Program PWSCF v.5.1.1 starts on 29Nov2015 at 16:55:27 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./ZnxCNx2.save/ file Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 67 37 10 2885 1171 180 Max 68 38 11 2890 1187 185 Sum 3241 1781 509 138601 56619 8733 bravais-lattice index = 14 lattice parameter (alat) = 11.1498 a.u. unit-cell volume = 1386.1068 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 3 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 45.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.149761 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.000000 ) 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 1.000000 ) PseudoPot. # 1 for C read from file: /home/autes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Zn read from file: /home/autes/Pseudo/Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 8d14e5a70806ad8c3d477ea097862760 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1201 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for N read from file: /home/autes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential C 4.00 12.01070 C( 1.00) Zn 12.00 65.40900 Zn( 1.00) N 5.00 14.00670 N( 1.00) 24 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] 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 = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 120 deg rotation - cart. axis [-1,-1,-1] cryst. s( 5) = ( 0 0 1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 6 120 deg rotation - cart. axis [-1,1,1] cryst. s( 6) = ( 0 0 -1 ) ( -1 0 0 ) ( 0 1 0 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 7 120 deg rotation - cart. axis [1,1,-1] cryst. s( 7) = ( 0 0 -1 ) ( 1 0 0 ) ( 0 -1 0 ) cart. s( 7) = ( -0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 8 120 deg rotation - cart. axis [1,-1,1] cryst. s( 8) = ( 0 0 1 ) ( -1 0 0 ) ( 0 -1 0 ) cart. s( 8) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 9 120 deg rotation - cart. axis [1,1,1] cryst. s( 9) = ( 0 1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s( 9) = ( 0.0000000 0.0000000 1.0000000 ) ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 10 120 deg rotation - cart. axis [-1,1,-1] cryst. s(10) = ( 0 -1 0 ) ( 0 0 -1 ) ( 1 0 0 ) cart. s(10) = ( -0.0000000 -0.0000000 1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 11 120 deg rotation - cart. axis [1,-1,-1] cryst. s(11) = ( 0 -1 0 ) ( 0 0 1 ) ( -1 0 0 ) cart. s(11) = ( -0.0000000 0.0000000 -1.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 12 120 deg rotation - cart. axis [-1,-1,1] cryst. s(12) = ( 0 1 0 ) ( 0 0 -1 ) ( -1 0 0 ) cart. s(12) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 17 inv. 180 deg rotation - cart. axis [1,0,1] cryst. s(17) = ( 0 0 -1 ) ( 0 1 0 ) ( -1 0 0 ) cart. s(17) = ( -0.0000000 0.0000000 -1.0000000 ) ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 18 inv. 180 deg rotation - cart. axis [-1,0,1] cryst. s(18) = ( 0 0 1 ) ( 0 1 0 ) ( 1 0 0 ) cart. s(18) = ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 19 inv. 90 deg rotation - cart. axis [0,1,0] cryst. s(19) = ( 0 0 1 ) ( 0 -1 0 ) ( -1 0 0 ) cart. s(19) = ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 20 inv. 90 deg rotation - cart. axis [0,-1,0] cryst. s(20) = ( 0 0 -1 ) ( 0 -1 0 ) ( 1 0 0 ) cart. s(20) = ( -0.0000000 -0.0000000 1.0000000 ) ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) isym = 21 inv. 180 deg rotation - cart. axis [0,1,1] cryst. s(21) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s(21) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 22 inv. 180 deg rotation - cart. axis [0,1,-1] cryst. s(22) = ( 1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s(22) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 23 inv. 90 deg rotation - cart. axis [-1,0,0] cryst. s(23) = ( -1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s(23) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 24 inv. 90 deg rotation - cart. axis [1,0,0] cryst. s(24) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s(24) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) double point group T_d (-43m) there are 8 classes and 3 irreducible representations the character table: E -E 8C3 -8C3 3C2 6s_d 6S4 -6S4 -3C2 -6s_d G_6 2.00 -2.00 1.00 -1.00 0.00 0.00 1.41 -1.41 G_7 2.00 -2.00 1.00 -1.00 0.00 0.00 -1.41 1.41 G_8 4.00 -4.00 -1.00 1.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 3C2 -3C2 2 -2 3 -3 4 -4 8C3 5 7 8 6 12 9 10 11 6s_d -6s_d 13 -13 14 -14 17 -17 18 -18 21 -21 22 -22 6S4 15 16 20 19 23 24 -E -1 -8C3 -5 -7 -8 -6 -12 -9 -10 -11 -6S4 -15 -16 -20 -19 -23 -24 Cartesian axes number of k points= 210 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0000000 0.0185185 -0.0000000), wk = 0.0047619 k( 3) = ( 0.0000000 0.0370370 -0.0000000), wk = 0.0047619 k( 4) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0047619 k( 5) = ( 0.0000000 0.0740741 -0.0000000), wk = 0.0047619 k( 6) = ( 0.0000000 0.0925926 -0.0000000), wk = 0.0047619 k( 7) = ( 0.0000000 0.1111111 -0.0000000), wk = 0.0047619 k( 8) = ( 0.0000000 0.1296296 -0.0000000), wk = 0.0047619 k( 9) = ( 0.0000000 0.1481482 -0.0000000), wk = 0.0047619 k( 10) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0047619 k( 11) = ( 0.0000000 0.1851852 -0.0000000), wk = 0.0047619 k( 12) = ( 0.0000000 0.2037037 -0.0000000), wk = 0.0047619 k( 13) = ( 0.0000000 0.2222222 -0.0000000), wk = 0.0047619 k( 14) = ( 0.0000000 0.2407407 -0.0000000), wk = 0.0047619 k( 15) = ( 0.0000000 0.2592593 -0.0000000), wk = 0.0047619 k( 16) = ( 0.0000000 0.2777778 -0.0000000), wk = 0.0047619 k( 17) = ( 0.0000000 0.2962963 -0.0000000), wk = 0.0047619 k( 18) = ( 0.0000000 0.3148148 -0.0000000), wk = 0.0047619 k( 19) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0047619 k( 20) = ( 0.0000000 0.3518519 -0.0000000), wk = 0.0047619 k( 21) = ( 0.0000000 0.3703704 -0.0000000), wk = 0.0047619 k( 22) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0047619 k( 23) = ( 0.0000000 0.4074074 -0.0000000), wk = 0.0047619 k( 24) = ( 0.0000000 0.4259259 -0.0000000), wk = 0.0047619 k( 25) = ( 0.0000000 0.4444444 -0.0000000), wk = 0.0047619 k( 26) = ( 0.0000000 0.4629630 -0.0000000), wk = 0.0047619 k( 27) = ( 0.0000000 0.4814815 -0.0000000), wk = 0.0047619 k( 28) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047619 k( 29) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047619 k( 30) = ( 0.0185185 0.5000000 -0.0000000), wk = 0.0047619 k( 31) = ( 0.0370370 0.5000000 -0.0000000), wk = 0.0047619 k( 32) = ( 0.0555556 0.5000000 -0.0000000), wk = 0.0047619 k( 33) = ( 0.0740741 0.5000000 -0.0000000), wk = 0.0047619 k( 34) = ( 0.0925926 0.5000000 -0.0000000), wk = 0.0047619 k( 35) = ( 0.1111111 0.5000000 -0.0000000), wk = 0.0047619 k( 36) = ( 0.1296296 0.5000000 -0.0000000), wk = 0.0047619 k( 37) = ( 0.1481482 0.5000000 -0.0000000), wk = 0.0047619 k( 38) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0047619 k( 39) = ( 0.1851852 0.5000000 -0.0000000), wk = 0.0047619 k( 40) = ( 0.2037037 0.5000000 -0.0000000), wk = 0.0047619 k( 41) = ( 0.2222222 0.5000000 -0.0000000), wk = 0.0047619 k( 42) = ( 0.2407407 0.5000000 -0.0000000), wk = 0.0047619 k( 43) = ( 0.2592593 0.5000000 -0.0000000), wk = 0.0047619 k( 44) = ( 0.2777778 0.5000000 -0.0000000), wk = 0.0047619 k( 45) = ( 0.2962963 0.5000000 -0.0000000), wk = 0.0047619 k( 46) = ( 0.3148148 0.5000000 -0.0000000), wk = 0.0047619 k( 47) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0047619 k( 48) = ( 0.3518519 0.5000000 -0.0000000), wk = 0.0047619 k( 49) = ( 0.3703704 0.5000000 -0.0000000), wk = 0.0047619 k( 50) = ( 0.3888889 0.5000000 -0.0000000), wk = 0.0047619 k( 51) = ( 0.4074074 0.5000000 -0.0000000), wk = 0.0047619 k( 52) = ( 0.4259259 0.5000000 -0.0000000), wk = 0.0047619 k( 53) = ( 0.4444444 0.5000000 -0.0000000), wk = 0.0047619 k( 54) = ( 0.4629630 0.5000000 -0.0000000), wk = 0.0047619 k( 55) = ( 0.4814815 0.5000000 -0.0000000), wk = 0.0047619 k( 56) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047619 k( 57) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047619 k( 58) = ( 0.4868421 0.4868421 -0.0000000), wk = 0.0047619 k( 59) = ( 0.4736842 0.4736842 -0.0000000), wk = 0.0047619 k( 60) = ( 0.4605263 0.4605263 -0.0000000), wk = 0.0047619 k( 61) = ( 0.4473684 0.4473684 -0.0000000), wk = 0.0047619 k( 62) = ( 0.4342105 0.4342105 -0.0000000), wk = 0.0047619 k( 63) = ( 0.4210526 0.4210526 -0.0000000), wk = 0.0047619 k( 64) = ( 0.4078947 0.4078947 -0.0000000), wk = 0.0047619 k( 65) = ( 0.3947368 0.3947368 -0.0000000), wk = 0.0047619 k( 66) = ( 0.3815789 0.3815789 -0.0000000), wk = 0.0047619 k( 67) = ( 0.3684211 0.3684210 -0.0000000), wk = 0.0047619 k( 68) = ( 0.3552632 0.3552632 -0.0000000), wk = 0.0047619 k( 69) = ( 0.3421053 0.3421053 -0.0000000), wk = 0.0047619 k( 70) = ( 0.3289474 0.3289474 -0.0000000), wk = 0.0047619 k( 71) = ( 0.3157895 0.3157895 -0.0000000), wk = 0.0047619 k( 72) = ( 0.3026316 0.3026316 -0.0000000), wk = 0.0047619 k( 73) = ( 0.2894737 0.2894737 -0.0000000), wk = 0.0047619 k( 74) = ( 0.2763158 0.2763158 -0.0000000), wk = 0.0047619 k( 75) = ( 0.2631579 0.2631579 -0.0000000), wk = 0.0047619 k( 76) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0047619 k( 77) = ( 0.2368421 0.2368421 -0.0000000), wk = 0.0047619 k( 78) = ( 0.2236842 0.2236842 -0.0000000), wk = 0.0047619 k( 79) = ( 0.2105263 0.2105263 -0.0000000), wk = 0.0047619 k( 80) = ( 0.1973684 0.1973684 -0.0000000), wk = 0.0047619 k( 81) = ( 0.1842105 0.1842105 -0.0000000), wk = 0.0047619 k( 82) = ( 0.1710526 0.1710526 -0.0000000), wk = 0.0047619 k( 83) = ( 0.1578947 0.1578947 -0.0000000), wk = 0.0047619 k( 84) = ( 0.1447368 0.1447368 -0.0000000), wk = 0.0047619 k( 85) = ( 0.1315790 0.1315790 -0.0000000), wk = 0.0047619 k( 86) = ( 0.1184210 0.1184210 -0.0000000), wk = 0.0047619 k( 87) = ( 0.1052632 0.1052632 -0.0000000), wk = 0.0047619 k( 88) = ( 0.0921053 0.0921053 -0.0000000), wk = 0.0047619 k( 89) = ( 0.0789474 0.0789474 -0.0000000), wk = 0.0047619 k( 90) = ( 0.0657895 0.0657895 -0.0000000), wk = 0.0047619 k( 91) = ( 0.0526316 0.0526316 -0.0000000), wk = 0.0047619 k( 92) = ( 0.0394737 0.0394737 -0.0000000), wk = 0.0047619 k( 93) = ( 0.0263158 0.0263158 -0.0000000), wk = 0.0047619 k( 94) = ( 0.0131579 0.0131579 -0.0000000), wk = 0.0047619 k( 95) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 96) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 97) = ( 0.0106383 0.0106383 0.0106383), wk = 0.0047619 k( 98) = ( 0.0212766 0.0212766 0.0212766), wk = 0.0047619 k( 99) = ( 0.0319149 0.0319149 0.0319149), wk = 0.0047619 k( 100) = ( 0.0425532 0.0425532 0.0425532), wk = 0.0047619 k( 101) = ( 0.0531915 0.0531915 0.0531915), wk = 0.0047619 k( 102) = ( 0.0638298 0.0638298 0.0638298), wk = 0.0047619 k( 103) = ( 0.0744681 0.0744681 0.0744681), wk = 0.0047619 k( 104) = ( 0.0851064 0.0851064 0.0851064), wk = 0.0047619 k( 105) = ( 0.0957447 0.0957447 0.0957447), wk = 0.0047619 k( 106) = ( 0.1063830 0.1063830 0.1063830), wk = 0.0047619 k( 107) = ( 0.1170213 0.1170213 0.1170213), wk = 0.0047619 k( 108) = ( 0.1276596 0.1276596 0.1276596), wk = 0.0047619 k( 109) = ( 0.1382979 0.1382979 0.1382979), wk = 0.0047619 k( 110) = ( 0.1489362 0.1489362 0.1489362), wk = 0.0047619 k( 111) = ( 0.1595745 0.1595745 0.1595745), wk = 0.0047619 k( 112) = ( 0.1702128 0.1702128 0.1702128), wk = 0.0047619 k( 113) = ( 0.1808511 0.1808511 0.1808511), wk = 0.0047619 k( 114) = ( 0.1914894 0.1914894 0.1914894), wk = 0.0047619 k( 115) = ( 0.2021277 0.2021277 0.2021277), wk = 0.0047619 k( 116) = ( 0.2127660 0.2127660 0.2127660), wk = 0.0047619 k( 117) = ( 0.2234043 0.2234043 0.2234043), wk = 0.0047619 k( 118) = ( 0.2340425 0.2340425 0.2340425), wk = 0.0047619 k( 119) = ( 0.2446809 0.2446808 0.2446808), wk = 0.0047619 k( 120) = ( 0.2553191 0.2553191 0.2553191), wk = 0.0047619 k( 121) = ( 0.2659574 0.2659574 0.2659574), wk = 0.0047619 k( 122) = ( 0.2765957 0.2765957 0.2765957), wk = 0.0047619 k( 123) = ( 0.2872340 0.2872340 0.2872340), wk = 0.0047619 k( 124) = ( 0.2978723 0.2978723 0.2978723), wk = 0.0047619 k( 125) = ( 0.3085106 0.3085106 0.3085106), wk = 0.0047619 k( 126) = ( 0.3191489 0.3191489 0.3191489), wk = 0.0047619 k( 127) = ( 0.3297872 0.3297872 0.3297872), wk = 0.0047619 k( 128) = ( 0.3404255 0.3404255 0.3404255), wk = 0.0047619 k( 129) = ( 0.3510638 0.3510638 0.3510638), wk = 0.0047619 k( 130) = ( 0.3617021 0.3617021 0.3617021), wk = 0.0047619 k( 131) = ( 0.3723404 0.3723404 0.3723404), wk = 0.0047619 k( 132) = ( 0.3829787 0.3829787 0.3829787), wk = 0.0047619 k( 133) = ( 0.3936170 0.3936170 0.3936170), wk = 0.0047619 k( 134) = ( 0.4042553 0.4042553 0.4042553), wk = 0.0047619 k( 135) = ( 0.4148936 0.4148936 0.4148936), wk = 0.0047619 k( 136) = ( 0.4255319 0.4255319 0.4255319), wk = 0.0047619 k( 137) = ( 0.4361702 0.4361702 0.4361702), wk = 0.0047619 k( 138) = ( 0.4468085 0.4468085 0.4468085), wk = 0.0047619 k( 139) = ( 0.4574468 0.4574468 0.4574468), wk = 0.0047619 k( 140) = ( 0.4680851 0.4680851 0.4680851), wk = 0.0047619 k( 141) = ( 0.4787234 0.4787234 0.4787234), wk = 0.0047619 k( 142) = ( 0.4893617 0.4893617 0.4893617), wk = 0.0047619 k( 143) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 144) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 145) = ( 0.4868421 0.5000000 0.4868421), wk = 0.0047619 k( 146) = ( 0.4736842 0.5000000 0.4736842), wk = 0.0047619 k( 147) = ( 0.4605263 0.5000000 0.4605263), wk = 0.0047619 k( 148) = ( 0.4473684 0.5000000 0.4473684), wk = 0.0047619 k( 149) = ( 0.4342105 0.5000000 0.4342105), wk = 0.0047619 k( 150) = ( 0.4210526 0.5000000 0.4210526), wk = 0.0047619 k( 151) = ( 0.4078947 0.5000000 0.4078947), wk = 0.0047619 k( 152) = ( 0.3947368 0.5000000 0.3947368), wk = 0.0047619 k( 153) = ( 0.3815789 0.5000000 0.3815789), wk = 0.0047619 k( 154) = ( 0.3684211 0.5000000 0.3684210), wk = 0.0047619 k( 155) = ( 0.3552632 0.5000000 0.3552632), wk = 0.0047619 k( 156) = ( 0.3421053 0.5000000 0.3421053), wk = 0.0047619 k( 157) = ( 0.3289474 0.5000000 0.3289474), wk = 0.0047619 k( 158) = ( 0.3157895 0.5000000 0.3157895), wk = 0.0047619 k( 159) = ( 0.3026316 0.5000000 0.3026316), wk = 0.0047619 k( 160) = ( 0.2894737 0.5000000 0.2894737), wk = 0.0047619 k( 161) = ( 0.2763158 0.5000000 0.2763158), wk = 0.0047619 k( 162) = ( 0.2631579 0.5000000 0.2631579), wk = 0.0047619 k( 163) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0047619 k( 164) = ( 0.2368421 0.5000000 0.2368421), wk = 0.0047619 k( 165) = ( 0.2236842 0.5000000 0.2236842), wk = 0.0047619 k( 166) = ( 0.2105263 0.5000000 0.2105263), wk = 0.0047619 k( 167) = ( 0.1973684 0.5000000 0.1973684), wk = 0.0047619 k( 168) = ( 0.1842105 0.5000000 0.1842105), wk = 0.0047619 k( 169) = ( 0.1710526 0.5000000 0.1710526), wk = 0.0047619 k( 170) = ( 0.1578947 0.5000000 0.1578947), wk = 0.0047619 k( 171) = ( 0.1447368 0.5000000 0.1447368), wk = 0.0047619 k( 172) = ( 0.1315790 0.5000000 0.1315789), wk = 0.0047619 k( 173) = ( 0.1184210 0.5000000 0.1184210), wk = 0.0047619 k( 174) = ( 0.1052632 0.5000000 0.1052632), wk = 0.0047619 k( 175) = ( 0.0921053 0.5000000 0.0921053), wk = 0.0047619 k( 176) = ( 0.0789474 0.5000000 0.0789474), wk = 0.0047619 k( 177) = ( 0.0657895 0.5000000 0.0657895), wk = 0.0047619 k( 178) = ( 0.0526316 0.5000000 0.0526316), wk = 0.0047619 k( 179) = ( 0.0394737 0.5000000 0.0394737), wk = 0.0047619 k( 180) = ( 0.0263158 0.5000000 0.0263158), wk = 0.0047619 k( 181) = ( 0.0131579 0.5000000 0.0131579), wk = 0.0047619 k( 182) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047619 k( 183) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0047619 k( 184) = ( 0.5000000 0.5000000 0.0185185), wk = 0.0047619 k( 185) = ( 0.5000000 0.5000000 0.0370370), wk = 0.0047619 k( 186) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0047619 k( 187) = ( 0.5000000 0.5000000 0.0740741), wk = 0.0047619 k( 188) = ( 0.5000000 0.5000000 0.0925926), wk = 0.0047619 k( 189) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0047619 k( 190) = ( 0.5000000 0.5000000 0.1296296), wk = 0.0047619 k( 191) = ( 0.5000000 0.5000000 0.1481481), wk = 0.0047619 k( 192) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0047619 k( 193) = ( 0.5000000 0.5000000 0.1851852), wk = 0.0047619 k( 194) = ( 0.5000000 0.5000000 0.2037037), wk = 0.0047619 k( 195) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0047619 k( 196) = ( 0.5000000 0.5000000 0.2407407), wk = 0.0047619 k( 197) = ( 0.5000000 0.5000000 0.2592593), wk = 0.0047619 k( 198) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0047619 k( 199) = ( 0.5000000 0.5000000 0.2962963), wk = 0.0047619 k( 200) = ( 0.5000000 0.5000000 0.3148148), wk = 0.0047619 k( 201) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0047619 k( 202) = ( 0.5000000 0.5000000 0.3518518), wk = 0.0047619 k( 203) = ( 0.5000000 0.5000000 0.3703704), wk = 0.0047619 k( 204) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0047619 k( 205) = ( 0.5000000 0.5000000 0.4074074), wk = 0.0047619 k( 206) = ( 0.5000000 0.5000000 0.4259259), wk = 0.0047619 k( 207) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0047619 k( 208) = ( 0.5000000 0.5000000 0.4629630), wk = 0.0047619 k( 209) = ( 0.5000000 0.5000000 0.4814815), wk = 0.0047619 k( 210) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0000000 0.0185185 0.0000000), wk = 0.0047619 k( 3) = ( 0.0000000 0.0370370 0.0000000), wk = 0.0047619 k( 4) = ( 0.0000000 0.0555556 0.0000000), wk = 0.0047619 k( 5) = ( 0.0000000 0.0740741 0.0000000), wk = 0.0047619 k( 6) = ( 0.0000000 0.0925926 0.0000000), wk = 0.0047619 k( 7) = ( 0.0000000 0.1111111 0.0000000), wk = 0.0047619 k( 8) = ( 0.0000000 0.1296296 0.0000000), wk = 0.0047619 k( 9) = ( 0.0000000 0.1481482 0.0000000), wk = 0.0047619 k( 10) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0047619 k( 11) = ( 0.0000000 0.1851852 0.0000000), wk = 0.0047619 k( 12) = ( 0.0000000 0.2037037 0.0000000), wk = 0.0047619 k( 13) = ( 0.0000000 0.2222222 0.0000000), wk = 0.0047619 k( 14) = ( 0.0000000 0.2407407 0.0000000), wk = 0.0047619 k( 15) = ( 0.0000000 0.2592593 0.0000000), wk = 0.0047619 k( 16) = ( 0.0000000 0.2777778 0.0000000), wk = 0.0047619 k( 17) = ( 0.0000000 0.2962963 0.0000000), wk = 0.0047619 k( 18) = ( 0.0000000 0.3148148 0.0000000), wk = 0.0047619 k( 19) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0047619 k( 20) = ( 0.0000000 0.3518519 0.0000000), wk = 0.0047619 k( 21) = ( 0.0000000 0.3703704 0.0000000), wk = 0.0047619 k( 22) = ( 0.0000000 0.3888889 0.0000000), wk = 0.0047619 k( 23) = ( 0.0000000 0.4074074 0.0000000), wk = 0.0047619 k( 24) = ( 0.0000000 0.4259259 0.0000000), wk = 0.0047619 k( 25) = ( 0.0000000 0.4444444 0.0000000), wk = 0.0047619 k( 26) = ( 0.0000000 0.4629630 0.0000000), wk = 0.0047619 k( 27) = ( 0.0000000 0.4814815 0.0000000), wk = 0.0047619 k( 28) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047619 k( 29) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047619 k( 30) = ( 0.0185185 0.5000000 0.0000000), wk = 0.0047619 k( 31) = ( 0.0370370 0.5000000 0.0000000), wk = 0.0047619 k( 32) = ( 0.0555556 0.5000000 0.0000000), wk = 0.0047619 k( 33) = ( 0.0740741 0.5000000 0.0000000), wk = 0.0047619 k( 34) = ( 0.0925926 0.5000000 0.0000000), wk = 0.0047619 k( 35) = ( 0.1111111 0.5000000 0.0000000), wk = 0.0047619 k( 36) = ( 0.1296296 0.5000000 0.0000000), wk = 0.0047619 k( 37) = ( 0.1481482 0.5000000 0.0000000), wk = 0.0047619 k( 38) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0047619 k( 39) = ( 0.1851852 0.5000000 0.0000000), wk = 0.0047619 k( 40) = ( 0.2037037 0.5000000 0.0000000), wk = 0.0047619 k( 41) = ( 0.2222222 0.5000000 0.0000000), wk = 0.0047619 k( 42) = ( 0.2407407 0.5000000 0.0000000), wk = 0.0047619 k( 43) = ( 0.2592593 0.5000000 0.0000000), wk = 0.0047619 k( 44) = ( 0.2777778 0.5000000 0.0000000), wk = 0.0047619 k( 45) = ( 0.2962963 0.5000000 0.0000000), wk = 0.0047619 k( 46) = ( 0.3148148 0.5000000 0.0000000), wk = 0.0047619 k( 47) = ( 0.3333333 0.5000000 0.0000000), wk = 0.0047619 k( 48) = ( 0.3518519 0.5000000 0.0000000), wk = 0.0047619 k( 49) = ( 0.3703704 0.5000000 0.0000000), wk = 0.0047619 k( 50) = ( 0.3888889 0.5000000 0.0000000), wk = 0.0047619 k( 51) = ( 0.4074074 0.5000000 0.0000000), wk = 0.0047619 k( 52) = ( 0.4259259 0.5000000 0.0000000), wk = 0.0047619 k( 53) = ( 0.4444444 0.5000000 0.0000000), wk = 0.0047619 k( 54) = ( 0.4629630 0.5000000 0.0000000), wk = 0.0047619 k( 55) = ( 0.4814815 0.5000000 0.0000000), wk = 0.0047619 k( 56) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047619 k( 57) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047619 k( 58) = ( 0.4868421 0.4868421 0.0000000), wk = 0.0047619 k( 59) = ( 0.4736842 0.4736842 0.0000000), wk = 0.0047619 k( 60) = ( 0.4605263 0.4605263 0.0000000), wk = 0.0047619 k( 61) = ( 0.4473684 0.4473684 0.0000000), wk = 0.0047619 k( 62) = ( 0.4342105 0.4342105 0.0000000), wk = 0.0047619 k( 63) = ( 0.4210526 0.4210526 0.0000000), wk = 0.0047619 k( 64) = ( 0.4078947 0.4078947 0.0000000), wk = 0.0047619 k( 65) = ( 0.3947368 0.3947368 0.0000000), wk = 0.0047619 k( 66) = ( 0.3815789 0.3815789 0.0000000), wk = 0.0047619 k( 67) = ( 0.3684211 0.3684211 -0.0000000), wk = 0.0047619 k( 68) = ( 0.3552632 0.3552632 0.0000000), wk = 0.0047619 k( 69) = ( 0.3421053 0.3421053 0.0000000), wk = 0.0047619 k( 70) = ( 0.3289474 0.3289474 0.0000000), wk = 0.0047619 k( 71) = ( 0.3157895 0.3157895 0.0000000), wk = 0.0047619 k( 72) = ( 0.3026316 0.3026316 0.0000000), wk = 0.0047619 k( 73) = ( 0.2894737 0.2894737 0.0000000), wk = 0.0047619 k( 74) = ( 0.2763158 0.2763158 0.0000000), wk = 0.0047619 k( 75) = ( 0.2631579 0.2631579 0.0000000), wk = 0.0047619 k( 76) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0047619 k( 77) = ( 0.2368421 0.2368421 0.0000000), wk = 0.0047619 k( 78) = ( 0.2236842 0.2236842 0.0000000), wk = 0.0047619 k( 79) = ( 0.2105263 0.2105263 0.0000000), wk = 0.0047619 k( 80) = ( 0.1973684 0.1973684 0.0000000), wk = 0.0047619 k( 81) = ( 0.1842105 0.1842105 0.0000000), wk = 0.0047619 k( 82) = ( 0.1710526 0.1710526 0.0000000), wk = 0.0047619 k( 83) = ( 0.1578947 0.1578947 0.0000000), wk = 0.0047619 k( 84) = ( 0.1447368 0.1447368 0.0000000), wk = 0.0047619 k( 85) = ( 0.1315790 0.1315790 0.0000000), wk = 0.0047619 k( 86) = ( 0.1184210 0.1184210 0.0000000), wk = 0.0047619 k( 87) = ( 0.1052632 0.1052632 0.0000000), wk = 0.0047619 k( 88) = ( 0.0921053 0.0921053 0.0000000), wk = 0.0047619 k( 89) = ( 0.0789474 0.0789474 0.0000000), wk = 0.0047619 k( 90) = ( 0.0657895 0.0657895 0.0000000), wk = 0.0047619 k( 91) = ( 0.0526316 0.0526316 0.0000000), wk = 0.0047619 k( 92) = ( 0.0394737 0.0394737 -0.0000000), wk = 0.0047619 k( 93) = ( 0.0263158 0.0263158 0.0000000), wk = 0.0047619 k( 94) = ( 0.0131579 0.0131579 0.0000000), wk = 0.0047619 k( 95) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 96) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 97) = ( 0.0106383 0.0106383 0.0106383), wk = 0.0047619 k( 98) = ( 0.0212766 0.0212766 0.0212766), wk = 0.0047619 k( 99) = ( 0.0319149 0.0319149 0.0319149), wk = 0.0047619 k( 100) = ( 0.0425532 0.0425532 0.0425532), wk = 0.0047619 k( 101) = ( 0.0531915 0.0531915 0.0531915), wk = 0.0047619 k( 102) = ( 0.0638298 0.0638298 0.0638298), wk = 0.0047619 k( 103) = ( 0.0744681 0.0744681 0.0744681), wk = 0.0047619 k( 104) = ( 0.0851064 0.0851064 0.0851064), wk = 0.0047619 k( 105) = ( 0.0957447 0.0957447 0.0957447), wk = 0.0047619 k( 106) = ( 0.1063830 0.1063830 0.1063830), wk = 0.0047619 k( 107) = ( 0.1170213 0.1170213 0.1170213), wk = 0.0047619 k( 108) = ( 0.1276596 0.1276596 0.1276596), wk = 0.0047619 k( 109) = ( 0.1382979 0.1382979 0.1382979), wk = 0.0047619 k( 110) = ( 0.1489362 0.1489362 0.1489362), wk = 0.0047619 k( 111) = ( 0.1595745 0.1595745 0.1595745), wk = 0.0047619 k( 112) = ( 0.1702128 0.1702128 0.1702128), wk = 0.0047619 k( 113) = ( 0.1808511 0.1808511 0.1808511), wk = 0.0047619 k( 114) = ( 0.1914894 0.1914894 0.1914894), wk = 0.0047619 k( 115) = ( 0.2021277 0.2021277 0.2021277), wk = 0.0047619 k( 116) = ( 0.2127660 0.2127660 0.2127660), wk = 0.0047619 k( 117) = ( 0.2234043 0.2234043 0.2234043), wk = 0.0047619 k( 118) = ( 0.2340425 0.2340425 0.2340425), wk = 0.0047619 k( 119) = ( 0.2446809 0.2446809 0.2446809), wk = 0.0047619 k( 120) = ( 0.2553191 0.2553191 0.2553191), wk = 0.0047619 k( 121) = ( 0.2659574 0.2659574 0.2659574), wk = 0.0047619 k( 122) = ( 0.2765957 0.2765957 0.2765957), wk = 0.0047619 k( 123) = ( 0.2872340 0.2872340 0.2872340), wk = 0.0047619 k( 124) = ( 0.2978723 0.2978723 0.2978723), wk = 0.0047619 k( 125) = ( 0.3085106 0.3085106 0.3085106), wk = 0.0047619 k( 126) = ( 0.3191489 0.3191489 0.3191489), wk = 0.0047619 k( 127) = ( 0.3297872 0.3297872 0.3297872), wk = 0.0047619 k( 128) = ( 0.3404255 0.3404255 0.3404255), wk = 0.0047619 k( 129) = ( 0.3510638 0.3510638 0.3510638), wk = 0.0047619 k( 130) = ( 0.3617021 0.3617021 0.3617021), wk = 0.0047619 k( 131) = ( 0.3723404 0.3723404 0.3723404), wk = 0.0047619 k( 132) = ( 0.3829787 0.3829787 0.3829787), wk = 0.0047619 k( 133) = ( 0.3936170 0.3936170 0.3936170), wk = 0.0047619 k( 134) = ( 0.4042553 0.4042553 0.4042553), wk = 0.0047619 k( 135) = ( 0.4148936 0.4148936 0.4148936), wk = 0.0047619 k( 136) = ( 0.4255319 0.4255319 0.4255319), wk = 0.0047619 k( 137) = ( 0.4361702 0.4361702 0.4361702), wk = 0.0047619 k( 138) = ( 0.4468085 0.4468085 0.4468085), wk = 0.0047619 k( 139) = ( 0.4574468 0.4574468 0.4574468), wk = 0.0047619 k( 140) = ( 0.4680851 0.4680851 0.4680851), wk = 0.0047619 k( 141) = ( 0.4787234 0.4787234 0.4787234), wk = 0.0047619 k( 142) = ( 0.4893617 0.4893617 0.4893617), wk = 0.0047619 k( 143) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 144) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 145) = ( 0.4868421 0.5000000 0.4868421), wk = 0.0047619 k( 146) = ( 0.4736842 0.5000000 0.4736842), wk = 0.0047619 k( 147) = ( 0.4605263 0.5000000 0.4605263), wk = 0.0047619 k( 148) = ( 0.4473684 0.5000000 0.4473684), wk = 0.0047619 k( 149) = ( 0.4342105 0.5000000 0.4342105), wk = 0.0047619 k( 150) = ( 0.4210526 0.5000000 0.4210526), wk = 0.0047619 k( 151) = ( 0.4078947 0.5000000 0.4078947), wk = 0.0047619 k( 152) = ( 0.3947368 0.5000000 0.3947368), wk = 0.0047619 k( 153) = ( 0.3815789 0.5000000 0.3815789), wk = 0.0047619 k( 154) = ( 0.3684211 0.5000000 0.3684211), wk = 0.0047619 k( 155) = ( 0.3552632 0.5000000 0.3552632), wk = 0.0047619 k( 156) = ( 0.3421053 0.5000000 0.3421053), wk = 0.0047619 k( 157) = ( 0.3289474 0.5000000 0.3289474), wk = 0.0047619 k( 158) = ( 0.3157895 0.5000000 0.3157895), wk = 0.0047619 k( 159) = ( 0.3026316 0.5000000 0.3026316), wk = 0.0047619 k( 160) = ( 0.2894737 0.5000000 0.2894737), wk = 0.0047619 k( 161) = ( 0.2763158 0.5000000 0.2763158), wk = 0.0047619 k( 162) = ( 0.2631579 0.5000000 0.2631579), wk = 0.0047619 k( 163) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0047619 k( 164) = ( 0.2368421 0.5000000 0.2368421), wk = 0.0047619 k( 165) = ( 0.2236842 0.5000000 0.2236842), wk = 0.0047619 k( 166) = ( 0.2105263 0.5000000 0.2105263), wk = 0.0047619 k( 167) = ( 0.1973684 0.5000000 0.1973684), wk = 0.0047619 k( 168) = ( 0.1842105 0.5000000 0.1842105), wk = 0.0047619 k( 169) = ( 0.1710526 0.5000000 0.1710526), wk = 0.0047619 k( 170) = ( 0.1578947 0.5000000 0.1578947), wk = 0.0047619 k( 171) = ( 0.1447368 0.5000000 0.1447368), wk = 0.0047619 k( 172) = ( 0.1315790 0.5000000 0.1315790), wk = 0.0047619 k( 173) = ( 0.1184210 0.5000000 0.1184210), wk = 0.0047619 k( 174) = ( 0.1052632 0.5000000 0.1052632), wk = 0.0047619 k( 175) = ( 0.0921053 0.5000000 0.0921053), wk = 0.0047619 k( 176) = ( 0.0789474 0.5000000 0.0789474), wk = 0.0047619 k( 177) = ( 0.0657895 0.5000000 0.0657895), wk = 0.0047619 k( 178) = ( 0.0526316 0.5000000 0.0526316), wk = 0.0047619 k( 179) = ( 0.0394737 0.5000000 0.0394737), wk = 0.0047619 k( 180) = ( 0.0263158 0.5000000 0.0263158), wk = 0.0047619 k( 181) = ( 0.0131579 0.5000000 0.0131579), wk = 0.0047619 k( 182) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0047619 k( 183) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047619 k( 184) = ( 0.5000000 0.5000000 0.0185185), wk = 0.0047619 k( 185) = ( 0.5000000 0.5000000 0.0370370), wk = 0.0047619 k( 186) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0047619 k( 187) = ( 0.5000000 0.5000000 0.0740741), wk = 0.0047619 k( 188) = ( 0.5000000 0.5000000 0.0925926), wk = 0.0047619 k( 189) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0047619 k( 190) = ( 0.5000000 0.5000000 0.1296296), wk = 0.0047619 k( 191) = ( 0.5000000 0.5000000 0.1481482), wk = 0.0047619 k( 192) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0047619 k( 193) = ( 0.5000000 0.5000000 0.1851852), wk = 0.0047619 k( 194) = ( 0.5000000 0.5000000 0.2037037), wk = 0.0047619 k( 195) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0047619 k( 196) = ( 0.5000000 0.5000000 0.2407407), wk = 0.0047619 k( 197) = ( 0.5000000 0.5000000 0.2592593), wk = 0.0047619 k( 198) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0047619 k( 199) = ( 0.5000000 0.5000000 0.2962963), wk = 0.0047619 k( 200) = ( 0.5000000 0.5000000 0.3148148), wk = 0.0047619 k( 201) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0047619 k( 202) = ( 0.5000000 0.5000000 0.3518519), wk = 0.0047619 k( 203) = ( 0.5000000 0.5000000 0.3703704), wk = 0.0047619 k( 204) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0047619 k( 205) = ( 0.5000000 0.5000000 0.4074074), wk = 0.0047619 k( 206) = ( 0.5000000 0.5000000 0.4259259), wk = 0.0047619 k( 207) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0047619 k( 208) = ( 0.5000000 0.5000000 0.4629630), wk = 0.0047619 k( 209) = ( 0.5000000 0.5000000 0.4814815), wk = 0.0047619 k( 210) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 Dense grid: 138601 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 56619 G-vectors FFT dimensions: ( 48, 48, 48) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.33 Mb ( 302, 72) NL pseudopotentials 0.41 Mb ( 151, 180) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2890) G-vector shells 0.00 Mb ( 620) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.33 Mb ( 302, 288) Each subspace H/S matrix 1.27 Mb ( 288, 288) Each matrix 0.40 Mb ( 180, 2, 72) Check: negative/imaginary core charge= -0.000006 0.000000 The potential is recalculated from file : ./ZnxCNx2.save/charge-density.dat Starting wfc are 100 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 44.8 secs Computing kpt #: 2 total cpu time spent up to now is 47.7 secs Computing kpt #: 3 total cpu time spent up to now is 50.7 secs Computing kpt #: 4 total cpu time spent up to now is 54.2 secs Computing kpt #: 5 total cpu time spent up to now is 57.0 secs Computing kpt #: 6 total cpu time spent up to now is 59.7 secs Computing kpt #: 7 total cpu time spent up to now is 62.6 secs Computing kpt #: 8 total cpu time spent up to now is 65.6 secs Computing kpt #: 9 total cpu time spent up to now is 68.7 secs Computing kpt #: 10 total cpu time spent up to now is 71.9 secs Computing kpt #: 11 total cpu time spent up to now is 74.9 secs Computing kpt #: 12 total cpu time spent up to now is 78.3 secs Computing kpt #: 13 total cpu time spent up to now is 81.6 secs Computing kpt #: 14 total cpu time spent up to now is 84.8 secs Computing kpt #: 15 total cpu time spent up to now is 88.1 secs Computing kpt #: 16 total cpu time spent up to now is 91.4 secs Computing kpt #: 17 total cpu time spent up to now is 94.7 secs Computing kpt #: 18 total cpu time spent up to now is 98.0 secs Computing kpt #: 19 total cpu time spent up to now is 101.3 secs Computing kpt #: 20 total cpu time spent up to now is 104.5 secs Computing kpt #: 21 total cpu time spent up to now is 107.6 secs Computing kpt #: 22 total cpu time spent up to now is 110.9 secs Computing kpt #: 23 total cpu time spent up to now is 114.1 secs Computing kpt #: 24 total cpu time spent up to now is 117.4 secs Computing kpt #: 25 total cpu time spent up to now is 120.6 secs Computing kpt #: 26 total cpu time spent up to now is 123.9 secs Computing kpt #: 27 total cpu time spent up to now is 127.0 secs Computing kpt #: 28 total cpu time spent up to now is 130.2 secs Computing kpt #: 29 total cpu time spent up to now is 133.3 secs Computing kpt #: 30 total cpu time spent up to now is 136.5 secs Computing kpt #: 31 total cpu time spent up to now is 139.7 secs Computing kpt #: 32 total cpu time spent up to now is 142.8 secs Computing kpt #: 33 total cpu time spent up to now is 145.9 secs Computing kpt #: 34 total cpu time spent up to now is 149.0 secs Computing kpt #: 35 total cpu time spent up to now is 152.1 secs Computing kpt #: 36 total cpu time spent up to now is 155.2 secs Computing kpt #: 37 total cpu time spent up to now is 158.4 secs Computing kpt #: 38 total cpu time spent up to now is 161.5 secs Computing kpt #: 39 total cpu time spent up to now is 164.5 secs Computing kpt #: 40 total cpu time spent up to now is 167.4 secs Computing kpt #: 41 total cpu time spent up to now is 170.4 secs Computing kpt #: 42 total cpu time spent up to now is 173.3 secs Computing kpt #: 43 total cpu time spent up to now is 176.4 secs Computing kpt #: 44 total cpu time spent up to now is 179.2 secs Computing kpt #: 45 total cpu time spent up to now is 182.1 secs Computing kpt #: 46 total cpu time spent up to now is 184.9 secs Computing kpt #: 47 total cpu time spent up to now is 187.9 secs Computing kpt #: 48 total cpu time spent up to now is 190.8 secs Computing kpt #: 49 total cpu time spent up to now is 193.8 secs Computing kpt #: 50 total cpu time spent up to now is 196.7 secs Computing kpt #: 51 total cpu time spent up to now is 199.8 secs Computing kpt #: 52 total cpu time spent up to now is 202.8 secs Computing kpt #: 53 total cpu time spent up to now is 205.8 secs Computing kpt #: 54 total cpu time spent up to now is 208.9 secs Computing kpt #: 55 total cpu time spent up to now is 212.0 secs Computing kpt #: 56 total cpu time spent up to now is 215.0 secs Computing kpt #: 57 total cpu time spent up to now is 218.0 secs Computing kpt #: 58 total cpu time spent up to now is 221.1 secs Computing kpt #: 59 total cpu time spent up to now is 224.3 secs Computing kpt #: 60 total cpu time spent up to now is 227.3 secs Computing kpt #: 61 total cpu time spent up to now is 230.3 secs Computing kpt #: 62 total cpu time spent up to now is 233.5 secs Computing kpt #: 63 total cpu time spent up to now is 236.5 secs Computing kpt #: 64 total cpu time spent up to now is 239.3 secs Computing kpt #: 65 total cpu time spent up to now is 242.2 secs Computing kpt #: 66 total cpu time spent up to now is 245.0 secs Computing kpt #: 67 total cpu time spent up to now is 248.0 secs Computing kpt #: 68 total cpu time spent up to now is 250.9 secs Computing kpt #: 69 total cpu time spent up to now is 253.8 secs Computing kpt #: 70 total cpu time spent up to now is 256.7 secs Computing kpt #: 71 total cpu time spent up to now is 259.5 secs Computing kpt #: 72 total cpu time spent up to now is 262.6 secs Computing kpt #: 73 total cpu time spent up to now is 265.6 secs Computing kpt #: 74 total cpu time spent up to now is 268.6 secs Computing kpt #: 75 total cpu time spent up to now is 271.7 secs Computing kpt #: 76 total cpu time spent up to now is 274.7 secs Computing kpt #: 77 total cpu time spent up to now is 277.8 secs Computing kpt #: 78 total cpu time spent up to now is 281.0 secs Computing kpt #: 79 total cpu time spent up to now is 284.3 secs Computing kpt #: 80 total cpu time spent up to now is 287.5 secs Computing kpt #: 81 total cpu time spent up to now is 290.9 secs Computing kpt #: 82 total cpu time spent up to now is 294.1 secs Computing kpt #: 83 total cpu time spent up to now is 297.5 secs Computing kpt #: 84 total cpu time spent up to now is 300.8 secs Computing kpt #: 85 total cpu time spent up to now is 304.2 secs Computing kpt #: 86 total cpu time spent up to now is 307.6 secs Computing kpt #: 87 total cpu time spent up to now is 310.9 secs Computing kpt #: 88 total cpu time spent up to now is 314.2 secs Computing kpt #: 89 total cpu time spent up to now is 317.3 secs Computing kpt #: 90 total cpu time spent up to now is 320.1 secs Computing kpt #: 91 total cpu time spent up to now is 322.9 secs Computing kpt #: 92 total cpu time spent up to now is 325.9 secs Computing kpt #: 93 total cpu time spent up to now is 328.9 secs Computing kpt #: 94 total cpu time spent up to now is 331.9 secs Computing kpt #: 95 total cpu time spent up to now is 334.8 secs Computing kpt #: 96 total cpu time spent up to now is 337.8 secs Computing kpt #: 97 total cpu time spent up to now is 340.7 secs Computing kpt #: 98 total cpu time spent up to now is 343.6 secs Computing kpt #: 99 total cpu time spent up to now is 346.5 secs Computing kpt #: 100 total cpu time spent up to now is 349.2 secs Computing kpt #: 101 total cpu time spent up to now is 352.8 secs Computing kpt #: 102 total cpu time spent up to now is 355.9 secs Computing kpt #: 103 total cpu time spent up to now is 359.0 secs Computing kpt #: 104 total cpu time spent up to now is 362.2 secs Computing kpt #: 105 total cpu time spent up to now is 365.5 secs Computing kpt #: 106 total cpu time spent up to now is 368.6 secs Computing kpt #: 107 total cpu time spent up to now is 371.8 secs Computing kpt #: 108 total cpu time spent up to now is 375.1 secs Computing kpt #: 109 total cpu time spent up to now is 378.3 secs Computing kpt #: 110 total cpu time spent up to now is 381.6 secs Computing kpt #: 111 total cpu time spent up to now is 384.9 secs Computing kpt #: 112 total cpu time spent up to now is 388.1 secs Computing kpt #: 113 total cpu time spent up to now is 391.4 secs Computing kpt #: 114 total cpu time spent up to now is 394.6 secs Computing kpt #: 115 total cpu time spent up to now is 397.7 secs Computing kpt #: 116 total cpu time spent up to now is 400.8 secs Computing kpt #: 117 total cpu time spent up to now is 403.9 secs Computing kpt #: 118 total cpu time spent up to now is 407.0 secs Computing kpt #: 119 total cpu time spent up to now is 410.1 secs Computing kpt #: 120 total cpu time spent up to now is 413.3 secs Computing kpt #: 121 total cpu time spent up to now is 416.3 secs Computing kpt #: 122 total cpu time spent up to now is 419.3 secs Computing kpt #: 123 total cpu time spent up to now is 422.6 secs Computing kpt #: 124 total cpu time spent up to now is 425.6 secs Computing kpt #: 125 total cpu time spent up to now is 428.7 secs Computing kpt #: 126 total cpu time spent up to now is 431.9 secs Computing kpt #: 127 total cpu time spent up to now is 434.8 secs Computing kpt #: 128 total cpu time spent up to now is 438.0 secs Computing kpt #: 129 total cpu time spent up to now is 441.2 secs Computing kpt #: 130 total cpu time spent up to now is 444.2 secs Computing kpt #: 131 total cpu time spent up to now is 447.3 secs Computing kpt #: 132 total cpu time spent up to now is 450.4 secs Computing kpt #: 133 total cpu time spent up to now is 453.5 secs Computing kpt #: 134 total cpu time spent up to now is 456.6 secs Computing kpt #: 135 total cpu time spent up to now is 459.6 secs Computing kpt #: 136 total cpu time spent up to now is 462.7 secs Computing kpt #: 137 total cpu time spent up to now is 466.4 secs Computing kpt #: 138 total cpu time spent up to now is 470.2 secs Computing kpt #: 139 total cpu time spent up to now is 473.3 secs Computing kpt #: 140 total cpu time spent up to now is 476.9 secs Computing kpt #: 141 total cpu time spent up to now is 480.2 secs Computing kpt #: 142 total cpu time spent up to now is 484.0 secs Computing kpt #: 143 total cpu time spent up to now is 487.8 secs Computing kpt #: 144 total cpu time spent up to now is 491.5 secs Computing kpt #: 145 total cpu time spent up to now is 494.9 secs Computing kpt #: 146 total cpu time spent up to now is 498.3 secs Computing kpt #: 147 total cpu time spent up to now is 501.9 secs Computing kpt #: 148 total cpu time spent up to now is 505.7 secs Computing kpt #: 149 total cpu time spent up to now is 509.2 secs Computing kpt #: 150 total cpu time spent up to now is 512.8 secs Computing kpt #: 151 total cpu time spent up to now is 515.9 secs Computing kpt #: 152 total cpu time spent up to now is 518.9 secs Computing kpt #: 153 total cpu time spent up to now is 522.0 secs Computing kpt #: 154 total cpu time spent up to now is 525.0 secs Computing kpt #: 155 total cpu time spent up to now is 527.9 secs Computing kpt #: 156 total cpu time spent up to now is 530.8 secs Computing kpt #: 157 total cpu time spent up to now is 533.7 secs Computing kpt #: 158 total cpu time spent up to now is 536.5 secs Computing kpt #: 159 total cpu time spent up to now is 539.4 secs Computing kpt #: 160 total cpu time spent up to now is 542.4 secs Computing kpt #: 161 total cpu time spent up to now is 545.2 secs Computing kpt #: 162 total cpu time spent up to now is 547.9 secs Computing kpt #: 163 total cpu time spent up to now is 550.7 secs Computing kpt #: 164 total cpu time spent up to now is 553.4 secs Computing kpt #: 165 total cpu time spent up to now is 556.1 secs Computing kpt #: 166 total cpu time spent up to now is 558.7 secs Computing kpt #: 167 total cpu time spent up to now is 561.5 secs Computing kpt #: 168 total cpu time spent up to now is 564.1 secs Computing kpt #: 169 total cpu time spent up to now is 567.1 secs Computing kpt #: 170 total cpu time spent up to now is 569.9 secs Computing kpt #: 171 total cpu time spent up to now is 572.9 secs Computing kpt #: 172 total cpu time spent up to now is 575.8 secs Computing kpt #: 173 total cpu time spent up to now is 578.8 secs Computing kpt #: 174 total cpu time spent up to now is 581.8 secs Computing kpt #: 175 total cpu time spent up to now is 584.8 secs Computing kpt #: 176 total cpu time spent up to now is 587.8 secs Computing kpt #: 177 total cpu time spent up to now is 591.0 secs Computing kpt #: 178 total cpu time spent up to now is 594.1 secs Computing kpt #: 179 total cpu time spent up to now is 597.3 secs Computing kpt #: 180 total cpu time spent up to now is 600.4 secs Computing kpt #: 181 total cpu time spent up to now is 603.6 secs Computing kpt #: 182 total cpu time spent up to now is 606.7 secs Computing kpt #: 183 total cpu time spent up to now is 609.9 secs Computing kpt #: 184 total cpu time spent up to now is 613.0 secs Computing kpt #: 185 total cpu time spent up to now is 616.0 secs Computing kpt #: 186 total cpu time spent up to now is 619.0 secs Computing kpt #: 187 total cpu time spent up to now is 622.1 secs Computing kpt #: 188 total cpu time spent up to now is 625.2 secs Computing kpt #: 189 total cpu time spent up to now is 628.2 secs Computing kpt #: 190 total cpu time spent up to now is 631.4 secs Computing kpt #: 191 total cpu time spent up to now is 634.5 secs Computing kpt #: 192 total cpu time spent up to now is 637.4 secs Computing kpt #: 193 total cpu time spent up to now is 640.5 secs Computing kpt #: 194 total cpu time spent up to now is 643.5 secs Computing kpt #: 195 total cpu time spent up to now is 646.6 secs Computing kpt #: 196 total cpu time spent up to now is 649.7 secs Computing kpt #: 197 total cpu time spent up to now is 653.5 secs Computing kpt #: 198 total cpu time spent up to now is 656.8 secs Computing kpt #: 199 total cpu time spent up to now is 660.2 secs Computing kpt #: 200 total cpu time spent up to now is 663.6 secs Computing kpt #: 201 total cpu time spent up to now is 666.6 secs Computing kpt #: 202 total cpu time spent up to now is 670.0 secs Computing kpt #: 203 total cpu time spent up to now is 673.2 secs Computing kpt #: 204 total cpu time spent up to now is 676.7 secs Computing kpt #: 205 total cpu time spent up to now is 679.8 secs Computing kpt #: 206 total cpu time spent up to now is 683.2 secs Computing kpt #: 207 total cpu time spent up to now is 686.6 secs Computing kpt #: 208 total cpu time spent up to now is 689.9 secs Computing kpt #: 209 total cpu time spent up to now is 693.2 secs Computing kpt #: 210 total cpu time spent up to now is 697.0 secs ethr = 1.67E-11, avg # of iterations = 26.8 total cpu time spent up to now is 697.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 7075 PWs) bands (ev): -17.3974 -17.3974 -17.2801 -17.2801 -17.2794 -17.2794 -17.2794 -17.2794 -8.1435 -8.1435 -7.3468 -7.3468 -7.3468 -7.3468 -7.2687 -7.2687 -6.5100 -6.5100 -6.5100 -6.5100 -6.3506 -6.3506 -6.3310 -6.3310 -5.9281 -5.9281 -5.9281 -5.9281 -5.6137 -5.6137 -5.6137 -5.6137 -4.5774 -4.5774 -4.5774 -4.5774 -4.4960 -4.4960 -3.3133 -3.3133 -3.3133 -3.3133 -3.1194 -3.1194 -3.1122 -3.1122 -3.1122 -3.1122 -3.0265 -3.0265 -3.0265 -3.0265 -3.0117 -3.0117 -2.3602 -2.3602 -2.3602 -2.3602 -2.3503 -2.3503 4.0475 4.0475 4.0490 4.0490 4.0490 4.0490 4.7986 4.7986 4.7986 4.7986 5.3162 5.3162 k = 0.0000 0.0185-0.0000 ( 7083 PWs) bands (ev): -17.3974 -17.3974 -17.2801 -17.2801 -17.2794 -17.2794 -17.2794 -17.2794 -8.1430 -8.1430 -7.3474 -7.3474 -7.3468 -7.3468 -7.2691 -7.2691 -6.5101 -6.5101 -6.5099 -6.5099 -6.3509 -6.3509 -6.3308 -6.3308 -5.9281 -5.9281 -5.9278 -5.9278 -5.6140 -5.6140 -5.6136 -5.6136 -4.5771 -4.5771 -4.5766 -4.5766 -4.4955 -4.4955 -3.3148 -3.3148 -3.3131 -3.3131 -3.1207 -3.1207 -3.1141 -3.1141 -3.1129 -3.1129 -3.0268 -3.0268 -3.0260 -3.0260 -3.0116 -3.0116 -2.3595 -2.3595 -2.3585 -2.3585 -2.3490 -2.3490 4.0480 4.0480 4.0495 4.0495 4.0497 4.0497 4.7982 4.7982 4.7993 4.7993 5.3180 5.3180 k = 0.0000 0.0370-0.0000 ( 7083 PWs) bands (ev): -17.3971 -17.3971 -17.2802 -17.2802 -17.2796 -17.2796 -17.2794 -17.2794 -8.1413 -8.1413 -7.3491 -7.3491 -7.3466 -7.3466 -7.2703 -7.2703 -6.5104 -6.5104 -6.5098 -6.5098 -6.3517 -6.3517 -6.3303 -6.3303 -5.9276 -5.9276 -5.9272 -5.9272 -5.6145 -5.6145 -5.6137 -5.6137 -4.5760 -4.5760 -4.5743 -4.5743 -4.4941 -4.4941 -3.3192 -3.3192 -3.3127 -3.3127 -3.1252 -3.1252 -3.1197 -3.1197 -3.1145 -3.1145 -3.0268 -3.0268 -3.0252 -3.0252 -3.0111 -3.0111 -2.3577 -2.3577 -2.3533 -2.3533 -2.3447 -2.3447 4.0495 4.0495 4.0509 4.0509 4.0517 4.0517 4.7974 4.7974 4.8015 4.8015 5.3233 5.3233 k = 0.0000 0.0556-0.0000 ( 7083 PWs) bands (ev): -17.3966 -17.3966 -17.2806 -17.2806 -17.2797 -17.2797 -17.2794 -17.2794 -8.1386 -8.1386 -7.3520 -7.3520 -7.3464 -7.3464 -7.2722 -7.2722 -6.5108 -6.5108 -6.5095 -6.5095 -6.3530 -6.3530 -6.3294 -6.3294 -5.9269 -5.9269 -5.9263 -5.9263 -5.6153 -5.6153 -5.6141 -5.6141 -4.5742 -4.5742 -4.5704 -4.5704 -4.4917 -4.4917 -3.3264 -3.3264 -3.3120 -3.3120 -3.1335 -3.1335 -3.1287 -3.1287 -3.1161 -3.1161 -3.0267 -3.0267 -3.0243 -3.0243 -3.0103 -3.0103 -2.3554 -2.3554 -2.3449 -2.3449 -2.3369 -2.3369 4.0518 4.0518 4.0533 4.0533 4.0551 4.0551 4.7958 4.7958 4.8051 4.8051 5.3322 5.3322 k = 0.0000 0.0741-0.0000 ( 7075 PWs) bands (ev): -17.3960 -17.3960 -17.2811 -17.2811 -17.2797 -17.2797 -17.2794 -17.2794 -8.1349 -8.1349 -7.3563 -7.3563 -7.3461 -7.3461 -7.2745 -7.2745 -6.5114 -6.5114 -6.5090 -6.5090 -6.3545 -6.3545 -6.3284 -6.3284 -5.9259 -5.9259 -5.9250 -5.9250 -5.6162 -5.6162 -5.6146 -5.6146 -4.5717 -4.5717 -4.5652 -4.5652 -4.4882 -4.4882 -3.3362 -3.3362 -3.3110 -3.3110 -3.1452 -3.1452 -3.1407 -3.1407 -3.1177 -3.1177 -3.0265 -3.0265 -3.0236 -3.0236 -3.0089 -3.0089 -2.3529 -2.3529 -2.3335 -2.3335 -2.3259 -2.3259 4.0551 4.0551 4.0566 4.0566 4.0599 4.0599 4.7937 4.7937 4.8102 4.8102 5.3445 5.3445 k = 0.0000 0.0926-0.0000 ( 7051 PWs) bands (ev): -17.3952 -17.3952 -17.2819 -17.2819 -17.2797 -17.2797 -17.2794 -17.2794 -8.1300 -8.1300 -7.3620 -7.3620 -7.3458 -7.3458 -7.2773 -7.2773 -6.5121 -6.5121 -6.5085 -6.5085 -6.3564 -6.3564 -6.3272 -6.3272 -5.9245 -5.9245 -5.9234 -5.9234 -5.6173 -5.6173 -5.6154 -5.6154 -4.5684 -4.5684 -4.5586 -4.5586 -4.4837 -4.4837 -3.3485 -3.3485 -3.3097 -3.3097 -3.1597 -3.1597 -3.1554 -3.1554 -3.1196 -3.1196 -3.0265 -3.0265 -3.0231 -3.0231 -3.0068 -3.0068 -2.3500 -2.3500 -2.3196 -2.3196 -2.3122 -2.3122 4.0592 4.0592 4.0607 4.0607 4.0661 4.0661 4.7909 4.7909 4.8166 4.8166 5.3602 5.3602 k = 0.0000 0.1111-0.0000 ( 7052 PWs) bands (ev): -17.3942 -17.3942 -17.2829 -17.2829 -17.2797 -17.2797 -17.2794 -17.2794 -8.1241 -8.1241 -7.3692 -7.3692 -7.3453 -7.3453 -7.2802 -7.2802 -6.5130 -6.5130 -6.5078 -6.5078 -6.3584 -6.3584 -6.3261 -6.3261 -5.9228 -5.9228 -5.9216 -5.9216 -5.6187 -5.6187 -5.6163 -5.6163 -4.5646 -4.5646 -4.5509 -4.5509 -4.4780 -4.4780 -3.3629 -3.3629 -3.3082 -3.3082 -3.1766 -3.1766 -3.1723 -3.1723 -3.1219 -3.1219 -3.0266 -3.0266 -3.0230 -3.0230 -3.0042 -3.0042 -2.3468 -2.3468 -2.3035 -2.3035 -2.2962 -2.2962 4.0641 4.0641 4.0658 4.0658 4.0737 4.0737 4.7874 4.7874 4.8244 4.8244 5.3793 5.3793 k = 0.0000 0.1296-0.0000 ( 7048 PWs) bands (ev): -17.3930 -17.3930 -17.2840 -17.2840 -17.2797 -17.2797 -17.2793 -17.2793 -8.1171 -8.1171 -7.3782 -7.3782 -7.3448 -7.3448 -7.2832 -7.2832 -6.5140 -6.5140 -6.5070 -6.5070 -6.3606 -6.3606 -6.3249 -6.3249 -5.9209 -5.9209 -5.9195 -5.9195 -5.6202 -5.6202 -5.6175 -5.6175 -4.5601 -4.5601 -4.5424 -4.5424 -4.4710 -4.4710 -3.3793 -3.3793 -3.3064 -3.3064 -3.1954 -3.1954 -3.1910 -3.1910 -3.1244 -3.1244 -3.0269 -3.0269 -3.0232 -3.0232 -3.0012 -3.0012 -2.3433 -2.3433 -2.2857 -2.2857 -2.2784 -2.2784 4.0699 4.0699 4.0717 4.0717 4.0827 4.0827 4.7832 4.7832 4.8335 4.8335 5.4016 5.4016 k = 0.0000 0.1481-0.0000 ( 7052 PWs) bands (ev): -17.3917 -17.3917 -17.2854 -17.2854 -17.2797 -17.2797 -17.2793 -17.2793 -8.1091 -8.1091 -7.3888 -7.3888 -7.3442 -7.3442 -7.2861 -7.2861 -6.5150 -6.5150 -6.5062 -6.5062 -6.3629 -6.3629 -6.3238 -6.3238 -5.9187 -5.9187 -5.9172 -5.9172 -5.6218 -5.6218 -5.6189 -5.6189 -4.5551 -4.5551 -4.5333 -4.5333 -4.4626 -4.4626 -3.3974 -3.3974 -3.3043 -3.3043 -3.2157 -3.2157 -3.2112 -3.2112 -3.1273 -3.1273 -3.0273 -3.0273 -3.0236 -3.0236 -2.9978 -2.9978 -2.3395 -2.3395 -2.2665 -2.2665 -2.2592 -2.2592 4.0764 4.0764 4.0783 4.0783 4.0930 4.0930 4.7782 4.7782 4.8439 4.8439 5.4271 5.4271 k = 0.0000 0.1667-0.0000 ( 7052 PWs) bands (ev): -17.3903 -17.3903 -17.2868 -17.2868 -17.2797 -17.2797 -17.2793 -17.2793 -8.1001 -8.1001 -7.4011 -7.4011 -7.3436 -7.3436 -7.2888 -7.2888 -6.5162 -6.5162 -6.5052 -6.5052 -6.3653 -6.3653 -6.3227 -6.3227 -5.9163 -5.9163 -5.9146 -5.9146 -5.6236 -5.6236 -5.6204 -5.6204 -4.5495 -4.5495 -4.5238 -4.5238 -4.4526 -4.4526 -3.4170 -3.4170 -3.3020 -3.3020 -3.2370 -3.2370 -3.2324 -3.2324 -3.1305 -3.1305 -3.0279 -3.0279 -3.0242 -3.0242 -2.9943 -2.9943 -2.3356 -2.3356 -2.2463 -2.2463 -2.2391 -2.2391 4.0836 4.0836 4.0857 4.0857 4.1047 4.1047 4.7723 4.7723 4.8554 4.8554 5.4555 5.4555 k = 0.0000 0.1852-0.0000 ( 7044 PWs) bands (ev): -17.3887 -17.3887 -17.2885 -17.2885 -17.2797 -17.2797 -17.2793 -17.2793 -8.0901 -8.0901 -7.4150 -7.4150 -7.3428 -7.3428 -7.2914 -7.2914 -6.5173 -6.5173 -6.5042 -6.5042 -6.3678 -6.3678 -6.3216 -6.3216 -5.9137 -5.9137 -5.9119 -5.9119 -5.6255 -5.6255 -5.6221 -5.6221 -4.5434 -4.5434 -4.5142 -4.5142 -4.4409 -4.4409 -3.4379 -3.4379 -3.2995 -3.2995 -3.2590 -3.2590 -3.2544 -3.2544 -3.1340 -3.1340 -3.0286 -3.0286 -3.0250 -3.0250 -2.9908 -2.9908 -2.3315 -2.3315 -2.2255 -2.2255 -2.2184 -2.2184 4.0915 4.0915 4.0938 4.0938 4.1176 4.1176 4.7655 4.7655 4.8680 4.8680 5.4867 5.4867 k = 0.0000 0.2037-0.0000 ( 7048 PWs) bands (ev): -17.3869 -17.3869 -17.2903 -17.2903 -17.2797 -17.2797 -17.2793 -17.2793 -8.0791 -8.0791 -7.4303 -7.4303 -7.3420 -7.3420 -7.2937 -7.2937 -6.5185 -6.5185 -6.5031 -6.5031 -6.3703 -6.3703 -6.3206 -6.3206 -5.9109 -5.9109 -5.9090 -5.9090 -5.6276 -5.6276 -5.6240 -5.6240 -4.5369 -4.5369 -4.5047 -4.5047 -4.4274 -4.4274 -3.4599 -3.4599 -3.2970 -3.2970 -3.2812 -3.2812 -3.2767 -3.2767 -3.1378 -3.1378 -3.0293 -3.0293 -3.0259 -3.0259 -2.9873 -2.9873 -2.3274 -2.3274 -2.2045 -2.2045 -2.1975 -2.1975 4.1000 4.1000 4.1024 4.1024 4.1318 4.1318 4.7579 4.7579 4.8817 4.8817 5.5206 5.5206 k = 0.0000 0.2222-0.0000 ( 7048 PWs) bands (ev): -17.3850 -17.3850 -17.2922 -17.2922 -17.2797 -17.2797 -17.2793 -17.2793 -8.0672 -8.0672 -7.4470 -7.4470 -7.3412 -7.3412 -7.2959 -7.2959 -6.5197 -6.5197 -6.5019 -6.5019 -6.3728 -6.3728 -6.3197 -6.3197 -5.9080 -5.9080 -5.9060 -5.9060 -5.6298 -5.6298 -5.6259 -5.6259 -4.5301 -4.5301 -4.4955 -4.4955 -4.4123 -4.4123 -3.4828 -3.4828 -3.3050 -3.3050 -3.2996 -3.2996 -3.2924 -3.2924 -3.1419 -3.1419 -3.0302 -3.0302 -3.0268 -3.0268 -2.9839 -2.9839 -2.3233 -2.3233 -2.1834 -2.1834 -2.1765 -2.1765 4.1091 4.1091 4.1116 4.1116 4.1473 4.1473 4.7493 4.7493 4.8962 4.8962 5.5569 5.5569 k = 0.0000 0.2407-0.0000 ( 7032 PWs) bands (ev): -17.3830 -17.3830 -17.2942 -17.2942 -17.2796 -17.2796 -17.2793 -17.2793 -8.0543 -8.0543 -7.4650 -7.4650 -7.3402 -7.3402 -7.2979 -7.2979 -6.5209 -6.5209 -6.5006 -6.5006 -6.3753 -6.3753 -6.3189 -6.3189 -5.9050 -5.9050 -5.9029 -5.9029 -5.6320 -5.6320 -5.6280 -5.6280 -4.5229 -4.5229 -4.4866 -4.4866 -4.3956 -4.3956 -3.5065 -3.5065 -3.3271 -3.3271 -3.3218 -3.3218 -3.2897 -3.2897 -3.1462 -3.1462 -3.0311 -3.0311 -3.0278 -3.0278 -2.9806 -2.9806 -2.3193 -2.3193 -2.1626 -2.1626 -2.1559 -2.1559 4.1185 4.1185 4.1212 4.1212 4.1639 4.1639 4.7397 4.7397 4.9115 4.9115 5.5953 5.5953 k = 0.0000 0.2593-0.0000 ( 7056 PWs) bands (ev): -17.3809 -17.3809 -17.2964 -17.2964 -17.2796 -17.2796 -17.2793 -17.2793 -8.0405 -8.0405 -7.4840 -7.4840 -7.3392 -7.3392 -7.2998 -7.2998 -6.5221 -6.5221 -6.4993 -6.4993 -6.3778 -6.3778 -6.3181 -6.3181 -5.9020 -5.9020 -5.8998 -5.8998 -5.6342 -5.6342 -5.6302 -5.6302 -4.5156 -4.5156 -4.4781 -4.4781 -4.3776 -4.3776 -3.5307 -3.5307 -3.3492 -3.3492 -3.3438 -3.3438 -3.2863 -3.2863 -3.1508 -3.1508 -3.0320 -3.0320 -3.0289 -3.0289 -2.9775 -2.9775 -2.3154 -2.3154 -2.1423 -2.1423 -2.1357 -2.1357 4.1282 4.1282 4.1311 4.1311 4.1815 4.1815 4.7291 4.7291 4.9274 4.9274 5.6356 5.6356 k = 0.0000 0.2778-0.0000 ( 7060 PWs) bands (ev): -17.3786 -17.3786 -17.2986 -17.2986 -17.2796 -17.2796 -17.2793 -17.2793 -8.0259 -8.0259 -7.5039 -7.5039 -7.3382 -7.3382 -7.3016 -7.3016 -6.5232 -6.5232 -6.4980 -6.4980 -6.3803 -6.3803 -6.3174 -6.3174 -5.8989 -5.8989 -5.8967 -5.8967 -5.6365 -5.6365 -5.6324 -5.6324 -4.5082 -4.5082 -4.4699 -4.4699 -4.3585 -4.3585 -3.5554 -3.5554 -3.3707 -3.3707 -3.3651 -3.3651 -3.2825 -3.2825 -3.1556 -3.1556 -3.0329 -3.0329 -3.0299 -3.0299 -2.9745 -2.9745 -2.3117 -2.3117 -2.1226 -2.1226 -2.1163 -2.1163 4.1382 4.1382 4.1411 4.1411 4.2002 4.2002 4.7174 4.7174 4.9438 4.9438 5.6775 5.6775 k = 0.0000 0.2963-0.0000 ( 7056 PWs) bands (ev): -17.3763 -17.3763 -17.3009 -17.3009 -17.2796 -17.2796 -17.2793 -17.2793 -8.0104 -8.0104 -7.5246 -7.5246 -7.3371 -7.3371 -7.3034 -7.3034 -6.5243 -6.5243 -6.4967 -6.4967 -6.3827 -6.3827 -6.3168 -6.3168 -5.8959 -5.8959 -5.8936 -5.8936 -5.6388 -5.6388 -5.6347 -5.6347 -4.5008 -4.5008 -4.4620 -4.4620 -4.3385 -4.3385 -3.5802 -3.5802 -3.3914 -3.3914 -3.3857 -3.3857 -3.2785 -3.2785 -3.1606 -3.1606 -3.0339 -3.0339 -3.0310 -3.0310 -2.9717 -2.9717 -2.3083 -2.3083 -2.1039 -2.1039 -2.0978 -2.0978 4.1482 4.1482 4.1513 4.1513 4.2197 4.2197 4.7048 4.7048 4.9605 4.9605 5.7204 5.7204 k = 0.0000 0.3148-0.0000 ( 7076 PWs) bands (ev): -17.3739 -17.3739 -17.3033 -17.3033 -17.2796 -17.2796 -17.2793 -17.2793 -7.9942 -7.9942 -7.5460 -7.5460 -7.3359 -7.3359 -7.3051 -7.3051 -6.5253 -6.5253 -6.4954 -6.4954 -6.3851 -6.3851 -6.3162 -6.3162 -5.8929 -5.8929 -5.8906 -5.8906 -5.6410 -5.6410 -5.6369 -5.6369 -4.4935 -4.4935 -4.4545 -4.4545 -4.3180 -4.3180 -3.6050 -3.6050 -3.4112 -3.4112 -3.4052 -3.4052 -3.2742 -3.2742 -3.1657 -3.1657 -3.0348 -3.0348 -3.0320 -3.0320 -2.9691 -2.9691 -2.3050 -2.3050 -2.0863 -2.0863 -2.0804 -2.0804 4.1582 4.1582 4.1613 4.1613 4.2401 4.2401 4.6911 4.6911 4.9773 4.9773 5.7641 5.7641 k = 0.0000 0.3333-0.0000 ( 7076 PWs) bands (ev): -17.3715 -17.3715 -17.3058 -17.3058 -17.2796 -17.2796 -17.2792 -17.2792 -7.9772 -7.9772 -7.5678 -7.5678 -7.3348 -7.3348 -7.3067 -7.3067 -6.5263 -6.5263 -6.4941 -6.4941 -6.3874 -6.3874 -6.3157 -6.3157 -5.8901 -5.8901 -5.8876 -5.8876 -5.6432 -5.6432 -5.6391 -5.6391 -4.4863 -4.4863 -4.4474 -4.4474 -4.2971 -4.2971 -3.6296 -3.6296 -3.4298 -3.4298 -3.4235 -3.4235 -3.2698 -3.2698 -3.1711 -3.1711 -3.0357 -3.0357 -3.0329 -3.0329 -2.9667 -2.9667 -2.3021 -2.3021 -2.0699 -2.0699 -2.0642 -2.0642 4.1679 4.1679 4.1711 4.1711 4.2611 4.2611 4.6765 4.6765 4.9938 4.9938 5.8079 5.8079 k = 0.0000 0.3519-0.0000 ( 7064 PWs) bands (ev): -17.3691 -17.3691 -17.3082 -17.3082 -17.2795 -17.2795 -17.2792 -17.2792 -7.9596 -7.9596 -7.5900 -7.5900 -7.3335 -7.3335 -7.3083 -7.3083 -6.5271 -6.5271 -6.4928 -6.4928 -6.3895 -6.3895 -6.3152 -6.3152 -5.8874 -5.8874 -5.8848 -5.8848 -5.6452 -5.6452 -5.6412 -5.6412 -4.4795 -4.4795 -4.4408 -4.4408 -4.2762 -4.2762 -3.6537 -3.6537 -3.4469 -3.4469 -3.4404 -3.4404 -3.2652 -3.2652 -3.1765 -3.1765 -3.0365 -3.0365 -3.0338 -3.0338 -2.9646 -2.9646 -2.2995 -2.2995 -2.0548 -2.0548 -2.0494 -2.0494 4.1772 4.1772 4.1805 4.1805 4.2826 4.2826 4.6611 4.6611 5.0100 5.0100 5.8166 5.8166 k = 0.0000 0.3704-0.0000 ( 7056 PWs) bands (ev): -17.3667 -17.3667 -17.3106 -17.3106 -17.2795 -17.2795 -17.2792 -17.2792 -7.9415 -7.9415 -7.6123 -7.6123 -7.3323 -7.3323 -7.3099 -7.3099 -6.5279 -6.5279 -6.4916 -6.4916 -6.3914 -6.3914 -6.3148 -6.3148 -5.8849 -5.8849 -5.8822 -5.8822 -5.6471 -5.6471 -5.6432 -5.6432 -4.4732 -4.4732 -4.4347 -4.4347 -4.2557 -4.2557 -3.6769 -3.6769 -3.4626 -3.4626 -3.4558 -3.4558 -3.2604 -3.2604 -3.1821 -3.1821 -3.0372 -3.0372 -3.0347 -3.0347 -2.9626 -2.9626 -2.2971 -2.2971 -2.0412 -2.0412 -2.0360 -2.0360 4.1860 4.1860 4.1894 4.1894 4.3043 4.3043 4.6448 4.6448 5.0254 5.0254 5.7932 5.7932 k = 0.0000 0.3889-0.0000 ( 7044 PWs) bands (ev): -17.3643 -17.3643 -17.3130 -17.3130 -17.2795 -17.2795 -17.2792 -17.2792 -7.9229 -7.9229 -7.6347 -7.6347 -7.3310 -7.3310 -7.3114 -7.3114 -6.5285 -6.5285 -6.4904 -6.4904 -6.3932 -6.3932 -6.3145 -6.3145 -5.8827 -5.8827 -5.8798 -5.8798 -5.6488 -5.6488 -5.6450 -5.6450 -4.4674 -4.4674 -4.4292 -4.4292 -4.2360 -4.2360 -3.6990 -3.6990 -3.4765 -3.4765 -3.4695 -3.4695 -3.2554 -3.2554 -3.1877 -3.1877 -3.0379 -3.0379 -3.0354 -3.0354 -2.9609 -2.9609 -2.2951 -2.2951 -2.0292 -2.0292 -2.0243 -2.0243 4.1941 4.1941 4.1975 4.1975 4.3262 4.3262 4.6280 4.6280 5.0398 5.0398 5.7721 5.7721 k = 0.0000 0.4074-0.0000 ( 7048 PWs) bands (ev): -17.3620 -17.3620 -17.3153 -17.3153 -17.2795 -17.2795 -17.2792 -17.2792 -7.9040 -7.9040 -7.6568 -7.6568 -7.3297 -7.3297 -7.3129 -7.3129 -6.5291 -6.5291 -6.4895 -6.4895 -6.3948 -6.3948 -6.3142 -6.3142 -5.8807 -5.8807 -5.8777 -5.8777 -5.6503 -5.6503 -5.6466 -5.6466 -4.4622 -4.4622 -4.4244 -4.4244 -4.2175 -4.2175 -3.7193 -3.7193 -3.4886 -3.4886 -3.4813 -3.4813 -3.2503 -3.2503 -3.1934 -3.1934 -3.0385 -3.0385 -3.0361 -3.0361 -2.9594 -2.9594 -2.2934 -2.2934 -2.0189 -2.0189 -2.0142 -2.0142 4.2013 4.2013 4.2047 4.2047 4.3477 4.3477 4.6107 4.6107 5.0529 5.0529 5.7537 5.7537 k = 0.0000 0.4259-0.0000 ( 7044 PWs) bands (ev): -17.3600 -17.3600 -17.3173 -17.3173 -17.2795 -17.2795 -17.2792 -17.2792 -7.8852 -7.8852 -7.6783 -7.6783 -7.3285 -7.3285 -7.3144 -7.3144 -6.5296 -6.5296 -6.4886 -6.4886 -6.3961 -6.3961 -6.3140 -6.3140 -5.8790 -5.8790 -5.8759 -5.8759 -5.6516 -5.6516 -5.6480 -5.6480 -4.4578 -4.4578 -4.4203 -4.4203 -4.2009 -4.2009 -3.7375 -3.7375 -3.4987 -3.4987 -3.4912 -3.4912 -3.2450 -3.2450 -3.1991 -3.1991 -3.0390 -3.0390 -3.0366 -3.0366 -2.9582 -2.9582 -2.2920 -2.2920 -2.0103 -2.0103 -2.0058 -2.0058 4.2074 4.2074 4.2108 4.2108 4.3685 4.3685 4.5936 4.5936 5.0641 5.0641 5.7383 5.7383 k = 0.0000 0.4444-0.0000 ( 7040 PWs) bands (ev): -17.3582 -17.3582 -17.3191 -17.3191 -17.2795 -17.2795 -17.2792 -17.2792 -7.8670 -7.8670 -7.6987 -7.6987 -7.3273 -7.3273 -7.3157 -7.3157 -6.5299 -6.5299 -6.4879 -6.4879 -6.3972 -6.3972 -6.3138 -6.3138 -5.8777 -5.8777 -5.8744 -5.8744 -5.6526 -5.6526 -5.6491 -5.6491 -4.4543 -4.4543 -4.4171 -4.4171 -4.1869 -4.1869 -3.7527 -3.7527 -3.5066 -3.5066 -3.4990 -3.4990 -3.2396 -3.2396 -3.2049 -3.2049 -3.0394 -3.0394 -3.0370 -3.0370 -2.9573 -2.9573 -2.2909 -2.2909 -2.0036 -2.0036 -1.9992 -1.9992 4.2123 4.2123 4.2158 4.2158 4.3878 4.3878 4.5771 4.5771 5.0733 5.0733 5.7261 5.7261 k = 0.0000 0.4630-0.0000 ( 7032 PWs) bands (ev): -17.3568 -17.3568 -17.3206 -17.3206 -17.2795 -17.2795 -17.2792 -17.2792 -7.8504 -7.8504 -7.7168 -7.7168 -7.3262 -7.3262 -7.3168 -7.3168 -6.5302 -6.5302 -6.4874 -6.4874 -6.3980 -6.3980 -6.3136 -6.3136 -5.8767 -5.8767 -5.8734 -5.8734 -5.6534 -5.6534 -5.6499 -5.6499 -4.4517 -4.4517 -4.4147 -4.4147 -4.1761 -4.1761 -3.7643 -3.7643 -3.5124 -3.5124 -3.5046 -3.5046 -3.2343 -3.2343 -3.2105 -3.2105 -3.0397 -3.0397 -3.0374 -3.0374 -2.9566 -2.9566 -2.2901 -2.2901 -1.9988 -1.9988 -1.9945 -1.9945 4.2160 4.2160 4.2194 4.2194 4.4044 4.4044 4.5627 4.5627 5.0802 5.0802 5.7172 5.7172 k = 0.0000 0.4815-0.0000 ( 7032 PWs) bands (ev): -17.3559 -17.3559 -17.3215 -17.3215 -17.2795 -17.2795 -17.2792 -17.2792 -7.8378 -7.8378 -7.7304 -7.7304 -7.3254 -7.3254 -7.3177 -7.3177 -6.5303 -6.5303 -6.4871 -6.4871 -6.3984 -6.3984 -6.3136 -6.3136 -5.8762 -5.8762 -5.8727 -5.8727 -5.6538 -5.6538 -5.6504 -5.6504 -4.4502 -4.4502 -4.4133 -4.4133 -4.1693 -4.1693 -3.7716 -3.7716 -3.5159 -3.5159 -3.5081 -3.5081 -3.2291 -3.2291 -3.2159 -3.2159 -3.0399 -3.0399 -3.0375 -3.0375 -2.9561 -2.9561 -2.2897 -2.2897 -1.9958 -1.9958 -1.9917 -1.9917 4.2182 4.2182 4.2216 4.2216 4.4162 4.4162 4.5521 4.5521 5.0844 5.0844 5.7118 5.7118 k = 0.0000 0.5000-0.0000 ( 7032 PWs) bands (ev): -17.3555 -17.3555 -17.3218 -17.3218 -17.2795 -17.2795 -17.2792 -17.2792 -7.8328 -7.8328 -7.7358 -7.7358 -7.3251 -7.3251 -7.3180 -7.3180 -6.5304 -6.5304 -6.4870 -6.4870 -6.3986 -6.3986 -6.3135 -6.3135 -5.8760 -5.8760 -5.8725 -5.8725 -5.6539 -5.6539 -5.6506 -5.6506 -4.4497 -4.4497 -4.4128 -4.4128 -4.1670 -4.1670 -3.7741 -3.7741 -3.5171 -3.5171 -3.5092 -3.5092 -3.2258 -3.2258 -3.2192 -3.2192 -3.0399 -3.0399 -3.0376 -3.0376 -2.9560 -2.9560 -2.2895 -2.2895 -1.9949 -1.9949 -1.9907 -1.9907 4.2189 4.2189 4.2223 4.2223 4.4206 4.4206 4.5482 4.5482 5.0858 5.0858 5.7100 5.7100 k = 0.0000 0.5000-0.0000 ( 7032 PWs) bands (ev): -17.3555 -17.3555 -17.3218 -17.3218 -17.2795 -17.2795 -17.2792 -17.2792 -7.8328 -7.8328 -7.7358 -7.7358 -7.3251 -7.3251 -7.3180 -7.3180 -6.5304 -6.5304 -6.4870 -6.4870 -6.3986 -6.3986 -6.3135 -6.3135 -5.8760 -5.8760 -5.8725 -5.8725 -5.6539 -5.6539 -5.6506 -5.6506 -4.4497 -4.4497 -4.4128 -4.4128 -4.1670 -4.1670 -3.7741 -3.7741 -3.5171 -3.5171 -3.5092 -3.5092 -3.2258 -3.2258 -3.2192 -3.2192 -3.0399 -3.0399 -3.0376 -3.0376 -2.9560 -2.9560 -2.2895 -2.2895 -1.9949 -1.9949 -1.9907 -1.9907 4.2189 4.2189 4.2223 4.2223 4.4206 4.4206 4.5482 4.5482 5.0858 5.0858 5.7100 5.7100 k = 0.0185 0.5000-0.0000 ( 7032 PWs) bands (ev): -17.3555 -17.3555 -17.3217 -17.3217 -17.2795 -17.2795 -17.2792 -17.2792 -7.8333 -7.8323 -7.7365 -7.7352 -7.3263 -7.3239 -7.3196 -7.3164 -6.5314 -6.5294 -6.4893 -6.4845 -6.3995 -6.3977 -6.3183 -6.3090 -5.8765 -5.8755 -5.8730 -5.8719 -5.6545 -5.6533 -5.6513 -5.6499 -4.4499 -4.4492 -4.4144 -4.4109 -4.1686 -4.1652 -3.7751 -3.7742 -3.5179 -3.5179 -3.5100 -3.5098 -3.2256 -3.2248 -3.2196 -3.2182 -3.0407 -3.0386 -3.0377 -3.0368 -2.9565 -2.9549 -2.2904 -2.2889 -1.9951 -1.9947 -1.9909 -1.9907 4.2179 4.2199 4.2219 4.2230 4.4217 4.4223 4.5493 4.5509 5.0843 5.0852 5.7062 5.7088 k = 0.0370 0.5000-0.0000 ( 7044 PWs) bands (ev): -17.3554 -17.3554 -17.3217 -17.3216 -17.2796 -17.2796 -17.2794 -17.2793 -7.8338 -7.8319 -7.7373 -7.7346 -7.3274 -7.3227 -7.3212 -7.3148 -6.5325 -6.5285 -6.4915 -6.4820 -6.4004 -6.3969 -6.3231 -6.3046 -5.8770 -5.8750 -5.8733 -5.8713 -5.6549 -5.6525 -5.6520 -5.6492 -4.4500 -4.4486 -4.4157 -4.4088 -4.1703 -4.1636 -3.7770 -3.7754 -3.5209 -3.5208 -3.5117 -3.5111 -3.2243 -3.2227 -3.2194 -3.2166 -3.0408 -3.0370 -3.0369 -3.0351 -2.9564 -2.9534 -2.2916 -2.2885 -1.9955 -1.9946 -1.9912 -1.9907 4.2170 4.2209 4.2216 4.2238 4.4255 4.4267 4.5541 4.5573 5.0809 5.0826 5.6961 5.7001 k = 0.0556 0.5000-0.0000 ( 7056 PWs) bands (ev): -17.3552 -17.3551 -17.3215 -17.3214 -17.2798 -17.2798 -17.2796 -17.2795 -7.8344 -7.8315 -7.7381 -7.7341 -7.3285 -7.3227 -7.3215 -7.3132 -6.5336 -6.5277 -6.4936 -6.4794 -6.4014 -6.3962 -6.3280 -6.3006 -5.8775 -5.8744 -5.8735 -5.8706 -5.6553 -5.6526 -5.6517 -5.6485 -4.4499 -4.4477 -4.4168 -4.4063 -4.1719 -4.1619 -3.7799 -3.7776 -3.5266 -3.5264 -3.5135 -3.5126 -3.2220 -3.2195 -3.2185 -3.2143 -3.0403 -3.0354 -3.0352 -3.0321 -2.9558 -2.9515 -2.2930 -2.2884 -1.9961 -1.9946 -1.9914 -1.9908 4.2163 4.2216 4.2219 4.2249 4.4320 4.4336 4.5627 4.5673 5.0754 5.0780 5.6807 5.6856 k = 0.0741 0.5000-0.0000 ( 7068 PWs) bands (ev): -17.3549 -17.3548 -17.3213 -17.3212 -17.2801 -17.2800 -17.2798 -17.2798 -7.8351 -7.8312 -7.7389 -7.7338 -7.3296 -7.3241 -7.3203 -7.3116 -6.5347 -6.5269 -6.4956 -6.4768 -6.4024 -6.3955 -6.3329 -6.2967 -5.8780 -5.8739 -5.8736 -5.8698 -5.6556 -5.6530 -5.6507 -5.6478 -4.4496 -4.4467 -4.4176 -4.4037 -4.1733 -4.1602 -3.7838 -3.7807 -3.5351 -3.5348 -3.5151 -3.5140 -3.2191 -3.2166 -3.2154 -3.2114 -3.0393 -3.0334 -3.0329 -3.0281 -2.9547 -2.9493 -2.2948 -2.2888 -1.9967 -1.9948 -1.9917 -1.9909 4.2161 4.2220 4.2232 4.2263 4.4408 4.4428 4.5748 4.5806 5.0680 5.0715 5.6617 5.6672 k = 0.0926 0.5000-0.0000 ( 7070 PWs) bands (ev): -17.3545 -17.3544 -17.3210 -17.3209 -17.2805 -17.2804 -17.2801 -17.2801 -7.8357 -7.8310 -7.7398 -7.7335 -7.3305 -7.3254 -7.3192 -7.3101 -6.5358 -6.5262 -6.4973 -6.4742 -6.4033 -6.3949 -6.3377 -6.2933 -5.8786 -5.8734 -5.8733 -5.8690 -5.6559 -5.6532 -5.6498 -5.6470 -4.4492 -4.4454 -4.4181 -4.4008 -4.1745 -4.1584 -3.7884 -3.7847 -3.5459 -3.5455 -3.5168 -3.5154 -3.2160 -3.2136 -3.2105 -3.2078 -3.0377 -3.0313 -3.0295 -3.0234 -2.9532 -2.9469 -2.2969 -2.2895 -1.9975 -1.9952 -1.9918 -1.9908 4.2164 4.2230 4.2248 4.2282 4.4518 4.4542 4.5903 4.5971 5.0586 5.0630 5.6403 5.6464 k = 0.1111 0.5000-0.0000 ( 7060 PWs) bands (ev): -17.3540 -17.3540 -17.3206 -17.3205 -17.2809 -17.2808 -17.2805 -17.2804 -7.8363 -7.8308 -7.7407 -7.7334 -7.3313 -7.3265 -7.3181 -7.3087 -6.5369 -6.5256 -6.4989 -6.4715 -6.4042 -6.3944 -6.3423 -6.2901 -5.8790 -5.8731 -5.8727 -5.8682 -5.6563 -5.6531 -5.6489 -5.6461 -4.4487 -4.4439 -4.4184 -4.3979 -4.1754 -4.1566 -3.7939 -3.7896 -3.5586 -3.5581 -3.5186 -3.5171 -3.2127 -3.2094 -3.2050 -3.2035 -3.0355 -3.0289 -3.0254 -3.0181 -2.9515 -2.9445 -2.2995 -2.2907 -1.9984 -1.9957 -1.9918 -1.9906 4.2176 4.2247 4.2271 4.2307 4.4647 4.4673 4.6089 4.6164 5.0474 5.0527 5.6174 5.6239 k = 0.1296 0.5000-0.0000 ( 7064 PWs) bands (ev): -17.3535 -17.3534 -17.3202 -17.3200 -17.2814 -17.2813 -17.2810 -17.2808 -7.8369 -7.8307 -7.7416 -7.7333 -7.3321 -7.3275 -7.3171 -7.3074 -6.5379 -6.5252 -6.5004 -6.4690 -6.4050 -6.3941 -6.3468 -6.2874 -5.8795 -5.8727 -5.8721 -5.8673 -5.6567 -5.6528 -5.6481 -5.6451 -4.4481 -4.4423 -4.4186 -4.3949 -4.1759 -4.1546 -3.8000 -3.7952 -3.5731 -3.5724 -3.5207 -3.5190 -3.2088 -3.2045 -3.1990 -3.1985 -3.0327 -3.0260 -3.0206 -3.0123 -2.9497 -2.9422 -2.3025 -2.2926 -1.9993 -1.9963 -1.9917 -1.9902 4.2196 4.2272 4.2300 4.2340 4.4792 4.4819 4.6302 4.6384 5.0344 5.0405 5.5935 5.6004 k = 0.1481 0.5000-0.0000 ( 7056 PWs) bands (ev): -17.3528 -17.3528 -17.3197 -17.3195 -17.2820 -17.2819 -17.2814 -17.2813 -7.8376 -7.8307 -7.7425 -7.7334 -7.3327 -7.3284 -7.3162 -7.3062 -6.5389 -6.5248 -6.5016 -6.4666 -6.4059 -6.3938 -6.3510 -6.2851 -5.8798 -5.8721 -5.8715 -5.8664 -5.6572 -5.6522 -5.6475 -5.6440 -4.4474 -4.4405 -4.4187 -4.3920 -4.1758 -4.1525 -3.8066 -3.8015 -3.5889 -3.5880 -3.5231 -3.5211 -3.2042 -3.1991 -3.1928 -3.1927 -3.0292 -3.0228 -3.0152 -3.0062 -2.9479 -2.9401 -2.3061 -2.2950 -2.0001 -1.9968 -1.9915 -1.9898 4.2227 4.2306 4.2337 4.2382 4.4949 4.4977 4.6542 4.6628 5.0196 5.0266 5.5693 5.5765 k = 0.1667 0.5000-0.0000 ( 7064 PWs) bands (ev): -17.3522 -17.3521 -17.3191 -17.3189 -17.2827 -17.2826 -17.2820 -17.2818 -7.8382 -7.8308 -7.7434 -7.7336 -7.3332 -7.3291 -7.3154 -7.3052 -6.5398 -6.5245 -6.5027 -6.4645 -6.4066 -6.3936 -6.3548 -6.2833 -5.8801 -5.8714 -5.8710 -5.8655 -5.6577 -5.6515 -5.6470 -5.6427 -4.4467 -4.4385 -4.4186 -4.3893 -4.1751 -4.1501 -3.8137 -3.8083 -3.6060 -3.6049 -3.5256 -3.5235 -3.1989 -3.1934 -3.1864 -3.1860 -3.0253 -3.0193 -3.0094 -2.9999 -2.9462 -2.9383 -2.3103 -2.2983 -2.0007 -1.9972 -1.9912 -1.9892 4.2270 4.2351 4.2384 4.2434 4.5114 4.5143 4.6805 4.6894 5.0032 5.0110 5.5450 5.5526 k = 0.1852 0.5000-0.0000 ( 7062 PWs) bands (ev): -17.3514 -17.3513 -17.3185 -17.3183 -17.2834 -17.2833 -17.2826 -17.2824 -7.8387 -7.8309 -7.7443 -7.7339 -7.3335 -7.3297 -7.3147 -7.3043 -6.5406 -6.5244 -6.5036 -6.4626 -6.4073 -6.3936 -6.3581 -6.2820 -5.8803 -5.8705 -5.8705 -5.8645 -5.6580 -5.6505 -5.6466 -5.6413 -4.4459 -4.4365 -4.4184 -4.3868 -4.1736 -4.1473 -3.8211 -3.8156 -3.6240 -3.6227 -3.5284 -3.5261 -3.1928 -3.1873 -3.1795 -3.1790 -3.0209 -3.0156 -3.0033 -2.9935 -2.9447 -2.9370 -2.3151 -2.3023 -2.0010 -1.9974 -1.9907 -1.9886 4.2325 4.2406 4.2441 4.2498 4.5285 4.5314 4.7088 4.7178 4.9852 4.9939 5.5213 5.5291 k = 0.2037 0.5000-0.0000 ( 7060 PWs) bands (ev): -17.3506 -17.3505 -17.3178 -17.3176 -17.2842 -17.2841 -17.2833 -17.2830 -7.8393 -7.8311 -7.7451 -7.7343 -7.3337 -7.3300 -7.3141 -7.3035 -6.5414 -6.5244 -6.5042 -6.4610 -6.4079 -6.3937 -6.3609 -6.2811 -5.8803 -5.8700 -5.8696 -5.8635 -5.6584 -5.6494 -5.6464 -5.6399 -4.4451 -4.4345 -4.4182 -4.3846 -4.1713 -4.1442 -3.8287 -3.8231 -3.6428 -3.6412 -3.5313 -3.5289 -3.1861 -3.1808 -3.1723 -3.1713 -3.0162 -3.0116 -2.9971 -2.9871 -2.9435 -2.9361 -2.3206 -2.3071 -2.0011 -1.9973 -1.9902 -1.9879 4.2393 4.2472 4.2508 4.2573 4.5457 4.5486 4.7390 4.7480 4.9659 4.9754 5.4985 5.5066 k = 0.2222 0.5000-0.0000 ( 7064 PWs) bands (ev): -17.3497 -17.3497 -17.3171 -17.3168 -17.2850 -17.2849 -17.2840 -17.2837 -7.8398 -7.8314 -7.7458 -7.7348 -7.3338 -7.3302 -7.3137 -7.3030 -6.5420 -6.5245 -6.5047 -6.4599 -6.4085 -6.3940 -6.3630 -6.2807 -5.8802 -5.8696 -5.8686 -5.8625 -5.6586 -5.6482 -5.6463 -5.6385 -4.4442 -4.4325 -4.4178 -4.3828 -4.1680 -4.1406 -3.8365 -3.8309 -3.6623 -3.6604 -3.5344 -3.5318 -3.1788 -3.1737 -3.1650 -3.1629 -3.0112 -3.0076 -2.9908 -2.9810 -2.9426 -2.9358 -2.3268 -2.3127 -2.0008 -1.9969 -1.9895 -1.9872 4.2474 4.2549 4.2585 4.2661 4.5627 4.5655 4.7707 4.7795 4.9453 4.9557 5.4772 5.4855 k = 0.2407 0.5000-0.0000 ( 7084 PWs) bands (ev): -17.3488 -17.3488 -17.3163 -17.3161 -17.2859 -17.2858 -17.2847 -17.2845 -7.8402 -7.8318 -7.7465 -7.7354 -7.3338 -7.3302 -7.3134 -7.3026 -6.5426 -6.5248 -6.5050 -6.4594 -6.4090 -6.3944 -6.3644 -6.2808 -5.8800 -5.8692 -5.8676 -5.8614 -5.6588 -5.6470 -5.6462 -5.6372 -4.4433 -4.4307 -4.4174 -4.3815 -4.1637 -4.1364 -3.8442 -3.8388 -3.6822 -3.6801 -3.5376 -3.5349 -3.1713 -3.1658 -3.1575 -3.1540 -3.0062 -3.0037 -2.9846 -2.9752 -2.9420 -2.9361 -2.3336 -2.3192 -2.0002 -1.9962 -1.9888 -1.9864 4.2567 4.2638 4.2672 4.2761 4.5789 4.5816 4.8036 4.8120 4.9237 4.9352 5.4576 5.4661 k = 0.2593 0.5000-0.0000 ( 7078 PWs) bands (ev): -17.3479 -17.3478 -17.3155 -17.3152 -17.2868 -17.2867 -17.2855 -17.2852 -7.8406 -7.8322 -7.7472 -7.7360 -7.3335 -7.3300 -7.3132 -7.3025 -6.5430 -6.5252 -6.5051 -6.4593 -6.4094 -6.3948 -6.3650 -6.2814 -5.8797 -5.8689 -5.8665 -5.8604 -5.6588 -5.6462 -5.6456 -5.6358 -4.4425 -4.4292 -4.4167 -4.3807 -4.1584 -4.1317 -3.8519 -3.8466 -3.7024 -3.7002 -3.5408 -3.5381 -3.1637 -3.1572 -3.1497 -3.1445 -3.0012 -3.0001 -2.9785 -2.9698 -2.9415 -2.9368 -2.3409 -2.3263 -1.9992 -1.9952 -1.9880 -1.9855 4.2672 4.2739 4.2769 4.2874 4.5941 4.5967 4.8369 4.8444 4.9019 4.9148 5.4403 5.4490 k = 0.2778 0.5000-0.0000 ( 7074 PWs) bands (ev): -17.3469 -17.3469 -17.3147 -17.3143 -17.2877 -17.2876 -17.2864 -17.2861 -7.8410 -7.8327 -7.7477 -7.7368 -7.3332 -7.3296 -7.3131 -7.3025 -6.5432 -6.5256 -6.5049 -6.4599 -6.4096 -6.3954 -6.3648 -6.2824 -5.8792 -5.8686 -5.8653 -5.8595 -5.6588 -5.6463 -5.6442 -5.6345 -4.4416 -4.4280 -4.4157 -4.3803 -4.1519 -4.1263 -3.8593 -3.8543 -3.7228 -3.7204 -3.5441 -3.5413 -3.1559 -3.1477 -3.1417 -3.1347 -2.9970 -2.9965 -2.9727 -2.9650 -2.9410 -2.9381 -2.3487 -2.3341 -1.9979 -1.9939 -1.9871 -1.9846 4.2788 4.2852 4.2874 4.3000 4.6077 4.6102 4.8629 4.8687 4.8874 4.9024 5.4258 5.4345 k = 0.2963 0.5000-0.0000 ( 7062 PWs) bands (ev): -17.3460 -17.3459 -17.3138 -17.3134 -17.2886 -17.2885 -17.2872 -17.2869 -7.8413 -7.8332 -7.7482 -7.7375 -7.3327 -7.3290 -7.3132 -7.3027 -6.5433 -6.5262 -6.5045 -6.4609 -6.4098 -6.3960 -6.3638 -6.2839 -5.8786 -5.8684 -5.8642 -5.8585 -5.6586 -5.6464 -5.6427 -5.6334 -4.4408 -4.4273 -4.4145 -4.3804 -4.1444 -4.1203 -3.8665 -3.8617 -3.7432 -3.7407 -3.5473 -3.5445 -3.1479 -3.1377 -3.1336 -3.1246 -2.9946 -2.9921 -2.9673 -2.9610 -2.9403 -2.9397 -2.3567 -2.3423 -1.9963 -1.9924 -1.9861 -1.9837 4.2911 4.2979 4.2988 4.3137 4.6193 4.6218 4.8486 4.8587 4.9133 4.9243 5.4143 5.4231 k = 0.3148 0.5000-0.0000 ( 7062 PWs) bands (ev): -17.3450 -17.3449 -17.3128 -17.3125 -17.2896 -17.2895 -17.2881 -17.2878 -7.8415 -7.8337 -7.7486 -7.7384 -7.3321 -7.3283 -7.3135 -7.3030 -6.5433 -6.5269 -6.5040 -6.4624 -6.4099 -6.3968 -6.3621 -6.2859 -5.8780 -5.8682 -5.8630 -5.8577 -5.6584 -5.6467 -5.6412 -5.6323 -4.4399 -4.4269 -4.4130 -4.3809 -4.1360 -4.1136 -3.8733 -3.8689 -3.7635 -3.7610 -3.5504 -3.5477 -3.1398 -3.1274 -3.1252 -3.1144 -2.9933 -2.9885 -2.9624 -2.9576 -2.9414 -2.9393 -2.3650 -2.3509 -1.9946 -1.9908 -1.9851 -1.9828 4.3040 4.3109 4.3120 4.3286 4.6286 4.6311 4.8246 4.8363 4.9487 4.9583 5.4062 5.4149 k = 0.3333 0.5000-0.0000 ( 7078 PWs) bands (ev): -17.3441 -17.3440 -17.3119 -17.3115 -17.2905 -17.2904 -17.2890 -17.2887 -7.8416 -7.8343 -7.7489 -7.7393 -7.3314 -7.3274 -7.3139 -7.3036 -6.5432 -6.5277 -6.5033 -6.4644 -6.4100 -6.3976 -6.3598 -6.2883 -5.8773 -5.8681 -5.8619 -5.8569 -5.6580 -5.6470 -5.6397 -5.6313 -4.4391 -4.4269 -4.4114 -4.3817 -4.1266 -4.1062 -3.8796 -3.8756 -3.7836 -3.7810 -3.5534 -3.5507 -3.1313 -3.1169 -3.1166 -3.1043 -2.9933 -2.9860 -2.9581 -2.9549 -2.9429 -2.9380 -2.3732 -2.3597 -1.9927 -1.9891 -1.9841 -1.9819 4.3172 4.3235 4.3275 4.3446 4.6354 4.6379 4.7994 4.8120 4.9851 4.9938 5.4017 5.4103 k = 0.3519 0.5000-0.0000 ( 7064 PWs) bands (ev): -17.3431 -17.3431 -17.3109 -17.3106 -17.2914 -17.2913 -17.2900 -17.2896 -7.8417 -7.8350 -7.7490 -7.7402 -7.3306 -7.3264 -7.3144 -7.3043 -6.5429 -6.5286 -6.5023 -6.4667 -6.4098 -6.3985 -6.3568 -6.2910 -5.8765 -5.8680 -5.8608 -5.8562 -5.6576 -5.6474 -5.6382 -5.6305 -4.4383 -4.4271 -4.4096 -4.3828 -4.1164 -4.0981 -3.8855 -3.8819 -3.8032 -3.8008 -3.5561 -3.5537 -3.1226 -3.1078 -3.1064 -3.0944 -2.9947 -2.9849 -2.9545 -2.9526 -2.9437 -2.9364 -2.3813 -2.3685 -1.9907 -1.9874 -1.9831 -1.9810 4.3306 4.3364 4.3442 4.3615 4.6396 4.6421 4.7739 4.7870 5.0215 5.0297 5.4008 5.4091 k = 0.3704 0.5000-0.0000 ( 7074 PWs) bands (ev): -17.3423 -17.3422 -17.3099 -17.3096 -17.2922 -17.2921 -17.2909 -17.2906 -7.8417 -7.8356 -7.7491 -7.7411 -7.3297 -7.3252 -7.3150 -7.3052 -6.5425 -6.5295 -6.5012 -6.4692 -6.4097 -6.3994 -6.3534 -6.2941 -5.8757 -5.8680 -5.8597 -5.8556 -5.6571 -5.6478 -5.6368 -5.6298 -4.4376 -4.4276 -4.4078 -4.3842 -4.1056 -4.0895 -3.8907 -3.8876 -3.8223 -3.8200 -3.5587 -3.5564 -3.1137 -3.0990 -3.0962 -3.0850 -2.9975 -2.9855 -2.9518 -2.9504 -2.9435 -2.9350 -2.3888 -2.3771 -1.9888 -1.9858 -1.9820 -1.9801 4.3441 4.3495 4.3620 4.3792 4.6413 4.6437 4.7484 4.7619 5.0576 5.0651 5.4032 5.4112 k = 0.3889 0.5000-0.0000 ( 7072 PWs) bands (ev): -17.3415 -17.3414 -17.3090 -17.3086 -17.2930 -17.2929 -17.2918 -17.2915 -7.8416 -7.8362 -7.7491 -7.7421 -7.3287 -7.3239 -7.3157 -7.3063 -6.5420 -6.5305 -6.4998 -6.4719 -6.4094 -6.4003 -6.3497 -6.2976 -5.8748 -5.8681 -5.8587 -5.8551 -5.6565 -5.6483 -5.6355 -5.6293 -4.4368 -4.4281 -4.4061 -4.3857 -4.0944 -4.0805 -3.8954 -3.8927 -3.8406 -3.8385 -3.5609 -3.5588 -3.1047 -3.0901 -3.0865 -3.0761 -3.0015 -2.9880 -2.9498 -2.9485 -2.9422 -2.9338 -2.3958 -2.3852 -1.9870 -1.9843 -1.9810 -1.9793 4.3574 4.3623 4.3805 4.3974 4.6408 4.6432 4.7232 4.7368 5.0928 5.0997 5.4087 5.4162 k = 0.4074 0.5000-0.0000 ( 7082 PWs) bands (ev): -17.3407 -17.3407 -17.3081 -17.3077 -17.2937 -17.2936 -17.2927 -17.2924 -7.8415 -7.8369 -7.7490 -7.7430 -7.3276 -7.3225 -7.3166 -7.3074 -6.5414 -6.5316 -6.4983 -6.4746 -6.4090 -6.4013 -6.3456 -6.3013 -5.8740 -5.8683 -5.8578 -5.8547 -5.6559 -5.6489 -5.6342 -5.6289 -4.4361 -4.4288 -4.4043 -4.3873 -4.0829 -4.0713 -3.8994 -3.8972 -3.8578 -3.8559 -3.5628 -3.5610 -3.0956 -3.0813 -3.0775 -3.0681 -3.0064 -2.9921 -2.9481 -2.9467 -2.9405 -2.9330 -2.4019 -2.3927 -1.9854 -1.9831 -1.9799 -1.9785 4.3701 4.3745 4.3995 4.4157 4.6385 4.6407 4.6988 4.7123 5.1266 5.1328 5.4165 5.4234 k = 0.4259 0.5000-0.0000 ( 7082 PWs) bands (ev): -17.3401 -17.3401 -17.3072 -17.3069 -17.2943 -17.2942 -17.2936 -17.2933 -7.8413 -7.8375 -7.7488 -7.7439 -7.3265 -7.3210 -7.3175 -7.3087 -6.5406 -6.5326 -6.4966 -6.4774 -6.4086 -6.4023 -6.3413 -6.3053 -5.8731 -5.8685 -5.8570 -5.8545 -5.6552 -5.6495 -5.6330 -5.6287 -4.4354 -4.4295 -4.4026 -4.3890 -4.0717 -4.0623 -3.9027 -3.9011 -3.8735 -3.8719 -3.5644 -3.5629 -3.0864 -3.0728 -3.0696 -3.0611 -3.0121 -2.9975 -2.9466 -2.9452 -2.9388 -2.9325 -2.4070 -2.3994 -1.9841 -1.9822 -1.9790 -1.9777 4.3819 4.3857 4.4185 4.4337 4.6350 4.6371 4.6757 4.6887 5.1582 5.1636 5.4258 5.4320 k = 0.4444 0.5000-0.0000 ( 7080 PWs) bands (ev): -17.3396 -17.3396 -17.3064 -17.3061 -17.2948 -17.2947 -17.2943 -17.2941 -7.8410 -7.8381 -7.7485 -7.7447 -7.3254 -7.3195 -7.3185 -7.3101 -6.5398 -6.5337 -6.4947 -6.4802 -6.4080 -6.4032 -6.3368 -6.3095 -5.8723 -5.8688 -5.8562 -5.8543 -5.6545 -5.6501 -5.6320 -5.6287 -4.4347 -4.4302 -4.4009 -4.3907 -4.0611 -4.0540 -3.9054 -3.9043 -3.8871 -3.8858 -3.5656 -3.5645 -3.0774 -3.0650 -3.0629 -3.0554 -3.0180 -3.0037 -2.9453 -2.9441 -2.9372 -2.9324 -2.4109 -2.4050 -1.9830 -1.9816 -1.9781 -1.9771 4.3922 4.3952 4.4369 4.4504 4.6312 4.6329 4.6550 4.6668 5.1864 5.1910 5.4354 5.4406 k = 0.4630 0.5000-0.0000 ( 7080 PWs) bands (ev): -17.3392 -17.3392 -17.3057 -17.3055 -17.2952 -17.2951 -17.2948 -17.2947 -7.8406 -7.8387 -7.7480 -7.7455 -7.3242 -7.3195 -7.3179 -7.3116 -6.5389 -6.5348 -6.4926 -6.4829 -6.4074 -6.4042 -6.3323 -6.3139 -5.8716 -5.8692 -5.8556 -5.8543 -5.6538 -5.6508 -5.6311 -5.6288 -4.4339 -4.4310 -4.3992 -4.3924 -4.0520 -4.0472 -3.9076 -3.9072 -3.8977 -3.8966 -3.5664 -3.5656 -3.0687 -3.0586 -3.0577 -3.0514 -3.0231 -3.0104 -2.9442 -2.9433 -2.9359 -2.9327 -2.4135 -2.4095 -1.9821 -1.9812 -1.9773 -1.9767 4.4004 4.4025 4.4535 4.4642 4.6277 4.6290 4.6382 4.6477 5.2098 5.2131 5.4438 5.4479 k = 0.4815 0.5000-0.0000 ( 7092 PWs) bands (ev): -17.3390 -17.3390 -17.3052 -17.3051 -17.2955 -17.2954 -17.2952 -17.2951 -7.8402 -7.8393 -7.7475 -7.7463 -7.3230 -7.3207 -7.3163 -7.3131 -6.5380 -6.5359 -6.4904 -6.4856 -6.4067 -6.4051 -6.3277 -6.3184 -5.8709 -5.8697 -5.8551 -5.8545 -5.6530 -5.6516 -5.6303 -5.6291 -4.4332 -4.4317 -4.3975 -4.3941 -4.0454 -4.0430 -3.9099 -3.9098 -3.9036 -3.9029 -3.5668 -3.5665 -3.0606 -3.0546 -3.0544 -3.0503 -3.0253 -3.0171 -2.9434 -2.9429 -2.9348 -2.9332 -2.4147 -2.4127 -1.9815 -1.9811 -1.9768 -1.9765 4.4058 4.4069 4.4666 4.4727 4.6254 4.6261 4.6277 4.6332 5.2259 5.2277 5.4491 5.4514 k = 0.5000 0.5000-0.0000 ( 7120 PWs) bands (ev): -17.3389 -17.3389 -17.3051 -17.3051 -17.2955 -17.2955 -17.2953 -17.2953 -7.8398 -7.8398 -7.7470 -7.7470 -7.3218 -7.3218 -7.3147 -7.3147 -6.5370 -6.5370 -6.4881 -6.4881 -6.4060 -6.4060 -6.3230 -6.3230 -5.8703 -5.8703 -5.8547 -5.8547 -5.6523 -5.6523 -5.6297 -5.6297 -4.4325 -4.4325 -4.3958 -4.3958 -4.0423 -4.0423 -3.9112 -3.9112 -3.9049 -3.9049 -3.5669 -3.5669 -3.0541 -3.0541 -3.0530 -3.0530 -3.0227 -3.0227 -2.9430 -2.9430 -2.9339 -2.9339 -2.4144 -2.4144 -1.9812 -1.9812 -1.9765 -1.9765 4.4081 4.4081 4.4737 4.4737 4.6249 4.6249 4.6258 4.6258 5.2323 5.2323 5.4502 5.4502 k = 0.5000 0.5000-0.0000 ( 7120 PWs) bands (ev): -17.3389 -17.3389 -17.3051 -17.3051 -17.2955 -17.2955 -17.2953 -17.2953 -7.8398 -7.8398 -7.7470 -7.7470 -7.3218 -7.3218 -7.3147 -7.3147 -6.5370 -6.5370 -6.4881 -6.4881 -6.4060 -6.4060 -6.3230 -6.3230 -5.8703 -5.8703 -5.8547 -5.8547 -5.6523 -5.6523 -5.6297 -5.6297 -4.4325 -4.4325 -4.3958 -4.3958 -4.0423 -4.0423 -3.9112 -3.9112 -3.9049 -3.9049 -3.5669 -3.5669 -3.0541 -3.0541 -3.0530 -3.0530 -3.0227 -3.0227 -2.9430 -2.9430 -2.9339 -2.9339 -2.4144 -2.4144 -1.9812 -1.9812 -1.9765 -1.9765 4.4081 4.4081 4.4737 4.4737 4.6249 4.6249 4.6258 4.6258 5.2323 5.2323 5.4502 5.4502 k = 0.4868 0.4868-0.0000 ( 7082 PWs) bands (ev): -17.3390 -17.3390 -17.3052 -17.3051 -17.2955 -17.2954 -17.2951 -17.2951 -7.8402 -7.8393 -7.7475 -7.7463 -7.3230 -7.3207 -7.3163 -7.3131 -6.5380 -6.5359 -6.4904 -6.4855 -6.4067 -6.4051 -6.3277 -6.3184 -5.8709 -5.8697 -5.8551 -5.8544 -5.6530 -5.6515 -5.6302 -5.6291 -4.4332 -4.4317 -4.3975 -4.3941 -4.0454 -4.0430 -3.9098 -3.9096 -3.9037 -3.9029 -3.5668 -3.5664 -3.0606 -3.0564 -3.0519 -3.0509 -3.0253 -3.0171 -2.9434 -2.9429 -2.9348 -2.9332 -2.4147 -2.4127 -1.9815 -1.9811 -1.9768 -1.9764 4.4058 4.4069 4.4667 4.4727 4.6251 4.6253 4.6285 4.6337 5.2259 5.2276 5.4504 5.4517 k = 0.4737 0.4737-0.0000 ( 7066 PWs) bands (ev): -17.3392 -17.3392 -17.3057 -17.3055 -17.2953 -17.2953 -17.2947 -17.2946 -7.8407 -7.8388 -7.7480 -7.7454 -7.3242 -7.3196 -7.3178 -7.3116 -6.5389 -6.5348 -6.4926 -6.4829 -6.4074 -6.4042 -6.3323 -6.3139 -5.8715 -5.8692 -5.8556 -5.8543 -5.6538 -5.6508 -5.6310 -5.6288 -4.4339 -4.4311 -4.3993 -4.3923 -4.0522 -4.0474 -3.9066 -3.9059 -3.8986 -3.8973 -3.5664 -3.5656 -3.0694 -3.0629 -3.0517 -3.0511 -3.0239 -3.0109 -2.9444 -2.9434 -2.9357 -2.9325 -2.4135 -2.4095 -1.9824 -1.9815 -1.9771 -1.9764 4.4000 4.4017 4.4544 4.4645 4.6257 4.6263 4.6409 4.6496 5.2094 5.2125 5.4508 5.4518 k = 0.4605 0.4605-0.0000 ( 7068 PWs) bands (ev): -17.3396 -17.3396 -17.3063 -17.3060 -17.2952 -17.2951 -17.2939 -17.2938 -7.8413 -7.8385 -7.7480 -7.7443 -7.3254 -7.3199 -7.3181 -7.3101 -6.5398 -6.5337 -6.4947 -6.4802 -6.4080 -6.4032 -6.3368 -6.3095 -5.8723 -5.8689 -5.8562 -5.8543 -5.6545 -5.6501 -5.6320 -5.6286 -4.4345 -4.4306 -4.4011 -4.3905 -4.0618 -4.0547 -3.9026 -3.9012 -3.8894 -3.8878 -3.5655 -3.5644 -3.0793 -3.0723 -3.0527 -3.0522 -3.0206 -3.0055 -2.9462 -2.9447 -2.9364 -2.9317 -2.4108 -2.4049 -1.9840 -1.9830 -1.9769 -1.9762 4.3904 4.3920 4.4406 4.4524 4.6269 4.6277 4.6599 4.6707 5.1851 5.1890 5.4497 5.4503 k = 0.4474 0.4474-0.0000 ( 7072 PWs) bands (ev): -17.3402 -17.3402 -17.3068 -17.3066 -17.2950 -17.2950 -17.2930 -17.2928 -7.8424 -7.8387 -7.7475 -7.7427 -7.3266 -7.3214 -7.3171 -7.3087 -6.5406 -6.5326 -6.4966 -6.4775 -6.4085 -6.4023 -6.3412 -6.3054 -5.8731 -5.8687 -5.8570 -5.8545 -5.6551 -5.6495 -5.6330 -5.6287 -4.4350 -4.4304 -4.4031 -4.3886 -4.0733 -4.0639 -3.8975 -3.8954 -3.8772 -3.8752 -3.5641 -3.5626 -3.0898 -3.0833 -3.0546 -3.0532 -3.0174 -3.0013 -2.9489 -2.9473 -2.9364 -2.9308 -2.4065 -2.3990 -1.9867 -1.9856 -1.9763 -1.9756 4.3770 4.3772 4.4278 4.4392 4.6286 4.6296 4.6828 4.6946 5.1551 5.1593 5.4476 5.4481 k = 0.4342 0.4342-0.0000 ( 7076 PWs) bands (ev): -17.3410 -17.3410 -17.3074 -17.3071 -17.2947 -17.2947 -17.2920 -17.2918 -7.8441 -7.8398 -7.7459 -7.7402 -7.3278 -7.3231 -7.3160 -7.3073 -6.5413 -6.5315 -6.4983 -6.4749 -6.4089 -6.4013 -6.3453 -6.3015 -5.8739 -5.8686 -5.8578 -5.8549 -5.6557 -5.6489 -5.6341 -5.6288 -4.4354 -4.4306 -4.4052 -4.3866 -4.0862 -4.0746 -3.8910 -3.8884 -3.8629 -3.8605 -3.5622 -3.5604 -3.1007 -3.0950 -3.0569 -3.0547 -3.0152 -2.9985 -2.9525 -2.9510 -2.9359 -2.9297 -2.4008 -2.3918 -1.9903 -1.9893 -1.9755 -1.9749 4.3586 4.3603 4.4162 4.4260 4.6305 4.6318 4.7077 4.7200 5.1211 5.1255 5.4451 5.4455 k = 0.4211 0.4211-0.0000 ( 7074 PWs) bands (ev): -17.3420 -17.3420 -17.3078 -17.3074 -17.2945 -17.2944 -17.2910 -17.2907 -7.8467 -7.8421 -7.7429 -7.7366 -7.3289 -7.3247 -7.3149 -7.3060 -6.5418 -6.5305 -6.4998 -6.4725 -6.4092 -6.4003 -6.3491 -6.2979 -5.8748 -5.8688 -5.8587 -5.8554 -5.6561 -5.6484 -5.6353 -5.6290 -4.4359 -4.4313 -4.4076 -4.3847 -4.0999 -4.0861 -3.8830 -3.8799 -3.8468 -3.8441 -3.5596 -3.5576 -3.1115 -3.1070 -3.0593 -3.0565 -3.0141 -2.9973 -2.9569 -2.9557 -2.9350 -2.9284 -2.3938 -2.3835 -1.9949 -1.9938 -1.9747 -1.9742 4.3377 4.3412 4.4051 4.4131 4.6325 4.6341 4.7335 4.7460 5.0845 5.0888 5.4426 5.4429 k = 0.4079 0.4079-0.0000 ( 7095 PWs) bands (ev): -17.3432 -17.3432 -17.3080 -17.3077 -17.2941 -17.2941 -17.2899 -17.2897 -7.8506 -7.8459 -7.7382 -7.7316 -7.3301 -7.3262 -7.3139 -7.3048 -6.5422 -6.5295 -6.5012 -6.4703 -6.4094 -6.3993 -6.3525 -6.2947 -5.8757 -5.8692 -5.8598 -5.8561 -5.6564 -5.6479 -5.6365 -5.6294 -4.4365 -4.4325 -4.4103 -4.3830 -4.1142 -4.0982 -3.8736 -3.8701 -3.8294 -3.8266 -3.5564 -3.5541 -3.1222 -3.1188 -3.0620 -3.0587 -3.0143 -2.9976 -2.9623 -2.9614 -2.9339 -2.9270 -2.3856 -2.3743 -2.0004 -1.9993 -1.9742 -1.9738 4.3158 4.3207 4.3936 4.4001 4.6343 4.6362 4.7594 4.7719 5.0462 5.0505 5.4406 5.4408 k = 0.3947 0.3947-0.0000 ( 7097 PWs) bands (ev): -17.3447 -17.3446 -17.3081 -17.3077 -17.2937 -17.2937 -17.2889 -17.2886 -7.8559 -7.8512 -7.7318 -7.7251 -7.3312 -7.3278 -7.3129 -7.3037 -6.5424 -6.5285 -6.5025 -6.4685 -6.4094 -6.3982 -6.3554 -6.2918 -5.8767 -5.8699 -5.8609 -5.8570 -5.6566 -5.6474 -5.6376 -5.6298 -4.4373 -4.4343 -4.4132 -4.3817 -4.1290 -4.1109 -3.8628 -3.8589 -3.8108 -3.8079 -3.5524 -3.5499 -3.1325 -3.1304 -3.0648 -3.0611 -3.0155 -2.9992 -2.9684 -2.9678 -2.9327 -2.9257 -2.3763 -2.3643 -2.0067 -2.0056 -1.9742 -1.9738 4.2937 4.2996 4.3815 4.3866 4.6357 4.6377 4.7847 4.7972 5.0073 5.0114 5.4396 5.4397 k = 0.3816 0.3816-0.0000 ( 7083 PWs) bands (ev): -17.3463 -17.3462 -17.3079 -17.3076 -17.2933 -17.2933 -17.2879 -17.2876 -7.8625 -7.8581 -7.7235 -7.7169 -7.3323 -7.3292 -7.3119 -7.3027 -6.5424 -6.5275 -6.5035 -6.4671 -6.4092 -6.3969 -6.3578 -6.2892 -5.8777 -5.8708 -5.8620 -5.8581 -5.6565 -5.6470 -5.6386 -5.6302 -4.4384 -4.4366 -4.4165 -4.3807 -4.1441 -4.1239 -3.8505 -3.8464 -3.7910 -3.7882 -3.5475 -3.5449 -3.1423 -3.1415 -3.0678 -3.0637 -3.0178 -3.0019 -2.9752 -2.9749 -2.9314 -2.9243 -2.3663 -2.3536 -2.0138 -2.0128 -1.9748 -1.9744 4.2718 4.2784 4.3685 4.3727 4.6362 4.6384 4.8090 4.8213 4.9685 4.9724 5.4400 5.4401 k = 0.3684 0.3684-0.0000 ( 7067 PWs) bands (ev): -17.3481 -17.3480 -17.3075 -17.3072 -17.2929 -17.2928 -17.2870 -17.2867 -7.8705 -7.8665 -7.7135 -7.7071 -7.3333 -7.3306 -7.3109 -7.3017 -6.5423 -6.5265 -6.5045 -6.4663 -6.4089 -6.3954 -6.3596 -6.2870 -5.8787 -5.8720 -5.8632 -5.8594 -5.6562 -5.6465 -5.6394 -5.6306 -4.4399 -4.4395 -4.4202 -4.3805 -4.1594 -4.1372 -3.8368 -3.8325 -3.7701 -3.7676 -3.5417 -3.5390 -3.1520 -3.1515 -3.0708 -3.0665 -3.0208 -3.0055 -2.9826 -2.9826 -2.9302 -2.9230 -2.3556 -2.3426 -2.0218 -2.0208 -1.9761 -1.9759 4.2505 4.2575 4.3548 4.3581 4.6351 4.6373 4.8315 4.8436 4.9309 4.9345 5.4425 5.4425 k = 0.3553 0.3553-0.0000 ( 7067 PWs) bands (ev): -17.3501 -17.3500 -17.3070 -17.3067 -17.2924 -17.2924 -17.2861 -17.2858 -7.8797 -7.8761 -7.7020 -7.6959 -7.3343 -7.3320 -7.3099 -7.3008 -6.5419 -6.5256 -6.5053 -6.4660 -6.4085 -6.3936 -6.3610 -6.2853 -5.8799 -5.8736 -5.8646 -5.8609 -5.6557 -5.6462 -5.6401 -5.6310 -4.4429 -4.4418 -4.4243 -4.3811 -4.1750 -4.1509 -3.8217 -3.8174 -3.7483 -3.7462 -3.5350 -3.5321 -3.1619 -3.1600 -3.0738 -3.0694 -3.0245 -3.0099 -2.9909 -2.9905 -2.9290 -2.9218 -2.3447 -2.3315 -2.0307 -2.0297 -1.9785 -1.9783 4.2298 4.2372 4.3403 4.3429 4.6316 4.6337 4.8518 4.8637 4.8955 4.8989 5.4476 5.4476 k = 0.3421 0.3421-0.0000 ( 7063 PWs) bands (ev): -17.3522 -17.3521 -17.3063 -17.3060 -17.2918 -17.2918 -17.2853 -17.2850 -7.8899 -7.8868 -7.6891 -7.6833 -7.3352 -7.3333 -7.3090 -7.3000 -6.5414 -6.5247 -6.5060 -6.4665 -6.4079 -6.3916 -6.3619 -6.2839 -5.8811 -5.8753 -5.8661 -5.8626 -5.6549 -5.6458 -5.6405 -5.6313 -4.4468 -4.4441 -4.4288 -4.3825 -4.1908 -4.1651 -3.8053 -3.8009 -3.7254 -3.7239 -3.5271 -3.5243 -3.1709 -3.1678 -3.0769 -3.0724 -3.0285 -3.0147 -2.9997 -2.9989 -2.9279 -2.9208 -2.3337 -2.3204 -2.0403 -2.0394 -1.9819 -1.9818 4.2101 4.2176 4.3253 4.3271 4.6244 4.6264 4.8638 4.8644 4.8719 4.8811 5.4558 5.4559 k = 0.3289 0.3289-0.0000 ( 7067 PWs) bands (ev): -17.3544 -17.3544 -17.3054 -17.3051 -17.2913 -17.2913 -17.2845 -17.2843 -7.9011 -7.8983 -7.6749 -7.6695 -7.3362 -7.3345 -7.3081 -7.2992 -6.5407 -6.5238 -6.5066 -6.4675 -6.4071 -6.3892 -6.3623 -6.2830 -5.8825 -5.8773 -5.8677 -5.8646 -5.6539 -5.6455 -5.6407 -5.6316 -4.4513 -4.4470 -4.4338 -4.3850 -4.2067 -4.1796 -3.7876 -3.7833 -3.7016 -3.7008 -3.5182 -3.5154 -3.1792 -3.1747 -3.0800 -3.0754 -3.0328 -3.0197 -3.0089 -3.0077 -2.9269 -2.9199 -2.3230 -2.3097 -2.0507 -2.0499 -1.9866 -1.9865 4.1913 4.1989 4.3097 4.3110 4.6125 4.6140 4.8371 4.8389 4.8848 4.8954 5.4677 5.4677 k = 0.3158 0.3158-0.0000 ( 7059 PWs) bands (ev): -17.3568 -17.3567 -17.3044 -17.3041 -17.2907 -17.2907 -17.2838 -17.2836 -7.9130 -7.9107 -7.6597 -7.6546 -7.3370 -7.3356 -7.3072 -7.2985 -6.5398 -6.5229 -6.5071 -6.4690 -6.4061 -6.3866 -6.3624 -6.2825 -5.8840 -5.8796 -5.8695 -5.8668 -5.6527 -5.6452 -5.6405 -5.6317 -4.4562 -4.4505 -4.4391 -4.3884 -4.2229 -4.1947 -3.7687 -3.7646 -3.6769 -3.6769 -3.5082 -3.5054 -3.1866 -3.1808 -3.0830 -3.0783 -3.0372 -3.0246 -3.0183 -3.0165 -2.9260 -2.9192 -2.3127 -2.2995 -2.0619 -2.0612 -1.9927 -1.9925 4.1736 4.1812 4.2937 4.2945 4.5949 4.5958 4.8166 4.8177 4.8962 4.9063 5.4833 5.4833 k = 0.3026 0.3026-0.0000 ( 7059 PWs) bands (ev): -17.3592 -17.3591 -17.3033 -17.3030 -17.2901 -17.2901 -17.2832 -17.2830 -7.9256 -7.9236 -7.6436 -7.6387 -7.3379 -7.3367 -7.3063 -7.2979 -6.5387 -6.5220 -6.5076 -6.4711 -6.4050 -6.3837 -6.3622 -6.2824 -5.8856 -5.8820 -5.8715 -5.8692 -5.6513 -5.6448 -5.6401 -5.6318 -4.4615 -4.4546 -4.4448 -4.3929 -4.2394 -4.2102 -3.7487 -3.7447 -3.6523 -3.6513 -3.4970 -3.4943 -3.1930 -3.1860 -3.0860 -3.0813 -3.0417 -3.0297 -3.0277 -3.0252 -2.9253 -2.9188 -2.3031 -2.2900 -2.0739 -2.0732 -2.0002 -1.9999 4.1570 4.1645 4.2775 4.2779 4.5715 4.5719 4.8022 4.8025 4.9043 4.9139 5.5027 5.5028 k = 0.2895 0.2895-0.0000 ( 7073 PWs) bands (ev): -17.3616 -17.3616 -17.3021 -17.3018 -17.2895 -17.2895 -17.2826 -17.2824 -7.9387 -7.9370 -7.6267 -7.6221 -7.3387 -7.3377 -7.3055 -7.2973 -6.5375 -6.5212 -6.5080 -6.4734 -6.4037 -6.3807 -6.3616 -6.2827 -5.8873 -5.8845 -5.8736 -5.8718 -5.6496 -5.6444 -5.6394 -5.6317 -4.4672 -4.4593 -4.4507 -4.3983 -4.2560 -4.2262 -3.7276 -3.7239 -3.6272 -3.6251 -3.4847 -3.4821 -3.1985 -3.1903 -3.0890 -3.0842 -3.0467 -3.0385 -3.0332 -3.0331 -2.9249 -2.9186 -2.2944 -2.2815 -2.0866 -2.0860 -2.0093 -2.0087 4.1416 4.1490 4.2612 4.2612 4.5431 4.5433 4.7927 4.7930 4.9092 4.9182 5.5257 5.5260 k = 0.2763 0.2763-0.0000 ( 7061 PWs) bands (ev): -17.3641 -17.3641 -17.3008 -17.3005 -17.2888 -17.2888 -17.2821 -17.2819 -7.9521 -7.9507 -7.6090 -7.6047 -7.3394 -7.3387 -7.3046 -7.2967 -6.5361 -6.5204 -6.5083 -6.4760 -6.4022 -6.3776 -6.3608 -6.2833 -5.8891 -5.8872 -5.8760 -5.8745 -5.6478 -5.6437 -5.6385 -5.6314 -4.4733 -4.4647 -4.4566 -4.4045 -4.2729 -4.2428 -3.7055 -3.7021 -3.6014 -3.5983 -3.4712 -3.4687 -3.2030 -3.1936 -3.0919 -3.0869 -3.0530 -3.0484 -3.0394 -3.0368 -2.9246 -2.9187 -2.2867 -2.2741 -2.0999 -2.0995 -2.0199 -2.0191 4.1275 4.1346 4.2446 4.2449 4.5110 4.5116 4.7869 4.7878 4.9112 4.9195 5.5518 5.5522 k = 0.2632 0.2632-0.0000 ( 7051 PWs) bands (ev): -17.3666 -17.3666 -17.2994 -17.2992 -17.2882 -17.2882 -17.2817 -17.2815 -7.9658 -7.9645 -7.5909 -7.5868 -7.3401 -7.3395 -7.3037 -7.2961 -6.5346 -6.5197 -6.5085 -6.4788 -6.4005 -6.3746 -6.3596 -6.2844 -5.8911 -5.8900 -5.8785 -5.8774 -5.6458 -5.6429 -5.6374 -5.6310 -4.4797 -4.4709 -4.4625 -4.4115 -4.2901 -4.2599 -3.6826 -3.6795 -3.5754 -3.5711 -3.4566 -3.4543 -3.2064 -3.1959 -3.0948 -3.0896 -3.0607 -3.0585 -3.0435 -3.0398 -2.9246 -2.9192 -2.2803 -2.2678 -2.1139 -2.1136 -2.0320 -2.0309 4.1146 4.1215 4.2282 4.2288 4.4770 4.4779 4.7839 4.7853 4.9106 4.9182 5.5801 5.5806 k = 0.2500 0.2500-0.0000 ( 7063 PWs) bands (ev): -17.3691 -17.3691 -17.2980 -17.2978 -17.2875 -17.2875 -17.2813 -17.2811 -7.9795 -7.9785 -7.5724 -7.5685 -7.3408 -7.3404 -7.3028 -7.2955 -6.5330 -6.5189 -6.5088 -6.4817 -6.3986 -6.3718 -6.3581 -6.2858 -5.8932 -5.8928 -5.8813 -5.8805 -5.6437 -5.6419 -5.6363 -5.6304 -4.4863 -4.4777 -4.4683 -4.4192 -4.3074 -4.2774 -3.6589 -3.6562 -3.5491 -3.5437 -3.4409 -3.4389 -3.2087 -3.1972 -3.0978 -3.0922 -3.0691 -3.0685 -3.0459 -3.0420 -2.9250 -2.9200 -2.2752 -2.2630 -2.1284 -2.1283 -2.0456 -2.0443 4.1029 4.1096 4.2121 4.2129 4.4421 4.4432 4.7828 4.7845 4.9078 4.9147 5.6091 5.6098 k = 0.2368 0.2368-0.0000 ( 7051 PWs) bands (ev): -17.3716 -17.3716 -17.2966 -17.2964 -17.2869 -17.2869 -17.2810 -17.2808 -7.9933 -7.9924 -7.5537 -7.5499 -7.3414 -7.3411 -7.3019 -7.2950 -6.5313 -6.5182 -6.5089 -6.4846 -6.3966 -6.3693 -6.3562 -6.2875 -5.8957 -5.8954 -5.8842 -5.8837 -5.6414 -5.6407 -5.6350 -5.6297 -4.4931 -4.4850 -4.4741 -4.4273 -4.3248 -4.2953 -3.6346 -3.6322 -3.5229 -3.5163 -3.4242 -3.4224 -3.2096 -3.1972 -3.1010 -3.0946 -3.0783 -3.0775 -3.0472 -3.0434 -2.9258 -2.9213 -2.2716 -2.2595 -2.1434 -2.1434 -2.0608 -2.0591 4.0926 4.0989 4.1964 4.1975 4.4070 4.4083 4.7828 4.7847 4.9032 4.9095 5.6362 5.6371 k = 0.2237 0.2237-0.0000 ( 7047 PWs) bands (ev): -17.3740 -17.3740 -17.2951 -17.2949 -17.2862 -17.2862 -17.2807 -17.2805 -8.0069 -8.0062 -7.5348 -7.5313 -7.3420 -7.3418 -7.3009 -7.2944 -6.5296 -6.5175 -6.5090 -6.4875 -6.3944 -6.3672 -6.3540 -6.2895 -5.8986 -5.8977 -5.8872 -5.8869 -5.6394 -5.6391 -5.6336 -5.6289 -4.5000 -4.4925 -4.4800 -4.4360 -4.3423 -4.3134 -3.6097 -3.6078 -3.4971 -3.4895 -3.4064 -3.4049 -3.2092 -3.1960 -3.1047 -3.0969 -3.0879 -3.0852 -3.0477 -3.0440 -2.9269 -2.9229 -2.2694 -2.2575 -2.1591 -2.1588 -2.0773 -2.0752 4.0834 4.0894 4.1812 4.1824 4.3724 4.3737 4.7836 4.7856 4.8972 4.9029 5.6560 5.6569 k = 0.2105 0.2105-0.0000 ( 7039 PWs) bands (ev): -17.3764 -17.3764 -17.2937 -17.2935 -17.2856 -17.2856 -17.2804 -17.2803 -8.0204 -8.0198 -7.5161 -7.5127 -7.3426 -7.3424 -7.2998 -7.2937 -6.5278 -6.5168 -6.5091 -6.4903 -6.3919 -6.3655 -6.3514 -6.2917 -5.9014 -5.9001 -5.8903 -5.8902 -5.6378 -5.6367 -5.6321 -5.6279 -4.5070 -4.5002 -4.4859 -4.4450 -4.3595 -4.3316 -3.5844 -3.5829 -3.4720 -3.4634 -3.3877 -3.3866 -3.2071 -3.1934 -3.1093 -3.0992 -3.0969 -3.0917 -3.0474 -3.0439 -2.9285 -2.9250 -2.2688 -2.2571 -2.1750 -2.1746 -2.0952 -2.0927 4.0755 4.0812 4.1666 4.1680 4.3386 4.3400 4.7848 4.7869 4.8901 4.8953 5.6598 5.6606 k = 0.1974 0.1974-0.0000 ( 7051 PWs) bands (ev): -17.3787 -17.3787 -17.2923 -17.2921 -17.2850 -17.2849 -17.2803 -17.2801 -8.0335 -8.0330 -7.4976 -7.4944 -7.3431 -7.3430 -7.2987 -7.2930 -6.5259 -6.5161 -6.5092 -6.4930 -6.3894 -6.3641 -6.3486 -6.2943 -5.9043 -5.9026 -5.8936 -5.8936 -5.6361 -5.6343 -5.6306 -5.6269 -4.5141 -4.5079 -4.4919 -4.4543 -4.3765 -4.3499 -3.5589 -3.5579 -3.4480 -3.4387 -3.3681 -3.3674 -3.2031 -3.1891 -3.1149 -3.1059 -3.1009 -3.0966 -3.0465 -3.0432 -2.9305 -2.9277 -2.2697 -2.2581 -2.1912 -2.1906 -2.1143 -2.1113 4.0688 4.0740 4.1527 4.1542 4.3059 4.3073 4.7862 4.7883 4.8824 4.8870 5.6445 5.6450 k = 0.1842 0.1842-0.0000 ( 7041 PWs) bands (ev): -17.3809 -17.3809 -17.2909 -17.2907 -17.2843 -17.2843 -17.2801 -17.2799 -8.0462 -8.0459 -7.4794 -7.4764 -7.3436 -7.3435 -7.2975 -7.2923 -6.5241 -6.5155 -6.5093 -6.4955 -6.3867 -6.3629 -6.3458 -6.2970 -5.9071 -5.9051 -5.8970 -5.8969 -5.6343 -5.6319 -5.6290 -5.6257 -4.5210 -4.5156 -4.4980 -4.4640 -4.3928 -4.3678 -3.5333 -3.5328 -3.4255 -3.4159 -3.3476 -3.3474 -3.1971 -3.1831 -3.1211 -3.1140 -3.1028 -3.1001 -3.0450 -3.0418 -2.9331 -2.9308 -2.2721 -2.2606 -2.2075 -2.2067 -2.1343 -2.1309 4.0631 4.0680 4.1395 4.1410 4.2747 4.2761 4.7877 4.7898 4.8742 4.8783 5.6170 5.6173 k = 0.1711 0.1711-0.0000 ( 7043 PWs) bands (ev): -17.3830 -17.3830 -17.2895 -17.2893 -17.2838 -17.2837 -17.2799 -17.2798 -8.0584 -8.0582 -7.4618 -7.4590 -7.3440 -7.3440 -7.2961 -7.2914 -6.5223 -6.5148 -6.5094 -6.4978 -6.3838 -6.3618 -6.3431 -6.2999 -5.9098 -5.9076 -5.9003 -5.9003 -5.6325 -5.6296 -5.6274 -5.6245 -4.5278 -4.5230 -4.5043 -4.4741 -4.4083 -4.3853 -3.5078 -3.5078 -3.4050 -3.3953 -3.3267 -3.3266 -3.1886 -3.1751 -3.1275 -3.1213 -3.1045 -3.1027 -3.0432 -3.0400 -2.9363 -2.9346 -2.2759 -2.2646 -2.2238 -2.2227 -2.1553 -2.1513 4.0585 4.0630 4.1271 4.1287 4.2450 4.2463 4.7891 4.7912 4.8658 4.8695 5.5844 5.5846 k = 0.1579 0.1579-0.0000 ( 7039 PWs) bands (ev): -17.3850 -17.3850 -17.2882 -17.2880 -17.2832 -17.2832 -17.2798 -17.2797 -8.0701 -8.0699 -7.4450 -7.4424 -7.3445 -7.3444 -7.2946 -7.2903 -6.5205 -6.5142 -6.5094 -6.5000 -6.3808 -6.3608 -6.3405 -6.3030 -5.9123 -5.9100 -5.9037 -5.9036 -5.6305 -5.6273 -5.6258 -5.6233 -4.5344 -4.5302 -4.5107 -4.4845 -4.4226 -4.4021 -3.4831 -3.4827 -3.3868 -3.3774 -3.3054 -3.3050 -3.1776 -3.1653 -3.1334 -3.1276 -3.1061 -3.1048 -3.0409 -3.0378 -2.9401 -2.9390 -2.2811 -2.2699 -2.2399 -2.2386 -2.1768 -2.1723 4.0548 4.0589 4.1156 4.1171 4.2170 4.2183 4.7906 4.7925 4.8574 4.8606 5.5505 5.5505 k = 0.1447 0.1447-0.0000 ( 7049 PWs) bands (ev): -17.3869 -17.3869 -17.2869 -17.2868 -17.2827 -17.2827 -17.2798 -17.2796 -8.0811 -8.0809 -7.4290 -7.4267 -7.3449 -7.3448 -7.2929 -7.2891 -6.5189 -6.5137 -6.5094 -6.5019 -6.3776 -6.3599 -6.3381 -6.3061 -5.9148 -5.9124 -5.9069 -5.9069 -5.6286 -5.6251 -5.6242 -5.6220 -4.5408 -4.5370 -4.5173 -4.4954 -4.4356 -4.4180 -3.4590 -3.4581 -3.3712 -3.3624 -3.2838 -3.2833 -3.1642 -3.1541 -3.1383 -3.1322 -3.1075 -3.1066 -3.0385 -3.0354 -2.9446 -2.9440 -2.2874 -2.2765 -2.2557 -2.2541 -2.1987 -2.1937 4.0520 4.0557 4.1049 4.1064 4.1909 4.1922 4.7918 4.7937 4.8491 4.8520 5.5169 5.5169 k = 0.1316 0.1316-0.0000 ( 7043 PWs) bands (ev): -17.3886 -17.3886 -17.2857 -17.2856 -17.2822 -17.2822 -17.2797 -17.2796 -8.0914 -8.0913 -7.4142 -7.4121 -7.3452 -7.3451 -7.2909 -7.2877 -6.5173 -6.5132 -6.5095 -6.5036 -6.3744 -6.3590 -6.3360 -6.3093 -5.9171 -5.9147 -5.9101 -5.9100 -5.6266 -5.6231 -5.6226 -5.6207 -4.5468 -4.5435 -4.5241 -4.5065 -4.4472 -4.4327 -3.4357 -3.4345 -3.3581 -3.3501 -3.2620 -3.2616 -3.1500 -3.1452 -3.1410 -3.1317 -3.1087 -3.1080 -3.0359 -3.0328 -2.9498 -2.9498 -2.2948 -2.2843 -2.2710 -2.2691 -2.2207 -2.2151 4.0499 4.0533 4.0951 4.0965 4.1668 4.1680 4.7930 4.7948 4.8411 4.8437 5.4848 5.4848 k = 0.1184 0.1184-0.0000 ( 7041 PWs) bands (ev): -17.3902 -17.3902 -17.2847 -17.2845 -17.2817 -17.2817 -17.2796 -17.2795 -8.1009 -8.1008 -7.4006 -7.3989 -7.3455 -7.3454 -7.2886 -7.2860 -6.5159 -6.5127 -6.5095 -6.5051 -6.3711 -6.3581 -6.3341 -6.3125 -5.9192 -5.9169 -5.9131 -5.9130 -5.6247 -5.6212 -5.6212 -5.6195 -4.5524 -4.5495 -4.5311 -4.5176 -4.4572 -4.4459 -3.4136 -3.4120 -3.3474 -3.3403 -3.2403 -3.2401 -3.1469 -3.1443 -3.1298 -3.1206 -3.1098 -3.1093 -3.0334 -3.0302 -2.9562 -2.9558 -2.3029 -2.2931 -2.2857 -2.2831 -2.2424 -2.2363 4.0485 4.0515 4.0862 4.0875 4.1447 4.1458 4.7941 4.7957 4.8336 4.8358 5.4546 5.4546 k = 0.1053 0.1053-0.0000 ( 7045 PWs) bands (ev): -17.3917 -17.3917 -17.2837 -17.2836 -17.2813 -17.2813 -17.2796 -17.2795 -8.1096 -8.1095 -7.3885 -7.3871 -7.3458 -7.3457 -7.2861 -7.2841 -6.5146 -6.5122 -6.5095 -6.5064 -6.3678 -6.3572 -6.3326 -6.3157 -5.9211 -5.9190 -5.9160 -5.9158 -5.6228 -5.6198 -5.6195 -5.6183 -4.5575 -4.5550 -4.5383 -4.5286 -4.4658 -4.4576 -3.3930 -3.3911 -3.3387 -3.3327 -3.2190 -3.2190 -3.1478 -3.1450 -3.1128 -3.1111 -3.1098 -3.1051 -3.0310 -3.0277 -2.9633 -2.9626 -2.3115 -2.3031 -2.2995 -2.2957 -2.2635 -2.2569 4.0476 4.0502 4.0782 4.0794 4.1248 4.1258 4.7950 4.7965 4.8266 4.8285 5.4268 5.4268 k = 0.0921 0.0921-0.0000 ( 7045 PWs) bands (ev): -17.3930 -17.3930 -17.2828 -17.2827 -17.2809 -17.2809 -17.2796 -17.2795 -8.1173 -8.1173 -7.3780 -7.3769 -7.3461 -7.3460 -7.2834 -7.2818 -6.5134 -6.5118 -6.5096 -6.5074 -6.3646 -6.3562 -6.3314 -6.3188 -5.9228 -5.9209 -5.9187 -5.9184 -5.6211 -5.6185 -5.6180 -5.6172 -4.5621 -4.5599 -4.5455 -4.5391 -4.4732 -4.4675 -3.3743 -3.3723 -3.3319 -3.3269 -3.1987 -3.1985 -3.1473 -3.1446 -3.1118 -3.1115 -3.0943 -3.0896 -3.0287 -3.0255 -2.9711 -2.9700 -2.3204 -2.3140 -2.3124 -2.3068 -2.2835 -2.2766 4.0471 4.0494 4.0712 4.0723 4.1071 4.1080 4.7958 4.7971 4.8203 4.8219 5.4017 5.4017 k = 0.0789 0.0789-0.0000 ( 7049 PWs) bands (ev): -17.3942 -17.3942 -17.2820 -17.2819 -17.2806 -17.2805 -17.2796 -17.2795 -8.1241 -8.1241 -7.3690 -7.3683 -7.3463 -7.3462 -7.2804 -7.2794 -6.5125 -6.5113 -6.5097 -6.5082 -6.3614 -6.3553 -6.3306 -6.3217 -5.9243 -5.9226 -5.9211 -5.9208 -5.6195 -5.6173 -5.6167 -5.6162 -4.5662 -4.5644 -4.5526 -4.5487 -4.4793 -4.4758 -3.3579 -3.3558 -3.3265 -3.3224 -3.1795 -3.1792 -3.1450 -3.1425 -3.1125 -3.1122 -3.0773 -3.0743 -3.0268 -3.0236 -2.9794 -2.9782 -2.3291 -2.3248 -2.3241 -2.3169 -2.3020 -2.2948 4.0470 4.0489 4.0651 4.0661 4.0916 4.0924 4.7965 4.7976 4.8146 4.8160 5.3795 5.3795 k = 0.0658 0.0658-0.0000 ( 7055 PWs) bands (ev): -17.3952 -17.3952 -17.2813 -17.2813 -17.2803 -17.2802 -17.2795 -17.2795 -8.1300 -8.1300 -7.3618 -7.3613 -7.3464 -7.3464 -7.2775 -7.2768 -6.5117 -6.5110 -6.5097 -6.5089 -6.3585 -6.3543 -6.3302 -6.3243 -5.9256 -5.9241 -5.9232 -5.9229 -5.6180 -5.6163 -5.6156 -5.6153 -4.5697 -4.5682 -4.5593 -4.5572 -4.4844 -4.4824 -3.3440 -3.3420 -3.3223 -3.3190 -3.1619 -3.1616 -3.1409 -3.1387 -3.1130 -3.1128 -3.0619 -3.0602 -3.0253 -3.0222 -2.9881 -2.9867 -2.3373 -2.3348 -2.3344 -2.3262 -2.3184 -2.3112 4.0471 4.0487 4.0599 4.0608 4.0785 4.0792 4.7970 4.7980 4.8097 4.8108 5.3604 5.3605 k = 0.0526 0.0526-0.0000 ( 7067 PWs) bands (ev): -17.3960 -17.3960 -17.2808 -17.2808 -17.2800 -17.2800 -17.2795 -17.2795 -8.1348 -8.1348 -7.3561 -7.3559 -7.3466 -7.3465 -7.2747 -7.2743 -6.5110 -6.5107 -6.5098 -6.5094 -6.3558 -6.3533 -6.3300 -6.3267 -5.9266 -5.9254 -5.9249 -5.9247 -5.6167 -5.6155 -5.6149 -5.6146 -4.5726 -4.5714 -4.5653 -4.5644 -4.4886 -4.4876 -3.3328 -3.3310 -3.3191 -3.3166 -3.1463 -3.1461 -3.1351 -3.1333 -3.1134 -3.1132 -3.0487 -3.0478 -3.0242 -3.0213 -2.9966 -2.9954 -2.3449 -2.3434 -2.3431 -2.3354 -2.3316 -2.3253 4.0473 4.0486 4.0557 4.0565 4.0677 4.0683 4.7975 4.7983 4.8057 4.8065 5.3447 5.3447 k = 0.0395 0.0395-0.0000 ( 7067 PWs) bands (ev): -17.3966 -17.3966 -17.2804 -17.2804 -17.2798 -17.2798 -17.2795 -17.2795 -8.1386 -8.1386 -7.3519 -7.3518 -7.3467 -7.3466 -7.2722 -7.2721 -6.5106 -6.5104 -6.5099 -6.5097 -6.3536 -6.3524 -6.3302 -6.3286 -5.9274 -5.9264 -5.9263 -5.9261 -5.6156 -5.6147 -5.6143 -5.6140 -4.5748 -4.5739 -4.5703 -4.5701 -4.4918 -4.4914 -3.3242 -3.3228 -3.3166 -3.3148 -3.1337 -3.1337 -3.1281 -3.1267 -3.1135 -3.1134 -3.0383 -3.0379 -3.0237 -3.0212 -3.0043 -3.0034 -2.3514 -2.3504 -2.3500 -2.3454 -2.3400 -2.3366 4.0476 4.0485 4.0525 4.0531 4.0593 4.0597 4.7979 4.7985 4.8025 4.8032 5.3323 5.3323 k = 0.0263 0.0263-0.0000 ( 7075 PWs) bands (ev): -17.3971 -17.3971 -17.2802 -17.2802 -17.2796 -17.2796 -17.2794 -17.2794 -8.1413 -8.1413 -7.3490 -7.3490 -7.3468 -7.3467 -7.2703 -7.2703 -6.5102 -6.5102 -6.5099 -6.5099 -6.3519 -6.3515 -6.3305 -6.3300 -5.9279 -5.9274 -5.9273 -5.9272 -5.6147 -5.6142 -5.6139 -5.6136 -4.5764 -4.5758 -4.5742 -4.5742 -4.4941 -4.4940 -3.3182 -3.3172 -3.3149 -3.3137 -3.1252 -3.1252 -3.1204 -3.1197 -3.1133 -3.1133 -3.0313 -3.0310 -3.0243 -3.0224 -3.0095 -3.0091 -2.3563 -2.3557 -2.3554 -2.3535 -2.3456 -2.3445 4.0478 4.0484 4.0503 4.0507 4.0533 4.0537 4.7982 4.7986 4.8003 4.8007 5.3234 5.3234 k = 0.0132 0.0132-0.0000 ( 7083 PWs) bands (ev): -17.3973 -17.3973 -17.2801 -17.2801 -17.2794 -17.2794 -17.2794 -17.2794 -8.1430 -8.1430 -7.3474 -7.3474 -7.3468 -7.3468 -7.2691 -7.2691 -6.5100 -6.5100 -6.5100 -6.5100 -6.3509 -6.3509 -6.3308 -6.3307 -5.9281 -5.9280 -5.9279 -5.9278 -5.6141 -5.6139 -5.6137 -5.6135 -4.5773 -4.5770 -4.5767 -4.5766 -4.4955 -4.4955 -3.3147 -3.3141 -3.3138 -3.3132 -3.1207 -3.1207 -3.1144 -3.1142 -3.1127 -3.1127 -3.0277 -3.0274 -3.0259 -3.0249 -3.0115 -3.0114 -2.3594 -2.3590 -2.3590 -2.3585 -2.3491 -2.3489 4.0478 4.0479 4.0493 4.0493 4.0499 4.0501 4.7984 4.7986 4.7989 4.7991 5.3180 5.3180 k = 0.0000 0.0000 0.0000 ( 7075 PWs) bands (ev): -17.3974 -17.3974 -17.2801 -17.2801 -17.2794 -17.2794 -17.2794 -17.2794 -8.1435 -8.1435 -7.3468 -7.3468 -7.3468 -7.3468 -7.2687 -7.2687 -6.5100 -6.5100 -6.5100 -6.5100 -6.3506 -6.3506 -6.3310 -6.3310 -5.9281 -5.9281 -5.9281 -5.9281 -5.6137 -5.6137 -5.6137 -5.6137 -4.5774 -4.5774 -4.5774 -4.5774 -4.4960 -4.4960 -3.3133 -3.3133 -3.3133 -3.3133 -3.1194 -3.1194 -3.1122 -3.1122 -3.1122 -3.1122 -3.0265 -3.0265 -3.0265 -3.0265 -3.0117 -3.0117 -2.3602 -2.3602 -2.3602 -2.3602 -2.3503 -2.3503 4.0475 4.0475 4.0490 4.0490 4.0490 4.0490 4.7986 4.7986 4.7986 4.7986 5.3162 5.3162 k = 0.0000 0.0000 0.0000 ( 7075 PWs) bands (ev): -17.3974 -17.3974 -17.2801 -17.2801 -17.2794 -17.2794 -17.2794 -17.2794 -8.1435 -8.1435 -7.3468 -7.3468 -7.3468 -7.3468 -7.2687 -7.2687 -6.5100 -6.5100 -6.5100 -6.5100 -6.3506 -6.3506 -6.3310 -6.3310 -5.9281 -5.9281 -5.9281 -5.9281 -5.6137 -5.6137 -5.6137 -5.6137 -4.5774 -4.5774 -4.5774 -4.5774 -4.4960 -4.4960 -3.3133 -3.3133 -3.3133 -3.3133 -3.1194 -3.1194 -3.1122 -3.1122 -3.1122 -3.1122 -3.0265 -3.0265 -3.0265 -3.0265 -3.0117 -3.0117 -2.3602 -2.3602 -2.3602 -2.3602 -2.3503 -2.3503 4.0475 4.0475 4.0490 4.0490 4.0490 4.0490 4.7986 4.7986 4.7986 4.7986 5.3162 5.3162 k = 0.0106 0.0106 0.0106 ( 7081 PWs) bands (ev): -17.3974 -17.3974 -17.2801 -17.2801 -17.2794 -17.2794 -17.2794 -17.2794 -8.1430 -8.1430 -7.3473 -7.3473 -7.3468 -7.3468 -7.2691 -7.2691 -6.5100 -6.5100 -6.5100 -6.5100 -6.3509 -6.3509 -6.3308 -6.3308 -5.9282 -5.9279 -5.9279 -5.9278 -5.6141 -5.6138 -5.6138 -5.6135 -4.5773 -4.5770 -4.5766 -4.5766 -4.4955 -4.4955 -3.3143 -3.3140 -3.3140 -3.3135 -3.1207 -3.1207 -3.1145 -3.1142 -3.1126 -3.1126 -3.0278 -3.0278 -3.0257 -3.0246 -3.0114 -3.0114 -2.3592 -2.3590 -2.3590 -2.3587 -2.3490 -2.3490 4.0477 4.0477 4.0494 4.0494 4.0499 4.0501 4.7986 4.7988 4.7988 4.7989 5.3180 5.3180 k = 0.0213 0.0213 0.0213 ( 7081 PWs) bands (ev): -17.3971 -17.3971 -17.2802 -17.2802 -17.2796 -17.2796 -17.2795 -17.2795 -8.1414 -8.1414 -7.3489 -7.3489 -7.3468 -7.3468 -7.2703 -7.2703 -6.5101 -6.5101 -6.5101 -6.5101 -6.3517 -6.3517 -6.3302 -6.3302 -5.9279 -5.9273 -5.9273 -5.9273 -5.6148 -5.6140 -5.6140 -5.6136 -4.5764 -4.5758 -4.5742 -4.5742 -4.4941 -4.4941 -3.3167 -3.3162 -3.3162 -3.3150 -3.1249 -3.1249 -3.1205 -3.1198 -3.1130 -3.1130 -3.0331 -3.0331 -3.0225 -3.0206 -3.0095 -3.0095 -2.3557 -2.3553 -2.3553 -2.3546 -2.3453 -2.3453 4.0472 4.0472 4.0520 4.0520 4.0526 4.0530 4.7991 4.7994 4.7994 4.7998 5.3232 5.3232 k = 0.0319 0.0319 0.0319 ( 7069 PWs) bands (ev): -17.3966 -17.3966 -17.2804 -17.2804 -17.2797 -17.2797 -17.2795 -17.2795 -8.1387 -8.1387 -7.3517 -7.3517 -7.3468 -7.3467 -7.2721 -7.2721 -6.5102 -6.5102 -6.5101 -6.5101 -6.3530 -6.3530 -6.3294 -6.3294 -5.9274 -5.9265 -5.9262 -5.9262 -5.6156 -5.6145 -5.6145 -5.6140 -4.5750 -4.5740 -4.5703 -4.5703 -4.4917 -4.4917 -3.3205 -3.3200 -3.3200 -3.3179 -3.1316 -3.1316 -3.1290 -3.1275 -3.1127 -3.1127 -3.0433 -3.0433 -3.0178 -3.0154 -3.0056 -3.0056 -2.3498 -2.3493 -2.3493 -2.3482 -2.3392 -2.3392 4.0460 4.0460 4.0566 4.0566 4.0572 4.0579 4.8001 4.8004 4.8004 4.8010 5.3320 5.3320 k = 0.0426 0.0426 0.0426 ( 7057 PWs) bands (ev): -17.3960 -17.3960 -17.2806 -17.2806 -17.2799 -17.2799 -17.2797 -17.2797 -8.1350 -8.1350 -7.3556 -7.3556 -7.3467 -7.3466 -7.2744 -7.2744 -6.5103 -6.5103 -6.5101 -6.5101 -6.3546 -6.3546 -6.3283 -6.3283 -5.9267 -5.9255 -5.9248 -5.9248 -5.6167 -5.6151 -5.6151 -5.6145 -4.5728 -4.5717 -4.5649 -4.5649 -4.4882 -4.4882 -3.3260 -3.3257 -3.3257 -3.3227 -3.1395 -3.1395 -3.1386 -3.1362 -3.1119 -3.1119 -3.0581 -3.0581 -3.0126 -3.0100 -3.0007 -3.0007 -2.3417 -2.3413 -2.3413 -2.3397 -2.3310 -2.3310 4.0442 4.0442 4.0633 4.0633 4.0637 4.0646 4.8014 4.8019 4.8019 4.8027 5.3441 5.3441 k = 0.0532 0.0532 0.0532 ( 7051 PWs) bands (ev): -17.3952 -17.3952 -17.2811 -17.2811 -17.2801 -17.2801 -17.2798 -17.2798 -8.1303 -8.1303 -7.3610 -7.3610 -7.3467 -7.3466 -7.2769 -7.2769 -6.5104 -6.5104 -6.5102 -6.5102 -6.3566 -6.3566 -6.3270 -6.3270 -5.9258 -5.9243 -5.9230 -5.9230 -5.6180 -5.6158 -5.6158 -5.6153 -4.5702 -4.5688 -4.5584 -4.5584 -4.4835 -4.4835 -3.3335 -3.3334 -3.3334 -3.3295 -3.1482 -3.1472 -3.1472 -3.1447 -3.1108 -3.1108 -3.0768 -3.0768 -3.0075 -3.0050 -2.9956 -2.9956 -2.3316 -2.3315 -2.3315 -2.3292 -2.3209 -2.3209 4.0421 4.0421 4.0718 4.0718 4.0721 4.0731 4.8032 4.8037 4.8037 4.8048 5.3596 5.3596 k = 0.0638 0.0638 0.0638 ( 7048 PWs) bands (ev): -17.3942 -17.3942 -17.2816 -17.2816 -17.2804 -17.2804 -17.2800 -17.2800 -8.1246 -8.1246 -7.3679 -7.3679 -7.3466 -7.3465 -7.2796 -7.2796 -6.5106 -6.5106 -6.5103 -6.5103 -6.3588 -6.3588 -6.3256 -6.3256 -5.9246 -5.9229 -5.9209 -5.9209 -5.6195 -5.6167 -5.6167 -5.6164 -4.5670 -4.5654 -4.5510 -4.5510 -4.4776 -4.4776 -3.3434 -3.3434 -3.3431 -3.3386 -3.1566 -3.1541 -3.1541 -3.1522 -3.1094 -3.1094 -3.0989 -3.0989 -3.0029 -3.0006 -2.9907 -2.9907 -2.3202 -2.3202 -2.3199 -2.3172 -2.3094 -2.3094 4.0397 4.0397 4.0821 4.0821 4.0823 4.0836 4.8053 4.8058 4.8058 4.8073 5.3782 5.3782 k = 0.0745 0.0745 0.0745 ( 7036 PWs) bands (ev): -17.3931 -17.3931 -17.2823 -17.2823 -17.2806 -17.2806 -17.2802 -17.2802 -8.1180 -8.1180 -7.3763 -7.3763 -7.3465 -7.3464 -7.2822 -7.2822 -6.5108 -6.5108 -6.5103 -6.5103 -6.3612 -6.3612 -6.3242 -6.3242 -5.9232 -5.9213 -5.9185 -5.9185 -5.6211 -5.6177 -5.6177 -5.6176 -4.5634 -4.5617 -4.5429 -4.5429 -4.4700 -4.4700 -3.3556 -3.3556 -3.3549 -3.3502 -3.1633 -3.1596 -3.1596 -3.1580 -3.1241 -3.1241 -3.1077 -3.1077 -2.9988 -2.9969 -2.9864 -2.9864 -2.3077 -2.3077 -2.3068 -2.3039 -2.2967 -2.2967 4.0373 4.0373 4.0943 4.0943 4.0943 4.0958 4.8078 4.8083 4.8083 4.8102 5.3999 5.3999 k = 0.0851 0.0851 0.0851 ( 7039 PWs) bands (ev): -17.3918 -17.3918 -17.2830 -17.2830 -17.2809 -17.2809 -17.2805 -17.2805 -8.1105 -8.1105 -7.3863 -7.3863 -7.3465 -7.3463 -7.2845 -7.2845 -6.5111 -6.5111 -6.5103 -6.5103 -6.3638 -6.3638 -6.3227 -6.3227 -5.9216 -5.9196 -5.9158 -5.9158 -5.6228 -5.6191 -5.6189 -5.6189 -4.5594 -4.5577 -4.5347 -4.5347 -4.4607 -4.4607 -3.3697 -3.3697 -3.3688 -3.3642 -3.1679 -3.1642 -3.1642 -3.1620 -3.1511 -3.1511 -3.1057 -3.1057 -2.9954 -2.9941 -2.9828 -2.9828 -2.2944 -2.2944 -2.2927 -2.2897 -2.2833 -2.2833 4.0349 4.0349 4.1080 4.1083 4.1083 4.1098 4.8107 4.8111 4.8111 4.8134 5.4245 5.4245 k = 0.0957 0.0957 0.0957 ( 7039 PWs) bands (ev): -17.3904 -17.3904 -17.2839 -17.2839 -17.2811 -17.2811 -17.2807 -17.2807 -8.1022 -8.1022 -7.3978 -7.3978 -7.3464 -7.3462 -7.2866 -7.2866 -6.5113 -6.5113 -6.5103 -6.5103 -6.3665 -6.3665 -6.3211 -6.3211 -5.9198 -5.9177 -5.9129 -5.9129 -5.6245 -5.6207 -5.6201 -5.6201 -4.5552 -4.5535 -4.5267 -4.5267 -4.4493 -4.4493 -3.3856 -3.3856 -3.3845 -3.3802 -3.1840 -3.1840 -3.1704 -3.1641 -3.1635 -3.1635 -3.1035 -3.1035 -2.9928 -2.9921 -2.9798 -2.9798 -2.2806 -2.2806 -2.2779 -2.2749 -2.2693 -2.2693 4.0327 4.0327 4.1236 4.1241 4.1241 4.1255 4.8138 4.8142 4.8142 4.8168 5.4518 5.4518 k = 0.1064 0.1064 0.1064 ( 7045 PWs) bands (ev): -17.3888 -17.3888 -17.2848 -17.2848 -17.2815 -17.2815 -17.2810 -17.2810 -8.0931 -8.0931 -7.4105 -7.4105 -7.3463 -7.3461 -7.2883 -7.2883 -6.5116 -6.5116 -6.5103 -6.5103 -6.3693 -6.3693 -6.3195 -6.3195 -5.9179 -5.9157 -5.9099 -5.9099 -5.6264 -5.6224 -5.6213 -5.6213 -4.5508 -4.5492 -4.5193 -4.5193 -4.4357 -4.4357 -3.4026 -3.4026 -3.4014 -3.3978 -3.2160 -3.2160 -3.1710 -3.1643 -3.1641 -3.1641 -3.1010 -3.1010 -2.9909 -2.9907 -2.9776 -2.9776 -2.2666 -2.2666 -2.2628 -2.2597 -2.2551 -2.2551 4.0309 4.0309 4.1407 4.1415 4.1415 4.1429 4.8172 4.8175 4.8175 4.8206 5.4817 5.4817 k = 0.1170 0.1170 0.1170 ( 7045 PWs) bands (ev): -17.3871 -17.3871 -17.2858 -17.2858 -17.2818 -17.2818 -17.2814 -17.2814 -8.0835 -8.0835 -7.4244 -7.4244 -7.3461 -7.3459 -7.2898 -7.2898 -6.5119 -6.5119 -6.5103 -6.5103 -6.3722 -6.3722 -6.3180 -6.3180 -5.9158 -5.9137 -5.9068 -5.9068 -5.6282 -5.6243 -5.6226 -5.6226 -4.5464 -4.5450 -4.5127 -4.5127 -4.4199 -4.4199 -3.4203 -3.4203 -3.4192 -3.4163 -3.2502 -3.2502 -3.1699 -3.1629 -3.1628 -3.1628 -3.0984 -3.0984 -2.9904 -2.9893 -2.9759 -2.9759 -2.2527 -2.2527 -2.2476 -2.2445 -2.2409 -2.2409 4.0296 4.0296 4.1596 4.1606 4.1606 4.1619 4.8208 4.8209 4.8209 4.8246 5.5138 5.5138 k = 0.1277 0.1277 0.1277 ( 7049 PWs) bands (ev): -17.3853 -17.3853 -17.2869 -17.2869 -17.2822 -17.2822 -17.2817 -17.2817 -8.0733 -8.0733 -7.4391 -7.4391 -7.3460 -7.3458 -7.2909 -7.2909 -6.5122 -6.5122 -6.5103 -6.5103 -6.3751 -6.3751 -6.3164 -6.3164 -5.9135 -5.9115 -5.9035 -5.9035 -5.6300 -5.6262 -5.6240 -5.6240 -4.5422 -4.5410 -4.5070 -4.5070 -4.4020 -4.4020 -3.4382 -3.4382 -3.4372 -3.4352 -3.2860 -3.2860 -3.1673 -3.1602 -3.1602 -3.1601 -3.0955 -3.0955 -2.9904 -2.9883 -2.9749 -2.9749 -2.2391 -2.2391 -2.2326 -2.2296 -2.2269 -2.2269 4.0290 4.0290 4.1799 4.1813 4.1813 4.1825 4.8245 4.8245 4.8246 4.8287 5.5479 5.5479 k = 0.1383 0.1383 0.1383 ( 7055 PWs) bands (ev): -17.3833 -17.3833 -17.2880 -17.2880 -17.2826 -17.2826 -17.2821 -17.2821 -8.0628 -8.0628 -7.4543 -7.4543 -7.3459 -7.3456 -7.2919 -7.2919 -6.5125 -6.5125 -6.5102 -6.5102 -6.3779 -6.3779 -6.3148 -6.3148 -5.9112 -5.9094 -5.9003 -5.9003 -5.6318 -5.6281 -5.6253 -5.6253 -4.5382 -4.5374 -4.5023 -4.5023 -4.3824 -4.3824 -3.4558 -3.4558 -3.4550 -3.4541 -3.3231 -3.3231 -3.1635 -3.1565 -3.1565 -3.1561 -3.0924 -3.0924 -2.9910 -2.9878 -2.9743 -2.9743 -2.2261 -2.2261 -2.2180 -2.2151 -2.2134 -2.2134 4.0292 4.0292 4.2017 4.2034 4.2034 4.2045 4.8281 4.8281 4.8284 4.8330 5.5837 5.5837 k = 0.1489 0.1489 0.1489 ( 7052 PWs) bands (ev): -17.3813 -17.3813 -17.2892 -17.2892 -17.2830 -17.2830 -17.2825 -17.2825 -8.0521 -8.0521 -7.4699 -7.4699 -7.3457 -7.3455 -7.2927 -7.2927 -6.5129 -6.5128 -6.5101 -6.5101 -6.3808 -6.3808 -6.3133 -6.3133 -5.9088 -5.9072 -5.8970 -5.8970 -5.6334 -5.6301 -5.6265 -5.6265 -4.5347 -4.5343 -4.4986 -4.4986 -4.3612 -4.3612 -3.4728 -3.4728 -3.4724 -3.4723 -3.3613 -3.3613 -3.1588 -3.1518 -3.1518 -3.1509 -3.0891 -3.0891 -2.9921 -2.9877 -2.9742 -2.9742 -2.2139 -2.2139 -2.2041 -2.2014 -2.2005 -2.2005 4.0304 4.0304 4.2249 4.2270 4.2270 4.2278 4.8317 4.8317 4.8324 4.8373 5.6209 5.6209 k = 0.1596 0.1596 0.1596 ( 7055 PWs) bands (ev): -17.3791 -17.3791 -17.2904 -17.2904 -17.2834 -17.2834 -17.2830 -17.2830 -8.0415 -8.0415 -7.4854 -7.4854 -7.3456 -7.3453 -7.2932 -7.2932 -6.5132 -6.5131 -6.5099 -6.5099 -6.3835 -6.3835 -6.3117 -6.3117 -5.9063 -5.9050 -5.8938 -5.8938 -5.6350 -5.6321 -5.6277 -5.6277 -4.5318 -4.5317 -4.4959 -4.4959 -4.3388 -4.3388 -3.4897 -3.4889 -3.4889 -3.4885 -3.4000 -3.4000 -3.1531 -3.1463 -3.1463 -3.1450 -3.0857 -3.0857 -2.9936 -2.9879 -2.9745 -2.9745 -2.2027 -2.2027 -2.1911 -2.1885 -2.1883 -2.1883 4.0327 4.0327 4.2493 4.2518 4.2518 4.2524 4.8352 4.8352 4.8362 4.8415 5.6592 5.6592 k = 0.1702 0.1702 0.1702 ( 7055 PWs) bands (ev): -17.3769 -17.3769 -17.2917 -17.2917 -17.2839 -17.2839 -17.2834 -17.2834 -8.0311 -8.0311 -7.5006 -7.5006 -7.3454 -7.3451 -7.2937 -7.2937 -6.5135 -6.5134 -6.5098 -6.5098 -6.3861 -6.3861 -6.3102 -6.3102 -5.9038 -5.9029 -5.8907 -5.8907 -5.6363 -5.6339 -5.6288 -5.6288 -4.5302 -4.5295 -4.4943 -4.4943 -4.3156 -4.3156 -3.5057 -3.5037 -3.5037 -3.5034 -3.4391 -3.4391 -3.1469 -3.1402 -3.1402 -3.1382 -3.0821 -3.0821 -2.9954 -2.9884 -2.9750 -2.9750 -2.1926 -2.1926 -2.1792 -2.1771 -2.1771 -2.1767 4.0363 4.0363 4.2747 4.2777 4.2777 4.2781 4.8386 4.8386 4.8400 4.8457 5.6980 5.6980 k = 0.1809 0.1809 0.1809 ( 7052 PWs) bands (ev): -17.3746 -17.3746 -17.2929 -17.2929 -17.2843 -17.2843 -17.2839 -17.2839 -8.0212 -8.0212 -7.5150 -7.5150 -7.3453 -7.3450 -7.2940 -7.2940 -6.5138 -6.5137 -6.5096 -6.5096 -6.3885 -6.3885 -6.3087 -6.3087 -5.9013 -5.9008 -5.8877 -5.8877 -5.6375 -5.6357 -5.6298 -5.6298 -4.5296 -4.5282 -4.4939 -4.4939 -4.2918 -4.2918 -3.5201 -3.5176 -3.5176 -3.5166 -3.4774 -3.4774 -3.1401 -3.1335 -3.1335 -3.1308 -3.0783 -3.0783 -2.9975 -2.9890 -2.9758 -2.9758 -2.1838 -2.1838 -2.1684 -2.1670 -2.1670 -2.1661 4.0411 4.0411 4.3011 4.3046 4.3046 4.3046 4.8416 4.8416 4.8436 4.8496 5.7371 5.7371 k = 0.1915 0.1915 0.1915 ( 7067 PWs) bands (ev): -17.3723 -17.3723 -17.2942 -17.2942 -17.2848 -17.2848 -17.2844 -17.2844 -8.0123 -8.0123 -7.5282 -7.5282 -7.3451 -7.3448 -7.2943 -7.2943 -6.5141 -6.5140 -6.5094 -6.5094 -6.3908 -6.3908 -6.3072 -6.3072 -5.8989 -5.8989 -5.8848 -5.8848 -5.6384 -5.6374 -5.6307 -5.6307 -4.5301 -4.5279 -4.4947 -4.4947 -4.2681 -4.2681 -3.5335 -3.5335 -3.5325 -3.5278 -3.5115 -3.5115 -3.1329 -3.1264 -3.1264 -3.1229 -3.0745 -3.0745 -2.9998 -2.9897 -2.9768 -2.9768 -2.1762 -2.1762 -2.1589 -2.1582 -2.1582 -2.1568 4.0474 4.0474 4.3282 4.3318 4.3323 4.3323 4.8443 4.8443 4.8469 4.8533 5.7419 5.7419 k = 0.2021 0.2021 0.2021 ( 7073 PWs) bands (ev): -17.3700 -17.3700 -17.2955 -17.2955 -17.2853 -17.2853 -17.2848 -17.2848 -8.0045 -8.0045 -7.5399 -7.5399 -7.3449 -7.3446 -7.2945 -7.2945 -6.5144 -6.5142 -6.5092 -6.5092 -6.3927 -6.3927 -6.3057 -6.3057 -5.8970 -5.8965 -5.8822 -5.8822 -5.6391 -5.6389 -5.6313 -5.6313 -4.5318 -4.5289 -4.4968 -4.4968 -4.2449 -4.2449 -3.5622 -3.5622 -3.5428 -3.5369 -3.5298 -3.5298 -3.1254 -3.1190 -3.1190 -3.1145 -3.0705 -3.0705 -3.0023 -2.9903 -2.9778 -2.9778 -2.1701 -2.1701 -2.1509 -2.1506 -2.1506 -2.1490 4.0551 4.0551 4.3558 4.3596 4.3605 4.3605 4.8465 4.8465 4.8499 4.8565 5.7098 5.7098 k = 0.2128 0.2128 0.2128 ( 7064 PWs) bands (ev): -17.3676 -17.3676 -17.2968 -17.2968 -17.2858 -17.2858 -17.2853 -17.2853 -7.9983 -7.9983 -7.5495 -7.5495 -7.3448 -7.3444 -7.2945 -7.2945 -6.5147 -6.5145 -6.5090 -6.5090 -6.3944 -6.3944 -6.3042 -6.3042 -5.8953 -5.8941 -5.8797 -5.8797 -5.6402 -5.6396 -5.6318 -5.6318 -4.5348 -4.5311 -4.5002 -4.5002 -4.2230 -4.2230 -3.5969 -3.5969 -3.5507 -3.5437 -3.5381 -3.5381 -3.1177 -3.1114 -3.1114 -3.1057 -3.0664 -3.0664 -3.0048 -2.9909 -2.9788 -2.9788 -2.1653 -2.1653 -2.1446 -2.1446 -2.1444 -2.1427 4.0644 4.0644 4.3836 4.3875 4.3890 4.3890 4.8481 4.8481 4.8523 4.8592 5.6804 5.6804 k = 0.2234 0.2234 0.2234 ( 7073 PWs) bands (ev): -17.3653 -17.3653 -17.2980 -17.2980 -17.2863 -17.2863 -17.2859 -17.2858 -7.9940 -7.9940 -7.5568 -7.5568 -7.3446 -7.3443 -7.2946 -7.2946 -6.5149 -6.5147 -6.5089 -6.5089 -6.3957 -6.3957 -6.3027 -6.3027 -5.8938 -5.8919 -5.8775 -5.8775 -5.6413 -5.6398 -5.6322 -5.6322 -4.5391 -4.5347 -4.5049 -4.5049 -4.2033 -4.2033 -3.6305 -3.6305 -3.5562 -3.5480 -3.5426 -3.5426 -3.1100 -3.1037 -3.1037 -3.0967 -3.0623 -3.0623 -3.0073 -2.9912 -2.9798 -2.9798 -2.1620 -2.1620 -2.1400 -2.1400 -2.1396 -2.1381 4.0752 4.0752 4.4113 4.4153 4.4175 4.4175 4.8490 4.8490 4.8541 4.8612 5.6542 5.6542 k = 0.2340 0.2340 0.2340 ( 7073 PWs) bands (ev): -17.3630 -17.3630 -17.2991 -17.2991 -17.2868 -17.2868 -17.2864 -17.2864 -7.9919 -7.9919 -7.5614 -7.5614 -7.3444 -7.3441 -7.2945 -7.2945 -6.5152 -6.5150 -6.5087 -6.5087 -6.3965 -6.3965 -6.3012 -6.3012 -5.8924 -5.8898 -5.8755 -5.8755 -5.6422 -5.6397 -5.6323 -5.6323 -4.5448 -4.5396 -4.5109 -4.5109 -4.1870 -4.1870 -3.6606 -3.6606 -3.5592 -3.5498 -3.5443 -3.5443 -3.1024 -3.0960 -3.0960 -3.0875 -3.0580 -3.0580 -3.0098 -2.9913 -2.9805 -2.9805 -2.1603 -2.1603 -2.1370 -2.1370 -2.1363 -2.1351 4.0875 4.0875 4.4387 4.4427 4.4457 4.4457 4.8491 4.8491 4.8553 4.8624 5.6316 5.6316 k = 0.2447 0.2447 0.2447 ( 7079 PWs) bands (ev): -17.3608 -17.3608 -17.3002 -17.3002 -17.2873 -17.2873 -17.2869 -17.2869 -7.9923 -7.9923 -7.5630 -7.5630 -7.3442 -7.3439 -7.2944 -7.2944 -6.5154 -6.5152 -6.5087 -6.5087 -6.3970 -6.3970 -6.2996 -6.2996 -5.8911 -5.8879 -5.8738 -5.8738 -5.6429 -5.6393 -5.6322 -5.6322 -4.5518 -4.5459 -4.5182 -4.5182 -4.1757 -4.1757 -3.6856 -3.6856 -3.5595 -3.5492 -3.5433 -3.5433 -3.0950 -3.0884 -3.0884 -3.0783 -3.0538 -3.0538 -3.0121 -2.9909 -2.9810 -2.9810 -2.1600 -2.1600 -2.1357 -2.1357 -2.1348 -2.1338 4.1014 4.1014 4.4654 4.4693 4.4732 4.4732 4.8483 4.8483 4.8558 4.8628 5.6133 5.6133 k = 0.2553 0.2553 0.2553 ( 7082 PWs) bands (ev): -17.3586 -17.3586 -17.3012 -17.3012 -17.2878 -17.2878 -17.2874 -17.2874 -7.9951 -7.9951 -7.5616 -7.5616 -7.3440 -7.3437 -7.2942 -7.2942 -6.5156 -6.5153 -6.5086 -6.5086 -6.3970 -6.3970 -6.2980 -6.2980 -5.8901 -5.8861 -5.8723 -5.8723 -5.6432 -5.6386 -5.6320 -5.6320 -4.5602 -4.5535 -4.5267 -4.5267 -4.1708 -4.1708 -3.7039 -3.7039 -3.5574 -3.5460 -3.5399 -3.5399 -3.0879 -3.0811 -3.0811 -3.0692 -3.0495 -3.0495 -3.0140 -2.9900 -2.9811 -2.9811 -2.1612 -2.1612 -2.1360 -2.1360 -2.1350 -2.1342 4.1168 4.1168 4.4910 4.4947 4.4996 4.4996 4.8468 4.8468 4.8555 4.8623 5.5996 5.5996 k = 0.2660 0.2660 0.2660 ( 7088 PWs) bands (ev): -17.3566 -17.3566 -17.3021 -17.3021 -17.2883 -17.2883 -17.2879 -17.2879 -8.0003 -8.0003 -7.5573 -7.5573 -7.3439 -7.3435 -7.2940 -7.2940 -6.5158 -6.5155 -6.5087 -6.5087 -6.3965 -6.3965 -6.2963 -6.2963 -5.8892 -5.8846 -5.8712 -5.8712 -5.6433 -5.6377 -5.6315 -5.6315 -4.5696 -4.5624 -4.5363 -4.5363 -4.1736 -4.1736 -3.7141 -3.7141 -3.5528 -3.5406 -3.5342 -3.5342 -3.0813 -3.0741 -3.0741 -3.0605 -3.0452 -3.0452 -3.0154 -2.9884 -2.9806 -2.9806 -2.1640 -2.1640 -2.1380 -2.1380 -2.1369 -2.1363 4.1337 4.1337 4.5150 4.5185 4.5244 4.5244 4.8445 4.8445 4.8546 4.8609 5.5909 5.5909 k = 0.2766 0.2766 0.2766 ( 7085 PWs) bands (ev): -17.3546 -17.3546 -17.3029 -17.3029 -17.2889 -17.2889 -17.2884 -17.2884 -8.0076 -8.0076 -7.5502 -7.5502 -7.3437 -7.3434 -7.2937 -7.2937 -6.5159 -6.5156 -6.5088 -6.5088 -6.3955 -6.3955 -6.2946 -6.2946 -5.8884 -5.8832 -5.8703 -5.8703 -5.6430 -5.6365 -5.6307 -5.6307 -4.5801 -4.5724 -4.5468 -4.5468 -4.1848 -4.1848 -3.7157 -3.7157 -3.5460 -3.5328 -3.5262 -3.5262 -3.0752 -3.0677 -3.0677 -3.0526 -3.0410 -3.0410 -3.0158 -2.9861 -2.9795 -2.9795 -2.1682 -2.1682 -2.1416 -2.1416 -2.1406 -2.1402 4.1519 4.1519 4.5371 4.5402 4.5471 4.5471 4.8417 4.8417 4.8531 4.8589 5.5875 5.5875 k = 0.2872 0.2872 0.2872 ( 7085 PWs) bands (ev): -17.3529 -17.3529 -17.3035 -17.3035 -17.2894 -17.2894 -17.2889 -17.2889 -8.0168 -8.0168 -7.5408 -7.5408 -7.3435 -7.3432 -7.2934 -7.2934 -6.5160 -6.5157 -6.5090 -6.5090 -6.3940 -6.3940 -6.2927 -6.2927 -5.8878 -5.8820 -5.8697 -5.8697 -5.6425 -5.6351 -5.6299 -5.6299 -4.5916 -4.5833 -4.5581 -4.5581 -4.2038 -4.2038 -3.7091 -3.7091 -3.5370 -3.5231 -3.5161 -3.5161 -3.0698 -3.0618 -3.0618 -3.0461 -3.0368 -3.0368 -3.0145 -2.9829 -2.9776 -2.9776 -2.1738 -2.1738 -2.1469 -2.1469 -2.1459 -2.1457 4.1714 4.1714 4.5568 4.5593 4.5672 4.5672 4.8387 4.8387 4.8513 4.8563 5.5895 5.5895 k = 0.2979 0.2979 0.2979 ( 7079 PWs) bands (ev): -17.3513 -17.3513 -17.3039 -17.3039 -17.2898 -17.2898 -17.2894 -17.2894 -8.0276 -8.0276 -7.5294 -7.5294 -7.3433 -7.3430 -7.2929 -7.2929 -6.5161 -6.5158 -6.5093 -6.5093 -6.3919 -6.3919 -6.2907 -6.2907 -5.8874 -5.8810 -5.8694 -5.8694 -5.6417 -5.6334 -5.6288 -5.6288 -4.6037 -4.5951 -4.5701 -4.5701 -4.2294 -4.2294 -3.6954 -3.6954 -3.5260 -3.5115 -3.5042 -3.5042 -3.0650 -3.0567 -3.0567 -3.0417 -3.0327 -3.0327 -3.0109 -2.9789 -2.9749 -2.9749 -2.1808 -2.1808 -2.1537 -2.1537 -2.1528 -2.1528 4.1921 4.1921 4.5737 4.5756 4.5842 4.5842 4.8359 4.8359 4.8495 4.8535 5.5970 5.5970 k = 0.3085 0.3085 0.3085 ( 7088 PWs) bands (ev): -17.3499 -17.3499 -17.3042 -17.3042 -17.2903 -17.2903 -17.2899 -17.2899 -8.0394 -8.0394 -7.5164 -7.5164 -7.3431 -7.3428 -7.2925 -7.2925 -6.5162 -6.5158 -6.5096 -6.5096 -6.3893 -6.3893 -6.2886 -6.2886 -5.8871 -5.8803 -5.8693 -5.8693 -5.6406 -5.6316 -5.6276 -5.6276 -4.6164 -4.6075 -4.5826 -4.5826 -4.2601 -4.2601 -3.6761 -3.6761 -3.5134 -3.4982 -3.4907 -3.4907 -3.0608 -3.0522 -3.0522 -3.0394 -3.0288 -3.0288 -3.0050 -2.9742 -2.9714 -2.9714 -2.1892 -2.1892 -2.1620 -2.1620 -2.1616 -2.1613 4.2138 4.2138 4.5874 4.5885 4.5977 4.5977 4.8338 4.8338 4.8481 4.8509 5.6099 5.6099 k = 0.3191 0.3191 0.3191 ( 7076 PWs) bands (ev): -17.3488 -17.3488 -17.3042 -17.3042 -17.2908 -17.2908 -17.2904 -17.2904 -8.0521 -8.0521 -7.5023 -7.5023 -7.3430 -7.3427 -7.2919 -7.2919 -6.5162 -6.5158 -6.5100 -6.5100 -6.3863 -6.3863 -6.2862 -6.2862 -5.8869 -5.8797 -5.8695 -5.8695 -5.6392 -5.6296 -5.6262 -5.6262 -4.6295 -4.6204 -4.5954 -4.5954 -4.2945 -4.2945 -3.6527 -3.6527 -3.4993 -3.4836 -3.4758 -3.4758 -3.0570 -3.0483 -3.0483 -3.0383 -3.0249 -3.0249 -2.9977 -2.9687 -2.9670 -2.9670 -2.1987 -2.1987 -2.1718 -2.1718 -2.1718 -2.1713 4.2364 4.2364 4.5977 4.5979 4.6072 4.6072 4.8329 4.8329 4.8473 4.8490 5.6278 5.6278 k = 0.3298 0.3298 0.3298 ( 7082 PWs) bands (ev): -17.3478 -17.3478 -17.3041 -17.3041 -17.2913 -17.2913 -17.2908 -17.2908 -8.0654 -8.0654 -7.4873 -7.4873 -7.3428 -7.3425 -7.2912 -7.2912 -6.5163 -6.5159 -6.5104 -6.5104 -6.3828 -6.3828 -6.2837 -6.2837 -5.8868 -5.8793 -5.8699 -5.8699 -5.6377 -5.6276 -5.6247 -5.6247 -4.6428 -4.6336 -4.6084 -4.6084 -4.3312 -4.3312 -3.6264 -3.6264 -3.4840 -3.4679 -3.4597 -3.4597 -3.0536 -3.0450 -3.0450 -3.0378 -3.0211 -3.0211 -2.9895 -2.9628 -2.9620 -2.9620 -2.2093 -2.2093 -2.1834 -2.1829 -2.1829 -2.1827 4.2598 4.2598 4.6038 4.6045 4.6129 4.6129 4.8333 4.8333 4.8475 4.8479 5.6506 5.6506 k = 0.3404 0.3404 0.3404 ( 7076 PWs) bands (ev): -17.3471 -17.3471 -17.3038 -17.3038 -17.2917 -17.2917 -17.2913 -17.2913 -8.0788 -8.0788 -7.4719 -7.4719 -7.3426 -7.3423 -7.2904 -7.2904 -6.5162 -6.5159 -6.5108 -6.5108 -6.3790 -6.3790 -6.2808 -6.2808 -5.8868 -5.8792 -5.8706 -5.8706 -5.6359 -5.6254 -5.6232 -5.6232 -4.6562 -4.6470 -4.6215 -4.6215 -4.3693 -4.3693 -3.5981 -3.5981 -3.4678 -3.4514 -3.4427 -3.4427 -3.0503 -3.0421 -3.0421 -3.0372 -3.0175 -3.0175 -2.9812 -2.9565 -2.9565 -2.9565 -2.2210 -2.2210 -2.1962 -2.1953 -2.1952 -2.1952 4.2837 4.2837 4.6064 4.6079 4.6147 4.6147 4.8352 4.8352 4.8480 4.8486 5.6776 5.6776 k = 0.3511 0.3511 0.3511 ( 7070 PWs) bands (ev): -17.3466 -17.3466 -17.3033 -17.3033 -17.2921 -17.2921 -17.2917 -17.2917 -8.0922 -8.0922 -7.4564 -7.4564 -7.3425 -7.3422 -7.2894 -7.2894 -6.5162 -6.5158 -6.5113 -6.5113 -6.3750 -6.3750 -6.2776 -6.2776 -5.8869 -5.8791 -5.8714 -5.8714 -5.6339 -5.6232 -5.6216 -5.6216 -4.6694 -4.6603 -4.6344 -4.6344 -4.4079 -4.4079 -3.5686 -3.5686 -3.4510 -3.4344 -3.4251 -3.4251 -3.0469 -3.0393 -3.0393 -3.0363 -3.0140 -3.0140 -2.9728 -2.9507 -2.9507 -2.9499 -2.2336 -2.2336 -2.2102 -2.2091 -2.2086 -2.2086 4.3080 4.3080 4.6060 4.6082 4.6133 4.6133 4.8384 4.8384 4.8491 4.8507 5.7084 5.7084 k = 0.3617 0.3617 0.3617 ( 7070 PWs) bands (ev): -17.3462 -17.3462 -17.3027 -17.3027 -17.2925 -17.2925 -17.2921 -17.2921 -8.1053 -8.1053 -7.4412 -7.4412 -7.3423 -7.3420 -7.2883 -7.2883 -6.5162 -6.5158 -6.5118 -6.5118 -6.3707 -6.3707 -6.2740 -6.2740 -5.8870 -5.8793 -5.8724 -5.8724 -5.6317 -5.6210 -5.6200 -5.6200 -4.6823 -4.6734 -4.6472 -4.6472 -4.4464 -4.4464 -3.5386 -3.5386 -3.4338 -3.4172 -3.4071 -3.4071 -3.0434 -3.0365 -3.0365 -3.0349 -3.0107 -3.0107 -2.9645 -2.9447 -2.9447 -2.9433 -2.2469 -2.2469 -2.2252 -2.2239 -2.2229 -2.2229 4.3324 4.3324 4.6032 4.6059 4.6092 4.6092 4.8425 4.8425 4.8513 4.8535 5.7423 5.7423 k = 0.3723 0.3723 0.3723 ( 7055 PWs) bands (ev): -17.3460 -17.3460 -17.3020 -17.3020 -17.2929 -17.2929 -17.2925 -17.2925 -8.1180 -8.1180 -7.4264 -7.4264 -7.3422 -7.3419 -7.2870 -7.2870 -6.5161 -6.5158 -6.5122 -6.5122 -6.3664 -6.3664 -6.2701 -6.2701 -5.8871 -5.8795 -5.8735 -5.8735 -5.6295 -5.6188 -5.6184 -5.6184 -4.6948 -4.6862 -4.6597 -4.6597 -4.4841 -4.4841 -3.5085 -3.5085 -3.4167 -3.4001 -3.3890 -3.3890 -3.0396 -3.0336 -3.0336 -3.0329 -3.0076 -3.0076 -2.9565 -2.9386 -2.9386 -2.9367 -2.2608 -2.2608 -2.2409 -2.2395 -2.2379 -2.2379 4.3567 4.3567 4.5986 4.6016 4.6033 4.6033 4.8473 4.8473 4.8542 4.8569 5.7787 5.7787 k = 0.3830 0.3830 0.3830 ( 7049 PWs) bands (ev): -17.3459 -17.3459 -17.3012 -17.3012 -17.2932 -17.2932 -17.2928 -17.2928 -8.1302 -8.1302 -7.4123 -7.4123 -7.3420 -7.3418 -7.2855 -7.2855 -6.5160 -6.5157 -6.5127 -6.5127 -6.3622 -6.3622 -6.2658 -6.2658 -5.8872 -5.8799 -5.8747 -5.8747 -5.6271 -5.6168 -5.6168 -5.6167 -4.7068 -4.6985 -4.6718 -4.6718 -4.5205 -4.5205 -3.4789 -3.4789 -3.3998 -3.3835 -3.3711 -3.3711 -3.0354 -3.0305 -3.0305 -3.0302 -3.0046 -3.0046 -2.9488 -2.9326 -2.9326 -2.9303 -2.2751 -2.2751 -2.2573 -2.2556 -2.2535 -2.2535 4.3806 4.3806 4.5927 4.5958 4.5961 4.5961 4.8523 4.8523 4.8576 4.8605 5.8170 5.8170 k = 0.3936 0.3936 0.3936 ( 7061 PWs) bands (ev): -17.3460 -17.3460 -17.3004 -17.3004 -17.2936 -17.2936 -17.2931 -17.2931 -8.1417 -8.1417 -7.3993 -7.3993 -7.3419 -7.3417 -7.2838 -7.2838 -6.5160 -6.5157 -6.5131 -6.5131 -6.3581 -6.3581 -6.2611 -6.2611 -5.8874 -5.8804 -5.8761 -5.8761 -5.6248 -5.6152 -5.6152 -5.6147 -4.7181 -4.7102 -4.6835 -4.6835 -4.5551 -4.5551 -3.4501 -3.4501 -3.3834 -3.3676 -3.3538 -3.3538 -3.0308 -3.0271 -3.0271 -3.0267 -3.0018 -3.0018 -2.9414 -2.9268 -2.9268 -2.9241 -2.2897 -2.2897 -2.2739 -2.2722 -2.2694 -2.2694 4.4039 4.4039 4.5860 4.5882 4.5882 4.5890 4.8573 4.8573 4.8612 4.8642 5.8563 5.8563 k = 0.4043 0.4043 0.4043 ( 7061 PWs) bands (ev): -17.3461 -17.3461 -17.2995 -17.2995 -17.2939 -17.2939 -17.2934 -17.2934 -8.1524 -8.1524 -7.3874 -7.3874 -7.3418 -7.3416 -7.2817 -7.2817 -6.5159 -6.5156 -6.5135 -6.5135 -6.3544 -6.3544 -6.2561 -6.2561 -5.8875 -5.8809 -5.8775 -5.8775 -5.6224 -5.6138 -5.6138 -5.6129 -4.7286 -4.7213 -4.6949 -4.6949 -4.5874 -4.5874 -3.4226 -3.4226 -3.3679 -3.3528 -3.3372 -3.3372 -3.0257 -3.0232 -3.0232 -3.0225 -2.9992 -2.9992 -2.9345 -2.9213 -2.9213 -2.9183 -2.3041 -2.3041 -2.2907 -2.2888 -2.2852 -2.2852 4.4263 4.4263 4.5789 4.5800 4.5800 4.5819 4.8621 4.8621 4.8648 4.8678 5.8959 5.8959 k = 0.4149 0.4149 0.4149 ( 7052 PWs) bands (ev): -17.3463 -17.3463 -17.2987 -17.2987 -17.2941 -17.2941 -17.2937 -17.2937 -8.1621 -8.1621 -7.3769 -7.3769 -7.3417 -7.3415 -7.2794 -7.2794 -6.5158 -6.5155 -6.5139 -6.5139 -6.3509 -6.3509 -6.2508 -6.2508 -5.8876 -5.8815 -5.8789 -5.8789 -5.6200 -5.6124 -5.6124 -5.6112 -4.7382 -4.7315 -4.7060 -4.7060 -4.6168 -4.6168 -3.3968 -3.3968 -3.3535 -3.3393 -3.3215 -3.3215 -3.0202 -3.0190 -3.0190 -3.0177 -2.9969 -2.9969 -2.9279 -2.9161 -2.9161 -2.9128 -2.3183 -2.3183 -2.3072 -2.3052 -2.3008 -2.3008 4.4474 4.4474 4.5719 4.5721 4.5721 4.5747 4.8666 4.8666 4.8683 4.8712 5.9350 5.9350 k = 0.4255 0.4255 0.4255 ( 7049 PWs) bands (ev): -17.3464 -17.3464 -17.2979 -17.2979 -17.2944 -17.2944 -17.2940 -17.2940 -8.1709 -8.1709 -7.3678 -7.3678 -7.3416 -7.3414 -7.2769 -7.2769 -6.5157 -6.5155 -6.5142 -6.5142 -6.3478 -6.3478 -6.2455 -6.2455 -5.8876 -5.8821 -5.8803 -5.8803 -5.6178 -5.6112 -5.6112 -5.6097 -4.7469 -4.7408 -4.7170 -4.7170 -4.6428 -4.6428 -3.3730 -3.3730 -3.3403 -3.3273 -3.3071 -3.3071 -3.0145 -3.0145 -3.0144 -3.0124 -2.9948 -2.9948 -2.9217 -2.9113 -2.9113 -2.9079 -2.3319 -2.3319 -2.3231 -2.3211 -2.3159 -2.3159 4.4671 4.4671 4.5645 4.5645 4.5652 4.5677 4.8706 4.8706 4.8716 4.8742 5.9726 5.9726 k = 0.4362 0.4362 0.4362 ( 7049 PWs) bands (ev): -17.3466 -17.3466 -17.2972 -17.2972 -17.2946 -17.2946 -17.2942 -17.2942 -8.1787 -8.1787 -7.3601 -7.3601 -7.3415 -7.3414 -7.2742 -7.2742 -6.5157 -6.5155 -6.5145 -6.5145 -6.3451 -6.3451 -6.2402 -6.2402 -5.8876 -5.8827 -5.8817 -5.8817 -5.6156 -5.6101 -5.6101 -5.6085 -4.7544 -4.7491 -4.7281 -4.7281 -4.6646 -4.6646 -3.3518 -3.3518 -3.3286 -3.3169 -3.2939 -3.2939 -3.0099 -3.0099 -3.0086 -3.0068 -2.9928 -2.9928 -2.9160 -2.9070 -2.9070 -2.9034 -2.3447 -2.3447 -2.3380 -2.3361 -2.3299 -2.3299 4.4849 4.4849 4.5576 4.5576 4.5590 4.5612 4.8741 4.8741 4.8746 4.8769 5.9814 5.9814 k = 0.4468 0.4468 0.4468 ( 7058 PWs) bands (ev): -17.3468 -17.3468 -17.2966 -17.2966 -17.2948 -17.2948 -17.2944 -17.2944 -8.1853 -8.1853 -7.3540 -7.3540 -7.3414 -7.3413 -7.2715 -7.2715 -6.5156 -6.5154 -6.5148 -6.5148 -6.3429 -6.3429 -6.2352 -6.2352 -5.8875 -5.8834 -5.8829 -5.8829 -5.6136 -5.6092 -5.6092 -5.6075 -4.7609 -4.7563 -4.7393 -4.7393 -4.6819 -4.6819 -3.3335 -3.3335 -3.3184 -3.3084 -3.2822 -3.2822 -3.0054 -3.0054 -3.0028 -3.0013 -2.9911 -2.9911 -2.9108 -2.9032 -2.9032 -2.8997 -2.3563 -2.3563 -2.3516 -2.3499 -2.3427 -2.3427 4.5005 4.5005 4.5516 4.5516 4.5535 4.5554 4.8771 4.8771 4.8772 4.8792 5.9724 5.9724 k = 0.4574 0.4574 0.4574 ( 7064 PWs) bands (ev): -17.3470 -17.3470 -17.2961 -17.2961 -17.2949 -17.2949 -17.2945 -17.2945 -8.1908 -8.1908 -7.3491 -7.3491 -7.3414 -7.3413 -7.2690 -7.2690 -6.5156 -6.5154 -6.5150 -6.5150 -6.3411 -6.3411 -6.2308 -6.2308 -5.8874 -5.8840 -5.8840 -5.8840 -5.6118 -5.6084 -5.6084 -5.6068 -4.7661 -4.7624 -4.7503 -4.7503 -4.6948 -4.6948 -3.3185 -3.3185 -3.3098 -3.3016 -3.2721 -3.2721 -3.0012 -3.0012 -2.9975 -2.9961 -2.9896 -2.9896 -2.9060 -2.8999 -2.8999 -2.8967 -2.3664 -2.3664 -2.3635 -2.3619 -2.3537 -2.3537 4.5137 4.5137 4.5465 4.5465 4.5489 4.5504 4.8795 4.8795 4.8795 4.8811 5.9645 5.9645 k = 0.4681 0.4681 0.4681 ( 7070 PWs) bands (ev): -17.3472 -17.3472 -17.2957 -17.2957 -17.2949 -17.2949 -17.2946 -17.2946 -8.1951 -8.1951 -7.3456 -7.3456 -7.3413 -7.3412 -7.2668 -7.2668 -6.5155 -6.5154 -6.5152 -6.5152 -6.3398 -6.3398 -6.2270 -6.2270 -5.8872 -5.8850 -5.8850 -5.8847 -5.6102 -5.6078 -5.6078 -5.6064 -4.7702 -4.7673 -4.7602 -4.7602 -4.7039 -4.7039 -3.3068 -3.3068 -3.3029 -3.2966 -3.2638 -3.2638 -2.9978 -2.9978 -2.9929 -2.9918 -2.9883 -2.9883 -2.9019 -2.8974 -2.8974 -2.8945 -2.3746 -2.3746 -2.3731 -2.3719 -2.3627 -2.3627 4.5242 4.5242 4.5426 4.5426 4.5453 4.5464 4.8812 4.8815 4.8815 4.8825 5.9580 5.9580 k = 0.4787 0.4787 0.4787 ( 7088 PWs) bands (ev): -17.3473 -17.3473 -17.2955 -17.2955 -17.2949 -17.2949 -17.2947 -17.2947 -8.1982 -8.1982 -7.3431 -7.3431 -7.3413 -7.3412 -7.2650 -7.2650 -6.5155 -6.5154 -6.5153 -6.5153 -6.3388 -6.3388 -6.2242 -6.2242 -5.8870 -5.8857 -5.8857 -5.8852 -5.6089 -5.6074 -5.6074 -5.6063 -4.7729 -4.7710 -4.7679 -4.7679 -4.7098 -4.7098 -3.2986 -3.2986 -3.2977 -3.2934 -3.2575 -3.2575 -2.9952 -2.9952 -2.9893 -2.9885 -2.9871 -2.9871 -2.8984 -2.8955 -2.8955 -2.8933 -2.3808 -2.3808 -2.3803 -2.3794 -2.3694 -2.3694 4.5313 4.5313 4.5402 4.5402 4.5427 4.5435 4.8826 4.8828 4.8828 4.8834 5.9531 5.9531 k = 0.4894 0.4894 0.4894 ( 7088 PWs) bands (ev): -17.3473 -17.3473 -17.2955 -17.2955 -17.2948 -17.2948 -17.2948 -17.2948 -8.2001 -8.2001 -7.3417 -7.3417 -7.3412 -7.3412 -7.2639 -7.2639 -6.5155 -6.5154 -6.5154 -6.5154 -6.3383 -6.3383 -6.2225 -6.2225 -5.8866 -5.8861 -5.8861 -5.8858 -5.6078 -5.6071 -5.6071 -5.6065 -4.7744 -4.7734 -4.7729 -4.7729 -4.7132 -4.7132 -3.2941 -3.2938 -3.2938 -3.2920 -3.2535 -3.2535 -2.9937 -2.9937 -2.9870 -2.9865 -2.9863 -2.9863 -2.8957 -2.8943 -2.8943 -2.8931 -2.3846 -2.3846 -2.3846 -2.3841 -2.3735 -2.3735 4.5343 4.5343 4.5402 4.5402 4.5412 4.5416 4.8835 4.8836 4.8836 4.8839 5.9501 5.9501 k = 0.5000 0.5000 0.5000 ( 7088 PWs) bands (ev): -17.3474 -17.3474 -17.2955 -17.2955 -17.2948 -17.2948 -17.2948 -17.2948 -8.2007 -8.2007 -7.3412 -7.3412 -7.3412 -7.3412 -7.2636 -7.2636 -6.5154 -6.5154 -6.5154 -6.5154 -6.3381 -6.3381 -6.2219 -6.2219 -5.8862 -5.8862 -5.8862 -5.8862 -5.6070 -5.6070 -5.6070 -5.6070 -4.7746 -4.7746 -4.7746 -4.7746 -4.7143 -4.7143 -3.2922 -3.2922 -3.2922 -3.2922 -3.2522 -3.2522 -2.9932 -2.9932 -2.9860 -2.9860 -2.9860 -2.9860 -2.8939 -2.8939 -2.8939 -2.8939 -2.3859 -2.3859 -2.3859 -2.3859 -2.3749 -2.3749 4.5346 4.5346 4.5408 4.5408 4.5408 4.5408 4.8839 4.8839 4.8839 4.8839 5.9491 5.9491 k = 0.5000 0.5000 0.5000 ( 7088 PWs) bands (ev): -17.3474 -17.3474 -17.2955 -17.2955 -17.2948 -17.2948 -17.2948 -17.2948 -8.2007 -8.2007 -7.3412 -7.3412 -7.3412 -7.3412 -7.2636 -7.2636 -6.5154 -6.5154 -6.5154 -6.5154 -6.3381 -6.3381 -6.2219 -6.2219 -5.8862 -5.8862 -5.8862 -5.8862 -5.6070 -5.6070 -5.6070 -5.6070 -4.7746 -4.7746 -4.7746 -4.7746 -4.7143 -4.7143 -3.2922 -3.2922 -3.2922 -3.2922 -3.2522 -3.2522 -2.9932 -2.9932 -2.9860 -2.9860 -2.9860 -2.9860 -2.8939 -2.8939 -2.8939 -2.8939 -2.3859 -2.3859 -2.3859 -2.3859 -2.3749 -2.3749 4.5346 4.5346 4.5408 4.5408 4.5408 4.5408 4.8839 4.8839 4.8839 4.8839 5.9491 5.9491 k = 0.4868 0.5000 0.4868 ( 7088 PWs) bands (ev): -17.3473 -17.3473 -17.2955 -17.2955 -17.2948 -17.2948 -17.2948 -17.2948 -8.2001 -8.2001 -7.3417 -7.3417 -7.3412 -7.3412 -7.2640 -7.2640 -6.5155 -6.5154 -6.5154 -6.5154 -6.3383 -6.3383 -6.2225 -6.2225 -5.8866 -5.8862 -5.8860 -5.8858 -5.6078 -5.6073 -5.6070 -5.6065 -4.7743 -4.7734 -4.7730 -4.7727 -4.7132 -4.7131 -3.2944 -3.2938 -3.2936 -3.2920 -3.2536 -3.2536 -2.9937 -2.9937 -2.9870 -2.9866 -2.9863 -2.9862 -2.8957 -2.8946 -2.8940 -2.8931 -2.3850 -2.3847 -2.3843 -2.3839 -2.3735 -2.3734 4.5343 4.5343 4.5402 4.5402 4.5411 4.5415 4.8830 4.8833 4.8841 4.8843 5.9501 5.9501 k = 0.4737 0.5000 0.4737 ( 7088 PWs) bands (ev): -17.3473 -17.3473 -17.2955 -17.2955 -17.2949 -17.2949 -17.2947 -17.2947 -8.1982 -8.1982 -7.3432 -7.3432 -7.3412 -7.3412 -7.2651 -7.2650 -6.5156 -6.5155 -6.5153 -6.5152 -6.3389 -6.3388 -6.2244 -6.2242 -5.8869 -5.8859 -5.8855 -5.8852 -5.6089 -5.6077 -5.6071 -5.6063 -4.7728 -4.7709 -4.7680 -4.7678 -4.7099 -4.7096 -3.2997 -3.2983 -3.2973 -3.2936 -3.2576 -3.2574 -2.9954 -2.9953 -2.9895 -2.9887 -2.9871 -2.9868 -2.8986 -2.8959 -2.8952 -2.8931 -2.3821 -2.3814 -2.3799 -2.3782 -2.3696 -2.3683 4.5315 4.5321 4.5394 4.5398 4.5427 4.5436 4.8805 4.8810 4.8848 4.8853 5.9532 5.9532 k = 0.4605 0.5000 0.4605 ( 7072 PWs) bands (ev): -17.3471 -17.3471 -17.2957 -17.2957 -17.2950 -17.2950 -17.2946 -17.2946 -8.1950 -8.1950 -7.3458 -7.3457 -7.3412 -7.3411 -7.2669 -7.2668 -6.5157 -6.5156 -6.5151 -6.5149 -6.3400 -6.3396 -6.2275 -6.2268 -5.8872 -5.8853 -5.8848 -5.8845 -5.6102 -5.6083 -5.6074 -5.6064 -4.7698 -4.7671 -4.7601 -4.7599 -4.7042 -4.7033 -3.3083 -3.3065 -3.3029 -3.2973 -3.2639 -3.2633 -2.9983 -2.9980 -2.9930 -2.9920 -2.9880 -2.9877 -2.9026 -2.8977 -2.8976 -2.8936 -2.3776 -2.3760 -2.3735 -2.3699 -2.3625 -2.3590 4.5251 4.5262 4.5399 4.5407 4.5461 4.5472 4.8765 4.8772 4.8860 4.8868 5.9582 5.9582 k = 0.4474 0.5000 0.4474 ( 7056 PWs) bands (ev): -17.3470 -17.3470 -17.2960 -17.2960 -17.2951 -17.2950 -17.2945 -17.2945 -8.1906 -8.1906 -7.3496 -7.3493 -7.3412 -7.3411 -7.2693 -7.2689 -6.5159 -6.5157 -6.5148 -6.5145 -6.3417 -6.3407 -6.2318 -6.2302 -5.8873 -5.8844 -5.8841 -5.8836 -5.6118 -5.6090 -5.6080 -5.6067 -4.7656 -4.7619 -4.7506 -4.7491 -4.6958 -4.6936 -3.3201 -3.3181 -3.3112 -3.3039 -3.2717 -3.2703 -3.0027 -3.0023 -2.9967 -2.9961 -2.9890 -2.9886 -2.9076 -2.9012 -2.8998 -2.8946 -2.3719 -2.3690 -2.3653 -2.3608 -2.3508 -2.3457 4.5157 4.5172 4.5410 4.5419 4.5513 4.5526 4.8708 4.8717 4.8879 4.8890 5.9649 5.9649 k = 0.4342 0.5000 0.4342 ( 7056 PWs) bands (ev): -17.3468 -17.3468 -17.2965 -17.2964 -17.2951 -17.2950 -17.2943 -17.2943 -8.1850 -8.1850 -7.3547 -7.3543 -7.3412 -7.3410 -7.2720 -7.2714 -6.5163 -6.5159 -6.5145 -6.5139 -6.3440 -6.3420 -6.2372 -6.2340 -5.8874 -5.8834 -5.8833 -5.8825 -5.6137 -5.6098 -5.6088 -5.6074 -4.7601 -4.7554 -4.7402 -4.7366 -4.6840 -4.6799 -3.3350 -3.3328 -3.3230 -3.3144 -3.2800 -3.2774 -3.0087 -3.0085 -3.0001 -2.9998 -2.9901 -2.9895 -2.9136 -2.9060 -2.9022 -2.8961 -2.3652 -2.3606 -2.3554 -2.3511 -2.3350 -2.3291 4.5039 4.5058 4.5424 4.5433 4.5582 4.5596 4.8635 4.8646 4.8905 4.8918 5.9730 5.9732 k = 0.4211 0.5000 0.4211 ( 7064 PWs) bands (ev): -17.3466 -17.3466 -17.2971 -17.2970 -17.2951 -17.2949 -17.2940 -17.2940 -8.1782 -8.1781 -7.3613 -7.3606 -7.3411 -7.3410 -7.2750 -7.2740 -6.5167 -6.5161 -6.5142 -6.5132 -6.3468 -6.3436 -6.2434 -6.2381 -5.8874 -5.8827 -5.8820 -5.8813 -5.6158 -5.6108 -5.6098 -5.6083 -4.7534 -4.7477 -4.7294 -4.7232 -4.6682 -4.6617 -3.3527 -3.3504 -3.3385 -3.3291 -3.2883 -3.2842 -3.0162 -3.0161 -3.0036 -3.0022 -2.9913 -2.9906 -2.9204 -2.9119 -2.9048 -2.8979 -2.3577 -2.3515 -2.3439 -2.3403 -2.3163 -2.3101 4.4899 4.4922 4.5438 4.5448 4.5666 4.5681 4.8545 4.8559 4.8938 4.8954 5.9812 5.9825 k = 0.4079 0.5000 0.4079 ( 7066 PWs) bands (ev): -17.3464 -17.3464 -17.2978 -17.2976 -17.2951 -17.2949 -17.2937 -17.2937 -8.1702 -8.1702 -7.3694 -7.3684 -7.3411 -7.3409 -7.2780 -7.2766 -6.5173 -6.5163 -6.5139 -6.5123 -6.3503 -6.3453 -6.2504 -6.2423 -5.8874 -5.8819 -5.8806 -5.8800 -5.6181 -5.6119 -5.6110 -5.6094 -4.7456 -4.7389 -4.7186 -4.7096 -4.6480 -4.6393 -3.3732 -3.3704 -3.3575 -3.3479 -3.2963 -3.2907 -3.0248 -3.0246 -3.0064 -3.0037 -2.9926 -2.9918 -2.9280 -2.9187 -2.9076 -2.9000 -2.3497 -2.3420 -2.3311 -2.3282 -2.2955 -2.2892 4.4742 4.4768 4.5453 4.5463 4.5765 4.5781 4.8439 4.8454 4.8980 4.8997 5.9553 5.9564 k = 0.3947 0.5000 0.3947 ( 7058 PWs) bands (ev): -17.3461 -17.3461 -17.2986 -17.2984 -17.2950 -17.2948 -17.2933 -17.2933 -8.1611 -8.1611 -7.3791 -7.3777 -7.3410 -7.3408 -7.2810 -7.2790 -6.5179 -6.5165 -6.5135 -6.5113 -6.3543 -6.3472 -6.2579 -6.2462 -5.8872 -5.8811 -5.8790 -5.8787 -5.6205 -5.6130 -5.6124 -5.6107 -4.7368 -4.7290 -4.7074 -4.6960 -4.6236 -4.6129 -3.3962 -3.3924 -3.3794 -3.3700 -3.3044 -3.2975 -3.0342 -3.0337 -3.0082 -3.0044 -2.9940 -2.9931 -2.9363 -2.9264 -2.9105 -2.9023 -2.3414 -2.3326 -2.3171 -2.3148 -2.2733 -2.2670 4.4569 4.4599 4.5466 4.5476 4.5877 4.5895 4.8316 4.8332 4.9030 4.9050 5.9117 5.9124 k = 0.3816 0.5000 0.3816 ( 7062 PWs) bands (ev): -17.3459 -17.3459 -17.2994 -17.2992 -17.2950 -17.2947 -17.2929 -17.2929 -8.1510 -8.1510 -7.3904 -7.3886 -7.3409 -7.3407 -7.2837 -7.2812 -6.5187 -6.5167 -6.5131 -6.5100 -6.3588 -6.3492 -6.2658 -6.2499 -5.8871 -5.8803 -5.8774 -5.8774 -5.6231 -5.6142 -5.6140 -5.6122 -4.7270 -4.7182 -4.6957 -4.6820 -4.5955 -4.5834 -3.4214 -3.4161 -3.4033 -3.3950 -3.3126 -3.3046 -3.0440 -3.0434 -3.0090 -3.0041 -2.9956 -2.9945 -2.9452 -2.9348 -2.9135 -2.9049 -2.3330 -2.3233 -2.3022 -2.3004 -2.2501 -2.2441 4.4385 4.4418 4.5477 4.5487 4.6002 4.6020 4.8177 4.8193 4.9089 4.9112 5.8651 5.8659 k = 0.3684 0.5000 0.3684 ( 7062 PWs) bands (ev): -17.3457 -17.3457 -17.3003 -17.3001 -17.2948 -17.2946 -17.2925 -17.2925 -8.1399 -8.1398 -7.4031 -7.4010 -7.3408 -7.3406 -7.2862 -7.2832 -6.5196 -6.5170 -6.5128 -6.5086 -6.3636 -6.3514 -6.2738 -6.2533 -5.8869 -5.8794 -5.8761 -5.8757 -5.6257 -5.6157 -5.6155 -5.6140 -4.7164 -4.7067 -4.6833 -4.6675 -4.5644 -4.5511 -3.4485 -3.4410 -3.4287 -3.4223 -3.3212 -3.3124 -3.0542 -3.0532 -3.0088 -3.0031 -2.9973 -2.9960 -2.9547 -2.9438 -2.9167 -2.9076 -2.3249 -2.3145 -2.2866 -2.2852 -2.2266 -2.2207 4.4192 4.4227 4.5485 4.5495 4.6139 4.6156 4.8023 4.8038 4.9157 4.9182 5.8168 5.8176 k = 0.3553 0.5000 0.3553 ( 7066 PWs) bands (ev): -17.3455 -17.3455 -17.3013 -17.3011 -17.2947 -17.2944 -17.2920 -17.2920 -8.1279 -8.1277 -7.4172 -7.4148 -7.3407 -7.3404 -7.2885 -7.2849 -6.5207 -6.5173 -6.5124 -6.5069 -6.3686 -6.3537 -6.2819 -6.2562 -5.8866 -5.8786 -5.8749 -5.8741 -5.6284 -5.6174 -5.6169 -5.6159 -4.7051 -4.6946 -4.6699 -4.6523 -4.5310 -4.5166 -3.4773 -3.4668 -3.4549 -3.4512 -3.3303 -3.3208 -3.0644 -3.0631 -3.0079 -3.0020 -2.9986 -2.9977 -2.9645 -2.9533 -2.9199 -2.9104 -2.3172 -2.3063 -2.2705 -2.2695 -2.2030 -2.1974 4.3992 4.4032 4.5488 4.5497 4.6284 4.6299 4.7856 4.7868 4.9234 4.9262 5.7674 5.7684 k = 0.3421 0.5000 0.3421 ( 7076 PWs) bands (ev): -17.3454 -17.3453 -17.3024 -17.3021 -17.2945 -17.2942 -17.2915 -17.2914 -8.1149 -8.1147 -7.4324 -7.4298 -7.3406 -7.3402 -7.2906 -7.2864 -6.5219 -6.5176 -6.5120 -6.5050 -6.3736 -6.3562 -6.2898 -6.2588 -5.8863 -5.8778 -5.8738 -5.8725 -5.6310 -5.6193 -5.6183 -5.6179 -4.6931 -4.6820 -4.6556 -4.6363 -4.4958 -4.4805 -3.5074 -3.4936 -3.4817 -3.4811 -3.3398 -3.3299 -3.0747 -3.0729 -3.0066 -3.0033 -2.9995 -2.9972 -2.9743 -2.9631 -2.9233 -2.9134 -2.3102 -2.2988 -2.2541 -2.2534 -2.1797 -2.1745 4.3790 4.3833 4.5486 4.5495 4.6434 4.6444 4.7682 4.7687 4.9317 4.9348 5.7179 5.7190 k = 0.3289 0.5000 0.3289 ( 7072 PWs) bands (ev): -17.3453 -17.3452 -17.3034 -17.3032 -17.2942 -17.2940 -17.2909 -17.2909 -8.1012 -8.1010 -7.4487 -7.4458 -7.3405 -7.3400 -7.2924 -7.2878 -6.5232 -6.5179 -6.5116 -6.5029 -6.3786 -6.3587 -6.2976 -6.2610 -5.8860 -5.8771 -5.8728 -5.8710 -5.6337 -5.6212 -5.6201 -5.6198 -4.6806 -4.6691 -4.6401 -4.6194 -4.4593 -4.4431 -3.5383 -3.5216 -3.5108 -3.5085 -3.3496 -3.3395 -3.0848 -3.0824 -3.0064 -3.0056 -3.0019 -2.9941 -2.9832 -2.9728 -2.9268 -2.9164 -2.3039 -2.2921 -2.2376 -2.2372 -2.1569 -2.1521 4.3588 4.3633 4.5478 4.5486 4.6576 4.6577 4.7505 4.7514 4.9406 4.9439 5.6688 5.6701 k = 0.3158 0.5000 0.3158 ( 7080 PWs) bands (ev): -17.3452 -17.3452 -17.3046 -17.3043 -17.2939 -17.2936 -17.2903 -17.2903 -8.0868 -8.0865 -7.4658 -7.4627 -7.3403 -7.3398 -7.2941 -7.2890 -6.5246 -6.5182 -6.5112 -6.5005 -6.3833 -6.3614 -6.3050 -6.2629 -5.8856 -5.8763 -5.8719 -5.8696 -5.6363 -5.6231 -5.6224 -5.6213 -4.6677 -4.6560 -4.6238 -4.6016 -4.4220 -4.4049 -3.5695 -3.5512 -3.5391 -3.5351 -3.3599 -3.3497 -3.0947 -3.0916 -3.0107 -3.0075 -3.0053 -2.9905 -2.9882 -2.9819 -2.9304 -2.9195 -2.2984 -2.2863 -2.2210 -2.2209 -2.1350 -2.1306 4.3388 4.3436 4.5464 4.5472 4.6659 4.6684 4.7354 4.7389 4.9495 4.9531 5.6211 5.6226 k = 0.3026 0.5000 0.3026 ( 7088 PWs) bands (ev): -17.3453 -17.3452 -17.3057 -17.3054 -17.2935 -17.2932 -17.2897 -17.2897 -8.0718 -8.0714 -7.4837 -7.4804 -7.3402 -7.3396 -7.2957 -7.2901 -6.5262 -6.5185 -6.5108 -6.4980 -6.3876 -6.3642 -6.3119 -6.2645 -5.8853 -5.8757 -5.8711 -5.8683 -5.6388 -5.6252 -5.6246 -5.6229 -4.6544 -4.6426 -4.6065 -4.5831 -4.3846 -4.3666 -3.6006 -3.5818 -3.5657 -3.5613 -3.3704 -3.3603 -3.1043 -3.1005 -3.0168 -3.0164 -3.0067 -2.9904 -2.9879 -2.9860 -2.9342 -2.9226 -2.2939 -2.2816 -2.2047 -2.2046 -2.1142 -2.1102 4.3193 4.3244 4.5444 4.5450 4.6627 4.6678 4.7310 4.7373 4.9578 4.9618 5.5757 5.5773 k = 0.2895 0.5000 0.2895 ( 7088 PWs) bands (ev): -17.3454 -17.3453 -17.3068 -17.3065 -17.2930 -17.2927 -17.2891 -17.2891 -8.0562 -8.0557 -7.5020 -7.4985 -7.3400 -7.3393 -7.2972 -7.2911 -6.5277 -6.5188 -6.5104 -6.4952 -6.3916 -6.3671 -6.3184 -6.2660 -5.8849 -5.8750 -5.8704 -5.8671 -5.6412 -5.6274 -5.6267 -5.6245 -4.6408 -4.6292 -4.5886 -4.5639 -4.3475 -4.3286 -3.6309 -3.6122 -3.5912 -3.5868 -3.3811 -3.3712 -3.1136 -3.1090 -3.0276 -3.0250 -3.0086 -2.9963 -2.9851 -2.9822 -2.9381 -2.9256 -2.2904 -2.2778 -2.1886 -2.1883 -2.0946 -2.0909 4.3005 4.3059 4.5417 4.5422 4.6471 4.6527 4.7406 4.7476 4.9649 4.9692 5.5336 5.5354 k = 0.2763 0.5000 0.2763 ( 7084 PWs) bands (ev): -17.3456 -17.3455 -17.3080 -17.3077 -17.2925 -17.2922 -17.2885 -17.2885 -8.0402 -8.0396 -7.5207 -7.5171 -7.3397 -7.3390 -7.2985 -7.2920 -6.5294 -6.5191 -6.5099 -6.4923 -6.3951 -6.3700 -6.3243 -6.2672 -5.8845 -5.8745 -5.8698 -5.8660 -5.6434 -5.6298 -5.6286 -5.6261 -4.6271 -4.6156 -4.5702 -4.5441 -4.3114 -4.2915 -3.6598 -3.6415 -3.6155 -3.6113 -3.3918 -3.3823 -3.1226 -3.1171 -3.0397 -3.0351 -3.0107 -3.0010 -2.9812 -2.9783 -2.9421 -2.9285 -2.2878 -2.2750 -2.1729 -2.1724 -2.0763 -2.0730 4.2826 4.2882 4.5384 4.5388 4.6249 4.6301 4.7573 4.7642 4.9697 4.9743 5.4961 5.4979 k = 0.2632 0.5000 0.2632 ( 7080 PWs) bands (ev): -17.3458 -17.3458 -17.3091 -17.3088 -17.2919 -17.2916 -17.2878 -17.2878 -8.0239 -8.0232 -7.5395 -7.5357 -7.3395 -7.3386 -7.2998 -7.2929 -6.5310 -6.5194 -6.5095 -6.4892 -6.3981 -6.3731 -6.3297 -6.2684 -5.8841 -5.8740 -5.8694 -5.8651 -5.6455 -5.6322 -5.6303 -5.6278 -4.6133 -4.6021 -4.5515 -4.5240 -4.2772 -4.2561 -3.6866 -3.6686 -3.6386 -3.6347 -3.4025 -3.3935 -3.1312 -3.1249 -3.0522 -3.0464 -3.0128 -3.0046 -2.9769 -2.9748 -2.9463 -2.9312 -2.2862 -2.2731 -2.1575 -2.1568 -2.0596 -2.0566 4.2657 4.2716 4.5344 4.5348 4.5996 4.6043 4.7769 4.7836 4.9709 4.9759 5.4644 5.4664 k = 0.2500 0.5000 0.2500 ( 7072 PWs) bands (ev): -17.3462 -17.3461 -17.3102 -17.3099 -17.2912 -17.2909 -17.2872 -17.2872 -8.0075 -8.0066 -7.5584 -7.5544 -7.3392 -7.3382 -7.3011 -7.2938 -6.5325 -6.5197 -6.5091 -6.4861 -6.4007 -6.3761 -6.3345 -6.2694 -5.8837 -5.8736 -5.8691 -5.8644 -5.6474 -5.6346 -5.6320 -5.6294 -4.5995 -4.5886 -4.5328 -4.5038 -4.2457 -4.2234 -3.7104 -3.6927 -3.6604 -3.6566 -3.4131 -3.4046 -3.1395 -3.1324 -3.0649 -3.0584 -3.0151 -3.0078 -2.9725 -2.9720 -2.9507 -2.9334 -2.2854 -2.2722 -2.1426 -2.1417 -2.0444 -2.0418 4.2501 4.2562 4.5297 4.5303 4.5730 4.5770 4.7978 4.8044 4.9672 4.9725 5.4401 5.4422 k = 0.2368 0.5000 0.2368 ( 7076 PWs) bands (ev): -17.3466 -17.3465 -17.3113 -17.3110 -17.2905 -17.2902 -17.2865 -17.2865 -7.9909 -7.9899 -7.5771 -7.5730 -7.3389 -7.3378 -7.3024 -7.2947 -6.5340 -6.5200 -6.5086 -6.4828 -6.4027 -6.3792 -6.3387 -6.2704 -5.8833 -5.8733 -5.8689 -5.8638 -5.6491 -5.6370 -5.6336 -5.6310 -4.5858 -4.5752 -4.5144 -4.4838 -4.2180 -4.1942 -3.7302 -3.7126 -3.6807 -3.6768 -3.4234 -3.4155 -3.1474 -3.1396 -3.0777 -3.0708 -3.0173 -3.0106 -2.9704 -2.9682 -2.9553 -2.9349 -2.2854 -2.2720 -2.1282 -2.1272 -2.0309 -2.0286 4.2358 4.2421 4.5237 4.5251 4.5463 4.5491 4.8194 4.8260 4.9577 4.9633 5.4242 5.4264 k = 0.2237 0.5000 0.2237 ( 7078 PWs) bands (ev): -17.3471 -17.3470 -17.3124 -17.3120 -17.2897 -17.2895 -17.2859 -17.2859 -7.9745 -7.9732 -7.5956 -7.5912 -7.3385 -7.3373 -7.3036 -7.2956 -6.5353 -6.5204 -6.5081 -6.4797 -6.4044 -6.3821 -6.3423 -6.2714 -5.8829 -5.8730 -5.8688 -5.8634 -5.6506 -5.6393 -5.6351 -5.6326 -4.5722 -4.5620 -4.4966 -4.4641 -4.1951 -4.1698 -3.7453 -3.7274 -3.6992 -3.6947 -3.4334 -3.4261 -3.1550 -3.1465 -3.0905 -3.0834 -3.0196 -3.0132 -2.9701 -2.9642 -2.9599 -2.9356 -2.2861 -2.2726 -2.1143 -2.1132 -2.0190 -2.0170 4.2231 4.2295 4.5108 4.5163 4.5241 4.5259 4.8413 4.8478 4.9420 4.9478 5.4169 5.4192 k = 0.2105 0.5000 0.2105 ( 7078 PWs) bands (ev): -17.3477 -17.3476 -17.3134 -17.3131 -17.2889 -17.2887 -17.2853 -17.2852 -7.9582 -7.9567 -7.6135 -7.6089 -7.3381 -7.3367 -7.3048 -7.2965 -6.5365 -6.5207 -6.5076 -6.4767 -6.4056 -6.3848 -6.3453 -6.2724 -5.8825 -5.8729 -5.8689 -5.8631 -5.6519 -5.6415 -5.6365 -5.6342 -4.5589 -4.5490 -4.4797 -4.4453 -4.1780 -4.1510 -3.7552 -3.7367 -3.7150 -3.7096 -3.4430 -3.4362 -3.1623 -3.1531 -3.1032 -3.0960 -3.0218 -3.0157 -2.9712 -2.9650 -2.9603 -2.9354 -2.2872 -2.2737 -2.1011 -2.0999 -2.0088 -2.0071 4.2119 4.2185 4.4857 4.4908 4.5155 4.5174 4.8634 4.8696 4.9207 4.9264 5.4180 5.4204 k = 0.1974 0.5000 0.1974 ( 7072 PWs) bands (ev): -17.3483 -17.3482 -17.3144 -17.3140 -17.2881 -17.2878 -17.2846 -17.2846 -7.9423 -7.9405 -7.6309 -7.6260 -7.3377 -7.3361 -7.3060 -7.2975 -6.5375 -6.5211 -6.5071 -6.4739 -6.4065 -6.3873 -6.3478 -6.2734 -5.8821 -5.8728 -5.8690 -5.8631 -5.6530 -5.6436 -5.6378 -5.6358 -4.5460 -4.5364 -4.4641 -4.4277 -4.1670 -4.1385 -3.7611 -3.7426 -3.7254 -3.7194 -3.4521 -3.4459 -3.1691 -3.1596 -3.1156 -3.1085 -3.0240 -3.0180 -2.9736 -2.9701 -2.9571 -2.9348 -2.2887 -2.2752 -2.0885 -2.0872 -2.0003 -1.9989 4.2023 4.2090 4.4585 4.4630 4.5093 4.5110 4.8853 4.8867 4.8991 4.9002 5.4263 5.4289 k = 0.1842 0.5000 0.1842 ( 7068 PWs) bands (ev): -17.3489 -17.3488 -17.3153 -17.3150 -17.2872 -17.2870 -17.2840 -17.2840 -7.9269 -7.9248 -7.6474 -7.6423 -7.3373 -7.3354 -7.3072 -7.2985 -6.5383 -6.5215 -6.5065 -6.4714 -6.4071 -6.3894 -6.3497 -6.2745 -5.8817 -5.8728 -5.8692 -5.8631 -5.6538 -5.6456 -5.6390 -5.6374 -4.5334 -4.5243 -4.4501 -4.4117 -4.1618 -4.1319 -3.7661 -3.7512 -3.7243 -3.7211 -3.4607 -3.4551 -3.1757 -3.1658 -3.1278 -3.1209 -3.0261 -3.0203 -2.9770 -2.9754 -2.9544 -2.9341 -2.2905 -2.2770 -2.0766 -2.0752 -1.9935 -1.9922 4.1945 4.2013 4.4315 4.4356 4.5032 4.5050 4.8627 4.8703 4.9071 4.9147 5.4404 5.4431 k = 0.1711 0.5000 0.1711 ( 7086 PWs) bands (ev): -17.3496 -17.3495 -17.3162 -17.3159 -17.2864 -17.2861 -17.2834 -17.2834 -7.9122 -7.9097 -7.6631 -7.6577 -7.3368 -7.3347 -7.3085 -7.2995 -6.5389 -6.5219 -6.5059 -6.4694 -6.4074 -6.3911 -6.3510 -6.2758 -5.8814 -5.8729 -5.8695 -5.8634 -5.6545 -5.6474 -5.6402 -5.6389 -4.5214 -4.5126 -4.4383 -4.3980 -4.1614 -4.1302 -3.7723 -3.7612 -3.7138 -3.7134 -3.4686 -3.4636 -3.1819 -3.1718 -3.1396 -3.1330 -3.0281 -3.0225 -2.9811 -2.9808 -2.9522 -2.9336 -2.2923 -2.2790 -2.0654 -2.0640 -1.9882 -1.9871 4.1884 4.1952 4.4053 4.4090 4.4970 4.4989 4.8308 4.8382 4.9282 4.9354 5.4591 5.4619 k = 0.1579 0.5000 0.1579 ( 7078 PWs) bands (ev): -17.3503 -17.3502 -17.3170 -17.3167 -17.2855 -17.2853 -17.2829 -17.2829 -7.8983 -7.8954 -7.6777 -7.6720 -7.3362 -7.3339 -7.3097 -7.3006 -6.5392 -6.5223 -6.5052 -6.4680 -6.4074 -6.3924 -6.3517 -6.2772 -5.8810 -5.8731 -5.8698 -5.8638 -5.6550 -5.6490 -5.6412 -5.6404 -4.5100 -4.5016 -4.4287 -4.3870 -4.1640 -4.1320 -3.7789 -3.7700 -3.6985 -3.6977 -3.4758 -3.4714 -3.1876 -3.1776 -3.1510 -3.1446 -3.0300 -3.0245 -2.9864 -2.9857 -2.9507 -2.9334 -2.2939 -2.2809 -2.0550 -2.0535 -1.9843 -1.9834 4.1841 4.1909 4.3801 4.3836 4.4906 4.4927 4.7974 4.8049 4.9487 4.9557 5.4811 5.4839 k = 0.1447 0.5000 0.1447 ( 7074 PWs) bands (ev): -17.3510 -17.3509 -17.3177 -17.3175 -17.2847 -17.2845 -17.2824 -17.2823 -7.8855 -7.8821 -7.6911 -7.6850 -7.3356 -7.3330 -7.3109 -7.3018 -6.5393 -6.5227 -6.5043 -6.4673 -6.4072 -6.3932 -6.3518 -6.2787 -5.8806 -5.8733 -5.8703 -5.8642 -5.6553 -5.6505 -5.6422 -5.6418 -4.4992 -4.4913 -4.4217 -4.3793 -4.1681 -4.1358 -3.7846 -3.7769 -3.6792 -3.6781 -3.4824 -3.4785 -3.1930 -3.1832 -3.1618 -3.1558 -3.0318 -3.0265 -2.9922 -2.9908 -2.9498 -2.9338 -2.2954 -2.2828 -2.0453 -2.0439 -1.9818 -1.9811 4.1815 4.1883 4.3563 4.3595 4.4843 4.4866 4.7638 4.7714 4.9683 4.9750 5.5053 5.5082 k = 0.1316 0.5000 0.1316 ( 7058 PWs) bands (ev): -17.3517 -17.3516 -17.3184 -17.3182 -17.2838 -17.2837 -17.2819 -17.2818 -7.8738 -7.8700 -7.7030 -7.6966 -7.3349 -7.3320 -7.3122 -7.3030 -6.5392 -6.5231 -6.5035 -6.4672 -6.4068 -6.3937 -6.3511 -6.2805 -5.8802 -5.8735 -5.8707 -5.8648 -5.6554 -5.6517 -5.6432 -5.6431 -4.4892 -4.4818 -4.4172 -4.3752 -4.1721 -4.1403 -3.7887 -3.7818 -3.6576 -3.6566 -3.4883 -3.4849 -3.1980 -3.1886 -3.1719 -3.1665 -3.0335 -3.0283 -2.9980 -2.9961 -2.9495 -2.9348 -2.2964 -2.2844 -2.0364 -2.0350 -1.9806 -1.9799 4.1807 4.1874 4.3339 4.3369 4.4778 4.4803 4.7306 4.7383 4.9869 4.9933 5.5308 5.5338 k = 0.1184 0.5000 0.1184 ( 7062 PWs) bands (ev): -17.3523 -17.3523 -17.3191 -17.3189 -17.2831 -17.2829 -17.2814 -17.2814 -7.8636 -7.8594 -7.7134 -7.7067 -7.3342 -7.3309 -7.3135 -7.3043 -6.5388 -6.5237 -6.5025 -6.4677 -6.4063 -6.3939 -6.3497 -6.2825 -5.8799 -5.8737 -5.8711 -5.8655 -5.6553 -5.6528 -5.6446 -5.6439 -4.4802 -4.4732 -4.4151 -4.3746 -4.1751 -4.1448 -3.7911 -3.7848 -3.6352 -3.6344 -3.4935 -3.4906 -3.2025 -3.1937 -3.1813 -3.1765 -3.0350 -3.0301 -3.0039 -3.0017 -2.9497 -2.9363 -2.2971 -2.2857 -2.0283 -2.0270 -1.9803 -1.9798 4.1815 4.1880 4.3132 4.3159 4.4713 4.4740 4.6986 4.7064 5.0042 5.0103 5.5570 5.5599 k = 0.1053 0.5000 0.1053 ( 7056 PWs) bands (ev): -17.3529 -17.3529 -17.3196 -17.3194 -17.2824 -17.2822 -17.2810 -17.2810 -7.8550 -7.8504 -7.7219 -7.7151 -7.3334 -7.3298 -7.3147 -7.3056 -6.5383 -6.5242 -6.5014 -6.4688 -6.4057 -6.3941 -6.3475 -6.2847 -5.8795 -5.8739 -5.8716 -5.8663 -5.6551 -5.6537 -5.6459 -5.6447 -4.4720 -4.4657 -4.4148 -4.3770 -4.1767 -4.1488 -3.7917 -3.7860 -3.6130 -3.6125 -3.4979 -3.4955 -3.2066 -3.1987 -3.1898 -3.1859 -3.0364 -3.0316 -3.0096 -3.0073 -2.9504 -2.9383 -2.2973 -2.2867 -2.0211 -2.0197 -1.9810 -1.9806 4.1838 4.1901 4.2943 4.2968 4.4647 4.4675 4.6684 4.6762 5.0202 5.0259 5.5830 5.5859 k = 0.0921 0.5000 0.0921 ( 7060 PWs) bands (ev): -17.3535 -17.3535 -17.3202 -17.3200 -17.2817 -17.2816 -17.2806 -17.2806 -7.8480 -7.8432 -7.7286 -7.7218 -7.3325 -7.3285 -7.3160 -7.3070 -6.5375 -6.5248 -6.5001 -6.4704 -6.4049 -6.3943 -6.3446 -6.2872 -5.8791 -5.8740 -5.8721 -5.8671 -5.6548 -5.6543 -5.6472 -5.6455 -4.4650 -4.4594 -4.4157 -4.3817 -4.1771 -4.1522 -3.7908 -3.7857 -3.5919 -3.5916 -3.5018 -3.4997 -3.2102 -3.2037 -3.1972 -3.1944 -3.0376 -3.0331 -3.0152 -3.0130 -2.9514 -2.9408 -2.2970 -2.2874 -2.0146 -2.0134 -1.9823 -1.9820 4.1874 4.1934 4.2774 4.2796 4.4580 4.4609 4.6406 4.6482 5.0347 5.0399 5.6083 5.6111 k = 0.0789 0.5000 0.0789 ( 7060 PWs) bands (ev): -17.3540 -17.3540 -17.3206 -17.3204 -17.2811 -17.2810 -17.2803 -17.2802 -7.8427 -7.8380 -7.7332 -7.7267 -7.3316 -7.3272 -7.3173 -7.3085 -6.5367 -6.5254 -6.4987 -6.4724 -6.4041 -6.3946 -6.3411 -6.2901 -5.8787 -5.8742 -5.8726 -5.8680 -5.6548 -5.6544 -5.6484 -5.6463 -4.4591 -4.4547 -4.4170 -4.3877 -4.1765 -4.1551 -3.7888 -3.7843 -3.5726 -3.5724 -3.5049 -3.5032 -3.2132 -3.2087 -3.2032 -3.2020 -3.0386 -3.0344 -3.0205 -3.0185 -2.9526 -2.9434 -2.2963 -2.2878 -2.0091 -2.0079 -1.9840 -1.9838 4.1922 4.1978 4.2625 4.2645 4.4511 4.4540 4.6157 4.6230 5.0475 5.0522 5.6322 5.6349 k = 0.0658 0.5000 0.0658 ( 7058 PWs) bands (ev): -17.3545 -17.3544 -17.3210 -17.3208 -17.2806 -17.2805 -17.2800 -17.2800 -7.8389 -7.8346 -7.7361 -7.7302 -7.3307 -7.3259 -7.3186 -7.3100 -6.5357 -6.5261 -6.4972 -6.4746 -6.4032 -6.3950 -6.3370 -6.2933 -5.8783 -5.8742 -5.8731 -5.8688 -5.6551 -5.6539 -5.6495 -5.6470 -4.4546 -4.4515 -4.4179 -4.3940 -4.1753 -4.1576 -3.7859 -3.7821 -3.5554 -3.5554 -3.5075 -3.5061 -3.2158 -3.2136 -3.2086 -3.2078 -3.0395 -3.0356 -3.0253 -3.0237 -2.9539 -2.9462 -2.2953 -2.2880 -2.0044 -2.0033 -1.9860 -1.9859 4.1977 4.2029 4.2498 4.2515 4.4441 4.4467 4.5943 4.6010 5.0586 5.0627 5.6540 5.6566 k = 0.0526 0.5000 0.0526 ( 7058 PWs) bands (ev): -17.3549 -17.3548 -17.3213 -17.3212 -17.2802 -17.2801 -17.2797 -17.2797 -7.8364 -7.8327 -7.7374 -7.7324 -7.3296 -7.3244 -7.3199 -7.3115 -6.5347 -6.5268 -6.4955 -6.4770 -6.4023 -6.3955 -6.3326 -6.2967 -5.8779 -5.8743 -5.8735 -5.8697 -5.6552 -5.6534 -5.6506 -5.6478 -4.4514 -4.4500 -4.4179 -4.3998 -4.1738 -4.1597 -3.7827 -3.7796 -3.5410 -3.5409 -3.5094 -3.5082 -3.2181 -3.2179 -3.2141 -3.2114 -3.0402 -3.0366 -3.0295 -3.0284 -2.9550 -2.9488 -2.2941 -2.2881 -2.0006 -1.9995 -1.9879 -1.9878 4.2037 4.2083 4.2392 4.2408 4.4371 4.4394 4.5768 4.5826 5.0679 5.0713 5.6731 5.6756 k = 0.0395 0.5000 0.0395 ( 7054 PWs) bands (ev): -17.3552 -17.3551 -17.3215 -17.3214 -17.2799 -17.2798 -17.2795 -17.2795 -7.8349 -7.8320 -7.7376 -7.7337 -7.3286 -7.3230 -7.3211 -7.3131 -6.5336 -6.5276 -6.4936 -6.4795 -6.4014 -6.3962 -6.3279 -6.3005 -5.8774 -5.8746 -5.8736 -5.8705 -5.6552 -5.6528 -5.6516 -5.6485 -4.4497 -4.4497 -4.4172 -4.4047 -4.1721 -4.1617 -3.7796 -3.7772 -3.5296 -3.5295 -3.5105 -3.5097 -3.2217 -3.2199 -3.2180 -3.2143 -3.0407 -3.0373 -3.0328 -3.0325 -2.9559 -2.9513 -2.2928 -2.2882 -1.9978 -1.9968 -1.9896 -1.9894 4.2094 4.2134 4.2310 4.2325 4.4307 4.4325 4.5635 4.5680 5.0754 5.0779 5.6886 5.6912 k = 0.0263 0.5000 0.0263 ( 7040 PWs) bands (ev): -17.3554 -17.3554 -17.3217 -17.3216 -17.2796 -17.2796 -17.2794 -17.2793 -7.8339 -7.8320 -7.7372 -7.7345 -7.3274 -7.3227 -7.3211 -7.3147 -6.5325 -6.5285 -6.4915 -6.4820 -6.4004 -6.3969 -6.3231 -6.3046 -5.8769 -5.8750 -5.8734 -5.8712 -5.6549 -5.6526 -5.6519 -5.6492 -4.4498 -4.4491 -4.4159 -4.4083 -4.1704 -4.1635 -3.7770 -3.7753 -3.5218 -3.5217 -3.5108 -3.5102 -3.2242 -3.2227 -3.2194 -3.2166 -3.0409 -3.0379 -3.0357 -3.0353 -2.9564 -2.9533 -2.2915 -2.2884 -1.9960 -1.9951 -1.9907 -1.9903 4.2143 4.2175 4.2252 4.2266 4.4253 4.4265 4.5543 4.5575 5.0808 5.0826 5.6998 5.7026 k = 0.0132 0.5000 0.0132 ( 7032 PWs) bands (ev): -17.3555 -17.3555 -17.3217 -17.3217 -17.2795 -17.2795 -17.2792 -17.2792 -7.8333 -7.8323 -7.7365 -7.7351 -7.3263 -7.3239 -7.3196 -7.3164 -6.5314 -6.5294 -6.4893 -6.4845 -6.3995 -6.3977 -6.3183 -6.3090 -5.8765 -5.8755 -5.8730 -5.8719 -5.6545 -5.6533 -5.6513 -5.6499 -4.4499 -4.4493 -4.4145 -4.4109 -4.1687 -4.1652 -3.7751 -3.7742 -3.5180 -3.5180 -3.5099 -3.5097 -3.2256 -3.2248 -3.2196 -3.2182 -3.0407 -3.0386 -3.0376 -3.0368 -2.9565 -2.9549 -2.2904 -2.2889 -1.9952 -1.9947 -1.9909 -1.9907 4.2175 4.2197 4.2221 4.2234 4.4217 4.4223 4.5493 4.5509 5.0843 5.0852 5.7068 5.7089 k = 0.0000 0.5000-0.0000 ( 7032 PWs) bands (ev): -17.3555 -17.3555 -17.3218 -17.3218 -17.2795 -17.2795 -17.2792 -17.2792 -7.8328 -7.8328 -7.7358 -7.7358 -7.3251 -7.3251 -7.3180 -7.3180 -6.5304 -6.5304 -6.4870 -6.4870 -6.3986 -6.3986 -6.3135 -6.3135 -5.8760 -5.8760 -5.8725 -5.8725 -5.6539 -5.6539 -5.6506 -5.6506 -4.4497 -4.4497 -4.4128 -4.4128 -4.1670 -4.1670 -3.7741 -3.7741 -3.5171 -3.5171 -3.5092 -3.5092 -3.2258 -3.2258 -3.2192 -3.2192 -3.0399 -3.0399 -3.0376 -3.0376 -2.9560 -2.9560 -2.2895 -2.2895 -1.9949 -1.9949 -1.9907 -1.9907 4.2189 4.2189 4.2223 4.2223 4.4206 4.4206 4.5482 4.5482 5.0858 5.0858 5.7100 5.7100 k = 0.5000 0.5000-0.0000 ( 7120 PWs) bands (ev): -17.3389 -17.3389 -17.3051 -17.3051 -17.2955 -17.2955 -17.2953 -17.2953 -7.8398 -7.8398 -7.7470 -7.7470 -7.3218 -7.3218 -7.3147 -7.3147 -6.5370 -6.5370 -6.4881 -6.4881 -6.4060 -6.4060 -6.3230 -6.3230 -5.8703 -5.8703 -5.8547 -5.8547 -5.6523 -5.6523 -5.6297 -5.6297 -4.4325 -4.4325 -4.3958 -4.3958 -4.0423 -4.0423 -3.9112 -3.9112 -3.9049 -3.9049 -3.5669 -3.5669 -3.0541 -3.0541 -3.0530 -3.0530 -3.0227 -3.0227 -2.9430 -2.9430 -2.9339 -2.9339 -2.4144 -2.4144 -1.9812 -1.9812 -1.9765 -1.9765 4.4081 4.4081 4.4737 4.4737 4.6249 4.6249 4.6258 4.6258 5.2323 5.2323 5.4502 5.4502 k = 0.5000 0.5000 0.0185 ( 7092 PWs) bands (ev): -17.3390 -17.3390 -17.3050 -17.3050 -17.2955 -17.2955 -17.2953 -17.2953 -7.8462 -7.8462 -7.7403 -7.7403 -7.3221 -7.3221 -7.3144 -7.3144 -6.5369 -6.5369 -6.4881 -6.4881 -6.4057 -6.4057 -6.3228 -6.3228 -5.8703 -5.8703 -5.8548 -5.8548 -5.6521 -5.6521 -5.6296 -5.6296 -4.4347 -4.4347 -4.3981 -4.3981 -4.0466 -4.0466 -3.9081 -3.9081 -3.9020 -3.9020 -3.5633 -3.5633 -3.0541 -3.0541 -3.0528 -3.0528 -3.0228 -3.0228 -2.9438 -2.9438 -2.9331 -2.9331 -2.4143 -2.4143 -1.9822 -1.9822 -1.9775 -1.9775 4.4075 4.4075 4.4759 4.4759 4.6244 4.6244 4.6255 4.6255 5.2301 5.2301 5.4522 5.4522 k = 0.5000 0.5000 0.0370 ( 7068 PWs) bands (ev): -17.3391 -17.3391 -17.3049 -17.3049 -17.2955 -17.2955 -17.2953 -17.2953 -7.8618 -7.8618 -7.7239 -7.7239 -7.3228 -7.3228 -7.3135 -7.3135 -6.5366 -6.5366 -6.4885 -6.4885 -6.4049 -6.4049 -6.3222 -6.3222 -5.8705 -5.8705 -5.8551 -5.8551 -5.6517 -5.6517 -5.6292 -5.6292 -4.4410 -4.4410 -4.4048 -4.4048 -4.0593 -4.0593 -3.8990 -3.8990 -3.8933 -3.8933 -3.5533 -3.5533 -3.0542 -3.0542 -3.0524 -3.0524 -3.0229 -3.0229 -2.9456 -2.9456 -2.9312 -2.9312 -2.4138 -2.4138 -1.9852 -1.9852 -1.9805 -1.9805 4.4060 4.4060 4.4822 4.4822 4.6229 4.6229 4.6243 4.6243 5.2238 5.2238 5.4581 5.4581 k = 0.5000 0.5000 0.0556 ( 7092 PWs) bands (ev): -17.3392 -17.3392 -17.3047 -17.3047 -17.2955 -17.2955 -17.2953 -17.2953 -7.8815 -7.8815 -7.7030 -7.7030 -7.3239 -7.3239 -7.3124 -7.3124 -6.5362 -6.5362 -6.4891 -6.4891 -6.4038 -6.4038 -6.3213 -6.3213 -5.8708 -5.8708 -5.8556 -5.8556 -5.6510 -5.6510 -5.6288 -5.6288 -4.4513 -4.4513 -4.4155 -4.4155 -4.0792 -4.0792 -3.8845 -3.8845 -3.8795 -3.8795 -3.5377 -3.5377 -3.0543 -3.0543 -3.0518 -3.0518 -3.0230 -3.0230 -2.9480 -2.9480 -2.9290 -2.9290 -2.4130 -2.4130 -1.9902 -1.9902 -1.9854 -1.9854 4.4042 4.4042 4.4918 4.4918 4.6205 4.6205 4.6224 4.6224 5.2136 5.2136 5.4677 5.4677 k = 0.5000 0.5000 0.0741 ( 7088 PWs) bands (ev): -17.3395 -17.3395 -17.3044 -17.3044 -17.2955 -17.2955 -17.2952 -17.2952 -7.9028 -7.9028 -7.6800 -7.6800 -7.3250 -7.3250 -7.3111 -7.3111 -6.5356 -6.5356 -6.4899 -6.4899 -6.4022 -6.4022 -6.3199 -6.3199 -5.8712 -5.8712 -5.8562 -5.8562 -5.6501 -5.6501 -5.6281 -5.6281 -4.4646 -4.4646 -4.4293 -4.4293 -4.1048 -4.1048 -3.8653 -3.8653 -3.8609 -3.8609 -3.5181 -3.5181 -3.0542 -3.0542 -3.0510 -3.0510 -3.0231 -3.0231 -2.9505 -2.9505 -2.9266 -2.9266 -2.4119 -2.4119 -1.9972 -1.9972 -1.9923 -1.9923 4.4029 4.4029 4.5040 4.5040 4.6173 4.6173 4.6197 4.6197 5.2003 5.2003 5.4811 5.4811 k = 0.5000 0.5000 0.0926 ( 7088 PWs) bands (ev): -17.3398 -17.3398 -17.3040 -17.3040 -17.2955 -17.2955 -17.2952 -17.2952 -7.9246 -7.9246 -7.6562 -7.6562 -7.3262 -7.3262 -7.3096 -7.3096 -6.5349 -6.5349 -6.4909 -6.4909 -6.4002 -6.4002 -6.3182 -6.3182 -5.8718 -5.8718 -5.8570 -5.8570 -5.6489 -5.6489 -5.6274 -5.6274 -4.4804 -4.4804 -4.4456 -4.4456 -4.1349 -4.1349 -3.8423 -3.8423 -3.8384 -3.8384 -3.4958 -3.4958 -3.0540 -3.0540 -3.0501 -3.0501 -3.0230 -3.0230 -2.9531 -2.9531 -2.9241 -2.9241 -2.4105 -2.4105 -2.0061 -2.0061 -2.0011 -2.0011 4.4024 4.4024 4.5184 4.5184 4.6135 4.6135 4.6164 4.6164 5.1844 5.1844 5.4980 5.4980 k = 0.5000 0.5000 0.1111 ( 7088 PWs) bands (ev): -17.3402 -17.3402 -17.3036 -17.3036 -17.2955 -17.2955 -17.2952 -17.2952 -7.9463 -7.9463 -7.6319 -7.6319 -7.3274 -7.3274 -7.3081 -7.3081 -6.5340 -6.5340 -6.4921 -6.4921 -6.3978 -6.3978 -6.3160 -6.3160 -5.8724 -5.8724 -5.8580 -5.8580 -5.6475 -5.6475 -5.6264 -5.6264 -4.4981 -4.4981 -4.4637 -4.4637 -4.1683 -4.1683 -3.8163 -3.8163 -3.8124 -3.8124 -3.4720 -3.4720 -3.0536 -3.0536 -3.0490 -3.0490 -3.0228 -3.0228 -2.9557 -2.9557 -2.9217 -2.9217 -2.4090 -2.4090 -2.0169 -2.0169 -2.0117 -2.0117 4.4029 4.4029 4.5343 4.5343 4.6091 4.6091 4.6127 4.6127 5.1666 5.1666 5.5183 5.5183 k = 0.5000 0.5000 0.1296 ( 7084 PWs) bands (ev): -17.3405 -17.3405 -17.3032 -17.3032 -17.2955 -17.2955 -17.2952 -17.2952 -7.9677 -7.9677 -7.6077 -7.6077 -7.3285 -7.3285 -7.3065 -7.3065 -6.5331 -6.5331 -6.4933 -6.4933 -6.3950 -6.3950 -6.3135 -6.3135 -5.8732 -5.8732 -5.8592 -5.8592 -5.6458 -5.6458 -5.6254 -5.6254 -4.5171 -4.5171 -4.4829 -4.4829 -4.2040 -4.2040 -3.7880 -3.7880 -3.7837 -3.7837 -3.4478 -3.4478 -3.0530 -3.0530 -3.0476 -3.0476 -3.0222 -3.0222 -2.9582 -2.9582 -2.9192 -2.9192 -2.4072 -2.4072 -2.0294 -2.0294 -2.0241 -2.0241 4.4046 4.4046 4.5515 4.5515 4.6043 4.6043 4.6089 4.6089 5.1476 5.1476 5.5416 5.5416 k = 0.5000 0.5000 0.1481 ( 7092 PWs) bands (ev): -17.3410 -17.3410 -17.3027 -17.3027 -17.2955 -17.2955 -17.2952 -17.2952 -7.9885 -7.9885 -7.5837 -7.5837 -7.3297 -7.3297 -7.3048 -7.3048 -6.5320 -6.5320 -6.4948 -6.4948 -6.3919 -6.3919 -6.3106 -6.3106 -5.8740 -5.8740 -5.8604 -5.8604 -5.6440 -5.6440 -5.6242 -5.6242 -4.5368 -4.5368 -4.5028 -4.5028 -4.2414 -4.2414 -3.7577 -3.7577 -3.7528 -3.7528 -3.4238 -3.4238 -3.0522 -3.0522 -3.0461 -3.0461 -3.0210 -3.0210 -2.9608 -2.9608 -2.9169 -2.9169 -2.4053 -2.4053 -2.0437 -2.0437 -2.0383 -2.0383 4.4074 4.4074 4.5690 4.5690 4.5993 4.5993 4.6057 4.6057 5.1276 5.1276 5.5679 5.5679 k = 0.5000 0.5000 0.1667 ( 7084 PWs) bands (ev): -17.3414 -17.3414 -17.3021 -17.3021 -17.2954 -17.2954 -17.2951 -17.2951 -8.0088 -8.0088 -7.5602 -7.5602 -7.3308 -7.3308 -7.3031 -7.3031 -6.5308 -6.5308 -6.4962 -6.4962 -6.3884 -6.3884 -6.3072 -6.3072 -5.8748 -5.8748 -5.8618 -5.8618 -5.6419 -5.6419 -5.6229 -5.6229 -4.5569 -4.5569 -4.5230 -4.5230 -4.2797 -4.2797 -3.7260 -3.7260 -3.7202 -3.7202 -3.4009 -3.4009 -3.0512 -3.0512 -3.0444 -3.0444 -3.0192 -3.0192 -2.9632 -2.9632 -2.9146 -2.9146 -2.4033 -2.4033 -2.0596 -2.0596 -2.0540 -2.0540 4.4115 4.4115 4.5832 4.5832 4.5942 4.5942 4.6066 4.6066 5.1073 5.1073 5.5967 5.5967 k = 0.5000 0.5000 0.1852 ( 7088 PWs) bands (ev): -17.3419 -17.3419 -17.3016 -17.3016 -17.2954 -17.2954 -17.2951 -17.2951 -8.0282 -8.0282 -7.5372 -7.5372 -7.3318 -7.3318 -7.3013 -7.3013 -6.5296 -6.5296 -6.4978 -6.4978 -6.3847 -6.3847 -6.3035 -6.3035 -5.8758 -5.8758 -5.8633 -5.8633 -5.6398 -5.6398 -5.6216 -5.6216 -4.5770 -4.5770 -4.5432 -4.5432 -4.3185 -4.3185 -3.6933 -3.6933 -3.6865 -3.6865 -3.3794 -3.3794 -3.0498 -3.0498 -3.0425 -3.0425 -3.0164 -3.0164 -2.9657 -2.9657 -2.9124 -2.9124 -2.4013 -2.4013 -2.0770 -2.0770 -2.0713 -2.0713 4.4167 4.4167 4.5862 4.5862 4.5893 4.5893 4.6192 4.6192 5.0869 5.0869 5.6278 5.6278 k = 0.5000 0.5000 0.2037 ( 7088 PWs) bands (ev): -17.3424 -17.3424 -17.3010 -17.3010 -17.2954 -17.2954 -17.2951 -17.2951 -8.0469 -8.0469 -7.5150 -7.5150 -7.3329 -7.3329 -7.2995 -7.2995 -6.5283 -6.5283 -6.4993 -6.4993 -6.3808 -6.3808 -6.2994 -6.2994 -5.8768 -5.8768 -5.8649 -5.8649 -5.6375 -5.6375 -5.6202 -5.6202 -4.5969 -4.5969 -4.5631 -4.5631 -4.3573 -4.3573 -3.6598 -3.6598 -3.6520 -3.6520 -3.3599 -3.3599 -3.0482 -3.0482 -3.0405 -3.0405 -3.0125 -3.0125 -2.9680 -2.9680 -2.9102 -2.9102 -2.3992 -2.3992 -2.0958 -2.0958 -2.0899 -2.0899 4.4230 4.4230 4.5825 4.5825 4.5848 4.5848 4.6387 4.6387 5.0667 5.0667 5.6610 5.6610 k = 0.5000 0.5000 0.2222 ( 7088 PWs) bands (ev): -17.3429 -17.3429 -17.3004 -17.3004 -17.2954 -17.2954 -17.2951 -17.2951 -8.0647 -8.0647 -7.4937 -7.4937 -7.3338 -7.3338 -7.2976 -7.2976 -6.5271 -6.5271 -6.5009 -6.5009 -6.3768 -6.3768 -6.2948 -6.2948 -5.8777 -5.8777 -5.8665 -5.8665 -5.6352 -5.6352 -5.6188 -5.6188 -4.6163 -4.6163 -4.5825 -4.5825 -4.3958 -4.3958 -3.6259 -3.6259 -3.6171 -3.6171 -3.3425 -3.3425 -3.0462 -3.0462 -3.0383 -3.0383 -3.0074 -3.0074 -2.9702 -2.9702 -2.9082 -2.9082 -2.3972 -2.3972 -2.1159 -2.1159 -2.1098 -2.1098 4.4302 4.4302 4.5777 4.5777 4.5803 4.5803 4.6601 4.6601 5.0469 5.0469 5.6960 5.6960 k = 0.5000 0.5000 0.2407 ( 7080 PWs) bands (ev): -17.3434 -17.3434 -17.2998 -17.2998 -17.2954 -17.2954 -17.2950 -17.2950 -8.0816 -8.0816 -7.4733 -7.4733 -7.3347 -7.3347 -7.2956 -7.2956 -6.5258 -6.5258 -6.5025 -6.5025 -6.3727 -6.3727 -6.2898 -6.2898 -5.8787 -5.8787 -5.8682 -5.8682 -5.6327 -5.6327 -5.6174 -5.6174 -4.6351 -4.6351 -4.6013 -4.6013 -4.4337 -4.4337 -3.5919 -3.5919 -3.5820 -3.5820 -3.3276 -3.3276 -3.0439 -3.0439 -3.0359 -3.0359 -3.0009 -3.0009 -2.9723 -2.9723 -2.9063 -2.9063 -2.3952 -2.3952 -2.1371 -2.1371 -2.1308 -2.1308 4.4383 4.4383 4.5728 4.5728 4.5757 4.5757 4.6821 4.6821 5.0277 5.0277 5.7323 5.7323 k = 0.5000 0.5000 0.2593 ( 7072 PWs) bands (ev): -17.3439 -17.3439 -17.2993 -17.2993 -17.2954 -17.2954 -17.2950 -17.2950 -8.0975 -8.0975 -7.4542 -7.4542 -7.3356 -7.3356 -7.2935 -7.2935 -6.5245 -6.5245 -6.5040 -6.5040 -6.3685 -6.3685 -6.2844 -6.2844 -5.8797 -5.8797 -5.8699 -5.8699 -5.6302 -5.6302 -5.6159 -5.6159 -4.6530 -4.6530 -4.6194 -4.6194 -4.4705 -4.4705 -3.5581 -3.5581 -3.5472 -3.5472 -3.3150 -3.3150 -3.0412 -3.0412 -3.0335 -3.0335 -2.9931 -2.9931 -2.9743 -2.9743 -2.9045 -2.9045 -2.3933 -2.3933 -2.1591 -2.1591 -2.1528 -2.1528 4.4470 4.4470 4.5680 4.5680 4.5712 4.5712 4.7042 4.7042 5.0093 5.0093 5.7697 5.7697 k = 0.5000 0.5000 0.2778 ( 7072 PWs) bands (ev): -17.3443 -17.3443 -17.2987 -17.2987 -17.2953 -17.2953 -17.2950 -17.2950 -8.1123 -8.1123 -7.4363 -7.4363 -7.3364 -7.3364 -7.2913 -7.2913 -6.5233 -6.5233 -6.5055 -6.5055 -6.3645 -6.3645 -6.2787 -6.2787 -5.8807 -5.8807 -5.8716 -5.8716 -5.6277 -5.6277 -5.6146 -5.6146 -4.6700 -4.6700 -4.6367 -4.6367 -4.5060 -4.5060 -3.5250 -3.5250 -3.5129 -3.5129 -3.3048 -3.3048 -3.0382 -3.0382 -3.0308 -3.0308 -2.9843 -2.9843 -2.9760 -2.9760 -2.9028 -2.9028 -2.3916 -2.3916 -2.1819 -2.1819 -2.1754 -2.1754 4.4563 4.4563 4.5636 4.5636 4.5669 4.5669 4.7262 4.7262 4.9919 4.9919 5.8077 5.8077 k = 0.5000 0.5000 0.2963 ( 7068 PWs) bands (ev): -17.3448 -17.3448 -17.2982 -17.2982 -17.2953 -17.2953 -17.2949 -17.2949 -8.1261 -8.1261 -7.4199 -7.4199 -7.3372 -7.3372 -7.2889 -7.2889 -6.5221 -6.5221 -6.5069 -6.5069 -6.3606 -6.3606 -6.2726 -6.2726 -5.8816 -5.8816 -5.8734 -5.8734 -5.6252 -5.6252 -5.6132 -5.6132 -4.6860 -4.6860 -4.6532 -4.6532 -4.5398 -4.5398 -3.4927 -3.4927 -3.4794 -3.4794 -3.2966 -3.2966 -3.0348 -3.0348 -3.0279 -3.0279 -2.9789 -2.9789 -2.9733 -2.9733 -2.9012 -2.9012 -2.3900 -2.3900 -2.2052 -2.2052 -2.1986 -2.1986 4.4659 4.4659 4.5594 4.5594 4.5629 4.5629 4.7478 4.7478 4.9754 4.9754 5.8460 5.8460 k = 0.5000 0.5000 0.3148 ( 7068 PWs) bands (ev): -17.3452 -17.3452 -17.2977 -17.2977 -17.2953 -17.2953 -17.2949 -17.2949 -8.1388 -8.1388 -7.4050 -7.4050 -7.3379 -7.3379 -7.2864 -7.2864 -6.5210 -6.5210 -6.5083 -6.5083 -6.3569 -6.3569 -6.2663 -6.2663 -5.8825 -5.8825 -5.8751 -5.8751 -5.6228 -5.6228 -5.6120 -5.6120 -4.7009 -4.7009 -4.6689 -4.6689 -4.5715 -4.5715 -3.4616 -3.4616 -3.4473 -3.4473 -3.2902 -3.2902 -3.0310 -3.0310 -3.0247 -3.0247 -2.9800 -2.9800 -2.9633 -2.9633 -2.8997 -2.8997 -2.3885 -2.3885 -2.2287 -2.2287 -2.2219 -2.2219 4.4757 4.4757 4.5555 4.5555 4.5591 4.5591 4.7685 4.7685 4.9602 4.9602 5.8841 5.8841 k = 0.5000 0.5000 0.3333 ( 7060 PWs) bands (ev): -17.3456 -17.3456 -17.2972 -17.2972 -17.2953 -17.2953 -17.2949 -17.2949 -8.1504 -8.1504 -7.3917 -7.3917 -7.3385 -7.3385 -7.2837 -7.2837 -6.5200 -6.5200 -6.5095 -6.5095 -6.3534 -6.3534 -6.2599 -6.2599 -5.8833 -5.8833 -5.8767 -5.8767 -5.6204 -5.6204 -5.6109 -5.6109 -4.7145 -4.7145 -4.6839 -4.6839 -4.6007 -4.6007 -3.4322 -3.4322 -3.4168 -3.4168 -3.2853 -3.2853 -3.0268 -3.0268 -3.0211 -3.0211 -2.9814 -2.9814 -2.9527 -2.9527 -2.8984 -2.8984 -2.3873 -2.3873 -2.2521 -2.2521 -2.2452 -2.2452 4.4854 4.4854 4.5520 4.5520 4.5557 4.5557 4.7883 4.7883 4.9461 4.9461 5.9215 5.9215 k = 0.5000 0.5000 0.3519 ( 7052 PWs) bands (ev): -17.3459 -17.3459 -17.2968 -17.2968 -17.2952 -17.2952 -17.2949 -17.2949 -8.1608 -8.1608 -7.3800 -7.3800 -7.3390 -7.3390 -7.2808 -7.2808 -6.5190 -6.5190 -6.5107 -6.5107 -6.3502 -6.3502 -6.2535 -6.2535 -5.8840 -5.8840 -5.8783 -5.8783 -5.6182 -5.6182 -5.6098 -5.6098 -4.7268 -4.7268 -4.6983 -4.6983 -4.6269 -4.6269 -3.4047 -3.4047 -3.3884 -3.3884 -3.2815 -3.2815 -3.0221 -3.0221 -3.0171 -3.0171 -2.9827 -2.9827 -2.9423 -2.9423 -2.8972 -2.8972 -2.3862 -2.3862 -2.2750 -2.2750 -2.2680 -2.2680 4.4949 4.4949 4.5489 4.5489 4.5526 4.5526 4.8069 4.8069 4.9334 4.9334 5.9575 5.9575 k = 0.5000 0.5000 0.3704 ( 7048 PWs) bands (ev): -17.3462 -17.3462 -17.2964 -17.2964 -17.2952 -17.2952 -17.2948 -17.2948 -8.1701 -8.1701 -7.3701 -7.3701 -7.3395 -7.3395 -7.2778 -7.2778 -6.5182 -6.5182 -6.5117 -6.5117 -6.3474 -6.3474 -6.2472 -6.2472 -5.8847 -5.8847 -5.8798 -5.8798 -5.6160 -5.6160 -5.6088 -5.6088 -4.7379 -4.7379 -4.7122 -4.7122 -4.6498 -4.6498 -3.3796 -3.3796 -3.3626 -3.3626 -3.2783 -3.2783 -3.0171 -3.0171 -3.0127 -3.0127 -2.9839 -2.9839 -2.9323 -2.9323 -2.8962 -2.8962 -2.3853 -2.3853 -2.2971 -2.2971 -2.2899 -2.2899 4.5040 4.5040 4.5461 4.5461 4.5499 4.5499 4.8239 4.8239 4.9220 4.9220 5.9909 5.9909 k = 0.5000 0.5000 0.3889 ( 7048 PWs) bands (ev): -17.3465 -17.3465 -17.2961 -17.2961 -17.2951 -17.2951 -17.2948 -17.2948 -8.1782 -8.1782 -7.3618 -7.3618 -7.3400 -7.3400 -7.2748 -7.2748 -6.5175 -6.5175 -6.5126 -6.5126 -6.3449 -6.3449 -6.2413 -6.2413 -5.8853 -5.8853 -5.8811 -5.8811 -5.6141 -5.6141 -5.6080 -5.6080 -4.7475 -4.7475 -4.7257 -4.7257 -4.6689 -4.6689 -3.3572 -3.3572 -3.3402 -3.3402 -3.2754 -3.2754 -3.0120 -3.0120 -3.0080 -3.0080 -2.9849 -2.9849 -2.9231 -2.9231 -2.8953 -2.8953 -2.3845 -2.3845 -2.3179 -2.3179 -2.3105 -2.3105 4.5123 4.5123 4.5438 4.5438 4.5475 4.5475 4.8391 4.8391 4.9120 4.9120 5.9842 5.9842 k = 0.5000 0.5000 0.4074 ( 7044 PWs) bands (ev): -17.3468 -17.3468 -17.2959 -17.2959 -17.2951 -17.2951 -17.2948 -17.2948 -8.1850 -8.1850 -7.3551 -7.3551 -7.3403 -7.3403 -7.2718 -7.2718 -6.5168 -6.5168 -6.5135 -6.5135 -6.3428 -6.3428 -6.2358 -6.2358 -5.8858 -5.8858 -5.8824 -5.8824 -5.6124 -5.6124 -5.6074 -5.6074 -4.7558 -4.7558 -4.7387 -4.7387 -4.6840 -4.6840 -3.3378 -3.3378 -3.3217 -3.3217 -3.2721 -3.2721 -3.0069 -3.0069 -3.0029 -3.0029 -2.9857 -2.9857 -2.9149 -2.9149 -2.8945 -2.8945 -2.3840 -2.3840 -2.3368 -2.3368 -2.3293 -2.3293 4.5197 4.5197 4.5418 4.5418 4.5455 4.5455 4.8524 4.8524 4.9035 4.9035 5.9738 5.9738 k = 0.5000 0.5000 0.4259 ( 7060 PWs) bands (ev): -17.3470 -17.3470 -17.2957 -17.2957 -17.2950 -17.2950 -17.2948 -17.2948 -8.1906 -8.1906 -7.3498 -7.3498 -7.3407 -7.3407 -7.2691 -7.2691 -6.5163 -6.5163 -6.5141 -6.5141 -6.3411 -6.3411 -6.2311 -6.2311 -5.8861 -5.8861 -5.8835 -5.8835 -5.6108 -5.6108 -5.6069 -5.6069 -4.7625 -4.7625 -4.7505 -4.7505 -4.6957 -4.6957 -3.3217 -3.3217 -3.3081 -3.3081 -3.2678 -3.2678 -3.0022 -3.0022 -2.9978 -2.9978 -2.9863 -2.9863 -2.9079 -2.9079 -2.8940 -2.8940 -2.3837 -2.3837 -2.3534 -2.3534 -2.3456 -2.3456 4.5259 4.5259 4.5403 4.5403 4.5438 4.5438 4.8635 4.8635 4.8965 4.8965 5.9651 5.9651 k = 0.5000 0.5000 0.4444 ( 7080 PWs) bands (ev): -17.3471 -17.3471 -17.2956 -17.2956 -17.2949 -17.2949 -17.2948 -17.2948 -8.1950 -8.1950 -7.3460 -7.3460 -7.3409 -7.3409 -7.2668 -7.2668 -6.5159 -6.5159 -6.5147 -6.5147 -6.3398 -6.3398 -6.2272 -6.2272 -5.8864 -5.8864 -5.8845 -5.8845 -5.6095 -5.6095 -5.6066 -5.6066 -4.7679 -4.7679 -4.7605 -4.7605 -4.7041 -4.7041 -3.3090 -3.3090 -3.2994 -3.2994 -3.2626 -3.2626 -2.9983 -2.9983 -2.9932 -2.9932 -2.9865 -2.9865 -2.9023 -2.9023 -2.8935 -2.8935 -2.3838 -2.3838 -2.3671 -2.3671 -2.3588 -2.3588 4.5306 4.5306 4.5395 4.5395 4.5425 4.5425 4.8723 4.8723 4.8910 4.8910 5.9582 5.9582 k = 0.5000 0.5000 0.4630 ( 7088 PWs) bands (ev): -17.3473 -17.3473 -17.2955 -17.2955 -17.2949 -17.2949 -17.2948 -17.2948 -8.1982 -8.1982 -7.3433 -7.3433 -7.3411 -7.3411 -7.2651 -7.2651 -6.5157 -6.5157 -6.5151 -6.5151 -6.3388 -6.3388 -6.2243 -6.2243 -5.8865 -5.8865 -5.8852 -5.8852 -5.6084 -5.6084 -5.6066 -5.6066 -4.7717 -4.7717 -4.7681 -4.7681 -4.7098 -4.7098 -3.2999 -3.2999 -3.2947 -3.2947 -3.2573 -3.2573 -2.9954 -2.9954 -2.9894 -2.9894 -2.9864 -2.9864 -2.8981 -2.8981 -2.8933 -2.8933 -2.3843 -2.3843 -2.3774 -2.3774 -2.3683 -2.3683 4.5334 4.5334 4.5396 4.5396 4.5416 4.5416 4.8787 4.8787 4.8871 4.8871 5.9532 5.9532 k = 0.5000 0.5000 0.4815 ( 7088 PWs) bands (ev): -17.3473 -17.3473 -17.2955 -17.2955 -17.2948 -17.2948 -17.2948 -17.2948 -8.2001 -8.2001 -7.3417 -7.3417 -7.3412 -7.3412 -7.2640 -7.2640 -6.5155 -6.5155 -6.5153 -6.5153 -6.3383 -6.3383 -6.2225 -6.2225 -5.8865 -5.8865 -5.8858 -5.8858 -5.6076 -5.6076 -5.6067 -5.6067 -4.7739 -4.7739 -4.7728 -4.7728 -4.7132 -4.7132 -3.2944 -3.2944 -3.2925 -3.2925 -3.2535 -3.2535 -2.9937 -2.9937 -2.9869 -2.9869 -2.9861 -2.9861 -2.8954 -2.8954 -2.8934 -2.8934 -2.3853 -2.3853 -2.3837 -2.3837 -2.3734 -2.3734 4.5344 4.5344 4.5404 4.5404 4.5410 4.5410 4.8826 4.8826 4.8847 4.8847 5.9501 5.9501 k = 0.5000 0.5000 0.5000 ( 7088 PWs) bands (ev): -17.3474 -17.3474 -17.2955 -17.2955 -17.2948 -17.2948 -17.2948 -17.2948 -8.2007 -8.2007 -7.3412 -7.3412 -7.3412 -7.3412 -7.2636 -7.2636 -6.5154 -6.5154 -6.5154 -6.5154 -6.3381 -6.3381 -6.2219 -6.2219 -5.8862 -5.8862 -5.8862 -5.8862 -5.6070 -5.6070 -5.6070 -5.6070 -4.7746 -4.7746 -4.7746 -4.7746 -4.7143 -4.7143 -3.2922 -3.2922 -3.2922 -3.2922 -3.2522 -3.2522 -2.9932 -2.9932 -2.9860 -2.9860 -2.9860 -2.9860 -2.8939 -2.8939 -2.8939 -2.8939 -2.3859 -2.3859 -2.3859 -2.3859 -2.3749 -2.3749 4.5346 4.5346 4.5408 4.5408 4.5408 4.5408 4.8839 4.8839 4.8839 4.8839 5.9491 5.9491 Writing output data file ZnxCNx2.save init_run : 4.30s CPU 14.19s WALL ( 1 calls) electrons : 648.22s CPU 658.18s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.35s CPU 2.00s WALL ( 1 calls) Called by electrons: c_bands : 648.19s CPU 657.87s WALL ( 1 calls) v_of_rho : 0.14s CPU 1.39s WALL ( 1 calls) v_h : 0.00s CPU 0.01s WALL ( 1 calls) v_xc : 0.12s CPU 0.99s WALL ( 1 calls) newd : 0.50s CPU 0.67s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.37s WALL ( 210 calls) cegterg : 607.62s CPU 613.99s WALL ( 422 calls) Called by sum_band: Called by *egterg: h_psi : 243.07s CPU 248.24s WALL ( 6267 calls) s_psi : 29.73s CPU 29.94s WALL ( 6267 calls) g_psi : 0.85s CPU 0.84s WALL ( 5635 calls) cdiaghg : 230.99s CPU 229.93s WALL ( 5845 calls) cegterg:over : 64.17s CPU 63.04s WALL ( 5635 calls) cegterg:upda : 19.75s CPU 21.26s WALL ( 5635 calls) cegterg:last : 16.15s CPU 16.51s WALL ( 1052 calls) Called by h_psi: h_psi:vloc : 177.96s CPU 181.26s WALL ( 6267 calls) h_psi:vnl : 64.69s CPU 66.15s WALL ( 6267 calls) add_vuspsi : 23.34s CPU 25.54s WALL ( 6267 calls) General routines calbec : 41.32s CPU 40.55s WALL ( 6267 calls) fft : 0.26s CPU 1.18s WALL ( 19 calls) ffts : 0.09s CPU 0.09s WALL ( 4 calls) fftw : 165.83s CPU 167.46s WALL ( 931040 calls) interpolate : 0.11s CPU 0.13s WALL ( 4 calls) davcio : 0.05s CPU 2.00s WALL ( 420 calls) Parallel routines fft_scatter : 116.33s CPU 115.63s WALL ( 931063 calls) PWSCF : 11m49.97s CPU 13m35.55s WALL This run was terminated on: 17: 9: 2 29Nov2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=