.5487 -14.5487 -14.5100 -14.5100 -5.0135 -5.0135 -4.7485 -4.7485 -3.8577 -3.8577 -3.4613 -3.4613 -2.8351 -2.8351 -2.7457 -2.7457 -2.6515 -2.6515 -2.4464 -2.4464 3.4764 3.4764 3.7098 3.7098 3.7803 3.7803 3.7884 3.7884 3.8270 3.8270 3.8456 3.8456 4.2004 4.2004 4.2854 4.2854 4.3726 4.3726 4.4085 4.4085 4.5043 4.5043 4.7784 4.7784 4.8951 4.8951 5.2992 5.2992 5.4772 5.4772 5.6707 5.6707 5.8040 5.8040 6.2684 6.2684 7.1119 7.1119 7.6504 7.6504 7.6932 7.6932 7.9910 7.9910 10.9497 10.9497 11.9454 11.9454 12.9611 12.9611 12.9671 12.9671 13.1591 13.1591 13.4540 13.4540 13.6875 13.6875 k = 0.2075 0.2075 0.2279 ( 6748 PWs) bands (ev): -18.2735 -18.2735 -18.1416 -18.1416 -14.5450 -14.5450 -14.5040 -14.5040 -5.0108 -5.0108 -4.7441 -4.7441 -3.8656 -3.8656 -3.4604 -3.4604 -2.8309 -2.8309 -2.7331 -2.7331 -2.6503 -2.6503 -2.4430 -2.4430 3.4995 3.4995 3.6864 3.6864 3.7572 3.7572 3.7685 3.7685 3.8050 3.8050 3.8459 3.8459 4.1941 4.1941 4.2772 4.2772 4.3670 4.3670 4.3980 4.3980 4.4692 4.4692 4.8000 4.8000 4.8992 4.8992 5.3216 5.3216 5.5051 5.5051 5.6882 5.6882 5.8223 5.8223 6.3047 6.3047 7.1129 7.1129 7.6928 7.6928 7.7145 7.7145 8.0109 8.0109 10.9200 10.9200 11.9548 11.9548 12.8421 12.8421 12.9156 12.9156 13.1441 13.1441 13.4279 13.4279 13.6655 13.6655 k = 0.1981 0.1981 0.2279 ( 6752 PWs) bands (ev): -18.2802 -18.2802 -18.1427 -18.1427 -14.5413 -14.5413 -14.4981 -14.4981 -5.0074 -5.0074 -4.7401 -4.7401 -3.8721 -3.8721 -3.4597 -3.4597 -2.8285 -2.8285 -2.7199 -2.7199 -2.6494 -2.6494 -2.4401 -2.4401 3.5229 3.5229 3.6613 3.6613 3.7353 3.7353 3.7490 3.7490 3.7842 3.7842 3.8442 3.8442 4.1861 4.1861 4.2690 4.2690 4.3535 4.3535 4.3955 4.3955 4.4362 4.4362 4.8189 4.8189 4.9076 4.9076 5.3411 5.3411 5.5364 5.5364 5.7058 5.7058 5.8423 5.8423 6.3429 6.3429 7.1134 7.1134 7.7147 7.7147 7.7519 7.7519 8.0308 8.0308 10.8898 10.8898 11.9704 11.9704 12.7225 12.7225 12.8585 12.8585 13.1230 13.1230 13.4018 13.4018 13.6563 13.6563 k = 0.1887 0.1887 0.2279 ( 6754 PWs) bands (ev): -18.2868 -18.2868 -18.1437 -18.1437 -14.5378 -14.5378 -14.4923 -14.4923 -5.0035 -5.0035 -4.7367 -4.7367 -3.8774 -3.8774 -3.4592 -3.4592 -2.8279 -2.8279 -2.7063 -2.7063 -2.6484 -2.6484 -2.4378 -2.4378 3.5461 3.5461 3.6346 3.6346 3.7148 3.7148 3.7300 3.7300 3.7649 3.7649 3.8407 3.8407 4.1765 4.1765 4.2604 4.2604 4.3372 4.3372 4.3935 4.3935 4.4090 4.4090 4.8345 4.8345 4.9202 4.9202 5.3577 5.3577 5.5707 5.5707 5.7234 5.7234 5.8643 5.8643 6.3826 6.3826 7.1135 7.1135 7.7241 7.7241 7.7972 7.7972 8.0510 8.0510 10.8589 10.8589 11.9918 11.9918 12.6054 12.6054 12.7948 12.7948 13.0941 13.0941 13.3758 13.3758 13.6583 13.6583 k = 0.1792 0.1792 0.2279 ( 6754 PWs) bands (ev): -18.2931 -18.2931 -18.1447 -18.1447 -14.5343 -14.5343 -14.4867 -14.4867 -4.9989 -4.9989 -4.7339 -4.7339 -3.8812 -3.8812 -3.4591 -3.4591 -2.8290 -2.8290 -2.6927 -2.6927 -2.6472 -2.6472 -2.4359 -2.4359 3.5682 3.5682 3.6067 3.6067 3.6963 3.6963 3.7119 3.7119 3.7469 3.7469 3.8356 3.8356 4.1654 4.1654 4.2503 4.2503 4.3198 4.3198 4.3775 4.3775 4.4017 4.4017 4.8472 4.8472 4.9363 4.9363 5.3717 5.3717 5.6068 5.6068 5.7409 5.7409 5.8884 5.8884 6.4237 6.4237 7.1131 7.1131 7.7285 7.7285 7.8429 7.8429 8.0716 8.0716 10.8273 10.8273 12.0184 12.0184 12.4910 12.4910 12.7267 12.7267 13.0570 13.0570 13.3503 13.3503 13.6698 13.6698 k = 0.1698 0.1698 0.2279 ( 6746 PWs) bands (ev): -18.2993 -18.2993 -18.1457 -18.1457 -14.5310 -14.5310 -14.4812 -14.4812 -4.9936 -4.9936 -4.7317 -4.7317 -3.8836 -3.8836 -3.4594 -3.4594 -2.8317 -2.8317 -2.6794 -2.6794 -2.6455 -2.6455 -2.4344 -2.4344 3.5750 3.5750 3.5905 3.5905 3.6801 3.6801 3.6956 3.6956 3.7303 3.7303 3.8292 3.8292 4.1532 4.1532 4.2383 4.2383 4.3002 4.3002 4.3612 4.3612 4.4021 4.4021 4.8578 4.8578 4.9546 4.9546 5.3837 5.3837 5.6436 5.6436 5.7581 5.7581 5.9151 5.9151 6.4656 6.4656 7.1122 7.1122 7.7290 7.7290 7.8884 7.8884 8.0926 8.0926 10.7950 10.7950 12.0489 12.0489 12.3795 12.3795 12.6560 12.6560 13.0132 13.0132 13.3256 13.3256 13.6892 13.6892 k = 0.1604 0.1604 0.2279 ( 6734 PWs) bands (ev): -18.3052 -18.3052 -18.1466 -18.1466 -14.5278 -14.5278 -14.4759 -14.4759 -4.9878 -4.9878 -4.7303 -4.7303 -3.8847 -3.8847 -3.4603 -3.4603 -2.8357 -2.8357 -2.6674 -2.6674 -2.6424 -2.6424 -2.4333 -2.4333 3.5463 3.5463 3.6040 3.6040 3.6661 3.6661 3.6833 3.6833 3.7154 3.7154 3.8220 3.8220 4.1400 4.1400 4.2241 4.2241 4.2788 4.2788 4.3515 4.3515 4.4029 4.4029 4.8675 4.8675 4.9740 4.9740 5.3941 5.3941 5.6798 5.6798 5.7750 5.7750 5.9447 5.9447 6.5083 6.5083 7.1107 7.1107 7.7259 7.7259 7.9331 7.9331 8.1141 8.1141 10.7620 10.7620 12.0817 12.0817 12.2713 12.2713 12.5842 12.5842 12.9661 12.9661 13.3020 13.3020 13.7150 13.7150 k = 0.1509 0.1509 0.2279 ( 6726 PWs) bands (ev): -18.3110 -18.3110 -18.1475 -18.1475 -14.5247 -14.5247 -14.4707 -14.4707 -4.9813 -4.9813 -4.7296 -4.7296 -3.8843 -3.8843 -3.4619 -3.4619 -2.8408 -2.8408 -2.6582 -2.6582 -2.6363 -2.6363 -2.4326 -2.4326 3.5161 3.5161 3.6090 3.6090 3.6524 3.6524 3.6792 3.6792 3.7039 3.7039 3.8145 3.8145 4.1261 4.1261 4.2081 4.2081 4.2573 4.2573 4.3469 4.3469 4.4036 4.4036 4.8768 4.8768 4.9935 4.9935 5.4033 5.4033 5.7140 5.7140 5.7915 5.7915 5.9775 5.9775 6.5513 6.5513 7.1086 7.1086 7.7197 7.7197 7.9771 7.9771 8.1362 8.1362 10.7283 10.7283 12.1140 12.1140 12.1666 12.1666 12.5125 12.5125 12.9204 12.9204 13.2797 13.2797 13.7463 13.7463 k = 0.1415 0.1415 0.2279 ( 6718 PWs) bands (ev): -18.3164 -18.3164 -18.1484 -18.1484 -14.5218 -14.5218 -14.4658 -14.4658 -4.9743 -4.9743 -4.7297 -4.7297 -3.8825 -3.8825 -3.4642 -3.4642 -2.8468 -2.8468 -2.6530 -2.6530 -2.6265 -2.6265 -2.4322 -2.4322 3.4859 3.4859 3.6045 3.6045 3.6382 3.6382 3.6759 3.6759 3.7034 3.7034 3.8073 3.8073 4.1118 4.1118 4.1906 4.1906 4.2369 4.2369 4.3453 4.3453 4.4042 4.4042 4.8861 4.8861 5.0127 5.0127 5.4116 5.4116 5.7453 5.7453 5.8078 5.8078 6.0136 6.0136 6.5942 6.5942 7.1058 7.1058 7.7108 7.7108 8.0201 8.0201 8.1587 8.1587 10.6942 10.6942 12.0656 12.0656 12.1421 12.1421 12.4420 12.4420 12.8820 12.8820 13.2587 13.2587 13.7821 13.7821 k = 0.1321 0.1321 0.2279 ( 6722 PWs) bands (ev): -18.3216 -18.3216 -18.1493 -18.1493 -14.5190 -14.5190 -14.4610 -14.4610 -4.9667 -4.9667 -4.7307 -4.7307 -3.8793 -3.8793 -3.4672 -3.4672 -2.8536 -2.8536 -2.6502 -2.6502 -2.6144 -2.6144 -2.4321 -2.4321 3.4562 3.4562 3.5954 3.5954 3.6242 3.6242 3.6662 3.6662 3.7144 3.7144 3.8017 3.8017 4.0973 4.0973 4.1721 4.1721 4.2182 4.2182 4.3455 4.3455 4.4046 4.4046 4.8953 4.8953 5.0312 5.0312 5.4192 5.4192 5.7728 5.7728 5.8239 5.8239 6.0526 6.0526 6.6368 6.6368 7.1022 7.1022 7.6995 7.6995 8.0621 8.0621 8.1816 8.1816 10.6598 10.6598 11.9686 11.9686 12.1611 12.1611 12.3734 12.3734 12.8577 12.8577 13.2390 13.2390 13.8213 13.8213 k = 0.1226 0.1226 0.2279 ( 6720 PWs) bands (ev): -18.3265 -18.3265 -18.1501 -18.1501 -14.5164 -14.5164 -14.4566 -14.4566 -4.9586 -4.9586 -4.7325 -4.7325 -3.8749 -3.8749 -3.4711 -3.4711 -2.8607 -2.8607 -2.6484 -2.6484 -2.6016 -2.6016 -2.4324 -2.4324 3.4273 3.4273 3.5849 3.5849 3.6109 3.6109 3.6550 3.6550 3.7264 3.7264 3.7994 3.7994 4.0828 4.0828 4.1535 4.1535 4.2012 4.2012 4.3465 4.3465 4.4050 4.4050 4.9047 4.9047 5.0489 5.0489 5.4263 5.4263 5.7963 5.7963 5.8403 5.8403 6.0942 6.0942 6.6786 6.6786 7.0980 7.0980 7.6864 7.6864 8.1028 8.1028 8.2048 8.2048 10.6254 10.6254 11.8760 11.8760 12.1666 12.1666 12.3074 12.3074 12.8531 12.8531 13.2206 13.2206 13.8612 13.8612 k = 0.1132 0.1132 0.2279 ( 6712 PWs) bands (ev): -18.3312 -18.3312 -18.1508 -18.1508 -14.5140 -14.5140 -14.4524 -14.4524 -4.9500 -4.9500 -4.7352 -4.7352 -3.8692 -3.8692 -3.4758 -3.4758 -2.8682 -2.8682 -2.6471 -2.6471 -2.5888 -2.5888 -2.4329 -2.4329 3.3994 3.3994 3.5744 3.5744 3.5984 3.5984 3.6440 3.6440 3.7335 3.7335 3.8032 3.8032 4.0687 4.0687 4.1355 4.1355 4.1855 4.1855 4.3479 4.3479 4.4052 4.4052 4.9140 4.9140 5.0657 5.0657 5.4329 5.4329 5.8156 5.8156 5.8568 5.8568 6.1376 6.1376 6.7193 6.7193 7.0931 7.0931 7.6719 7.6719 8.1422 8.1422 8.2281 8.2281 10.5912 10.5912 11.7881 11.7881 12.1564 12.1564 12.2445 12.2445 12.8717 12.8717 13.2037 13.2037 13.8930 13.8930 k = 0.1038 0.1038 0.2279 ( 6712 PWs) bands (ev): -18.3355 -18.3355 -18.1515 -18.1515 -14.5117 -14.5117 -14.4484 -14.4484 -4.9410 -4.9410 -4.7388 -4.7388 -3.8623 -3.8623 -3.4814 -3.4814 -2.8756 -2.8756 -2.6460 -2.6460 -2.5762 -2.5762 -2.4338 -2.4338 3.3729 3.3729 3.5643 3.5643 3.5869 3.5869 3.6338 3.6338 3.7343 3.7343 3.8134 3.8134 4.0550 4.0550 4.1184 4.1184 4.1708 4.1708 4.3494 4.3494 4.4054 4.4054 4.9233 4.9233 5.0816 5.0816 5.4392 5.4392 5.8313 5.8313 5.8733 5.8733 6.1820 6.1820 6.7585 6.7585 7.0876 7.0876 7.6565 7.6565 8.1799 8.1799 8.2514 8.2514 10.5576 10.5576 11.7052 11.7052 12.1317 12.1317 12.1851 12.1851 12.9125 12.9125 13.1881 13.1881 13.9105 13.9105 k = 0.0943 0.0943 0.2279 ( 6702 PWs) bands (ev): -18.3394 -18.3394 -18.1522 -18.1522 -14.5096 -14.5096 -14.4448 -14.4448 -4.9316 -4.9316 -4.7433 -4.7433 -3.8545 -3.8545 -3.4878 -3.4878 -2.8829 -2.8829 -2.6451 -2.6451 -2.5640 -2.5640 -2.4350 -2.4350 3.3479 3.3479 3.5549 3.5549 3.5763 3.5763 3.6244 3.6244 3.7308 3.7308 3.8279 3.8279 4.0419 4.0419 4.1025 4.1025 4.1571 4.1571 4.3508 4.3508 4.4056 4.4056 4.9323 4.9323 5.0965 5.0965 5.4451 5.4451 5.8441 5.8441 5.8893 5.8893 6.2265 6.2265 6.7957 6.7957 7.0814 7.0814 7.6405 7.6405 8.2157 8.2157 8.2742 8.2742 10.5250 10.5250 11.6277 11.6277 12.0967 12.0967 12.1295 12.1295 12.9719 12.9719 13.1739 13.1739 13.9193 13.9193 k = 0.0849 0.0849 0.2279 ( 6706 PWs) bands (ev): -18.3431 -18.3431 -18.1528 -18.1528 -14.5077 -14.5077 -14.4414 -14.4414 -4.9218 -4.9218 -4.7485 -4.7485 -3.8458 -3.8458 -3.4949 -3.4949 -2.8899 -2.8899 -2.6444 -2.6444 -2.5521 -2.5521 -2.4365 -2.4365 3.3247 3.3247 3.5463 3.5463 3.5668 3.5668 3.6158 3.6158 3.7253 3.7253 3.8440 3.8440 4.0296 4.0296 4.0880 4.0880 4.1441 4.1441 4.3520 4.3520 4.4058 4.4058 4.9409 4.9409 5.1103 5.1103 5.4506 5.4506 5.8547 5.8547 5.9042 5.9042 6.2702 6.2702 6.8305 6.8305 7.0748 7.0748 7.6244 7.6244 8.2494 8.2494 8.2965 8.2965 10.4936 10.4936 11.5559 11.5559 12.0560 12.0560 12.0780 12.0780 13.0454 13.0454 13.1613 13.1613 13.9232 13.9232 k = 0.0755 0.0755 0.2279 ( 6712 PWs) bands (ev): -18.3463 -18.3463 -18.1533 -18.1533 -14.5060 -14.5060 -14.4384 -14.4384 -4.9117 -4.9117 -4.7546 -4.7546 -3.8365 -3.8365 -3.5027 -3.5027 -2.8964 -2.8964 -2.6438 -2.6438 -2.5408 -2.5408 -2.4384 -2.4384 3.3035 3.3035 3.5385 3.5385 3.5583 3.5583 3.6081 3.6081 3.7191 3.7191 3.8604 3.8604 4.0181 4.0181 4.0750 4.0750 4.1318 4.1318 4.3529 4.3529 4.4060 4.4060 4.9489 4.9489 5.1230 5.1230 5.4557 5.4557 5.8635 5.8635 5.9178 5.9178 6.3124 6.3124 6.8625 6.8625 7.0680 7.0680 7.6088 7.6088 8.2807 8.2807 8.3177 8.3177 10.4640 10.4640 11.4902 11.4902 12.0133 12.0133 12.0308 12.0308 13.1271 13.1271 13.1521 13.1521 13.9246 13.9246 k = 0.0660 0.0660 0.2279 ( 6716 PWs) bands (ev): -18.3493 -18.3493 -18.1538 -18.1538 -14.5044 -14.5044 -14.4357 -14.4357 -4.9014 -4.9014 -4.7614 -4.7614 -3.8269 -3.8269 -3.5109 -3.5109 -2.9023 -2.9023 -2.6434 -2.6434 -2.5300 -2.5300 -2.4408 -2.4408 3.2844 3.2844 3.5315 3.5315 3.5509 3.5509 3.6013 3.6013 3.7130 3.7130 3.8761 3.8761 4.0078 4.0078 4.0635 4.0635 4.1203 4.1203 4.3536 4.3536 4.4062 4.4062 4.9563 4.9563 5.1345 5.1345 5.4603 5.4603 5.8710 5.8710 5.9301 5.9301 6.3524 6.3524 6.8910 6.8910 7.0613 7.0613 7.5939 7.5939 8.3093 8.3093 8.3377 8.3377 10.4365 10.4365 11.4310 11.4310 11.9714 11.9714 11.9884 11.9884 13.1382 13.1382 13.2217 13.2217 13.9249 13.9249 k = 0.0566 0.0566 0.2279 ( 6714 PWs) bands (ev): -18.3518 -18.3518 -18.1542 -18.1542 -14.5031 -14.5031 -14.4333 -14.4333 -4.8908 -4.8908 -4.7689 -4.7689 -3.8171 -3.8171 -3.5192 -3.5192 -2.9076 -2.9076 -2.6430 -2.6430 -2.5198 -2.5198 -2.4435 -2.4435 3.2677 3.2677 3.5255 3.5255 3.5444 3.5444 3.5955 3.5955 3.7073 3.7073 3.8907 3.8907 3.9988 3.9988 4.0536 4.0536 4.1095 4.1095 4.3542 4.3542 4.4064 4.4064 4.9628 4.9628 5.1447 5.1447 5.4645 5.4645 5.8773 5.8773 5.9408 5.9408 6.3894 6.3894 6.9155 6.9155 7.0552 7.0552 7.5801 7.5801 8.3349 8.3349 8.3560 8.3560 10.4115 10.4115 11.3787 11.3787 11.9320 11.9320 11.9512 11.9512 13.1298 13.1298 13.3160 13.3160 13.9259 13.9259 k = 0.0472 0.0472 0.2279 ( 6718 PWs) bands (ev): -18.3540 -18.3540 -18.1546 -18.1546 -14.5020 -14.5020 -14.4313 -14.4313 -4.8801 -4.8801 -4.7770 -4.7770 -3.8077 -3.8077 -3.5274 -3.5274 -2.9122 -2.9122 -2.6428 -2.6428 -2.5102 -2.5102 -2.4467 -2.4467 3.2532 3.2532 3.5204 3.5204 3.5391 3.5391 3.5905 3.5905 3.7023 3.7023 3.9039 3.9039 3.9911 3.9911 4.0453 4.0453 4.0997 4.0997 4.3545 4.3545 4.4066 4.4066 4.9684 4.9684 5.1535 5.1535 5.4681 5.4681 5.8823 5.8823 5.9498 5.9498 6.4226 6.4226 6.9352 6.9352 7.0503 7.0503 7.5679 7.5679 8.3571 8.3571 8.3723 8.3723 10.3895 10.3895 11.3337 11.3337 11.8966 11.8966 11.9195 11.9195 13.1225 13.1225 13.4109 13.4109 13.9293 13.9293 k = 0.0377 0.0377 0.2279 ( 6722 PWs) bands (ev): -18.3558 -18.3558 -18.1549 -18.1549 -14.5010 -14.5010 -14.4297 -14.4297 -4.8694 -4.8694 -4.7856 -4.7856 -3.7989 -3.7989 -3.5352 -3.5352 -2.9160 -2.9160 -2.6426 -2.6426 -2.5012 -2.5012 -2.4504 -2.4504 3.2413 3.2413 3.5162 3.5162 3.5346 3.5346 3.5865 3.5865 3.6980 3.6980 3.9151 3.9151 3.9851 3.9851 4.0384 4.0384 4.0908 4.0908 4.3547 4.3547 4.4067 4.4067 4.9730 4.9730 5.1609 5.1609 5.4712 5.4712 5.8864 5.8864 5.9573 5.9573 6.4515 6.4515 6.9497 6.9497 7.0474 7.0474 7.5574 7.5574 8.3758 8.3758 8.3862 8.3862 10.3710 10.3710 11.2963 11.2963 11.8663 11.8663 11.8934 11.8934 13.1165 13.1165 13.5018 13.5018 13.9371 13.9371 k = 0.0283 0.0283 0.2279 ( 6720 PWs) bands (ev): -18.3571 -18.3571 -18.1551 -18.1551 -14.5003 -14.5003 -14.4284 -14.4284 -4.8587 -4.8587 -4.7947 -4.7947 -3.7913 -3.7913 -3.5419 -3.5419 -2.9190 -2.9190 -2.6424 -2.6424 -2.4929 -2.4929 -2.4545 -2.4545 3.2320 3.2320 3.5129 3.5129 3.5313 3.5313 3.5834 3.5834 3.6947 3.6947 3.9241 3.9241 3.9808 3.9808 4.0331 4.0331 4.0833 4.0833 4.3549 4.3549 4.4069 4.4069 4.9767 4.9767 5.1668 5.1668 5.4736 5.4736 5.8896 5.8896 5.9632 5.9632 6.4750 6.4750 6.9589 6.9589 7.0467 7.0467 7.5490 7.5490 8.3905 8.3905 8.3976 8.3976 10.3561 10.3561 11.2668 11.2668 11.8420 11.8420 11.8729 11.8729 13.1118 13.1118 13.5822 13.5822 13.9523 13.9523 k = 0.0189 0.0189 0.2279 ( 6720 PWs) bands (ev): -18.3581 -18.3581 -18.1553 -18.1553 -14.4998 -14.4998 -14.4274 -14.4274 -4.8482 -4.8482 -4.8040 -4.8040 -3.7854 -3.7854 -3.5472 -3.5472 -2.9211 -2.9211 -2.6423 -2.6423 -2.4853 -2.4853 -2.4591 -2.4591 3.2252 3.2252 3.5105 3.5105 3.5288 3.5288 3.5812 3.5812 3.6922 3.6922 3.9305 3.9305 3.9783 3.9783 4.0293 4.0293 4.0775 4.0775 4.3549 4.3549 4.4069 4.4069 4.9793 4.9793 5.1711 5.1711 5.4754 5.4754 5.8917 5.8917 5.9673 5.9673 6.4925 6.4925 6.9637 6.9637 7.0476 7.0476 7.5429 7.5429 8.4010 8.4010 8.4061 8.4061 10.3452 10.3452 11.2456 11.2456 11.8243 11.8243 11.8582 11.8582 13.1084 13.1084 13.6446 13.6446 13.9760 13.9760 k = 0.0094 0.0094 0.2279 ( 6716 PWs) bands (ev): -18.3587 -18.3587 -18.1554 -18.1554 -14.4995 -14.4995 -14.4269 -14.4269 -4.8385 -4.8385 -4.8131 -4.8131 -3.7816 -3.7816 -3.5506 -3.5506 -2.9224 -2.9224 -2.6423 -2.6423 -2.4786 -2.4786 -2.4640 -2.4640 3.2212 3.2212 3.5091 3.5091 3.5274 3.5274 3.5799 3.5799 3.6907 3.6907 3.9342 3.9342 3.9772 3.9772 4.0271 4.0271 4.0738 4.0738 4.3550 4.3550 4.4070 4.4070 4.9809 4.9809 5.1737 5.1737 5.4765 5.4765 5.8930 5.8930 5.9698 5.9698 6.5033 6.5033 6.9656 6.9656 7.0489 7.0489 7.5391 7.5391 8.4073 8.4073 8.4114 8.4114 10.3386 10.3386 11.2327 11.2327 11.8135 11.8135 11.8494 11.8494 13.1064 13.1064 13.6826 13.6826 14.0027 14.0027 k = 0.0000 0.0000 0.2279 ( 6720 PWs) bands (ev): -18.3589 -18.3589 -18.1554 -18.1554 -14.4994 -14.4994 -14.4267 -14.4267 -4.8328 -4.8328 -4.8185 -4.8185 -3.7803 -3.7803 -3.5518 -3.5518 -2.9228 -2.9228 -2.6423 -2.6423 -2.4748 -2.4748 -2.4672 -2.4672 3.2198 3.2198 3.5086 3.5086 3.5269 3.5269 3.5794 3.5794 3.6903 3.6903 3.9354 3.9354 3.9770 3.9770 4.0262 4.0262 4.0725 4.0725 4.3550 4.3550 4.4070 4.4070 4.9814 4.9814 5.1745 5.1745 5.4769 5.4769 5.8934 5.8934 5.9706 5.9706 6.5070 6.5070 6.9661 6.9661 7.0494 7.0494 7.5378 7.5378 8.4093 8.4093 8.4133 8.4133 10.3364 10.3364 11.2285 11.2285 11.8099 11.8099 11.8464 11.8464 13.1057 13.1057 13.6951 13.6951 14.0155 14.0155 k = 0.0000 0.5000-0.0000 ( 6726 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6970 -3.6970 -3.6970 -3.6970 -2.7999 -2.7999 -2.7999 -2.7999 -2.4411 -2.4411 -2.4411 -2.4411 3.7693 3.7693 3.7693 3.7693 3.8990 3.8990 3.8990 3.8990 3.9802 3.9802 3.9802 3.9802 4.2350 4.2350 4.2350 4.2350 4.5265 4.5265 4.5265 4.5265 4.6679 4.6679 4.6679 4.6679 4.9344 4.9344 4.9344 4.9344 5.2941 5.2941 5.2941 5.2941 5.4686 5.4686 5.4686 5.4686 7.6647 7.6647 7.6647 7.6647 7.8089 7.8089 7.8089 7.8089 11.0339 11.0339 11.0339 11.0339 12.3939 12.3939 12.3939 12.3939 13.7770 13.7770 13.7770 13.7770 13.9182 13.9182 k = 0.0000 0.5000 0.0134 ( 6730 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6970 -3.6970 -3.6970 -3.6970 -2.7999 -2.7999 -2.7999 -2.7999 -2.4410 -2.4410 -2.4410 -2.4410 3.7694 3.7694 3.7694 3.7694 3.8991 3.8991 3.8991 3.8991 3.9801 3.9801 3.9801 3.9801 4.2347 4.2347 4.2347 4.2347 4.5261 4.5261 4.5261 4.5261 4.6682 4.6682 4.6682 4.6682 4.9345 4.9345 4.9345 4.9345 5.2941 5.2941 5.2941 5.2941 5.4685 5.4685 5.4685 5.4685 7.6650 7.6650 7.6650 7.6650 7.8090 7.8090 7.8090 7.8090 11.0348 11.0348 11.0348 11.0348 12.3938 12.3938 12.3939 12.3939 13.7768 13.7768 13.7768 13.7768 13.9181 13.9181 k = 0.0000 0.5000 0.0268 ( 6726 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6970 -3.6970 -3.6970 -3.6970 -2.7999 -2.7999 -2.7999 -2.7999 -2.4410 -2.4410 -2.4410 -2.4410 3.7699 3.7699 3.7699 3.7699 3.8995 3.8995 3.8995 3.8995 3.9797 3.9797 3.9797 3.9797 4.2339 4.2339 4.2339 4.2339 4.5252 4.5252 4.5252 4.5252 4.6690 4.6690 4.6690 4.6690 4.9346 4.9346 4.9346 4.9346 5.2939 5.2939 5.2939 5.2939 5.4684 5.4684 5.4684 5.4684 7.6660 7.6660 7.6660 7.6660 7.8095 7.8095 7.8095 7.8095 11.0377 11.0377 11.0377 11.0377 12.3938 12.3938 12.3938 12.3938 13.7762 13.7762 13.7762 13.7762 13.9179 13.9179 k = 0.0000 0.5000 0.0402 ( 6718 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6970 -3.6970 -3.6970 -3.6970 -2.7999 -2.7999 -2.7999 -2.7999 -2.4409 -2.4409 -2.4409 -2.4409 3.7706 3.7706 3.7706 3.7706 3.9001 3.9001 3.9001 3.9001 3.9790 3.9790 3.9790 3.9790 4.2326 4.2326 4.2326 4.2326 4.5237 4.5237 4.5237 4.5237 4.6702 4.6702 4.6702 4.6702 4.9348 4.9348 4.9348 4.9348 5.2938 5.2938 5.2938 5.2938 5.4681 5.4681 5.4681 5.4681 7.6677 7.6677 7.6677 7.6677 7.8102 7.8102 7.8102 7.8102 11.0423 11.0423 11.0423 11.0423 12.3936 12.3936 12.3936 12.3936 13.7752 13.7752 13.7752 13.7752 13.9177 13.9177 k = 0.0000 0.5000 0.0536 ( 6714 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6971 -3.6971 -3.6971 -3.6971 -2.7999 -2.7999 -2.7999 -2.7999 -2.4407 -2.4407 -2.4407 -2.4407 3.7716 3.7716 3.7716 3.7716 3.9008 3.9008 3.9008 3.9008 3.9782 3.9782 3.9782 3.9782 4.2308 4.2308 4.2308 4.2308 4.5218 4.5218 4.5218 4.5218 4.6718 4.6718 4.6718 4.6718 4.9351 4.9351 4.9351 4.9351 5.2936 5.2936 5.2936 5.2936 5.4678 5.4678 5.4678 5.4678 7.6699 7.6699 7.6699 7.6699 7.8112 7.8112 7.8112 7.8112 11.0487 11.0487 11.0487 11.0487 12.3932 12.3932 12.3932 12.3932 13.7739 13.7739 13.7739 13.7739 13.9177 13.9177 k = 0.0000 0.5000 0.0670 ( 6716 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6972 -3.6972 -3.6972 -3.6972 -2.8000 -2.8000 -2.8000 -2.8000 -2.4405 -2.4405 -2.4405 -2.4405 3.7728 3.7728 3.7728 3.7728 3.9018 3.9018 3.9018 3.9018 3.9771 3.9771 3.9771 3.9771 4.2285 4.2285 4.2285 4.2285 4.5194 4.5194 4.5194 4.5194 4.6738 4.6738 4.6738 4.6738 4.9354 4.9354 4.9354 4.9354 5.2933 5.2933 5.2933 5.2933 5.4674 5.4674 5.4674 5.4674 7.6726 7.6726 7.6726 7.6726 7.8124 7.8124 7.8124 7.8124 11.0566 11.0566 11.0566 11.0566 12.3926 12.3926 12.3926 12.3926 13.7723 13.7723 13.7723 13.7723 13.9182 13.9182 k = 0.0000 0.5000 0.0804 ( 6728 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6972 -3.6972 -3.6972 -3.6972 -2.8000 -2.8000 -2.8000 -2.8000 -2.4403 -2.4403 -2.4403 -2.4403 3.7742 3.7742 3.7742 3.7742 3.9028 3.9028 3.9028 3.9028 3.9759 3.9759 3.9759 3.9759 4.2259 4.2259 4.2259 4.2259 4.5167 4.5167 4.5167 4.5167 4.6759 4.6759 4.6759 4.6759 4.9358 4.9358 4.9358 4.9358 5.2929 5.2929 5.2929 5.2929 5.4669 5.4669 5.4669 5.4669 7.6756 7.6756 7.6756 7.6756 7.8138 7.8138 7.8138 7.8138 11.0658 11.0658 11.0658 11.0658 12.3918 12.3918 12.3918 12.3918 13.7705 13.7705 13.7705 13.7705 13.9195 13.9195 k = 0.0000 0.5000 0.0938 ( 6720 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6973 -3.6973 -3.6973 -3.6973 -2.8001 -2.8001 -2.8001 -2.8001 -2.4401 -2.4401 -2.4401 -2.4401 3.7757 3.7757 3.7757 3.7757 3.9041 3.9041 3.9041 3.9041 3.9746 3.9746 3.9746 3.9746 4.2231 4.2231 4.2231 4.2231 4.5139 4.5139 4.5139 4.5139 4.6781 4.6781 4.6781 4.6781 4.9363 4.9363 4.9363 4.9363 5.2926 5.2926 5.2926 5.2926 5.4663 5.4663 5.4663 5.4663 7.6790 7.6790 7.6790 7.6790 7.8153 7.8153 7.8153 7.8153 11.0761 11.0761 11.0761 11.0761 12.3906 12.3906 12.3906 12.3906 13.7685 13.7685 13.7685 13.7685 13.9222 13.9222 k = 0.0000 0.5000 0.1073 ( 6714 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6974 -3.6974 -3.6974 -3.6974 -2.8001 -2.8001 -2.8001 -2.8001 -2.4398 -2.4398 -2.4398 -2.4398 3.7774 3.7774 3.7774 3.7774 3.9053 3.9053 3.9053 3.9053 3.9733 3.9733 3.9733 3.9733 4.2201 4.2201 4.2201 4.2201 4.5110 4.5110 4.5110 4.5110 4.6804 4.6804 4.6804 4.6804 4.9368 4.9368 4.9368 4.9368 5.2922 5.2922 5.2922 5.2922 5.4658 5.4658 5.4658 5.4658 7.6826 7.6826 7.6826 7.6826 7.8170 7.8170 7.8170 7.8170 11.0872 11.0872 11.0872 11.0872 12.3890 12.3890 12.3890 12.3890 13.7664 13.7664 13.7664 13.7664 13.9265 13.9265 k = 0.0000 0.5000 0.1207 ( 6708 PWs) bands (ev): -18.1890 -18.1890 -18.1890 -18.1890 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6975 -3.6975 -3.6975 -3.6975 -2.8002 -2.8002 -2.8002 -2.8002 -2.4396 -2.4396 -2.4396 -2.4396 3.7790 3.7790 3.7790 3.7790 3.9067 3.9067 3.9067 3.9067 3.9719 3.9719 3.9719 3.9719 4.2170 4.2170 4.2170 4.2170 4.5081 4.5081 4.5081 4.5081 4.6826 4.6826 4.6826 4.6826 4.9373 4.9373 4.9373 4.9373 5.2918 5.2918 5.2918 5.2918 5.4653 5.4653 5.4653 5.4653 7.6862 7.6862 7.6862 7.6862 7.8187 7.8187 7.8187 7.8187 11.0988 11.0988 11.0988 11.0988 12.3870 12.3870 12.3870 12.3870 13.7643 13.7643 13.7643 13.7643 13.9330 13.9330 k = 0.0000 0.5000 0.1341 ( 6722 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9369 -4.9369 -4.9369 -4.9369 -3.6976 -3.6976 -3.6976 -3.6976 -2.8003 -2.8003 -2.8003 -2.8003 -2.4393 -2.4393 -2.4393 -2.4393 3.7806 3.7806 3.7806 3.7806 3.9080 3.9080 3.9080 3.9080 3.9706 3.9706 3.9706 3.9706 4.2139 4.2139 4.2139 4.2139 4.5052 4.5052 4.5052 4.5052 4.6847 4.6847 4.6847 4.6847 4.9378 4.9378 4.9378 4.9378 5.2914 5.2914 5.2914 5.2914 5.4647 5.4647 5.4647 5.4647 7.6896 7.6896 7.6896 7.6896 7.8203 7.8203 7.8203 7.8203 11.1104 11.1104 11.1104 11.1104 12.3846 12.3846 12.3846 12.3846 13.7621 13.7621 13.7621 13.7621 13.9419 13.9419 k = 0.0000 0.5000 0.1475 ( 6728 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9368 -4.9368 -4.9368 -4.9368 -3.6977 -3.6977 -3.6977 -3.6977 -2.8003 -2.8003 -2.8003 -2.8003 -2.4391 -2.4391 -2.4391 -2.4391 3.7822 3.7822 3.7822 3.7822 3.9092 3.9092 3.9092 3.9092 3.9694 3.9694 3.9694 3.9694 4.2109 4.2109 4.2109 4.2109 4.5026 4.5026 4.5026 4.5026 4.6866 4.6866 4.6866 4.6866 4.9382 4.9382 4.9382 4.9382 5.2910 5.2910 5.2910 5.2910 5.4642 5.4642 5.4642 5.4642 7.6930 7.6930 7.6930 7.6930 7.8219 7.8219 7.8219 7.8219 11.1217 11.1217 11.1217 11.1217 12.3820 12.3820 12.3820 12.3820 13.7601 13.7601 13.7601 13.7601 13.9534 13.9534 k = 0.0000 0.5000 0.1609 ( 6728 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9368 -4.9368 -4.9368 -4.9368 -3.6977 -3.6977 -3.6977 -3.6977 -2.8004 -2.8004 -2.8004 -2.8004 -2.4389 -2.4389 -2.4389 -2.4389 3.7836 3.7836 3.7836 3.7836 3.9104 3.9104 3.9104 3.9104 3.9683 3.9683 3.9683 3.9683 4.2082 4.2082 4.2082 4.2082 4.5003 4.5003 4.5003 4.5003 4.6882 4.6882 4.6882 4.6882 4.9387 4.9387 4.9387 4.9387 5.2907 5.2907 5.2907 5.2907 5.4637 5.4637 5.4637 5.4637 7.6960 7.6960 7.6960 7.6960 7.8234 7.8234 7.8234 7.8234 11.1322 11.1322 11.1322 11.1322 12.3794 12.3794 12.3794 12.3794 13.7581 13.7581 13.7581 13.7581 13.9675 13.9675 k = 0.0000 0.5000 0.1743 ( 6752 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9368 -4.9368 -4.9368 -4.9368 -3.6978 -3.6978 -3.6978 -3.6978 -2.8004 -2.8004 -2.8004 -2.8004 -2.4387 -2.4387 -2.4387 -2.4387 3.7848 3.7848 3.7848 3.7848 3.9114 3.9114 3.9114 3.9114 3.9674 3.9674 3.9674 3.9674 4.2058 4.2058 4.2058 4.2058 4.4982 4.4982 4.4982 4.4982 4.6896 4.6896 4.6896 4.6896 4.9390 4.9390 4.9390 4.9390 5.2903 5.2903 5.2903 5.2903 5.4633 5.4633 5.4633 5.4633 7.6985 7.6985 7.6985 7.6985 7.8246 7.8246 7.8246 7.8246 11.1415 11.1415 11.1415 11.1415 12.3767 12.3767 12.3767 12.3767 13.7564 13.7564 13.7564 13.7564 13.9835 13.9835 k = 0.0000 0.5000 0.1877 ( 6750 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9368 -4.9368 -4.9368 -4.9368 -3.6979 -3.6979 -3.6979 -3.6979 -2.8004 -2.8004 -2.8004 -2.8004 -2.4385 -2.4385 -2.4385 -2.4385 3.7858 3.7858 3.7858 3.7858 3.9122 3.9122 3.9122 3.9122 3.9666 3.9666 3.9666 3.9666 4.2039 4.2039 4.2039 4.2039 4.4966 4.4966 4.4966 4.4966 4.6907 4.6907 4.6907 4.6907 4.9393 4.9393 4.9393 4.9393 5.2901 5.2901 5.2901 5.2901 5.4629 5.4629 5.4629 5.4629 7.7006 7.7006 7.7006 7.7006 7.8257 7.8257 7.8257 7.8257 11.1492 11.1492 11.1492 11.1492 12.3744 12.3744 12.3744 12.3744 13.7549 13.7549 13.7549 13.7549 14.0006 14.0006 k = 0.0000 0.5000 0.2011 ( 6746 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9368 -4.9368 -4.9368 -4.9368 -3.6979 -3.6979 -3.6979 -3.6979 -2.8005 -2.8005 -2.8005 -2.8005 -2.4384 -2.4384 -2.4384 -2.4384 3.7866 3.7866 3.7866 3.7866 3.9129 3.9129 3.9129 3.9129 3.9661 3.9661 3.9661 3.9661 4.2025 4.2025 4.2025 4.2025 4.4954 4.4954 4.4954 4.4954 4.6915 4.6915 4.6915 4.6915 4.9396 4.9396 4.9396 4.9396 5.2899 5.2899 5.2899 5.2899 5.4627 5.4627 5.4627 5.4627 7.7022 7.7022 7.7022 7.7022 7.8265 7.8265 7.8265 7.8265 11.1550 11.1550 11.1550 11.1550 12.3726 12.3726 12.3726 12.3726 13.7538 13.7538 13.7538 13.7538 14.0165 14.0165 k = 0.0000 0.5000 0.2145 ( 6754 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9368 -4.9368 -4.9368 -4.9368 -3.6979 -3.6979 -3.6979 -3.6979 -2.8005 -2.8005 -2.8005 -2.8005 -2.4383 -2.4383 -2.4383 -2.4383 3.7870 3.7870 3.7870 3.7870 3.9132 3.9132 3.9132 3.9132 3.9658 3.9658 3.9658 3.9658 4.2016 4.2016 4.2016 4.2016 4.4947 4.4947 4.4947 4.4947 4.6920 4.6920 4.6920 4.6920 4.9397 4.9397 4.9397 4.9397 5.2898 5.2898 5.2898 5.2898 5.4625 5.4625 5.4625 5.4625 7.7031 7.7031 7.7031 7.7031 7.8269 7.8269 7.8269 7.8269 11.1586 11.1586 11.1586 11.1586 12.3714 12.3714 12.3714 12.3714 13.7531 13.7531 13.7531 13.7531 14.0283 14.0283 k = 0.0000 0.5000 0.2279 ( 6768 PWs) bands (ev): -18.1891 -18.1891 -18.1891 -18.1891 -14.5481 -14.5481 -14.5481 -14.5481 -4.9368 -4.9368 -4.9368 -4.9368 -3.6979 -3.6979 -3.6979 -3.6979 -2.8005 -2.8005 -2.8005 -2.8005 -2.4383 -2.4383 -2.4383 -2.4383 3.7872 3.7872 3.7872 3.7872 3.9134 3.9134 3.9134 3.9134 3.9657 3.9657 3.9657 3.9657 4.2012 4.2012 4.2012 4.2012 4.4944 4.4944 4.4944 4.4944 4.6921 4.6921 4.6921 4.6921 4.9398 4.9398 4.9398 4.9398 5.2897 5.2897 5.2897 5.2897 5.4625 5.4625 5.4625 5.4625 7.7034 7.7034 7.7034 7.7034 7.8271 7.8271 7.8271 7.8271 11.1598 11.1598 11.1598 11.1598 12.3710 12.3710 12.3710 12.3710 13.7529 13.7529 13.7529 13.7529 14.0327 14.0327 k = 0.5000 0.5000-0.0000 ( 6752 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9123 -4.9123 -4.9123 -4.9123 -3.2868 -3.2868 -3.2868 -3.2868 -3.1010 -3.1010 -3.1010 -3.1010 -2.8757 -2.8757 -2.8757 -2.8757 3.5314 3.5314 3.5314 3.5314 3.6991 3.6991 3.6991 3.6991 4.1993 4.1993 4.1993 4.1993 4.4129 4.4129 4.4129 4.4129 4.5919 4.5919 4.5919 4.5919 4.7363 4.7363 4.7363 4.7363 4.9366 4.9366 4.9366 4.9366 5.6831 5.6831 5.6831 5.6831 6.2857 6.2857 6.2857 6.2857 6.4124 6.4124 6.4124 6.4124 7.0947 7.0947 7.0947 7.0947 11.8627 11.8627 11.8627 11.8627 13.0903 13.0903 13.0903 13.0903 14.3116 14.3116 14.3116 14.3116 14.4974 14.4974 k = 0.5000 0.5000 0.0134 ( 6752 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9123 -4.9123 -4.9123 -4.9123 -3.2868 -3.2868 -3.2868 -3.2868 -3.1010 -3.1010 -3.1010 -3.1010 -2.8756 -2.8756 -2.8756 -2.8756 3.5318 3.5318 3.5318 3.5318 3.6985 3.6985 3.6985 3.6985 4.1999 4.1999 4.1999 4.1999 4.4129 4.4129 4.4129 4.4129 4.5915 4.5915 4.5915 4.5915 4.7362 4.7362 4.7362 4.7362 4.9365 4.9365 4.9365 4.9365 5.6831 5.6831 5.6831 5.6831 6.2862 6.2862 6.2862 6.2862 6.4123 6.4123 6.4123 6.4123 7.0947 7.0947 7.0947 7.0947 11.8644 11.8644 11.8644 11.8644 13.0902 13.0902 13.0902 13.0902 14.3116 14.3116 14.3116 14.3116 14.4900 14.4900 k = 0.5000 0.5000 0.0268 ( 6752 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9123 -4.9123 -4.9123 -4.9123 -3.2869 -3.2869 -3.2869 -3.2869 -3.1011 -3.1011 -3.1011 -3.1011 -2.8755 -2.8755 -2.8755 -2.8755 3.5327 3.5327 3.5327 3.5327 3.6968 3.6968 3.6968 3.6968 4.2014 4.2014 4.2014 4.2014 4.4129 4.4129 4.4129 4.4129 4.5902 4.5902 4.5902 4.5902 4.7359 4.7359 4.7359 4.7359 4.9362 4.9362 4.9362 4.9362 5.6831 5.6831 5.6831 5.6831 6.2875 6.2875 6.2875 6.2875 6.4121 6.4121 6.4121 6.4121 7.0948 7.0948 7.0948 7.0948 11.8696 11.8696 11.8696 11.8696 13.0899 13.0899 13.0899 13.0899 14.3115 14.3115 14.3115 14.3115 14.4684 14.4684 k = 0.5000 0.5000 0.0402 ( 6768 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9124 -4.9124 -4.9124 -4.9124 -3.2870 -3.2870 -3.2870 -3.2870 -3.1011 -3.1011 -3.1011 -3.1011 -2.8752 -2.8752 -2.8752 -2.8752 3.5342 3.5342 3.5342 3.5342 3.6940 3.6940 3.6940 3.6940 4.2038 4.2038 4.2038 4.2038 4.4129 4.4129 4.4129 4.4129 4.5881 4.5881 4.5881 4.5881 4.7355 4.7355 4.7355 4.7355 4.9357 4.9357 4.9357 4.9357 5.6831 5.6831 5.6831 5.6831 6.2897 6.2897 6.2897 6.2897 6.4117 6.4117 6.4117 6.4117 7.0950 7.0950 7.0950 7.0950 11.8781 11.8781 11.8781 11.8781 13.0894 13.0894 13.0894 13.0894 14.3111 14.3111 14.3111 14.3111 14.4344 14.4344 k = 0.5000 0.5000 0.0536 ( 6760 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9124 -4.9124 -4.9124 -4.9124 -3.2871 -3.2871 -3.2871 -3.2871 -3.1013 -3.1013 -3.1013 -3.1013 -2.8748 -2.8748 -2.8748 -2.8748 3.5364 3.5364 3.5364 3.5364 3.6903 3.6903 3.6903 3.6903 4.2071 4.2071 4.2071 4.2071 4.4130 4.4130 4.4130 4.4130 4.5852 4.5852 4.5852 4.5852 4.7352 4.7352 4.7352 4.7352 4.9352 4.9352 4.9352 4.9352 5.6831 5.6831 5.6831 5.6831 6.2926 6.2926 6.2926 6.2926 6.4112 6.4112 6.4112 6.4112 7.0952 7.0952 7.0952 7.0952 11.8897 11.8897 11.8897 11.8897 13.0887 13.0887 13.0887 13.0887 14.3094 14.3094 14.3094 14.3094 14.3913 14.3913 k = 0.5000 0.5000 0.0670 ( 6768 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9124 -4.9124 -4.9124 -4.9124 -3.2872 -3.2872 -3.2872 -3.2872 -3.1014 -3.1014 -3.1014 -3.1014 -2.8744 -2.8744 -2.8744 -2.8744 3.5390 3.5390 3.5390 3.5390 3.6858 3.6858 3.6858 3.6858 4.2110 4.2110 4.2110 4.2110 4.4130 4.4130 4.4130 4.4130 4.5815 4.5815 4.5815 4.5815 4.7350 4.7350 4.7350 4.7350 4.9345 4.9345 4.9345 4.9345 5.6831 5.6831 5.6831 5.6831 6.2960 6.2960 6.2960 6.2960 6.4107 6.4107 6.4107 6.4107 7.0954 7.0954 7.0954 7.0954 11.9043 11.9043 11.9043 11.9043 13.0878 13.0878 13.0878 13.0878 14.3004 14.3004 14.3004 14.3004 14.3473 14.3473 k = 0.5000 0.5000 0.0804 ( 6776 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9125 -4.9125 -4.9125 -4.9125 -3.2874 -3.2874 -3.2874 -3.2874 -3.1016 -3.1016 -3.1016 -3.1016 -2.8738 -2.8738 -2.8738 -2.8738 3.5420 3.5420 3.5420 3.5420 3.6806 3.6806 3.6806 3.6806 4.2154 4.2154 4.2154 4.2154 4.4130 4.4130 4.4130 4.4130 4.5770 4.5770 4.5770 4.5770 4.7349 4.7349 4.7349 4.7349 4.9336 4.9336 4.9336 4.9336 5.6830 5.6830 5.6830 5.6830 6.2997 6.2997 6.2997 6.2997 6.4102 6.4102 6.4102 6.4102 7.0956 7.0956 7.0956 7.0956 11.9216 11.9216 11.9216 11.9216 13.0868 13.0868 13.0868 13.0868 14.2619 14.2619 14.2619 14.2619 14.3270 14.3270 k = 0.5000 0.5000 0.0938 ( 6764 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9125 -4.9125 -4.9125 -4.9125 -3.2876 -3.2876 -3.2876 -3.2876 -3.1018 -3.1018 -3.1018 -3.1018 -2.8733 -2.8733 -2.8733 -2.8733 3.5455 3.5455 3.5455 3.5455 3.6751 3.6751 3.6751 3.6751 4.2201 4.2201 4.2201 4.2201 4.4131 4.4131 4.4131 4.4131 4.5719 4.5719 4.5719 4.5719 4.7352 4.7352 4.7352 4.7352 4.9328 4.9328 4.9328 4.9328 5.6831 5.6831 5.6831 5.6831 6.3036 6.3036 6.3036 6.3036 6.4098 6.4098 6.4098 6.4098 7.0959 7.0959 7.0959 7.0959 11.9412 11.9412 11.9412 11.9412 13.0857 13.0857 13.0857 13.0857 14.2031 14.2031 14.2031 14.2031 14.3236 14.3236 k = 0.5000 0.5000 0.1073 ( 6760 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9125 -4.9125 -4.9125 -4.9125 -3.2878 -3.2878 -3.2878 -3.2878 -3.1020 -3.1020 -3.1020 -3.1020 -2.8727 -2.8727 -2.8727 -2.8727 3.5492 3.5492 3.5492 3.5492 3.6692 3.6692 3.6692 3.6692 4.2250 4.2250 4.2250 4.2250 4.4131 4.4131 4.4131 4.4131 4.5662 4.5662 4.5662 4.5662 4.7358 4.7358 4.7358 4.7358 4.9318 4.9318 4.9318 4.9318 5.6831 5.6831 5.6831 5.6831 6.3075 6.3075 6.3075 6.3075 6.4096 6.4096 6.4096 6.4096 7.0962 7.0962 7.0962 7.0962 11.9625 11.9625 11.9625 11.9625 13.0846 13.0846 13.0846 13.0846 14.1397 14.1397 14.1397 14.1397 14.3233 14.3233 k = 0.5000 0.5000 0.1207 ( 6752 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9126 -4.9126 -4.9126 -4.9126 -3.2880 -3.2880 -3.2880 -3.2880 -3.1022 -3.1022 -3.1022 -3.1022 -2.8721 -2.8721 -2.8721 -2.8721 3.5531 3.5531 3.5531 3.5531 3.6634 3.6634 3.6634 3.6634 4.2298 4.2298 4.2298 4.2298 4.4132 4.4132 4.4132 4.4132 4.5602 4.5602 4.5602 4.5602 4.7366 4.7366 4.7366 4.7366 4.9309 4.9309 4.9309 4.9309 5.6831 5.6831 5.6831 5.6831 6.3112 6.3112 6.3112 6.3112 6.4096 6.4096 6.4096 6.4096 7.0966 7.0966 7.0966 7.0966 11.9852 11.9852 11.9852 11.9852 13.0834 13.0834 13.0834 13.0834 14.0759 14.0759 14.0759 14.0759 14.3238 14.3238 k = 0.5000 0.5000 0.1341 ( 6772 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9126 -4.9126 -4.9126 -4.9126 -3.2882 -3.2882 -3.2882 -3.2882 -3.1024 -3.1024 -3.1024 -3.1024 -2.8715 -2.8715 -2.8715 -2.8715 3.5571 3.5571 3.5571 3.5571 3.6576 3.6576 3.6576 3.6576 4.2344 4.2344 4.2344 4.2344 4.4133 4.4133 4.4133 4.4133 4.5539 4.5539 4.5539 4.5539 4.7377 4.7377 4.7377 4.7377 4.9298 4.9298 4.9298 4.9298 5.6830 5.6830 5.6830 5.6830 6.3145 6.3145 6.3145 6.3145 6.4098 6.4098 6.4098 6.4098 7.0968 7.0968 7.0968 7.0968 12.0083 12.0083 12.0083 12.0083 13.0822 13.0822 13.0822 13.0822 14.0140 14.0140 14.0140 14.0140 14.3247 14.3247 k = 0.5000 0.5000 0.1475 ( 6780 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9127 -4.9127 -4.9127 -4.9127 -3.2884 -3.2884 -3.2884 -3.2884 -3.1026 -3.1026 -3.1026 -3.1026 -2.8709 -2.8709 -2.8709 -2.8709 3.5610 3.5610 3.5610 3.5610 3.6521 3.6521 3.6521 3.6521 4.2387 4.2387 4.2387 4.2387 4.4133 4.4133 4.4133 4.4133 4.5479 4.5479 4.5479 4.5479 4.7389 4.7389 4.7389 4.7389 4.9289 4.9289 4.9289 4.9289 5.6830 5.6830 5.6830 5.6830 6.3174 6.3174 6.3174 6.3174 6.4103 6.4103 6.4103 6.4103 7.0970 7.0970 7.0970 7.0970 12.0312 12.0312 12.0312 12.0312 13.0812 13.0812 13.0812 13.0812 13.9557 13.9557 13.9557 13.9557 14.3256 14.3256 k = 0.5000 0.5000 0.1609 ( 6780 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9127 -4.9127 -4.9127 -4.9127 -3.2886 -3.2886 -3.2886 -3.2886 -3.1027 -3.1027 -3.1027 -3.1027 -2.8704 -2.8704 -2.8704 -2.8704 3.5647 3.5647 3.5647 3.5647 3.6470 3.6470 3.6470 3.6470 4.2425 4.2425 4.2425 4.2425 4.4134 4.4134 4.4134 4.4134 4.5422 4.5422 4.5422 4.5422 4.7402 4.7402 4.7402 4.7402 4.9280 4.9280 4.9280 4.9280 5.6831 5.6831 5.6831 5.6831 6.3197 6.3197 6.3197 6.3197 6.4110 6.4110 6.4110 6.4110 7.0973 7.0973 7.0973 7.0973 12.0530 12.0530 12.0530 12.0530 13.0802 13.0802 13.0802 13.0802 13.9029 13.9029 13.9029 13.9029 14.3265 14.3265 k = 0.5000 0.5000 0.1743 ( 6780 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9127 -4.9127 -4.9127 -4.9127 -3.2888 -3.2888 -3.2888 -3.2888 -3.1029 -3.1029 -3.1029 -3.1029 -2.8699 -2.8699 -2.8699 -2.8699 3.5681 3.5681 3.5681 3.5681 3.6425 3.6425 3.6425 3.6425 4.2457 4.2457 4.2457 4.2457 4.4135 4.4135 4.4135 4.4135 4.5371 4.5371 4.5371 4.5371 4.7415 4.7415 4.7415 4.7415 4.9273 4.9273 4.9273 4.9273 5.6831 5.6831 5.6831 5.6831 6.3215 6.3215 6.3215 6.3215 6.4118 6.4118 6.4118 6.4118 7.0976 7.0976 7.0976 7.0976 12.0727 12.0727 12.0727 12.0727 13.0793 13.0793 13.0793 13.0793 13.8570 13.8570 13.8570 13.8570 14.3273 14.3274 k = 0.5000 0.5000 0.1877 ( 6772 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9128 -4.9128 -4.9128 -4.9128 -3.2889 -3.2889 -3.2889 -3.2889 -3.1030 -3.1030 -3.1030 -3.1030 -2.8696 -2.8696 -2.8696 -2.8696 3.5710 3.5710 3.5710 3.5710 3.6387 3.6387 3.6387 3.6387 4.2483 4.2483 4.2483 4.2483 4.4135 4.4135 4.4135 4.4135 4.5329 4.5329 4.5329 4.5329 4.7426 4.7426 4.7426 4.7426 4.9267 4.9267 4.9267 4.9267 5.6832 5.6832 5.6832 5.6832 6.3228 6.3228 6.3228 6.3228 6.4126 6.4126 6.4126 6.4126 7.0978 7.0978 7.0978 7.0978 12.0894 12.0894 12.0894 12.0894 13.0786 13.0786 13.0786 13.0786 13.8195 13.8195 13.8195 13.8195 14.3281 14.3281 k = 0.5000 0.5000 0.2011 ( 6780 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9128 -4.9128 -4.9128 -4.9128 -3.2890 -3.2890 -3.2890 -3.2890 -3.1031 -3.1031 -3.1031 -3.1031 -2.8693 -2.8693 -2.8693 -2.8693 3.5733 3.5733 3.5733 3.5733 3.6359 3.6359 3.6359 3.6359 4.2502 4.2502 4.2502 4.2502 4.4136 4.4136 4.4136 4.4136 4.5297 4.5297 4.5297 4.5297 4.7435 4.7435 4.7435 4.7435 4.9262 4.9262 4.9262 4.9262 5.6832 5.6832 5.6832 5.6832 6.3237 6.3237 6.3237 6.3237 6.4132 6.4132 6.4132 6.4132 7.0979 7.0979 7.0979 7.0979 12.1021 12.1021 12.1021 12.1021 13.0781 13.0781 13.0781 13.0781 13.7917 13.7917 13.7917 13.7917 14.3286 14.3286 k = 0.5000 0.5000 0.2145 ( 6784 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9128 -4.9128 -4.9128 -4.9128 -3.2890 -3.2890 -3.2890 -3.2890 -3.1031 -3.1031 -3.1031 -3.1031 -2.8692 -2.8692 -2.8692 -2.8692 3.5747 3.5747 3.5747 3.5747 3.6341 3.6341 3.6341 3.6341 4.2514 4.2514 4.2514 4.2514 4.4136 4.4136 4.4136 4.4136 4.5278 4.5278 4.5278 4.5278 4.7440 4.7440 4.7440 4.7440 4.9259 4.9259 4.9259 4.9259 5.6832 5.6832 5.6832 5.6832 6.3242 6.3242 6.3242 6.3242 6.4136 6.4136 6.4136 6.4136 7.0980 7.0980 7.0980 7.0980 12.1101 12.1101 12.1101 12.1101 13.0778 13.0778 13.0778 13.0778 13.7746 13.7746 13.7746 13.7746 14.3289 14.3289 k = 0.5000 0.5000 0.2279 ( 6800 PWs) bands (ev): -18.1193 -18.1193 -18.1193 -18.1193 -14.6324 -14.6324 -14.6324 -14.6324 -4.9128 -4.9128 -4.9128 -4.9128 -3.2891 -3.2891 -3.2891 -3.2891 -3.1031 -3.1031 -3.1031 -3.1031 -2.8691 -2.8691 -2.8691 -2.8691 3.5752 3.5752 3.5752 3.5752 3.6334 3.6334 3.6334 3.6334 4.2518 4.2518 4.2518 4.2518 4.4136 4.4136 4.4136 4.4136 4.5271 4.5271 4.5271 4.5271 4.7442 4.7442 4.7442 4.7442 4.9258 4.9258 4.9258 4.9258 5.6831 5.6831 5.6831 5.6831 6.3244 6.3244 6.3244 6.3244 6.4137 6.4137 6.4137 6.4137 7.0980 7.0980 7.0980 7.0980 12.1128 12.1128 12.1128 12.1128 13.0777 13.0777 13.0777 13.0777 13.7688 13.7688 13.7688 13.7688 14.3290 14.3290 Writing output data file BaAgSF.save init_run : 0.47s CPU 0.69s WALL ( 1 calls) electrons : 355.87s CPU 360.57s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 355.86s CPU 360.56s WALL ( 1 calls) v_of_rho : 0.01s 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 : 0.14s CPU 0.22s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.15s WALL ( 318 calls) cegterg : 330.22s CPU 333.95s WALL ( 355 calls) Called by sum_band: Called by *egterg: h_psi : 162.93s CPU 165.27s WALL ( 6569 calls) s_psi : 17.02s CPU 16.98s WALL ( 6569 calls) g_psi : 0.56s CPU 0.60s WALL ( 5896 calls) cdiaghg : 121.50s CPU 123.18s WALL ( 6214 calls) cegterg:over : 18.84s CPU 18.92s WALL ( 5896 calls) cegterg:upda : 16.04s CPU 15.88s WALL ( 5896 calls) cegterg:last : 8.09s CPU 8.08s WALL ( 991 calls) cdiaghg:chol : 7.22s CPU 7.36s WALL ( 6214 calls) cdiaghg:inve : 5.30s CPU 5.53s WALL ( 6214 calls) cdiaghg:para : 10.14s CPU 10.03s WALL ( 12428 calls) Called by h_psi: h_psi:vloc : 129.84s CPU 131.78s WALL ( 6569 calls) h_psi:vnl : 32.61s CPU 32.94s WALL ( 6569 calls) add_vuspsi : 18.31s CPU 18.31s WALL ( 6569 calls) General routines calbec : 14.26s CPU 14.61s WALL ( 6569 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 121.69s CPU 123.71s WALL ( 1141904 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.30s CPU 0.51s WALL ( 636 calls) Parallel routines fft_scatter : 40.23s CPU 41.38s WALL ( 1141927 calls) PWSCF : 6m27.69s CPU 6m50.66s WALL This run was terminated on: 18:24:35 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=