Program PWSCF v.5.1.1 starts on 30Oct2015 at 12:38:45 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: ./Ga3BN4.save/ file B.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized file Ga.rel-pbe-dnl-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 36 19 6 1134 450 75 Max 37 20 8 1139 464 80 Sum 1741 949 293 54531 21879 3695 bravais-lattice index = 14 lattice parameter (alat) = 8.2033 a.u. unit-cell volume = 552.0340 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 62.00 number of Kohn-Sham states= 74 kinetic-energy cutoff = 44.0000 Ry charge density cutoff = 325.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.203301 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 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 PseudoPot. # 2 for B read from file: /home/autes/Pseudo/B.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e6935728e521ae6844adca162131706c Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1059 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. # 3 for Ga read from file: /home/autes/Pseudo/Ga.rel-pbe-dnl-rrkjus_psl.1.0.0.UPF MD5 check sum: a45069c11dc40ba088a6a50723da268c Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1205 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential N 5.00 14.00670 N( 1.00) B 3.00 10.81100 B( 1.00) Ga 13.00 69.72300 Ga( 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= 284 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 2) = ( 0.0000000 0.0135135 -0.0000000), wk = 0.0035211 k( 3) = ( 0.0000000 0.0270270 -0.0000000), wk = 0.0035211 k( 4) = ( 0.0000000 0.0405405 -0.0000000), wk = 0.0035211 k( 5) = ( 0.0000000 0.0540540 -0.0000000), wk = 0.0035211 k( 6) = ( 0.0000000 0.0675676 -0.0000000), wk = 0.0035211 k( 7) = ( 0.0000000 0.0810811 -0.0000000), wk = 0.0035211 k( 8) = ( 0.0000000 0.0945946 -0.0000000), wk = 0.0035211 k( 9) = ( 0.0000000 0.1081081 -0.0000000), wk = 0.0035211 k( 10) = ( 0.0000000 0.1216216 -0.0000000), wk = 0.0035211 k( 11) = ( 0.0000000 0.1351351 -0.0000000), wk = 0.0035211 k( 12) = ( 0.0000000 0.1486486 -0.0000000), wk = 0.0035211 k( 13) = ( 0.0000000 0.1621622 -0.0000000), wk = 0.0035211 k( 14) = ( 0.0000000 0.1756757 -0.0000000), wk = 0.0035211 k( 15) = ( 0.0000000 0.1891892 -0.0000000), wk = 0.0035211 k( 16) = ( 0.0000000 0.2027027 -0.0000000), wk = 0.0035211 k( 17) = ( 0.0000000 0.2162162 -0.0000000), wk = 0.0035211 k( 18) = ( 0.0000000 0.2297297 -0.0000000), wk = 0.0035211 k( 19) = ( 0.0000000 0.2432432 -0.0000000), wk = 0.0035211 k( 20) = ( 0.0000000 0.2567568 -0.0000000), wk = 0.0035211 k( 21) = ( 0.0000000 0.2702703 -0.0000000), wk = 0.0035211 k( 22) = ( 0.0000000 0.2837838 -0.0000000), wk = 0.0035211 k( 23) = ( 0.0000000 0.2972973 -0.0000000), wk = 0.0035211 k( 24) = ( 0.0000000 0.3108108 -0.0000000), wk = 0.0035211 k( 25) = ( 0.0000000 0.3243243 -0.0000000), wk = 0.0035211 k( 26) = ( 0.0000000 0.3378378 -0.0000000), wk = 0.0035211 k( 27) = ( 0.0000000 0.3513514 -0.0000000), wk = 0.0035211 k( 28) = ( 0.0000000 0.3648649 -0.0000000), wk = 0.0035211 k( 29) = ( 0.0000000 0.3783784 -0.0000000), wk = 0.0035211 k( 30) = ( 0.0000000 0.3918919 -0.0000000), wk = 0.0035211 k( 31) = ( 0.0000000 0.4054054 -0.0000000), wk = 0.0035211 k( 32) = ( 0.0000000 0.4189189 -0.0000000), wk = 0.0035211 k( 33) = ( 0.0000000 0.4324324 -0.0000000), wk = 0.0035211 k( 34) = ( 0.0000000 0.4459459 -0.0000000), wk = 0.0035211 k( 35) = ( 0.0000000 0.4594595 -0.0000000), wk = 0.0035211 k( 36) = ( 0.0000000 0.4729730 -0.0000000), wk = 0.0035211 k( 37) = ( 0.0000000 0.4864865 -0.0000000), wk = 0.0035211 k( 38) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0035211 k( 39) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0035211 k( 40) = ( 0.0135135 0.5000000 -0.0000000), wk = 0.0035211 k( 41) = ( 0.0270270 0.5000000 -0.0000000), wk = 0.0035211 k( 42) = ( 0.0405405 0.5000000 -0.0000000), wk = 0.0035211 k( 43) = ( 0.0540540 0.5000000 -0.0000000), wk = 0.0035211 k( 44) = ( 0.0675676 0.5000000 -0.0000000), wk = 0.0035211 k( 45) = ( 0.0810811 0.5000000 -0.0000000), wk = 0.0035211 k( 46) = ( 0.0945946 0.5000000 -0.0000000), wk = 0.0035211 k( 47) = ( 0.1081081 0.5000000 -0.0000000), wk = 0.0035211 k( 48) = ( 0.1216216 0.5000000 -0.0000000), wk = 0.0035211 k( 49) = ( 0.1351351 0.5000000 -0.0000000), wk = 0.0035211 k( 50) = ( 0.1486486 0.5000000 -0.0000000), wk = 0.0035211 k( 51) = ( 0.1621622 0.5000000 -0.0000000), wk = 0.0035211 k( 52) = ( 0.1756757 0.5000000 -0.0000000), wk = 0.0035211 k( 53) = ( 0.1891892 0.5000000 -0.0000000), wk = 0.0035211 k( 54) = ( 0.2027027 0.5000000 -0.0000000), wk = 0.0035211 k( 55) = ( 0.2162162 0.5000000 -0.0000000), wk = 0.0035211 k( 56) = ( 0.2297297 0.5000000 -0.0000000), wk = 0.0035211 k( 57) = ( 0.2432432 0.5000000 -0.0000000), wk = 0.0035211 k( 58) = ( 0.2567568 0.5000000 -0.0000000), wk = 0.0035211 k( 59) = ( 0.2702703 0.5000000 -0.0000000), wk = 0.0035211 k( 60) = ( 0.2837838 0.5000000 -0.0000000), wk = 0.0035211 k( 61) = ( 0.2972973 0.5000000 -0.0000000), wk = 0.0035211 k( 62) = ( 0.3108108 0.5000000 -0.0000000), wk = 0.0035211 k( 63) = ( 0.3243243 0.5000000 -0.0000000), wk = 0.0035211 k( 64) = ( 0.3378378 0.5000000 -0.0000000), wk = 0.0035211 k( 65) = ( 0.3513514 0.5000000 -0.0000000), wk = 0.0035211 k( 66) = ( 0.3648649 0.5000000 -0.0000000), wk = 0.0035211 k( 67) = ( 0.3783784 0.5000000 -0.0000000), wk = 0.0035211 k( 68) = ( 0.3918919 0.5000000 -0.0000000), wk = 0.0035211 k( 69) = ( 0.4054054 0.5000000 -0.0000000), wk = 0.0035211 k( 70) = ( 0.4189189 0.5000000 -0.0000000), wk = 0.0035211 k( 71) = ( 0.4324324 0.5000000 -0.0000000), wk = 0.0035211 k( 72) = ( 0.4459459 0.5000000 -0.0000000), wk = 0.0035211 k( 73) = ( 0.4594595 0.5000000 -0.0000000), wk = 0.0035211 k( 74) = ( 0.4729730 0.5000000 -0.0000000), wk = 0.0035211 k( 75) = ( 0.4864865 0.5000000 -0.0000000), wk = 0.0035211 k( 76) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0035211 k( 77) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0035211 k( 78) = ( 0.4903846 0.4903846 -0.0000000), wk = 0.0035211 k( 79) = ( 0.4807692 0.4807692 -0.0000000), wk = 0.0035211 k( 80) = ( 0.4711538 0.4711538 -0.0000000), wk = 0.0035211 k( 81) = ( 0.4615385 0.4615385 -0.0000000), wk = 0.0035211 k( 82) = ( 0.4519231 0.4519231 -0.0000000), wk = 0.0035211 k( 83) = ( 0.4423077 0.4423077 -0.0000000), wk = 0.0035211 k( 84) = ( 0.4326923 0.4326923 -0.0000000), wk = 0.0035211 k( 85) = ( 0.4230769 0.4230769 -0.0000000), wk = 0.0035211 k( 86) = ( 0.4134615 0.4134615 -0.0000000), wk = 0.0035211 k( 87) = ( 0.4038462 0.4038461 -0.0000000), wk = 0.0035211 k( 88) = ( 0.3942308 0.3942308 -0.0000000), wk = 0.0035211 k( 89) = ( 0.3846154 0.3846154 -0.0000000), wk = 0.0035211 k( 90) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0035211 k( 91) = ( 0.3653846 0.3653846 -0.0000000), wk = 0.0035211 k( 92) = ( 0.3557692 0.3557692 -0.0000000), wk = 0.0035211 k( 93) = ( 0.3461538 0.3461538 -0.0000000), wk = 0.0035211 k( 94) = ( 0.3365385 0.3365385 -0.0000000), wk = 0.0035211 k( 95) = ( 0.3269231 0.3269231 -0.0000000), wk = 0.0035211 k( 96) = ( 0.3173077 0.3173077 -0.0000000), wk = 0.0035211 k( 97) = ( 0.3076923 0.3076923 -0.0000000), wk = 0.0035211 k( 98) = ( 0.2980769 0.2980769 -0.0000000), wk = 0.0035211 k( 99) = ( 0.2884615 0.2884615 -0.0000000), wk = 0.0035211 k( 100) = ( 0.2788462 0.2788461 -0.0000000), wk = 0.0035211 k( 101) = ( 0.2692308 0.2692308 -0.0000000), wk = 0.0035211 k( 102) = ( 0.2596154 0.2596154 -0.0000000), wk = 0.0035211 k( 103) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0035211 k( 104) = ( 0.2403846 0.2403846 -0.0000000), wk = 0.0035211 k( 105) = ( 0.2307692 0.2307692 -0.0000000), wk = 0.0035211 k( 106) = ( 0.2211539 0.2211538 -0.0000000), wk = 0.0035211 k( 107) = ( 0.2115385 0.2115385 -0.0000000), wk = 0.0035211 k( 108) = ( 0.2019231 0.2019231 -0.0000000), wk = 0.0035211 k( 109) = ( 0.1923077 0.1923077 -0.0000000), wk = 0.0035211 k( 110) = ( 0.1826923 0.1826923 -0.0000000), wk = 0.0035211 k( 111) = ( 0.1730769 0.1730769 -0.0000000), wk = 0.0035211 k( 112) = ( 0.1634615 0.1634615 -0.0000000), wk = 0.0035211 k( 113) = ( 0.1538461 0.1538461 -0.0000000), wk = 0.0035211 k( 114) = ( 0.1442308 0.1442308 -0.0000000), wk = 0.0035211 k( 115) = ( 0.1346154 0.1346154 -0.0000000), wk = 0.0035211 k( 116) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0035211 k( 117) = ( 0.1153846 0.1153846 -0.0000000), wk = 0.0035211 k( 118) = ( 0.1057692 0.1057692 -0.0000000), wk = 0.0035211 k( 119) = ( 0.0961538 0.0961538 -0.0000000), wk = 0.0035211 k( 120) = ( 0.0865385 0.0865385 -0.0000000), wk = 0.0035211 k( 121) = ( 0.0769231 0.0769231 -0.0000000), wk = 0.0035211 k( 122) = ( 0.0673077 0.0673077 -0.0000000), wk = 0.0035211 k( 123) = ( 0.0576923 0.0576923 -0.0000000), wk = 0.0035211 k( 124) = ( 0.0480769 0.0480769 -0.0000000), wk = 0.0035211 k( 125) = ( 0.0384615 0.0384615 -0.0000000), wk = 0.0035211 k( 126) = ( 0.0288462 0.0288461 -0.0000000), wk = 0.0035211 k( 127) = ( 0.0192308 0.0192308 -0.0000000), wk = 0.0035211 k( 128) = ( 0.0096154 0.0096154 -0.0000000), wk = 0.0035211 k( 129) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 130) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 131) = ( 0.0079365 0.0079365 0.0079365), wk = 0.0035211 k( 132) = ( 0.0158730 0.0158730 0.0158730), wk = 0.0035211 k( 133) = ( 0.0238095 0.0238095 0.0238095), wk = 0.0035211 k( 134) = ( 0.0317460 0.0317460 0.0317460), wk = 0.0035211 k( 135) = ( 0.0396825 0.0396825 0.0396825), wk = 0.0035211 k( 136) = ( 0.0476191 0.0476190 0.0476190), wk = 0.0035211 k( 137) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0035211 k( 138) = ( 0.0634921 0.0634921 0.0634921), wk = 0.0035211 k( 139) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0035211 k( 140) = ( 0.0793651 0.0793651 0.0793651), wk = 0.0035211 k( 141) = ( 0.0873016 0.0873016 0.0873016), wk = 0.0035211 k( 142) = ( 0.0952381 0.0952381 0.0952381), wk = 0.0035211 k( 143) = ( 0.1031746 0.1031746 0.1031746), wk = 0.0035211 k( 144) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0035211 k( 145) = ( 0.1190476 0.1190476 0.1190476), wk = 0.0035211 k( 146) = ( 0.1269841 0.1269841 0.1269841), wk = 0.0035211 k( 147) = ( 0.1349206 0.1349206 0.1349206), wk = 0.0035211 k( 148) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0035211 k( 149) = ( 0.1507937 0.1507936 0.1507936), wk = 0.0035211 k( 150) = ( 0.1587302 0.1587302 0.1587302), wk = 0.0035211 k( 151) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0035211 k( 152) = ( 0.1746032 0.1746032 0.1746032), wk = 0.0035211 k( 153) = ( 0.1825397 0.1825397 0.1825397), wk = 0.0035211 k( 154) = ( 0.1904762 0.1904762 0.1904762), wk = 0.0035211 k( 155) = ( 0.1984127 0.1984127 0.1984127), wk = 0.0035211 k( 156) = ( 0.2063492 0.2063492 0.2063492), wk = 0.0035211 k( 157) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0035211 k( 158) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0035211 k( 159) = ( 0.2301587 0.2301587 0.2301587), wk = 0.0035211 k( 160) = ( 0.2380952 0.2380952 0.2380952), wk = 0.0035211 k( 161) = ( 0.2460317 0.2460317 0.2460317), wk = 0.0035211 k( 162) = ( 0.2539683 0.2539683 0.2539682), wk = 0.0035211 k( 163) = ( 0.2619048 0.2619048 0.2619048), wk = 0.0035211 k( 164) = ( 0.2698413 0.2698413 0.2698413), wk = 0.0035211 k( 165) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0035211 k( 166) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0035211 k( 167) = ( 0.2936508 0.2936508 0.2936508), wk = 0.0035211 k( 168) = ( 0.3015873 0.3015873 0.3015873), wk = 0.0035211 k( 169) = ( 0.3095238 0.3095238 0.3095238), wk = 0.0035211 k( 170) = ( 0.3174603 0.3174603 0.3174603), wk = 0.0035211 k( 171) = ( 0.3253968 0.3253968 0.3253968), wk = 0.0035211 k( 172) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0035211 k( 173) = ( 0.3412698 0.3412698 0.3412698), wk = 0.0035211 k( 174) = ( 0.3492063 0.3492063 0.3492063), wk = 0.0035211 k( 175) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0035211 k( 176) = ( 0.3650794 0.3650794 0.3650794), wk = 0.0035211 k( 177) = ( 0.3730159 0.3730159 0.3730159), wk = 0.0035211 k( 178) = ( 0.3809524 0.3809524 0.3809524), wk = 0.0035211 k( 179) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0035211 k( 180) = ( 0.3968254 0.3968254 0.3968254), wk = 0.0035211 k( 181) = ( 0.4047619 0.4047619 0.4047619), wk = 0.0035211 k( 182) = ( 0.4126984 0.4126984 0.4126984), wk = 0.0035211 k( 183) = ( 0.4206349 0.4206349 0.4206349), wk = 0.0035211 k( 184) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0035211 k( 185) = ( 0.4365079 0.4365079 0.4365079), wk = 0.0035211 k( 186) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0035211 k( 187) = ( 0.4523810 0.4523809 0.4523809), wk = 0.0035211 k( 188) = ( 0.4603175 0.4603175 0.4603175), wk = 0.0035211 k( 189) = ( 0.4682540 0.4682540 0.4682540), wk = 0.0035211 k( 190) = ( 0.4761905 0.4761905 0.4761905), wk = 0.0035211 k( 191) = ( 0.4841270 0.4841270 0.4841270), wk = 0.0035211 k( 192) = ( 0.4920635 0.4920635 0.4920635), wk = 0.0035211 k( 193) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035211 k( 194) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035211 k( 195) = ( 0.4903846 0.5000000 0.4903846), wk = 0.0035211 k( 196) = ( 0.4807692 0.5000000 0.4807692), wk = 0.0035211 k( 197) = ( 0.4711538 0.5000000 0.4711538), wk = 0.0035211 k( 198) = ( 0.4615385 0.5000000 0.4615385), wk = 0.0035211 k( 199) = ( 0.4519231 0.5000000 0.4519231), wk = 0.0035211 k( 200) = ( 0.4423077 0.5000000 0.4423077), wk = 0.0035211 k( 201) = ( 0.4326923 0.5000000 0.4326923), wk = 0.0035211 k( 202) = ( 0.4230769 0.5000000 0.4230769), wk = 0.0035211 k( 203) = ( 0.4134615 0.5000000 0.4134615), wk = 0.0035211 k( 204) = ( 0.4038462 0.5000000 0.4038461), wk = 0.0035211 k( 205) = ( 0.3942308 0.5000000 0.3942308), wk = 0.0035211 k( 206) = ( 0.3846154 0.5000000 0.3846154), wk = 0.0035211 k( 207) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0035211 k( 208) = ( 0.3653846 0.5000000 0.3653846), wk = 0.0035211 k( 209) = ( 0.3557692 0.5000000 0.3557692), wk = 0.0035211 k( 210) = ( 0.3461538 0.5000000 0.3461538), wk = 0.0035211 k( 211) = ( 0.3365385 0.5000000 0.3365385), wk = 0.0035211 k( 212) = ( 0.3269231 0.5000000 0.3269231), wk = 0.0035211 k( 213) = ( 0.3173077 0.5000000 0.3173077), wk = 0.0035211 k( 214) = ( 0.3076923 0.5000000 0.3076923), wk = 0.0035211 k( 215) = ( 0.2980769 0.5000000 0.2980769), wk = 0.0035211 k( 216) = ( 0.2884615 0.5000000 0.2884615), wk = 0.0035211 k( 217) = ( 0.2788462 0.5000000 0.2788461), wk = 0.0035211 k( 218) = ( 0.2692308 0.5000000 0.2692308), wk = 0.0035211 k( 219) = ( 0.2596154 0.5000000 0.2596154), wk = 0.0035211 k( 220) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0035211 k( 221) = ( 0.2403846 0.5000000 0.2403846), wk = 0.0035211 k( 222) = ( 0.2307692 0.5000000 0.2307692), wk = 0.0035211 k( 223) = ( 0.2211539 0.5000000 0.2211538), wk = 0.0035211 k( 224) = ( 0.2115385 0.5000000 0.2115385), wk = 0.0035211 k( 225) = ( 0.2019231 0.5000000 0.2019231), wk = 0.0035211 k( 226) = ( 0.1923077 0.5000000 0.1923077), wk = 0.0035211 k( 227) = ( 0.1826923 0.5000000 0.1826923), wk = 0.0035211 k( 228) = ( 0.1730769 0.5000000 0.1730769), wk = 0.0035211 k( 229) = ( 0.1634615 0.5000000 0.1634615), wk = 0.0035211 k( 230) = ( 0.1538461 0.5000000 0.1538461), wk = 0.0035211 k( 231) = ( 0.1442308 0.5000000 0.1442308), wk = 0.0035211 k( 232) = ( 0.1346154 0.5000000 0.1346154), wk = 0.0035211 k( 233) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0035211 k( 234) = ( 0.1153846 0.5000000 0.1153846), wk = 0.0035211 k( 235) = ( 0.1057692 0.5000000 0.1057692), wk = 0.0035211 k( 236) = ( 0.0961538 0.5000000 0.0961538), wk = 0.0035211 k( 237) = ( 0.0865385 0.5000000 0.0865385), wk = 0.0035211 k( 238) = ( 0.0769231 0.5000000 0.0769231), wk = 0.0035211 k( 239) = ( 0.0673077 0.5000000 0.0673077), wk = 0.0035211 k( 240) = ( 0.0576923 0.5000000 0.0576923), wk = 0.0035211 k( 241) = ( 0.0480769 0.5000000 0.0480769), wk = 0.0035211 k( 242) = ( 0.0384615 0.5000000 0.0384615), wk = 0.0035211 k( 243) = ( 0.0288462 0.5000000 0.0288461), wk = 0.0035211 k( 244) = ( 0.0192308 0.5000000 0.0192308), wk = 0.0035211 k( 245) = ( 0.0096154 0.5000000 0.0096154), wk = 0.0035211 k( 246) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0035211 k( 247) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0035211 k( 248) = ( 0.5000000 0.5000000 0.0135135), wk = 0.0035211 k( 249) = ( 0.5000000 0.5000000 0.0270270), wk = 0.0035211 k( 250) = ( 0.5000000 0.5000000 0.0405405), wk = 0.0035211 k( 251) = ( 0.5000000 0.5000000 0.0540540), wk = 0.0035211 k( 252) = ( 0.5000000 0.5000000 0.0675676), wk = 0.0035211 k( 253) = ( 0.5000000 0.5000000 0.0810811), wk = 0.0035211 k( 254) = ( 0.5000000 0.5000000 0.0945946), wk = 0.0035211 k( 255) = ( 0.5000000 0.5000000 0.1081081), wk = 0.0035211 k( 256) = ( 0.5000000 0.5000000 0.1216216), wk = 0.0035211 k( 257) = ( 0.5000000 0.5000000 0.1351351), wk = 0.0035211 k( 258) = ( 0.5000000 0.5000000 0.1486486), wk = 0.0035211 k( 259) = ( 0.5000000 0.5000000 0.1621622), wk = 0.0035211 k( 260) = ( 0.5000000 0.5000000 0.1756757), wk = 0.0035211 k( 261) = ( 0.5000000 0.5000000 0.1891892), wk = 0.0035211 k( 262) = ( 0.5000000 0.5000000 0.2027027), wk = 0.0035211 k( 263) = ( 0.5000000 0.5000000 0.2162162), wk = 0.0035211 k( 264) = ( 0.5000000 0.5000000 0.2297297), wk = 0.0035211 k( 265) = ( 0.5000000 0.5000000 0.2432432), wk = 0.0035211 k( 266) = ( 0.5000000 0.5000000 0.2567568), wk = 0.0035211 k( 267) = ( 0.5000000 0.5000000 0.2702703), wk = 0.0035211 k( 268) = ( 0.5000000 0.5000000 0.2837838), wk = 0.0035211 k( 269) = ( 0.5000000 0.5000000 0.2972973), wk = 0.0035211 k( 270) = ( 0.5000000 0.5000000 0.3108108), wk = 0.0035211 k( 271) = ( 0.5000000 0.5000000 0.3243243), wk = 0.0035211 k( 272) = ( 0.5000000 0.5000000 0.3378378), wk = 0.0035211 k( 273) = ( 0.5000000 0.5000000 0.3513513), wk = 0.0035211 k( 274) = ( 0.5000000 0.5000000 0.3648649), wk = 0.0035211 k( 275) = ( 0.5000000 0.5000000 0.3783784), wk = 0.0035211 k( 276) = ( 0.5000000 0.5000000 0.3918919), wk = 0.0035211 k( 277) = ( 0.5000000 0.5000000 0.4054054), wk = 0.0035211 k( 278) = ( 0.5000000 0.5000000 0.4189189), wk = 0.0035211 k( 279) = ( 0.5000000 0.5000000 0.4324324), wk = 0.0035211 k( 280) = ( 0.5000000 0.5000000 0.4459459), wk = 0.0035211 k( 281) = ( 0.5000000 0.5000000 0.4594595), wk = 0.0035211 k( 282) = ( 0.5000000 0.5000000 0.4729730), wk = 0.0035211 k( 283) = ( 0.5000000 0.5000000 0.4864865), wk = 0.0035211 k( 284) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035211 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 2) = ( 0.0000000 0.0135135 0.0000000), wk = 0.0035211 k( 3) = ( 0.0000000 0.0270270 0.0000000), wk = 0.0035211 k( 4) = ( 0.0000000 0.0405405 0.0000000), wk = 0.0035211 k( 5) = ( 0.0000000 0.0540540 0.0000000), wk = 0.0035211 k( 6) = ( 0.0000000 0.0675676 0.0000000), wk = 0.0035211 k( 7) = ( 0.0000000 0.0810811 0.0000000), wk = 0.0035211 k( 8) = ( 0.0000000 0.0945946 0.0000000), wk = 0.0035211 k( 9) = ( 0.0000000 0.1081081 0.0000000), wk = 0.0035211 k( 10) = ( 0.0000000 0.1216216 0.0000000), wk = 0.0035211 k( 11) = ( 0.0000000 0.1351351 0.0000000), wk = 0.0035211 k( 12) = ( 0.0000000 0.1486486 0.0000000), wk = 0.0035211 k( 13) = ( 0.0000000 0.1621622 0.0000000), wk = 0.0035211 k( 14) = ( 0.0000000 0.1756757 0.0000000), wk = 0.0035211 k( 15) = ( 0.0000000 0.1891892 0.0000000), wk = 0.0035211 k( 16) = ( 0.0000000 0.2027027 0.0000000), wk = 0.0035211 k( 17) = ( 0.0000000 0.2162162 0.0000000), wk = 0.0035211 k( 18) = ( 0.0000000 0.2297297 0.0000000), wk = 0.0035211 k( 19) = ( 0.0000000 0.2432432 0.0000000), wk = 0.0035211 k( 20) = ( 0.0000000 0.2567568 0.0000000), wk = 0.0035211 k( 21) = ( 0.0000000 0.2702703 0.0000000), wk = 0.0035211 k( 22) = ( 0.0000000 0.2837838 0.0000000), wk = 0.0035211 k( 23) = ( 0.0000000 0.2972973 0.0000000), wk = 0.0035211 k( 24) = ( 0.0000000 0.3108108 0.0000000), wk = 0.0035211 k( 25) = ( 0.0000000 0.3243243 0.0000000), wk = 0.0035211 k( 26) = ( 0.0000000 0.3378378 0.0000000), wk = 0.0035211 k( 27) = ( 0.0000000 0.3513514 0.0000000), wk = 0.0035211 k( 28) = ( 0.0000000 0.3648649 0.0000000), wk = 0.0035211 k( 29) = ( 0.0000000 0.3783784 0.0000000), wk = 0.0035211 k( 30) = ( 0.0000000 0.3918919 0.0000000), wk = 0.0035211 k( 31) = ( 0.0000000 0.4054054 0.0000000), wk = 0.0035211 k( 32) = ( 0.0000000 0.4189189 0.0000000), wk = 0.0035211 k( 33) = ( 0.0000000 0.4324324 0.0000000), wk = 0.0035211 k( 34) = ( 0.0000000 0.4459459 0.0000000), wk = 0.0035211 k( 35) = ( 0.0000000 0.4594595 0.0000000), wk = 0.0035211 k( 36) = ( 0.0000000 0.4729730 0.0000000), wk = 0.0035211 k( 37) = ( 0.0000000 0.4864865 0.0000000), wk = 0.0035211 k( 38) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0035211 k( 39) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0035211 k( 40) = ( 0.0135135 0.5000000 0.0000000), wk = 0.0035211 k( 41) = ( 0.0270270 0.5000000 0.0000000), wk = 0.0035211 k( 42) = ( 0.0405405 0.5000000 0.0000000), wk = 0.0035211 k( 43) = ( 0.0540540 0.5000000 0.0000000), wk = 0.0035211 k( 44) = ( 0.0675676 0.5000000 0.0000000), wk = 0.0035211 k( 45) = ( 0.0810811 0.5000000 0.0000000), wk = 0.0035211 k( 46) = ( 0.0945946 0.5000000 0.0000000), wk = 0.0035211 k( 47) = ( 0.1081081 0.5000000 0.0000000), wk = 0.0035211 k( 48) = ( 0.1216216 0.5000000 0.0000000), wk = 0.0035211 k( 49) = ( 0.1351351 0.5000000 0.0000000), wk = 0.0035211 k( 50) = ( 0.1486486 0.5000000 0.0000000), wk = 0.0035211 k( 51) = ( 0.1621622 0.5000000 0.0000000), wk = 0.0035211 k( 52) = ( 0.1756757 0.5000000 0.0000000), wk = 0.0035211 k( 53) = ( 0.1891892 0.5000000 0.0000000), wk = 0.0035211 k( 54) = ( 0.2027027 0.5000000 0.0000000), wk = 0.0035211 k( 55) = ( 0.2162162 0.5000000 0.0000000), wk = 0.0035211 k( 56) = ( 0.2297297 0.5000000 0.0000000), wk = 0.0035211 k( 57) = ( 0.2432432 0.5000000 0.0000000), wk = 0.0035211 k( 58) = ( 0.2567568 0.5000000 0.0000000), wk = 0.0035211 k( 59) = ( 0.2702703 0.5000000 0.0000000), wk = 0.0035211 k( 60) = ( 0.2837838 0.5000000 0.0000000), wk = 0.0035211 k( 61) = ( 0.2972973 0.5000000 0.0000000), wk = 0.0035211 k( 62) = ( 0.3108108 0.5000000 -0.0000000), wk = 0.0035211 k( 63) = ( 0.3243243 0.5000000 0.0000000), wk = 0.0035211 k( 64) = ( 0.3378378 0.5000000 0.0000000), wk = 0.0035211 k( 65) = ( 0.3513514 0.5000000 -0.0000000), wk = 0.0035211 k( 66) = ( 0.3648649 0.5000000 0.0000000), wk = 0.0035211 k( 67) = ( 0.3783784 0.5000000 0.0000000), wk = 0.0035211 k( 68) = ( 0.3918919 0.5000000 -0.0000000), wk = 0.0035211 k( 69) = ( 0.4054054 0.5000000 0.0000000), wk = 0.0035211 k( 70) = ( 0.4189189 0.5000000 0.0000000), wk = 0.0035211 k( 71) = ( 0.4324324 0.5000000 0.0000000), wk = 0.0035211 k( 72) = ( 0.4459459 0.5000000 0.0000000), wk = 0.0035211 k( 73) = ( 0.4594595 0.5000000 0.0000000), wk = 0.0035211 k( 74) = ( 0.4729730 0.5000000 0.0000000), wk = 0.0035211 k( 75) = ( 0.4864865 0.5000000 0.0000000), wk = 0.0035211 k( 76) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0035211 k( 77) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0035211 k( 78) = ( 0.4903846 0.4903846 0.0000000), wk = 0.0035211 k( 79) = ( 0.4807692 0.4807692 0.0000000), wk = 0.0035211 k( 80) = ( 0.4711538 0.4711538 0.0000000), wk = 0.0035211 k( 81) = ( 0.4615385 0.4615385 -0.0000000), wk = 0.0035211 k( 82) = ( 0.4519231 0.4519231 0.0000000), wk = 0.0035211 k( 83) = ( 0.4423077 0.4423077 0.0000000), wk = 0.0035211 k( 84) = ( 0.4326923 0.4326923 0.0000000), wk = 0.0035211 k( 85) = ( 0.4230769 0.4230769 0.0000000), wk = 0.0035211 k( 86) = ( 0.4134615 0.4134615 0.0000000), wk = 0.0035211 k( 87) = ( 0.4038462 0.4038462 0.0000000), wk = 0.0035211 k( 88) = ( 0.3942308 0.3942308 0.0000000), wk = 0.0035211 k( 89) = ( 0.3846154 0.3846154 0.0000000), wk = 0.0035211 k( 90) = ( 0.3750000 0.3750000 0.0000000), wk = 0.0035211 k( 91) = ( 0.3653846 0.3653846 0.0000000), wk = 0.0035211 k( 92) = ( 0.3557692 0.3557692 0.0000000), wk = 0.0035211 k( 93) = ( 0.3461538 0.3461538 -0.0000000), wk = 0.0035211 k( 94) = ( 0.3365385 0.3365385 0.0000000), wk = 0.0035211 k( 95) = ( 0.3269231 0.3269231 0.0000000), wk = 0.0035211 k( 96) = ( 0.3173077 0.3173077 -0.0000000), wk = 0.0035211 k( 97) = ( 0.3076923 0.3076923 0.0000000), wk = 0.0035211 k( 98) = ( 0.2980769 0.2980769 0.0000000), wk = 0.0035211 k( 99) = ( 0.2884615 0.2884615 0.0000000), wk = 0.0035211 k( 100) = ( 0.2788462 0.2788462 0.0000000), wk = 0.0035211 k( 101) = ( 0.2692308 0.2692308 0.0000000), wk = 0.0035211 k( 102) = ( 0.2596154 0.2596154 0.0000000), wk = 0.0035211 k( 103) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0035211 k( 104) = ( 0.2403846 0.2403846 -0.0000000), wk = 0.0035211 k( 105) = ( 0.2307692 0.2307692 -0.0000000), wk = 0.0035211 k( 106) = ( 0.2211539 0.2211539 0.0000000), wk = 0.0035211 k( 107) = ( 0.2115385 0.2115385 0.0000000), wk = 0.0035211 k( 108) = ( 0.2019231 0.2019231 0.0000000), wk = 0.0035211 k( 109) = ( 0.1923077 0.1923077 0.0000000), wk = 0.0035211 k( 110) = ( 0.1826923 0.1826923 0.0000000), wk = 0.0035211 k( 111) = ( 0.1730769 0.1730769 0.0000000), wk = 0.0035211 k( 112) = ( 0.1634615 0.1634615 0.0000000), wk = 0.0035211 k( 113) = ( 0.1538461 0.1538461 0.0000000), wk = 0.0035211 k( 114) = ( 0.1442308 0.1442308 0.0000000), wk = 0.0035211 k( 115) = ( 0.1346154 0.1346154 0.0000000), wk = 0.0035211 k( 116) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0035211 k( 117) = ( 0.1153846 0.1153846 0.0000000), wk = 0.0035211 k( 118) = ( 0.1057692 0.1057692 0.0000000), wk = 0.0035211 k( 119) = ( 0.0961538 0.0961538 0.0000000), wk = 0.0035211 k( 120) = ( 0.0865385 0.0865385 0.0000000), wk = 0.0035211 k( 121) = ( 0.0769231 0.0769231 0.0000000), wk = 0.0035211 k( 122) = ( 0.0673077 0.0673077 0.0000000), wk = 0.0035211 k( 123) = ( 0.0576923 0.0576923 0.0000000), wk = 0.0035211 k( 124) = ( 0.0480769 0.0480769 0.0000000), wk = 0.0035211 k( 125) = ( 0.0384615 0.0384615 0.0000000), wk = 0.0035211 k( 126) = ( 0.0288462 0.0288462 0.0000000), wk = 0.0035211 k( 127) = ( 0.0192308 0.0192308 0.0000000), wk = 0.0035211 k( 128) = ( 0.0096154 0.0096154 0.0000000), wk = 0.0035211 k( 129) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 130) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035211 k( 131) = ( 0.0079365 0.0079365 0.0079365), wk = 0.0035211 k( 132) = ( 0.0158730 0.0158730 0.0158730), wk = 0.0035211 k( 133) = ( 0.0238095 0.0238095 0.0238095), wk = 0.0035211 k( 134) = ( 0.0317460 0.0317460 0.0317460), wk = 0.0035211 k( 135) = ( 0.0396825 0.0396825 0.0396825), wk = 0.0035211 k( 136) = ( 0.0476191 0.0476191 0.0476191), wk = 0.0035211 k( 137) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0035211 k( 138) = ( 0.0634921 0.0634921 0.0634921), wk = 0.0035211 k( 139) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0035211 k( 140) = ( 0.0793651 0.0793651 0.0793651), wk = 0.0035211 k( 141) = ( 0.0873016 0.0873016 0.0873016), wk = 0.0035211 k( 142) = ( 0.0952381 0.0952381 0.0952381), wk = 0.0035211 k( 143) = ( 0.1031746 0.1031746 0.1031746), wk = 0.0035211 k( 144) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0035211 k( 145) = ( 0.1190476 0.1190476 0.1190476), wk = 0.0035211 k( 146) = ( 0.1269841 0.1269841 0.1269841), wk = 0.0035211 k( 147) = ( 0.1349206 0.1349206 0.1349206), wk = 0.0035211 k( 148) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0035211 k( 149) = ( 0.1507937 0.1507937 0.1507937), wk = 0.0035211 k( 150) = ( 0.1587302 0.1587302 0.1587302), wk = 0.0035211 k( 151) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0035211 k( 152) = ( 0.1746032 0.1746032 0.1746032), wk = 0.0035211 k( 153) = ( 0.1825397 0.1825397 0.1825397), wk = 0.0035211 k( 154) = ( 0.1904762 0.1904762 0.1904762), wk = 0.0035211 k( 155) = ( 0.1984127 0.1984127 0.1984127), wk = 0.0035211 k( 156) = ( 0.2063492 0.2063492 0.2063492), wk = 0.0035211 k( 157) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0035211 k( 158) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0035211 k( 159) = ( 0.2301587 0.2301587 0.2301587), wk = 0.0035211 k( 160) = ( 0.2380952 0.2380952 0.2380952), wk = 0.0035211 k( 161) = ( 0.2460317 0.2460317 0.2460317), wk = 0.0035211 k( 162) = ( 0.2539683 0.2539683 0.2539683), wk = 0.0035211 k( 163) = ( 0.2619048 0.2619048 0.2619048), wk = 0.0035211 k( 164) = ( 0.2698413 0.2698413 0.2698413), wk = 0.0035211 k( 165) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0035211 k( 166) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0035211 k( 167) = ( 0.2936508 0.2936508 0.2936508), wk = 0.0035211 k( 168) = ( 0.3015873 0.3015873 0.3015873), wk = 0.0035211 k( 169) = ( 0.3095238 0.3095238 0.3095238), wk = 0.0035211 k( 170) = ( 0.3174603 0.3174603 0.3174603), wk = 0.0035211 k( 171) = ( 0.3253968 0.3253968 0.3253968), wk = 0.0035211 k( 172) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0035211 k( 173) = ( 0.3412698 0.3412698 0.3412698), wk = 0.0035211 k( 174) = ( 0.3492063 0.3492063 0.3492063), wk = 0.0035211 k( 175) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0035211 k( 176) = ( 0.3650794 0.3650794 0.3650794), wk = 0.0035211 k( 177) = ( 0.3730159 0.3730159 0.3730159), wk = 0.0035211 k( 178) = ( 0.3809524 0.3809524 0.3809524), wk = 0.0035211 k( 179) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0035211 k( 180) = ( 0.3968254 0.3968254 0.3968254), wk = 0.0035211 k( 181) = ( 0.4047619 0.4047619 0.4047619), wk = 0.0035211 k( 182) = ( 0.4126984 0.4126984 0.4126984), wk = 0.0035211 k( 183) = ( 0.4206349 0.4206349 0.4206349), wk = 0.0035211 k( 184) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0035211 k( 185) = ( 0.4365079 0.4365079 0.4365079), wk = 0.0035211 k( 186) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0035211 k( 187) = ( 0.4523810 0.4523810 0.4523810), wk = 0.0035211 k( 188) = ( 0.4603175 0.4603175 0.4603175), wk = 0.0035211 k( 189) = ( 0.4682540 0.4682540 0.4682540), wk = 0.0035211 k( 190) = ( 0.4761905 0.4761905 0.4761905), wk = 0.0035211 k( 191) = ( 0.4841270 0.4841270 0.4841270), wk = 0.0035211 k( 192) = ( 0.4920635 0.4920635 0.4920635), wk = 0.0035211 k( 193) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035211 k( 194) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035211 k( 195) = ( 0.4903846 0.5000000 0.4903846), wk = 0.0035211 k( 196) = ( 0.4807692 0.5000000 0.4807692), wk = 0.0035211 k( 197) = ( 0.4711538 0.5000000 0.4711538), wk = 0.0035211 k( 198) = ( 0.4615385 0.5000000 0.4615385), wk = 0.0035211 k( 199) = ( 0.4519231 0.5000000 0.4519231), wk = 0.0035211 k( 200) = ( 0.4423077 0.5000000 0.4423077), wk = 0.0035211 k( 201) = ( 0.4326923 0.5000000 0.4326923), wk = 0.0035211 k( 202) = ( 0.4230769 0.5000000 0.4230769), wk = 0.0035211 k( 203) = ( 0.4134615 0.5000000 0.4134615), wk = 0.0035211 k( 204) = ( 0.4038462 0.5000000 0.4038462), wk = 0.0035211 k( 205) = ( 0.3942308 0.5000000 0.3942308), wk = 0.0035211 k( 206) = ( 0.3846154 0.5000000 0.3846154), wk = 0.0035211 k( 207) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0035211 k( 208) = ( 0.3653846 0.5000000 0.3653846), wk = 0.0035211 k( 209) = ( 0.3557692 0.5000000 0.3557692), wk = 0.0035211 k( 210) = ( 0.3461538 0.5000000 0.3461538), wk = 0.0035211 k( 211) = ( 0.3365385 0.5000000 0.3365385), wk = 0.0035211 k( 212) = ( 0.3269231 0.5000000 0.3269231), wk = 0.0035211 k( 213) = ( 0.3173077 0.5000000 0.3173077), wk = 0.0035211 k( 214) = ( 0.3076923 0.5000000 0.3076923), wk = 0.0035211 k( 215) = ( 0.2980769 0.5000000 0.2980769), wk = 0.0035211 k( 216) = ( 0.2884615 0.5000000 0.2884615), wk = 0.0035211 k( 217) = ( 0.2788462 0.5000000 0.2788462), wk = 0.0035211 k( 218) = ( 0.2692308 0.5000000 0.2692308), wk = 0.0035211 k( 219) = ( 0.2596154 0.5000000 0.2596154), wk = 0.0035211 k( 220) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0035211 k( 221) = ( 0.2403846 0.5000000 0.2403846), wk = 0.0035211 k( 222) = ( 0.2307692 0.5000000 0.2307692), wk = 0.0035211 k( 223) = ( 0.2211539 0.5000000 0.2211539), wk = 0.0035211 k( 224) = ( 0.2115385 0.5000000 0.2115385), wk = 0.0035211 k( 225) = ( 0.2019231 0.5000000 0.2019231), wk = 0.0035211 k( 226) = ( 0.1923077 0.5000000 0.1923077), wk = 0.0035211 k( 227) = ( 0.1826923 0.5000000 0.1826923), wk = 0.0035211 k( 228) = ( 0.1730769 0.5000000 0.1730769), wk = 0.0035211 k( 229) = ( 0.1634615 0.5000000 0.1634615), wk = 0.0035211 k( 230) = ( 0.1538461 0.5000000 0.1538461), wk = 0.0035211 k( 231) = ( 0.1442308 0.5000000 0.1442308), wk = 0.0035211 k( 232) = ( 0.1346154 0.5000000 0.1346154), wk = 0.0035211 k( 233) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0035211 k( 234) = ( 0.1153846 0.5000000 0.1153846), wk = 0.0035211 k( 235) = ( 0.1057692 0.5000000 0.1057692), wk = 0.0035211 k( 236) = ( 0.0961538 0.5000000 0.0961538), wk = 0.0035211 k( 237) = ( 0.0865385 0.5000000 0.0865385), wk = 0.0035211 k( 238) = ( 0.0769231 0.5000000 0.0769231), wk = 0.0035211 k( 239) = ( 0.0673077 0.5000000 0.0673077), wk = 0.0035211 k( 240) = ( 0.0576923 0.5000000 0.0576923), wk = 0.0035211 k( 241) = ( 0.0480769 0.5000000 0.0480769), wk = 0.0035211 k( 242) = ( 0.0384615 0.5000000 0.0384615), wk = 0.0035211 k( 243) = ( 0.0288462 0.5000000 0.0288462), wk = 0.0035211 k( 244) = ( 0.0192308 0.5000000 0.0192308), wk = 0.0035211 k( 245) = ( 0.0096154 0.5000000 0.0096154), wk = 0.0035211 k( 246) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0035211 k( 247) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0035211 k( 248) = ( 0.5000000 0.5000000 0.0135135), wk = 0.0035211 k( 249) = ( 0.5000000 0.5000000 0.0270270), wk = 0.0035211 k( 250) = ( 0.5000000 0.5000000 0.0405405), wk = 0.0035211 k( 251) = ( 0.5000000 0.5000000 0.0540540), wk = 0.0035211 k( 252) = ( 0.5000000 0.5000000 0.0675676), wk = 0.0035211 k( 253) = ( 0.5000000 0.5000000 0.0810811), wk = 0.0035211 k( 254) = ( 0.5000000 0.5000000 0.0945946), wk = 0.0035211 k( 255) = ( 0.5000000 0.5000000 0.1081081), wk = 0.0035211 k( 256) = ( 0.5000000 0.5000000 0.1216216), wk = 0.0035211 k( 257) = ( 0.5000000 0.5000000 0.1351351), wk = 0.0035211 k( 258) = ( 0.5000000 0.5000000 0.1486486), wk = 0.0035211 k( 259) = ( 0.5000000 0.5000000 0.1621622), wk = 0.0035211 k( 260) = ( 0.5000000 0.5000000 0.1756757), wk = 0.0035211 k( 261) = ( 0.5000000 0.5000000 0.1891892), wk = 0.0035211 k( 262) = ( 0.5000000 0.5000000 0.2027027), wk = 0.0035211 k( 263) = ( 0.5000000 0.5000000 0.2162162), wk = 0.0035211 k( 264) = ( 0.5000000 0.5000000 0.2297297), wk = 0.0035211 k( 265) = ( 0.5000000 0.5000000 0.2432432), wk = 0.0035211 k( 266) = ( 0.5000000 0.5000000 0.2567568), wk = 0.0035211 k( 267) = ( 0.5000000 0.5000000 0.2702703), wk = 0.0035211 k( 268) = ( 0.5000000 0.5000000 0.2837838), wk = 0.0035211 k( 269) = ( 0.5000000 0.5000000 0.2972973), wk = 0.0035211 k( 270) = ( 0.5000000 0.5000000 0.3108108), wk = 0.0035211 k( 271) = ( 0.5000000 0.5000000 0.3243243), wk = 0.0035211 k( 272) = ( 0.5000000 0.5000000 0.3378378), wk = 0.0035211 k( 273) = ( 0.5000000 0.5000000 0.3513514), wk = 0.0035211 k( 274) = ( 0.5000000 0.5000000 0.3648649), wk = 0.0035211 k( 275) = ( 0.5000000 0.5000000 0.3783784), wk = 0.0035211 k( 276) = ( 0.5000000 0.5000000 0.3918919), wk = 0.0035211 k( 277) = ( 0.5000000 0.5000000 0.4054054), wk = 0.0035211 k( 278) = ( 0.5000000 0.5000000 0.4189189), wk = 0.0035211 k( 279) = ( 0.5000000 0.5000000 0.4324324), wk = 0.0035211 k( 280) = ( 0.5000000 0.5000000 0.4459459), wk = 0.0035211 k( 281) = ( 0.5000000 0.5000000 0.4594595), wk = 0.0035211 k( 282) = ( 0.5000000 0.5000000 0.4729730), wk = 0.0035211 k( 283) = ( 0.5000000 0.5000000 0.4864865), wk = 0.0035211 k( 284) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035211 Dense grid: 54531 G-vectors FFT dimensions: ( 48, 48, 48) Smooth grid: 21879 G-vectors FFT dimensions: ( 36, 36, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.14 Mb ( 122, 74) NL pseudopotentials 0.16 Mb ( 61, 172) Each V/rho on FFT grid 0.04 Mb ( 2304) Each G-vector array 0.01 Mb ( 1136) G-vector shells 0.00 Mb ( 312) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.55 Mb ( 122, 296) Each subspace H/S matrix 1.34 Mb ( 296, 296) Each matrix 0.39 Mb ( 172, 2, 74) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./Ga3BN4.save/charge-density.dat Starting wfc are 94 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 42.0 secs Computing kpt #: 2 total cpu time spent up to now is 45.5 secs Computing kpt #: 3 total cpu time spent up to now is 48.9 secs Computing kpt #: 4 total cpu time spent up to now is 52.2 secs Computing kpt #: 5 total cpu time spent up to now is 55.5 secs Computing kpt #: 6 total cpu time spent up to now is 58.6 secs Computing kpt #: 7 total cpu time spent up to now is 61.8 secs Computing kpt #: 8 total cpu time spent up to now is 64.9 secs Computing kpt #: 9 total cpu time spent up to now is 68.1 secs Computing kpt #: 10 total cpu time spent up to now is 71.2 secs Computing kpt #: 11 total cpu time spent up to now is 74.4 secs Computing kpt #: 12 total cpu time spent up to now is 77.9 secs Computing kpt #: 13 total cpu time spent up to now is 80.9 secs Computing kpt #: 14 total cpu time spent up to now is 83.9 secs Computing kpt #: 15 total cpu time spent up to now is 86.8 secs Computing kpt #: 16 total cpu time spent up to now is 89.8 secs Computing kpt #: 17 total cpu time spent up to now is 92.7 secs Computing kpt #: 18 total cpu time spent up to now is 95.3 secs Computing kpt #: 19 total cpu time spent up to now is 97.8 secs Computing kpt #: 20 total cpu time spent up to now is 100.2 secs Computing kpt #: 21 total cpu time spent up to now is 102.7 secs Computing kpt #: 22 total cpu time spent up to now is 105.0 secs Computing kpt #: 23 total cpu time spent up to now is 107.3 secs Computing kpt #: 24 total cpu time spent up to now is 109.6 secs Computing kpt #: 25 total cpu time spent up to now is 112.0 secs Computing kpt #: 26 total cpu time spent up to now is 114.3 secs Computing kpt #: 27 total cpu time spent up to now is 116.5 secs Computing kpt #: 28 total cpu time spent up to now is 118.8 secs Computing kpt #: 29 total cpu time spent up to now is 121.1 secs Computing kpt #: 30 total cpu time spent up to now is 123.3 secs Computing kpt #: 31 total cpu time spent up to now is 125.8 secs Computing kpt #: 32 total cpu time spent up to now is 127.7 secs Computing kpt #: 33 total cpu time spent up to now is 129.6 secs Computing kpt #: 34 total cpu time spent up to now is 131.7 secs Computing kpt #: 35 total cpu time spent up to now is 133.7 secs Computing kpt #: 36 total cpu time spent up to now is 135.7 secs Computing kpt #: 37 total cpu time spent up to now is 137.6 secs Computing kpt #: 38 total cpu time spent up to now is 139.6 secs Computing kpt #: 39 total cpu time spent up to now is 141.7 secs Computing kpt #: 40 total cpu time spent up to now is 143.8 secs Computing kpt #: 41 total cpu time spent up to now is 145.8 secs Computing kpt #: 42 total cpu time spent up to now is 147.8 secs Computing kpt #: 43 total cpu time spent up to now is 149.8 secs Computing kpt #: 44 total cpu time spent up to now is 152.0 secs Computing kpt #: 45 total cpu time spent up to now is 154.2 secs Computing kpt #: 46 total cpu time spent up to now is 156.6 secs Computing kpt #: 47 total cpu time spent up to now is 158.9 secs Computing kpt #: 48 total cpu time spent up to now is 161.2 secs Computing kpt #: 49 total cpu time spent up to now is 163.5 secs Computing kpt #: 50 total cpu time spent up to now is 165.8 secs Computing kpt #: 51 total cpu time spent up to now is 168.0 secs Computing kpt #: 52 total cpu time spent up to now is 170.5 secs Computing kpt #: 53 total cpu time spent up to now is 173.2 secs Computing kpt #: 54 total cpu time spent up to now is 175.8 secs Computing kpt #: 55 total cpu time spent up to now is 178.5 secs Computing kpt #: 56 total cpu time spent up to now is 181.4 secs Computing kpt #: 57 total cpu time spent up to now is 184.1 secs Computing kpt #: 58 total cpu time spent up to now is 186.9 secs Computing kpt #: 59 total cpu time spent up to now is 189.8 secs Computing kpt #: 60 total cpu time spent up to now is 192.6 secs Computing kpt #: 61 total cpu time spent up to now is 195.5 secs Computing kpt #: 62 total cpu time spent up to now is 198.5 secs Computing kpt #: 63 total cpu time spent up to now is 201.3 secs Computing kpt #: 64 total cpu time spent up to now is 204.1 secs Computing kpt #: 65 total cpu time spent up to now is 206.9 secs Computing kpt #: 66 total cpu time spent up to now is 210.0 secs Computing kpt #: 67 total cpu time spent up to now is 212.8 secs Computing kpt #: 68 total cpu time spent up to now is 215.6 secs Computing kpt #: 69 total cpu time spent up to now is 218.4 secs Computing kpt #: 70 total cpu time spent up to now is 221.4 secs Computing kpt #: 71 total cpu time spent up to now is 224.4 secs Computing kpt #: 72 total cpu time spent up to now is 227.3 secs Computing kpt #: 73 total cpu time spent up to now is 230.4 secs Computing kpt #: 74 total cpu time spent up to now is 233.6 secs Computing kpt #: 75 total cpu time spent up to now is 237.0 secs Computing kpt #: 76 total cpu time spent up to now is 240.4 secs Computing kpt #: 77 total cpu time spent up to now is 243.9 secs Computing kpt #: 78 total cpu time spent up to now is 247.6 secs Computing kpt #: 79 total cpu time spent up to now is 251.4 secs Computing kpt #: 80 total cpu time spent up to now is 255.0 secs Computing kpt #: 81 total cpu time spent up to now is 258.4 secs Computing kpt #: 82 total cpu time spent up to now is 261.8 secs Computing kpt #: 83 total cpu time spent up to now is 265.6 secs Computing kpt #: 84 total cpu time spent up to now is 269.0 secs Computing kpt #: 85 total cpu time spent up to now is 272.4 secs Computing kpt #: 86 total cpu time spent up to now is 276.0 secs Computing kpt #: 87 total cpu time spent up to now is 279.3 secs Computing kpt #: 88 total cpu time spent up to now is 282.7 secs Computing kpt #: 89 total cpu time spent up to now is 286.6 secs Computing kpt #: 90 total cpu time spent up to now is 290.0 secs Computing kpt #: 91 total cpu time spent up to now is 293.3 secs Computing kpt #: 92 total cpu time spent up to now is 296.9 secs Computing kpt #: 93 total cpu time spent up to now is 300.5 secs Computing kpt #: 94 total cpu time spent up to now is 304.2 secs Computing kpt #: 95 total cpu time spent up to now is 308.0 secs Computing kpt #: 96 total cpu time spent up to now is 311.7 secs Computing kpt #: 97 total cpu time spent up to now is 316.0 secs Computing kpt #: 98 total cpu time spent up to now is 319.9 secs Computing kpt #: 99 total cpu time spent up to now is 323.6 secs Computing kpt #: 100 total cpu time spent up to now is 327.3 secs Computing kpt #: 101 total cpu time spent up to now is 331.0 secs Computing kpt #: 102 total cpu time spent up to now is 334.7 secs Computing kpt #: 103 total cpu time spent up to now is 338.3 secs Computing kpt #: 104 total cpu time spent up to now is 342.2 secs Computing kpt #: 105 total cpu time spent up to now is 345.9 secs Computing kpt #: 106 total cpu time spent up to now is 349.4 secs Computing kpt #: 107 total cpu time spent up to now is 353.0 secs Computing kpt #: 108 total cpu time spent up to now is 356.7 secs Computing kpt #: 109 total cpu time spent up to now is 361.4 secs Computing kpt #: 110 total cpu time spent up to now is 366.4 secs Computing kpt #: 111 total cpu time spent up to now is 370.3 secs Computing kpt #: 112 total cpu time spent up to now is 373.9 secs Computing kpt #: 113 total cpu time spent up to now is 377.9 secs Computing kpt #: 114 total cpu time spent up to now is 381.9 secs Computing kpt #: 115 total cpu time spent up to now is 385.2 secs Computing kpt #: 116 total cpu time spent up to now is 388.7 secs Computing kpt #: 117 total cpu time spent up to now is 392.4 secs Computing kpt #: 118 total cpu time spent up to now is 395.8 secs Computing kpt #: 119 total cpu time spent up to now is 399.3 secs Computing kpt #: 120 total cpu time spent up to now is 402.6 secs Computing kpt #: 121 total cpu time spent up to now is 406.2 secs Computing kpt #: 122 total cpu time spent up to now is 409.8 secs Computing kpt #: 123 total cpu time spent up to now is 413.3 secs Computing kpt #: 124 total cpu time spent up to now is 416.7 secs Computing kpt #: 125 total cpu time spent up to now is 420.1 secs Computing kpt #: 126 total cpu time spent up to now is 423.5 secs Computing kpt #: 127 total cpu time spent up to now is 426.9 secs Computing kpt #: 128 total cpu time spent up to now is 430.3 secs Computing kpt #: 129 total cpu time spent up to now is 432.6 secs Computing kpt #: 130 total cpu time spent up to now is 434.8 secs Computing kpt #: 131 total cpu time spent up to now is 437.2 secs Computing kpt #: 132 total cpu time spent up to now is 439.4 secs Computing kpt #: 133 total cpu time spent up to now is 443.0 secs Computing kpt #: 134 total cpu time spent up to now is 446.4 secs Computing kpt #: 135 total cpu time spent up to now is 449.9 secs Computing kpt #: 136 total cpu time spent up to now is 453.3 secs Computing kpt #: 137 total cpu time spent up to now is 458.1 secs Computing kpt #: 138 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 464.3 secs Computing kpt #: 139 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 470.7 secs Computing kpt #: 140 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 476.9 secs Computing kpt #: 141 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 483.1 secs Computing kpt #: 142 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 489.3 secs Computing kpt #: 143 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 496.0 secs Computing kpt #: 144 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 502.4 secs Computing kpt #: 145 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 508.6 secs Computing kpt #: 146 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 515.0 secs Computing kpt #: 147 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 521.3 secs Computing kpt #: 148 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 527.7 secs Computing kpt #: 149 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 534.0 secs Computing kpt #: 150 total cpu time spent up to now is 539.0 secs Computing kpt #: 151 total cpu time spent up to now is 544.1 secs Computing kpt #: 152 total cpu time spent up to now is 548.0 secs Computing kpt #: 153 total cpu time spent up to now is 552.1 secs Computing kpt #: 154 total cpu time spent up to now is 556.3 secs Computing kpt #: 155 total cpu time spent up to now is 560.4 secs Computing kpt #: 156 total cpu time spent up to now is 564.5 secs Computing kpt #: 157 total cpu time spent up to now is 568.9 secs Computing kpt #: 158 total cpu time spent up to now is 574.4 secs Computing kpt #: 159 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 580.7 secs Computing kpt #: 160 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 588.2 secs Computing kpt #: 161 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 594.9 secs Computing kpt #: 162 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 601.3 secs Computing kpt #: 163 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 607.7 secs Computing kpt #: 164 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 613.9 secs Computing kpt #: 165 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 620.3 secs Computing kpt #: 166 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 626.6 secs Computing kpt #: 167 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 633.0 secs Computing kpt #: 168 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 639.2 secs Computing kpt #: 169 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 645.8 secs Computing kpt #: 170 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 652.1 secs Computing kpt #: 171 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 658.4 secs Computing kpt #: 172 total cpu time spent up to now is 664.3 secs Computing kpt #: 173 total cpu time spent up to now is 669.1 secs Computing kpt #: 174 total cpu time spent up to now is 674.1 secs Computing kpt #: 175 total cpu time spent up to now is 678.0 secs Computing kpt #: 176 total cpu time spent up to now is 682.7 secs Computing kpt #: 177 total cpu time spent up to now is 686.2 secs Computing kpt #: 178 total cpu time spent up to now is 689.8 secs Computing kpt #: 179 total cpu time spent up to now is 694.8 secs Computing kpt #: 180 total cpu time spent up to now is 698.4 secs Computing kpt #: 181 total cpu time spent up to now is 701.9 secs Computing kpt #: 182 total cpu time spent up to now is 705.4 secs Computing kpt #: 183 total cpu time spent up to now is 708.9 secs Computing kpt #: 184 total cpu time spent up to now is 712.3 secs Computing kpt #: 185 total cpu time spent up to now is 715.7 secs Computing kpt #: 186 total cpu time spent up to now is 719.1 secs Computing kpt #: 187 total cpu time spent up to now is 722.5 secs Computing kpt #: 188 total cpu time spent up to now is 726.0 secs Computing kpt #: 189 total cpu time spent up to now is 729.4 secs Computing kpt #: 190 total cpu time spent up to now is 732.6 secs Computing kpt #: 191 total cpu time spent up to now is 735.7 secs Computing kpt #: 192 total cpu time spent up to now is 739.1 secs Computing kpt #: 193 total cpu time spent up to now is 742.3 secs Computing kpt #: 194 total cpu time spent up to now is 745.6 secs Computing kpt #: 195 total cpu time spent up to now is 749.1 secs Computing kpt #: 196 total cpu time spent up to now is 752.4 secs Computing kpt #: 197 total cpu time spent up to now is 755.8 secs Computing kpt #: 198 total cpu time spent up to now is 759.1 secs Computing kpt #: 199 total cpu time spent up to now is 762.4 secs Computing kpt #: 200 total cpu time spent up to now is 765.8 secs Computing kpt #: 201 total cpu time spent up to now is 769.1 secs Computing kpt #: 202 total cpu time spent up to now is 772.3 secs Computing kpt #: 203 total cpu time spent up to now is 775.6 secs Computing kpt #: 204 total cpu time spent up to now is 778.7 secs Computing kpt #: 205 total cpu time spent up to now is 781.8 secs Computing kpt #: 206 total cpu time spent up to now is 784.8 secs Computing kpt #: 207 total cpu time spent up to now is 788.0 secs Computing kpt #: 208 total cpu time spent up to now is 791.0 secs Computing kpt #: 209 total cpu time spent up to now is 794.4 secs Computing kpt #: 210 total cpu time spent up to now is 797.5 secs Computing kpt #: 211 total cpu time spent up to now is 800.3 secs Computing kpt #: 212 total cpu time spent up to now is 803.5 secs Computing kpt #: 213 total cpu time spent up to now is 806.6 secs Computing kpt #: 214 total cpu time spent up to now is 809.9 secs Computing kpt #: 215 total cpu time spent up to now is 813.3 secs Computing kpt #: 216 total cpu time spent up to now is 816.6 secs Computing kpt #: 217 total cpu time spent up to now is 820.3 secs Computing kpt #: 218 total cpu time spent up to now is 824.1 secs Computing kpt #: 219 total cpu time spent up to now is 827.8 secs Computing kpt #: 220 total cpu time spent up to now is 831.5 secs Computing kpt #: 221 total cpu time spent up to now is 835.3 secs Computing kpt #: 222 total cpu time spent up to now is 839.2 secs Computing kpt #: 223 total cpu time spent up to now is 843.2 secs Computing kpt #: 224 total cpu time spent up to now is 848.3 secs Computing kpt #: 225 total cpu time spent up to now is 851.8 secs Computing kpt #: 226 total cpu time spent up to now is 855.2 secs Computing kpt #: 227 total cpu time spent up to now is 858.6 secs Computing kpt #: 228 total cpu time spent up to now is 861.6 secs Computing kpt #: 229 total cpu time spent up to now is 864.5 secs Computing kpt #: 230 total cpu time spent up to now is 867.5 secs Computing kpt #: 231 total cpu time spent up to now is 870.1 secs Computing kpt #: 232 total cpu time spent up to now is 872.6 secs Computing kpt #: 233 total cpu time spent up to now is 875.0 secs Computing kpt #: 234 total cpu time spent up to now is 877.5 secs Computing kpt #: 235 total cpu time spent up to now is 879.9 secs Computing kpt #: 236 total cpu time spent up to now is 882.4 secs Computing kpt #: 237 total cpu time spent up to now is 885.7 secs Computing kpt #: 238 total cpu time spent up to now is 888.7 secs Computing kpt #: 239 total cpu time spent up to now is 891.0 secs Computing kpt #: 240 total cpu time spent up to now is 893.2 secs Computing kpt #: 241 total cpu time spent up to now is 895.4 secs Computing kpt #: 242 total cpu time spent up to now is 897.6 secs Computing kpt #: 243 total cpu time spent up to now is 899.7 secs Computing kpt #: 244 total cpu time spent up to now is 901.6 secs Computing kpt #: 245 total cpu time spent up to now is 903.6 secs Computing kpt #: 246 total cpu time spent up to now is 905.6 secs Computing kpt #: 247 total cpu time spent up to now is 909.0 secs Computing kpt #: 248 total cpu time spent up to now is 915.1 secs Computing kpt #: 249 total cpu time spent up to now is 919.9 secs Computing kpt #: 250 total cpu time spent up to now is 923.2 secs Computing kpt #: 251 total cpu time spent up to now is 926.8 secs Computing kpt #: 252 total cpu time spent up to now is 930.1 secs Computing kpt #: 253 total cpu time spent up to now is 933.4 secs Computing kpt #: 254 total cpu time spent up to now is 936.8 secs Computing kpt #: 255 total cpu time spent up to now is 940.2 secs Computing kpt #: 256 total cpu time spent up to now is 943.6 secs Computing kpt #: 257 total cpu time spent up to now is 947.2 secs Computing kpt #: 258 total cpu time spent up to now is 950.5 secs Computing kpt #: 259 total cpu time spent up to now is 953.8 secs Computing kpt #: 260 total cpu time spent up to now is 957.0 secs Computing kpt #: 261 total cpu time spent up to now is 960.3 secs Computing kpt #: 262 total cpu time spent up to now is 963.8 secs Computing kpt #: 263 total cpu time spent up to now is 967.1 secs Computing kpt #: 264 total cpu time spent up to now is 970.4 secs Computing kpt #: 265 total cpu time spent up to now is 973.7 secs Computing kpt #: 266 total cpu time spent up to now is 977.1 secs Computing kpt #: 267 total cpu time spent up to now is 980.8 secs Computing kpt #: 268 total cpu time spent up to now is 984.4 secs Computing kpt #: 269 total cpu time spent up to now is 987.7 secs Computing kpt #: 270 total cpu time spent up to now is 991.0 secs Computing kpt #: 271 total cpu time spent up to now is 994.4 secs Computing kpt #: 272 total cpu time spent up to now is 997.7 secs Computing kpt #: 273 total cpu time spent up to now is 1001.0 secs Computing kpt #: 274 total cpu time spent up to now is 1004.3 secs Computing kpt #: 275 total cpu time spent up to now is 1007.6 secs Computing kpt #: 276 total cpu time spent up to now is 1010.8 secs Computing kpt #: 277 total cpu time spent up to now is 1014.1 secs Computing kpt #: 278 total cpu time spent up to now is 1017.5 secs Computing kpt #: 279 total cpu time spent up to now is 1020.7 secs Computing kpt #: 280 total cpu time spent up to now is 1023.7 secs Computing kpt #: 281 total cpu time spent up to now is 1027.0 secs Computing kpt #: 282 total cpu time spent up to now is 1030.2 secs Computing kpt #: 283 total cpu time spent up to now is 1033.5 secs Computing kpt #: 284 total cpu time spent up to now is 1036.3 secs ethr = 1.61E-11, avg # of iterations = 50.3 total cpu time spent up to now is 1036.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2777 PWs) bands (ev): -6.8716 -6.8716 -5.3178 -5.3178 -5.2914 -5.2914 -5.2914 -5.2914 -3.8223 -3.8223 -3.8223 -3.8223 -3.8220 -3.8220 -3.5276 -3.5276 -3.5276 -3.5276 -3.4977 -3.4977 -3.3279 -3.3279 -3.2926 -3.2926 -3.2926 -3.2926 -3.1927 -3.1927 -3.1748 -3.1748 -3.1748 -3.1748 -1.8436 -1.8436 -1.7958 -1.7958 -1.7958 -1.7958 3.0370 3.0370 3.2632 3.2632 3.2632 3.2632 6.4044 6.4044 6.4044 6.4044 6.4123 6.4123 6.8806 6.8806 6.8806 6.8806 6.9170 6.9170 9.7270 9.7270 9.7393 9.7393 9.7393 9.7393 12.2712 12.2712 13.1134 13.1134 13.1134 13.1134 13.1333 13.1333 15.3012 15.3012 17.4122 17.4122 k = 0.0000 0.0135-0.0000 ( 2749 PWs) bands (ev): -6.8707 -6.8707 -5.3179 -5.3179 -5.2925 -5.2925 -5.2903 -5.2903 -3.8234 -3.8234 -3.8219 -3.8219 -3.8206 -3.8206 -3.5299 -3.5299 -3.5257 -3.5257 -3.4970 -3.4970 -3.3280 -3.3280 -3.2946 -3.2946 -3.2905 -3.2905 -3.1931 -3.1931 -3.1749 -3.1749 -3.1744 -3.1744 -1.8442 -1.8442 -1.7981 -1.7981 -1.7944 -1.7944 3.0385 3.0385 3.2639 3.2639 3.2661 3.2661 6.4032 6.4032 6.4039 6.4039 6.4116 6.4116 6.8781 6.8781 6.8808 6.8808 6.9159 6.9159 9.7238 9.7238 9.7355 9.7355 9.7382 9.7382 12.2773 12.2773 13.1159 13.1159 13.1181 13.1181 13.1370 13.1370 15.3035 15.3035 17.4138 17.4138 k = 0.0000 0.0270-0.0000 ( 2749 PWs) bands (ev): -6.8682 -6.8682 -5.3184 -5.3184 -5.2940 -5.2940 -5.2895 -5.2895 -3.8246 -3.8246 -3.8217 -3.8217 -3.8190 -3.8190 -3.5328 -3.5328 -3.5244 -3.5244 -3.4960 -3.4960 -3.3282 -3.3282 -3.2967 -3.2967 -3.2885 -3.2885 -3.1942 -3.1942 -3.1752 -3.1752 -3.1738 -3.1738 -1.8466 -1.8466 -1.8024 -1.8024 -1.7921 -1.7921 3.0427 3.0427 3.2660 3.2660 3.2746 3.2746 6.3990 6.3990 6.4022 6.4022 6.4098 6.4098 6.8732 6.8732 6.8790 6.8790 6.9128 6.9128 9.7081 9.7081 9.7264 9.7264 9.7327 9.7327 12.2953 12.2953 13.1236 13.1236 13.1314 13.1314 13.1487 13.1487 15.3105 15.3105 17.4186 17.4186 k = 0.0000 0.0405-0.0000 ( 2749 PWs) bands (ev): -6.8640 -6.8640 -5.3193 -5.3193 -5.2959 -5.2959 -5.2887 -5.2887 -3.8257 -3.8257 -3.8213 -3.8213 -3.8173 -3.8173 -3.5362 -3.5362 -3.5234 -3.5234 -3.4944 -3.4944 -3.3286 -3.3286 -3.2988 -3.2988 -3.2865 -3.2865 -3.1959 -3.1959 -3.1758 -3.1758 -3.1730 -3.1730 -1.8524 -1.8524 -1.8073 -1.8073 -1.7886 -1.7886 3.0494 3.0494 3.2696 3.2696 3.2891 3.2891 6.3913 6.3913 6.3993 6.3993 6.4073 6.4073 6.8654 6.8654 6.8755 6.8755 6.9084 6.9084 9.6781 9.6781 9.7159 9.7159 9.7235 9.7235 12.3246 12.3246 13.1352 13.1352 13.1532 13.1532 13.1695 13.1695 15.3220 15.3220 17.4266 17.4266 k = 0.0000 0.0541-0.0000 ( 2749 PWs) bands (ev): -6.8582 -6.8582 -5.3205 -5.3205 -5.2981 -5.2981 -5.2880 -5.2880 -3.8266 -3.8266 -3.8208 -3.8208 -3.8154 -3.8154 -3.5399 -3.5399 -3.5228 -3.5228 -3.4923 -3.4923 -3.3291 -3.3291 -3.3010 -3.3010 -3.2845 -3.2845 -3.1980 -3.1980 -3.1766 -3.1766 -3.1722 -3.1722 -1.8641 -1.8641 -1.8105 -1.8105 -1.7838 -1.7838 3.0580 3.0580 3.2746 3.2746 3.3098 3.3098 6.3800 6.3800 6.3950 6.3950 6.4040 6.4040 6.8542 6.8542 6.8710 6.8710 6.9034 6.9034 9.6360 9.6360 9.7024 9.7024 9.7108 9.7108 12.3643 12.3643 13.1504 13.1504 13.1837 13.1837 13.1995 13.1995 15.3380 15.3380 17.4378 17.4378 k = 0.0000 0.0676-0.0000 ( 2741 PWs) bands (ev): -6.8507 -6.8507 -5.3222 -5.3222 -5.3007 -5.3007 -5.2873 -5.2873 -3.8275 -3.8275 -3.8199 -3.8199 -3.8135 -3.8135 -3.5440 -3.5440 -3.5225 -3.5225 -3.4900 -3.4900 -3.3298 -3.3298 -3.3031 -3.3031 -3.2826 -3.2826 -3.2005 -3.2005 -3.1775 -3.1775 -3.1713 -3.1713 -1.8826 -1.8826 -1.8107 -1.8107 -1.7777 -1.7777 3.0682 3.0682 3.2810 3.2810 3.3371 3.3371 6.3655 6.3655 6.3887 6.3887 6.3993 6.3993 6.8390 6.8390 6.8661 6.8661 6.8987 6.8987 9.5835 9.5835 9.6857 9.6857 9.6945 9.6945 12.4130 12.4130 13.1695 13.1695 13.2225 13.2225 13.2384 13.2384 15.3584 15.3584 17.4522 17.4522 k = 0.0000 0.0811-0.0000 ( 2729 PWs) bands (ev): -6.8416 -6.8416 -5.3245 -5.3245 -5.3035 -5.3035 -5.2864 -5.2864 -3.8282 -3.8282 -3.8190 -3.8190 -3.8113 -3.8113 -3.5484 -3.5484 -3.5224 -3.5224 -3.4874 -3.4874 -3.3306 -3.3306 -3.3052 -3.3052 -3.2807 -3.2807 -3.2033 -3.2033 -3.1787 -3.1787 -3.1704 -3.1704 -1.9070 -1.9070 -1.8084 -1.8084 -1.7705 -1.7705 3.0794 3.0794 3.2888 3.2888 3.3711 3.3711 6.3478 6.3478 6.3804 6.3804 6.3928 6.3928 6.8198 6.8198 6.8618 6.8618 6.8951 6.8951 9.5218 9.5218 9.6654 9.6654 9.6748 9.6748 12.4694 12.4694 13.1928 13.1928 13.2696 13.2696 13.2858 13.2858 15.3828 15.3828 17.4696 17.4696 k = 0.0000 0.0946-0.0000 ( 2737 PWs) bands (ev): -6.8308 -6.8308 -5.3275 -5.3275 -5.3064 -5.3064 -5.2857 -5.2857 -3.8289 -3.8289 -3.8181 -3.8181 -3.8091 -3.8091 -3.5531 -3.5531 -3.5225 -3.5225 -3.4848 -3.4848 -3.3316 -3.3316 -3.3074 -3.3074 -3.2788 -3.2788 -3.2063 -3.2063 -3.1800 -3.1800 -3.1697 -3.1697 -1.9365 -1.9365 -1.8043 -1.8043 -1.7623 -1.7623 3.0913 3.0913 3.2979 3.2979 3.4118 3.4118 6.3272 6.3272 6.3693 6.3693 6.3838 6.3838 6.7967 6.7967 6.8586 6.8586 6.8930 6.8930 9.4520 9.4520 9.6416 9.6416 9.6515 9.6515 12.5321 12.5321 13.2206 13.2206 13.3245 13.3245 13.3412 13.3412 15.4110 15.4110 17.4901 17.4901 k = 0.0000 0.1081-0.0000 ( 2733 PWs) bands (ev): -6.8184 -6.8184 -5.3315 -5.3315 -5.3092 -5.3092 -5.2849 -5.2849 -3.8294 -3.8294 -3.8169 -3.8169 -3.8068 -3.8068 -3.5580 -3.5580 -3.5227 -3.5227 -3.4819 -3.4819 -3.3328 -3.3328 -3.3095 -3.3095 -3.2769 -3.2769 -3.2094 -3.2094 -3.1815 -3.1815 -3.1692 -3.1692 -1.9702 -1.9702 -1.7989 -1.7989 -1.7531 -1.7531 3.1037 3.1037 3.3084 3.3084 3.4590 3.4590 6.3038 6.3038 6.3553 6.3553 6.3720 6.3720 6.7700 6.7700 6.8575 6.8575 6.8930 6.8930 9.3755 9.3755 9.6146 9.6146 9.6251 9.6251 12.5996 12.5996 13.2531 13.2531 13.3871 13.3871 13.4043 13.4043 15.4428 15.4428 17.5134 17.5134 k = 0.0000 0.1216-0.0000 ( 2733 PWs) bands (ev): -6.8044 -6.8044 -5.3366 -5.3366 -5.3119 -5.3119 -5.2841 -5.2841 -3.8298 -3.8298 -3.8155 -3.8155 -3.8043 -3.8043 -3.5632 -3.5632 -3.5230 -3.5230 -3.4790 -3.4790 -3.3341 -3.3341 -3.3115 -3.3115 -3.2750 -3.2750 -3.2128 -3.2128 -3.1830 -3.1830 -3.1689 -3.1689 -2.0076 -2.0076 -1.7923 -1.7923 -1.7431 -1.7431 3.1164 3.1164 3.3202 3.3202 3.5126 3.5126 6.2777 6.2777 6.3379 6.3379 6.3570 6.3570 6.7399 6.7399 6.8590 6.8590 6.8957 6.8957 9.2932 9.2932 9.5844 9.5844 9.5955 9.5955 12.6706 12.6706 13.2908 13.2908 13.4569 13.4569 13.4747 13.4747 15.4778 15.4778 17.5395 17.5395 k = 0.0000 0.1351-0.0000 ( 2729 PWs) bands (ev): -6.7889 -6.7889 -5.3429 -5.3429 -5.3143 -5.3143 -5.2833 -5.2833 -3.8301 -3.8301 -3.8140 -3.8140 -3.8017 -3.8017 -3.5686 -3.5686 -3.5235 -3.5235 -3.4761 -3.4761 -3.3356 -3.3356 -3.3135 -3.3135 -3.2731 -3.2731 -3.2162 -3.2162 -3.1847 -3.1847 -3.1687 -3.1687 -2.0481 -2.0481 -1.7848 -1.7848 -1.7322 -1.7322 3.1296 3.1296 3.3333 3.3333 3.5721 3.5721 6.2493 6.2493 6.3171 6.3171 6.3386 6.3386 6.7067 6.7067 6.8637 6.8637 6.9013 6.9013 9.2058 9.2058 9.5511 9.5511 9.5628 9.5628 12.7436 12.7436 13.3340 13.3340 13.5336 13.5336 13.5519 13.5519 15.5157 15.5157 17.5682 17.5682 k = 0.0000 0.1486-0.0000 ( 2729 PWs) bands (ev): -6.7718 -6.7718 -5.3503 -5.3503 -5.3164 -5.3164 -5.2825 -5.2825 -3.8303 -3.8303 -3.8124 -3.8124 -3.7989 -3.7989 -3.5742 -3.5742 -3.5240 -3.5240 -3.4731 -3.4731 -3.3372 -3.3372 -3.3155 -3.3155 -3.2711 -3.2711 -3.2198 -3.2198 -3.1864 -3.1864 -3.1688 -3.1688 -2.0913 -2.0913 -1.7764 -1.7764 -1.7207 -1.7207 3.1432 3.1432 3.3477 3.3477 3.6370 3.6370 6.2186 6.2186 6.2930 6.2930 6.3167 6.3167 6.6707 6.6707 6.8719 6.8719 6.9100 6.9100 9.1143 9.1143 9.5148 9.5148 9.5272 9.5272 12.8175 12.8175 13.3829 13.3829 13.6168 13.6168 13.6356 13.6356 15.5560 15.5560 17.5989 17.5989 k = 0.0000 0.1622-0.0000 ( 2729 PWs) bands (ev): -6.7532 -6.7532 -5.3589 -5.3589 -5.3183 -5.3183 -5.2818 -5.2818 -3.8303 -3.8303 -3.8106 -3.8106 -3.7960 -3.7960 -3.5800 -3.5800 -3.5248 -3.5248 -3.4700 -3.4700 -3.3389 -3.3389 -3.3174 -3.3174 -3.2692 -3.2692 -3.2234 -3.2234 -3.1882 -3.1882 -3.1691 -3.1691 -2.1369 -2.1369 -1.7673 -1.7673 -1.7086 -1.7086 3.1573 3.1573 3.3633 3.3633 3.7071 3.7071 6.1859 6.1859 6.2656 6.2656 6.2915 6.2915 6.6322 6.6322 6.8836 6.8836 6.9222 6.9222 9.0191 9.0191 9.4757 9.4757 9.4888 9.4888 12.8910 12.8910 13.4379 13.4379 13.7062 13.7062 13.7253 13.7253 15.5985 15.5985 17.6311 17.6311 k = 0.0000 0.1757-0.0000 ( 2713 PWs) bands (ev): -6.7331 -6.7331 -5.3686 -5.3686 -5.3200 -5.3200 -5.2809 -5.2809 -3.8303 -3.8303 -3.8086 -3.8086 -3.7929 -3.7929 -3.5858 -3.5858 -3.5256 -3.5256 -3.4669 -3.4669 -3.3408 -3.3408 -3.3191 -3.3191 -3.2672 -3.2672 -3.2270 -3.2270 -3.1899 -3.1899 -3.1696 -3.1696 -2.1843 -2.1843 -1.7575 -1.7575 -1.6959 -1.6959 3.1719 3.1719 3.3801 3.3801 3.7818 3.7818 6.1516 6.1516 6.2354 6.2354 6.2634 6.2634 6.5916 6.5916 6.8990 6.8990 6.9377 6.9377 8.9210 8.9210 9.4339 9.4339 9.4477 9.4477 12.9633 12.9633 13.4991 13.4991 13.8013 13.8013 13.8207 13.8207 15.6428 15.6428 17.6636 17.6636 k = 0.0000 0.1892-0.0000 ( 2709 PWs) bands (ev): -6.7116 -6.7116 -5.3794 -5.3794 -5.3216 -5.3216 -5.2802 -5.2802 -3.8301 -3.8301 -3.8065 -3.8065 -3.7898 -3.7898 -3.5918 -3.5918 -3.5266 -3.5266 -3.4637 -3.4637 -3.3427 -3.3427 -3.3208 -3.3208 -3.2651 -3.2651 -3.2307 -3.2307 -3.1917 -3.1917 -3.1703 -3.1703 -2.2332 -2.2332 -1.7471 -1.7471 -1.6828 -1.6828 3.1868 3.1868 3.3979 3.3979 3.8608 3.8608 6.1156 6.1156 6.2027 6.2027 6.2326 6.2326 6.5488 6.5488 6.9178 6.9178 6.9565 6.9565 8.8204 8.8204 9.3896 9.3896 9.4041 9.4041 13.0338 13.0338 13.5664 13.5664 13.9016 13.9016 13.9213 13.9213 15.6881 15.6881 17.6941 17.6941 k = 0.0000 0.2027-0.0000 ( 2709 PWs) bands (ev): -6.6886 -6.6886 -5.3914 -5.3914 -5.3232 -5.3232 -5.2795 -5.2795 -3.8298 -3.8298 -3.8043 -3.8043 -3.7865 -3.7865 -3.5980 -3.5980 -3.5277 -3.5277 -3.4604 -3.4604 -3.3448 -3.3448 -3.3225 -3.3225 -3.2631 -3.2631 -3.2344 -3.2344 -3.1933 -3.1933 -3.1713 -3.1713 -2.2831 -2.2831 -1.7363 -1.7363 -1.6694 -1.6694 3.2023 3.2023 3.4168 3.4168 3.9436 3.9436 6.0784 6.0784 6.1679 6.1679 6.1997 6.1997 6.5044 6.5044 6.9400 6.9400 6.9786 6.9786 8.7175 8.7175 9.3428 9.3428 9.3581 9.3581 13.1021 13.1021 13.6394 13.6394 14.0067 14.0067 14.0266 14.0266 15.7342 15.7342 17.7187 17.7187 k = 0.0000 0.2162-0.0000 ( 2717 PWs) bands (ev): -6.6643 -6.6643 -5.4045 -5.4045 -5.3247 -5.3247 -5.2788 -5.2788 -3.8295 -3.8295 -3.8020 -3.8020 -3.7830 -3.7830 -3.6042 -3.6042 -3.5291 -3.5291 -3.4571 -3.4571 -3.3470 -3.3470 -3.3240 -3.3240 -3.2611 -3.2611 -3.2380 -3.2380 -3.1950 -3.1950 -3.1725 -3.1725 -2.3339 -2.3339 -1.7250 -1.7250 -1.6558 -1.6558 3.2182 3.2182 3.4366 3.4366 4.0299 4.0299 6.0401 6.0401 6.1315 6.1315 6.1650 6.1650 6.4584 6.4584 6.9652 6.9652 7.0036 7.0036 8.6128 8.6128 9.2938 9.2938 9.3100 9.3100 13.1682 13.1682 13.7175 13.7175 14.1163 14.1163 14.1361 14.1361 15.7804 15.7804 17.7313 17.7313 k = 0.0000 0.2297-0.0000 ( 2725 PWs) bands (ev): -6.6387 -6.6387 -5.4187 -5.4187 -5.3262 -5.3262 -5.2782 -5.2782 -3.8290 -3.8290 -3.7996 -3.7996 -3.7795 -3.7795 -3.6105 -3.6105 -3.5307 -3.5307 -3.4538 -3.4538 -3.3492 -3.3492 -3.3255 -3.3255 -3.2592 -3.2592 -3.2416 -3.2416 -3.1965 -3.1965 -3.1739 -3.1739 -2.3849 -2.3849 -1.7135 -1.7135 -1.6420 -1.6420 3.2346 3.2346 3.4574 3.4574 4.1194 4.1194 6.0009 6.0009 6.0939 6.0939 6.1291 6.1291 6.4113 6.4113 6.9934 6.9934 7.0314 7.0314 8.5066 8.5066 9.2428 9.2428 9.2597 9.2597 13.2321 13.2321 13.7998 13.7998 14.2296 14.2296 14.2494 14.2494 15.8264 15.8264 17.7264 17.7264 k = 0.0000 0.2432-0.0000 ( 2725 PWs) bands (ev): -6.6117 -6.6117 -5.4341 -5.4341 -5.3275 -5.3275 -5.2776 -5.2776 -3.8285 -3.8285 -3.7971 -3.7971 -3.7757 -3.7757 -3.6168 -3.6168 -3.5325 -3.5325 -3.4504 -3.4504 -3.3515 -3.3515 -3.3268 -3.3268 -3.2575 -3.2575 -3.2449 -3.2449 -3.1978 -3.1978 -3.1755 -3.1755 -2.4360 -2.4360 -1.7017 -1.7017 -1.6282 -1.6282 3.2513 3.2513 3.4789 3.4789 4.2117 4.2117 5.9613 5.9613 6.0556 6.0556 6.0924 6.0924 6.3634 6.3634 7.0244 7.0244 7.0620 7.0620 8.3992 8.3992 9.1899 9.1899 9.2076 9.2076 13.2942 13.2942 13.8856 13.8856 14.3466 14.3466 14.3662 14.3662 15.8717 15.8717 17.7048 17.7048 k = 0.0000 0.2568-0.0000 ( 2721 PWs) bands (ev): -6.5836 -6.5836 -5.4506 -5.4506 -5.3288 -5.3288 -5.2770 -5.2770 -3.8277 -3.8277 -3.7945 -3.7945 -3.7718 -3.7718 -3.6230 -3.6230 -3.5346 -3.5346 -3.4469 -3.4469 -3.3537 -3.3537 -3.3280 -3.3280 -3.2563 -3.2563 -3.2476 -3.2476 -3.1989 -3.1989 -3.1773 -3.1773 -2.4867 -2.4867 -1.6898 -1.6898 -1.6143 -1.6143 3.2683 3.2683 3.5011 3.5011 4.3065 4.3065 5.9215 5.9215 6.0171 6.0171 6.0553 6.0553 6.3149 6.3149 7.0579 7.0579 7.0952 7.0952 8.2907 8.2907 9.1353 9.1353 9.1539 9.1539 13.3547 13.3547 13.9738 13.9738 14.4665 14.4665 14.4858 14.4858 15.9156 15.9156 17.6715 17.6715 k = 0.0000 0.2703-0.0000 ( 2733 PWs) bands (ev): -6.5543 -6.5543 -5.4684 -5.4684 -5.3301 -5.3301 -5.2764 -5.2764 -3.8270 -3.8270 -3.7918 -3.7918 -3.7677 -3.7677 -3.6293 -3.6293 -3.5369 -3.5369 -3.4434 -3.4434 -3.3560 -3.3560 -3.3291 -3.3291 -3.2566 -3.2566 -3.2489 -3.2489 -3.1997 -3.1997 -3.1794 -3.1794 -2.5369 -2.5369 -1.6780 -1.6780 -1.6006 -1.6006 3.2856 3.2856 3.5240 3.5240 4.4035 4.4035 5.8817 5.8817 5.9787 5.9787 6.0182 6.0182 6.2662 6.2662 7.0938 7.0938 7.1307 7.1307 8.1812 8.1812 9.0789 9.0789 9.0983 9.0983 13.4139 13.4139 14.0636 14.0636 14.5889 14.5889 14.6079 14.6079 15.9578 15.9578 17.6316 17.6316 k = 0.0000 0.2838-0.0000 ( 2733 PWs) bands (ev): -6.5239 -6.5239 -5.4873 -5.4873 -5.3313 -5.3313 -5.2759 -5.2759 -3.8261 -3.8261 -3.7892 -3.7892 -3.7633 -3.7633 -3.6355 -3.6355 -3.5396 -3.5396 -3.4397 -3.4397 -3.3582 -3.3582 -3.3301 -3.3301 -3.2586 -3.2586 -3.2483 -3.2483 -3.2003 -3.2003 -3.1816 -3.1816 -2.5863 -2.5863 -1.6661 -1.6661 -1.5872 -1.5872 3.3031 3.3031 3.5472 3.5472 4.5024 4.5024 5.8422 5.8422 5.9407 5.9407 5.9815 5.9815 6.2175 6.2175 7.1320 7.1320 7.1684 7.1684 8.0710 8.0710 9.0213 9.0213 9.0415 9.0415 13.4719 13.4719 14.1539 14.1539 14.7133 14.7133 14.7317 14.7317 15.9977 15.9977 17.5883 17.5883 k = 0.0000 0.2973-0.0000 ( 2733 PWs) bands (ev): -6.4925 -6.4925 -5.5075 -5.5075 -5.3325 -5.3325 -5.2754 -5.2754 -3.8251 -3.8251 -3.7865 -3.7865 -3.7587 -3.7587 -3.6415 -3.6415 -3.5426 -3.5426 -3.4360 -3.4360 -3.3604 -3.3604 -3.3309 -3.3309 -3.2615 -3.2615 -3.2469 -3.2469 -3.2004 -3.2004 -3.1841 -3.1841 -2.6345 -2.6345 -1.6544 -1.6544 -1.5740 -1.5740 3.3206 3.3206 3.5708 3.5708 4.6030 4.6030 5.8035 5.8035 5.9035 5.9035 5.9456 5.9456 6.1692 6.1692 7.1723 7.1723 7.2082 7.2082 7.9601 7.9601 8.9625 8.9625 8.9835 8.9835 13.5288 13.5288 14.2441 14.2441 14.8390 14.8390 14.8569 14.8569 16.0349 16.0349 17.5436 17.5436 k = 0.0000 0.3108-0.0000 ( 2741 PWs) bands (ev): -6.4601 -6.4601 -5.5290 -5.5290 -5.3336 -5.3336 -5.2750 -5.2750 -3.8241 -3.8241 -3.7839 -3.7839 -3.7538 -3.7538 -3.6475 -3.6475 -3.5461 -3.5461 -3.4323 -3.4323 -3.3625 -3.3625 -3.3316 -3.3316 -3.2645 -3.2645 -3.2454 -3.2454 -3.2001 -3.2001 -3.1868 -3.1868 -2.6813 -2.6813 -1.6430 -1.6430 -1.5612 -1.5612 3.3380 3.3380 3.5945 3.5945 4.7050 4.7050 5.7657 5.7657 5.8674 5.8674 5.9105 5.9105 6.1216 6.1216 7.2145 7.2145 7.2500 7.2500 7.8488 7.8488 8.9026 8.9026 8.9244 8.9244 13.5845 13.5845 14.3334 14.3334 14.9655 14.9655 14.9827 14.9827 16.0689 16.0689 17.4987 17.4987 k = 0.0000 0.3243-0.0000 ( 2741 PWs) bands (ev): -6.4268 -6.4268 -5.5517 -5.5517 -5.3346 -5.3346 -5.2745 -5.2745 -3.8230 -3.8230 -3.7814 -3.7814 -3.7486 -3.7486 -3.6532 -3.6532 -3.5500 -3.5500 -3.4285 -3.4285 -3.3644 -3.3644 -3.3322 -3.3322 -3.2674 -3.2674 -3.2440 -3.2440 -3.1992 -3.1992 -3.1896 -3.1896 -2.7265 -2.7265 -1.6320 -1.6320 -1.5489 -1.5489 3.3553 3.3553 3.6182 3.6182 4.8081 4.8081 5.7293 5.7293 5.8326 5.8326 5.8768 5.8768 6.0750 6.0750 7.2586 7.2586 7.2937 7.2937 7.7369 7.7369 8.8417 8.8417 8.8644 8.8644 13.6390 13.6390 14.4209 14.4209 15.0922 15.0922 15.1085 15.1085 16.0995 16.0995 17.4546 17.4546 k = 0.0000 0.3378-0.0000 ( 2741 PWs) bands (ev): -6.3927 -6.3927 -5.5757 -5.5757 -5.3356 -5.3356 -5.2741 -5.2741 -3.8218 -3.8218 -3.7790 -3.7790 -3.7431 -3.7431 -3.6586 -3.6586 -3.5543 -3.5543 -3.4247 -3.4247 -3.3663 -3.3663 -3.3326 -3.3326 -3.2703 -3.2703 -3.2427 -3.2427 -3.1978 -3.1978 -3.1926 -3.1926 -2.7700 -2.7700 -1.6213 -1.6213 -1.5371 -1.5371 3.3723 3.3723 3.6416 3.6416 4.9120 4.9120 5.6948 5.6948 5.7994 5.7994 5.8446 5.8446 6.0298 6.0298 7.3044 7.3044 7.3390 7.3390 7.6248 7.6248 8.7802 8.7802 8.8037 8.8037 13.6920 13.6920 14.5060 14.5060 15.2182 15.2182 15.2337 15.2337 16.1262 16.1262 17.4120 17.4120 k = 0.0000 0.3514-0.0000 ( 2742 PWs) bands (ev): -6.3578 -6.3578 -5.6009 -5.6009 -5.3365 -5.3365 -5.2738 -5.2738 -3.8205 -3.8205 -3.7768 -3.7768 -3.7372 -3.7372 -3.6638 -3.6638 -3.5591 -3.5591 -3.4208 -3.4208 -3.3679 -3.3679 -3.3329 -3.3329 -3.2729 -3.2729 -3.2416 -3.2416 -3.1960 -3.1960 -3.1954 -3.1954 -2.8115 -2.8115 -1.6112 -1.6112 -1.5259 -1.5259 3.3887 3.3887 3.6646 3.6646 5.0160 5.0160 5.6627 5.6627 5.7680 5.7680 5.8142 5.8142 5.9864 5.9864 7.3518 7.3518 7.3858 7.3858 7.5124 7.5124 8.7182 8.7182 8.7424 8.7424 13.7433 13.7433 14.5880 14.5880 15.3428 15.3428 15.3572 15.3572 16.1490 16.1490 17.3715 17.3715 k = 0.0000 0.3649-0.0000 ( 2750 PWs) bands (ev): -6.3223 -6.3223 -5.6274 -5.6274 -5.3373 -5.3373 -5.2734 -5.2734 -3.8192 -3.8192 -3.7747 -3.7747 -3.7311 -3.7311 -3.6686 -3.6686 -3.5646 -3.5646 -3.4171 -3.4171 -3.3695 -3.3695 -3.3331 -3.3331 -3.2752 -3.2752 -3.2407 -3.2407 -3.1992 -3.1992 -3.1928 -3.1928 -2.8509 -2.8509 -1.6016 -1.6016 -1.5155 -1.5155 3.4046 3.4046 3.6870 3.6870 5.1193 5.1193 5.6342 5.6342 5.7387 5.7387 5.7857 5.7857 5.9450 5.9450 7.3982 7.3982 7.4019 7.4019 7.4341 7.4341 8.6558 8.6558 8.6808 8.6808 13.7925 13.7925 14.6662 14.6662 15.4650 15.4650 15.4783 15.4783 16.1678 16.1678 17.3336 17.3336 k = 0.0000 0.3784-0.0000 ( 2742 PWs) bands (ev): -6.2863 -6.2863 -5.6551 -5.6551 -5.3380 -5.3380 -5.2731 -5.2731 -3.8179 -3.8179 -3.7728 -3.7728 -3.7248 -3.7248 -3.6729 -3.6729 -3.5704 -3.5704 -3.4133 -3.4133 -3.3708 -3.3708 -3.3332 -3.3332 -3.2772 -3.2772 -3.2400 -3.2400 -3.2026 -3.2026 -3.1892 -3.1892 -2.8880 -2.8880 -1.5928 -1.5928 -1.5058 -1.5058 3.4197 3.4197 3.7084 3.7084 5.2202 5.2202 5.6110 5.6110 5.7117 5.7117 5.7595 5.7595 5.9061 5.9061 7.2869 7.2869 7.4506 7.4506 7.4835 7.4835 8.5934 8.5934 8.6191 8.6191 13.8392 13.8392 14.7399 14.7399 15.5839 15.5839 15.5960 15.5960 16.1826 16.1826 17.2987 17.2987 k = 0.0000 0.3919-0.0000 ( 2750 PWs) bands (ev): -6.2498 -6.2498 -5.6839 -5.6839 -5.3388 -5.3388 -5.2729 -5.2729 -3.8166 -3.8166 -3.7711 -3.7711 -3.7184 -3.7184 -3.6765 -3.6765 -3.5768 -3.5768 -3.4097 -3.4097 -3.3719 -3.3719 -3.3332 -3.3332 -3.2790 -3.2790 -3.2395 -3.2395 -3.2061 -3.2061 -3.1849 -3.1849 -2.9228 -2.9228 -1.5846 -1.5846 -1.4969 -1.4969 3.4338 3.4338 3.7285 3.7285 5.3143 5.3143 5.5976 5.5976 5.6869 5.6869 5.7355 5.7355 5.8700 5.8700 7.1740 7.1740 7.5017 7.5017 7.5340 7.5340 8.5311 8.5311 8.5575 8.5575 13.8830 13.8830 14.8084 14.8084 15.6978 15.6978 15.7085 15.7085 16.1937 16.1937 17.2671 17.2671 k = 0.0000 0.4054-0.0000 ( 2746 PWs) bands (ev): -6.2130 -6.2130 -5.7139 -5.7139 -5.3394 -5.3394 -5.2727 -5.2727 -3.8153 -3.8153 -3.7696 -3.7696 -3.7122 -3.7122 -3.6791 -3.6791 -3.5836 -3.5836 -3.4062 -3.4062 -3.3729 -3.3729 -3.3331 -3.3331 -3.2803 -3.2803 -3.2392 -3.2392 -3.2097 -3.2097 -3.1797 -3.1797 -2.9550 -2.9550 -1.5773 -1.5773 -1.4890 -1.4890 3.4468 3.4468 3.7472 3.7472 5.3901 5.3901 5.6055 5.6055 5.6650 5.6650 5.7139 5.7139 5.8371 5.8371 7.0611 7.0611 7.5537 7.5537 7.5852 7.5852 8.4692 8.4692 8.4963 8.4963 13.9234 13.9234 14.8710 14.8710 15.8055 15.8055 15.8149 15.8149 16.2014 16.2014 17.2391 17.2391 k = 0.0000 0.4189-0.0000 ( 2730 PWs) bands (ev): -6.1760 -6.1760 -5.7448 -5.7448 -5.3399 -5.3399 -5.2724 -5.2724 -3.8140 -3.8140 -3.7683 -3.7683 -3.7069 -3.7069 -3.6801 -3.6801 -3.5909 -3.5909 -3.4030 -3.4030 -3.3736 -3.3736 -3.3329 -3.3329 -3.2811 -3.2811 -3.2390 -3.2390 -3.2133 -3.2133 -3.1736 -3.1736 -2.9848 -2.9848 -1.5708 -1.5708 -1.4819 -1.4819 3.4585 3.4585 3.7642 3.7642 5.4302 5.4302 5.6405 5.6405 5.6579 5.6579 5.6950 5.6950 5.8079 5.8079 6.9482 6.9482 7.6062 7.6062 7.6368 7.6368 8.4082 8.4082 8.4360 8.4360 13.9599 13.9599 14.9270 14.9270 15.9055 15.9055 15.9135 15.9135 16.2063 16.2063 17.2146 17.2146 k = 0.0000 0.4324-0.0000 ( 2726 PWs) bands (ev): -6.1389 -6.1389 -5.7768 -5.7768 -5.3403 -5.3403 -5.2723 -5.2723 -3.8128 -3.8128 -3.7672 -3.7672 -3.7033 -3.7033 -3.6786 -3.6786 -3.5986 -3.5986 -3.4000 -3.4000 -3.3743 -3.3743 -3.3327 -3.3327 -3.2816 -3.2816 -3.2388 -3.2388 -3.2167 -3.2167 -3.1666 -3.1666 -3.0121 -3.0121 -1.5652 -1.5652 -1.4759 -1.4759 3.4687 3.4687 3.7792 3.7792 5.4388 5.4388 5.6273 5.6273 5.6788 5.6788 5.7358 5.7358 5.7832 5.7832 6.8355 6.8355 7.6586 7.6586 7.6881 7.6881 8.3487 8.3487 8.3770 8.3770 13.9920 13.9920 14.9758 14.9758 15.9957 15.9957 16.0023 16.0023 16.2089 16.2089 17.1939 17.1939 k = 0.0000 0.4459-0.0000 ( 2730 PWs) bands (ev): -6.1018 -6.1018 -5.8096 -5.8096 -5.3407 -5.3407 -5.2721 -5.2721 -3.8118 -3.8118 -3.7664 -3.7664 -3.7018 -3.7018 -3.6742 -3.6742 -3.6068 -3.6068 -3.3975 -3.3975 -3.3749 -3.3749 -3.3326 -3.3326 -3.2816 -3.2816 -3.2387 -3.2387 -3.2200 -3.2200 -3.1586 -3.1586 -3.0369 -3.0369 -1.5606 -1.5606 -1.4710 -1.4710 3.4773 3.4773 3.7918 3.7918 5.4350 5.4350 5.6136 5.6136 5.6654 5.6654 5.7600 5.7600 5.8356 5.8356 6.7229 6.7229 7.7101 7.7101 7.7382 7.7382 8.2915 8.2915 8.3204 8.3204 14.0190 14.0190 15.0166 15.0166 16.0740 16.0740 16.0792 16.0792 16.2098 16.2098 17.1769 17.1769 k = 0.0000 0.4595-0.0000 ( 2738 PWs) bands (ev): -6.0650 -6.0650 -5.8430 -5.8430 -5.3410 -5.3410 -5.2720 -5.2720 -3.8111 -3.8111 -3.7658 -3.7658 -3.7018 -3.7018 -3.6677 -3.6677 -3.6152 -3.6152 -3.3954 -3.3954 -3.3755 -3.3755 -3.3325 -3.3325 -3.2814 -3.2814 -3.2387 -3.2387 -3.2229 -3.2229 -3.1493 -3.1493 -3.0593 -3.0593 -1.5570 -1.5570 -1.4670 -1.4670 3.4841 3.4841 3.8019 3.8019 5.4282 5.4282 5.6028 5.6028 5.6550 5.6550 5.7436 5.7436 5.9396 5.9396 6.6107 6.6107 7.7592 7.7592 7.7853 7.7853 8.2385 8.2385 8.2677 8.2677 14.0406 14.0406 15.0488 15.0488 16.1381 16.1381 16.1421 16.1421 16.2097 16.2097 17.1635 17.1635 k = 0.0000 0.4730-0.0000 ( 2738 PWs) bands (ev): -6.0290 -6.0290 -5.8766 -5.8766 -5.3412 -5.3412 -5.2719 -5.2719 -3.8105 -3.8105 -3.7654 -3.7654 -3.7022 -3.7022 -3.6602 -3.6602 -3.6236 -3.6236 -3.3938 -3.3938 -3.3758 -3.3758 -3.3324 -3.3324 -3.2811 -3.2811 -3.2386 -3.2386 -3.2252 -3.2252 -3.1387 -3.1387 -3.0793 -3.0793 -1.5543 -1.5543 -1.4642 -1.4642 3.4891 3.4891 3.8093 3.8093 5.4222 5.4222 5.5949 5.5949 5.6474 5.6474 5.7314 5.7314 6.0466 6.0466 6.4993 6.4993 7.8031 7.8031 7.8262 7.8262 8.1926 8.1926 8.2218 8.2218 14.0563 14.0563 15.0722 15.0722 16.1859 16.1859 16.1889 16.1889 16.2093 16.2093 17.1541 17.1541 k = 0.0000 0.4865-0.0000 ( 2730 PWs) bands (ev): -5.9953 -5.9953 -5.9088 -5.9088 -5.3412 -5.3412 -5.2718 -5.2718 -3.8101 -3.8101 -3.7651 -3.7651 -3.7025 -3.7025 -3.6525 -3.6525 -3.6318 -3.6318 -3.3928 -3.3928 -3.3761 -3.3761 -3.3324 -3.3324 -3.2808 -3.2808 -3.2386 -3.2386 -3.2266 -3.2266 -3.1266 -3.1266 -3.0971 -3.0971 -1.5528 -1.5528 -1.4625 -1.4625 3.4921 3.4921 3.8138 3.8138 5.4182 5.4182 5.5902 5.5902 5.6429 5.6429 5.7241 5.7241 6.1530 6.1530 6.3907 6.3907 7.8362 7.8362 7.8555 7.8555 8.1596 8.1596 8.1883 8.1883 14.0659 14.0659 15.0864 15.0864 16.2088 16.2088 16.2156 16.2156 16.2178 16.2178 17.1484 17.1484 k = 0.0000 0.5000-0.0000 ( 2730 PWs) bands (ev): -5.9753 -5.9753 -5.9283 -5.9283 -5.3413 -5.3413 -5.2718 -5.2718 -3.8100 -3.8100 -3.7650 -3.7650 -3.7027 -3.7027 -3.6476 -3.6476 -3.6367 -3.6367 -3.3924 -3.3924 -3.3761 -3.3761 -3.3324 -3.3324 -3.2807 -3.2807 -3.2386 -3.2386 -3.2272 -3.2272 -3.1128 -3.1128 -3.1128 -3.1128 -1.5522 -1.5522 -1.4620 -1.4620 3.4931 3.4931 3.8153 3.8153 5.4168 5.4168 5.5887 5.5887 5.6414 5.6414 5.7216 5.7216 6.2301 6.2301 6.3128 6.3128 7.8493 7.8493 7.8662 7.8662 8.1472 8.1472 8.1755 8.1755 14.0691 14.0691 15.0912 15.0912 16.2087 16.2087 16.2256 16.2256 16.2276 16.2276 17.1465 17.1465 k = 0.0000 0.5000-0.0000 ( 2730 PWs) bands (ev): -5.9753 -5.9753 -5.9283 -5.9283 -5.3413 -5.3413 -5.2718 -5.2718 -3.8100 -3.8100 -3.7650 -3.7650 -3.7027 -3.7027 -3.6476 -3.6476 -3.6367 -3.6367 -3.3924 -3.3924 -3.3761 -3.3761 -3.3324 -3.3324 -3.2807 -3.2807 -3.2386 -3.2386 -3.2272 -3.2272 -3.1128 -3.1128 -3.1128 -3.1128 -1.5522 -1.5522 -1.4620 -1.4620 3.4931 3.4931 3.8153 3.8153 5.4168 5.4168 5.5887 5.5887 5.6414 5.6414 5.7216 5.7216 6.2301 6.2301 6.3128 6.3128 7.8493 7.8493 7.8662 7.8662 8.1472 8.1472 8.1755 8.1755 14.0691 14.0691 15.0912 15.0912 16.2087 16.2087 16.2256 16.2256 16.2276 16.2276 17.1465 17.1465 k = 0.0135 0.5000-0.0000 ( 2730 PWs) bands (ev): -5.9756 -5.9744 -5.9283 -5.9274 -5.3416 -5.3414 -5.2724 -5.2717 -3.8116 -3.8083 -3.7658 -3.7643 -3.7048 -3.7005 -3.6547 -3.6406 -3.6387 -3.6339 -3.3940 -3.3908 -3.3766 -3.3756 -3.3324 -3.3324 -3.2845 -3.2772 -3.2392 -3.2378 -3.2280 -3.2261 -3.1136 -3.1125 -3.1122 -3.1118 -1.5534 -1.5530 -1.4636 -1.4621 3.4923 3.4929 3.8139 3.8147 5.3977 5.4049 5.5611 5.5980 5.6388 5.6461 5.7423 5.7643 6.2251 6.2270 6.3079 6.3101 7.8482 7.8512 7.8662 7.8674 8.1455 8.1491 8.1750 8.1762 14.0715 14.0728 15.0922 15.0937 16.2047 16.2048 16.2263 16.2269 16.2330 16.2336 17.1474 17.1481 k = 0.0270 0.5000-0.0000 ( 2738 PWs) bands (ev): -5.9751 -5.9727 -5.9275 -5.9256 -5.3422 -5.3419 -5.2733 -5.2719 -3.8134 -3.8066 -3.7669 -3.7639 -3.7068 -3.6981 -3.6614 -3.6416 -3.6322 -3.6307 -3.3955 -3.3892 -3.3771 -3.3751 -3.3325 -3.3325 -3.2885 -3.2745 -3.2398 -3.2368 -3.2287 -3.2248 -3.1142 -3.1113 -3.1111 -3.1104 -1.5565 -1.5557 -1.4670 -1.4641 3.4905 3.4916 3.8107 3.8123 5.3615 5.3715 5.5170 5.5558 5.6838 5.6846 5.8004 5.8276 6.2120 6.2157 6.2954 6.2998 7.8474 7.8539 7.8667 7.8696 8.1440 8.1515 8.1750 8.1778 14.0798 14.0824 15.0965 15.0995 16.1989 16.1993 16.2263 16.2278 16.2461 16.2473 17.1510 17.1523 k = 0.0405 0.5000-0.0000 ( 2738 PWs) bands (ev): -5.9740 -5.9704 -5.9257 -5.9229 -5.3432 -5.3427 -5.2746 -5.2726 -3.8151 -3.8050 -3.7680 -3.7636 -3.7085 -3.6956 -3.6677 -3.6434 -3.6269 -3.6242 -3.3970 -3.3875 -3.3774 -3.3744 -3.3326 -3.3326 -3.2925 -3.2727 -3.2406 -3.2352 -3.2292 -3.2233 -3.1147 -3.1098 -3.1090 -3.1081 -1.5614 -1.5605 -1.4723 -1.4677 3.4877 3.4893 3.8057 3.8081 5.3210 5.3317 5.4693 5.5068 5.7425 5.7455 5.8688 5.8977 6.1913 6.1966 6.2761 6.2823 7.8460 7.8560 7.8672 7.8720 8.1430 8.1550 8.1760 8.1811 14.0941 14.0979 15.1042 15.1085 16.1950 16.1958 16.2266 16.2288 16.2628 16.2644 17.1570 17.1590 k = 0.0541 0.5000-0.0000 ( 2738 PWs) bands (ev): -5.9721 -5.9674 -5.9231 -5.9193 -5.3446 -5.3439 -5.2763 -5.2737 -3.8168 -3.8033 -3.7693 -3.7636 -3.7101 -3.6931 -3.6735 -3.6450 -3.6227 -3.6159 -3.3984 -3.3857 -3.3777 -3.3738 -3.3328 -3.3327 -3.2963 -3.2719 -3.2415 -3.2330 -3.2296 -3.2215 -3.1151 -3.1082 -3.1056 -3.1049 -1.5682 -1.5674 -1.4794 -1.4729 3.4840 3.4862 3.7990 3.8022 5.2816 5.2923 5.4236 5.4602 5.8089 5.8135 5.9424 5.9718 6.1633 6.1700 6.2510 6.2588 7.8426 7.8557 7.8671 7.8735 8.1436 8.1603 8.1795 8.1873 14.1142 14.1192 15.1151 15.1208 16.1935 16.1947 16.2271 16.2301 16.2822 16.2843 17.1654 17.1681 k = 0.0676 0.5000-0.0000 ( 2734 PWs) bands (ev): -5.9696 -5.9637 -5.9196 -5.9148 -5.3462 -5.3455 -5.2783 -5.2751 -3.8185 -3.8017 -3.7707 -3.7638 -3.7116 -3.6905 -3.6788 -3.6464 -3.6180 -3.6075 -3.3998 -3.3840 -3.3779 -3.3731 -3.3329 -3.3329 -3.2999 -3.2721 -3.2426 -3.2308 -3.2294 -3.2196 -3.1152 -3.1065 -3.1010 -3.1009 -1.5769 -1.5765 -1.4883 -1.4796 3.4795 3.4823 3.7908 3.7948 5.2455 5.2558 5.3816 5.4176 5.8789 5.8838 6.0194 6.0488 6.1290 6.1368 6.2224 6.2311 7.8357 7.8505 7.8653 7.8723 8.1467 8.1681 8.1868 8.1976 14.1401 14.1462 15.1290 15.1359 16.1947 16.1963 16.2278 16.2316 16.3041 16.3067 17.1761 17.1795 k = 0.0811 0.5000-0.0000 ( 2732 PWs) bands (ev): -5.9664 -5.9593 -5.9152 -5.9095 -5.3482 -5.3475 -5.2806 -5.2770 -3.8203 -3.8000 -3.7722 -3.7644 -3.7128 -3.6878 -3.6836 -3.6476 -3.6127 -3.5989 -3.4012 -3.3822 -3.3781 -3.3724 -3.3330 -3.3329 -3.3032 -3.2731 -3.2437 -3.2306 -3.2270 -3.2175 -3.1153 -3.1045 -3.0964 -3.0950 -1.5878 -1.5875 -1.4990 -1.4878 3.4743 3.4776 3.7813 3.7860 5.2134 5.2234 5.3439 5.3793 5.9474 5.9510 6.0857 6.0902 6.1058 6.1311 6.1956 6.2037 7.8241 7.8396 7.8596 7.8666 8.1539 8.1791 8.1990 8.2125 14.1715 14.1787 15.1456 15.1536 16.1986 16.2006 16.2287 16.2332 16.3282 16.3313 17.1889 17.1930 k = 0.0946 0.5000-0.0000 ( 2732 PWs) bands (ev): -5.9626 -5.9543 -5.9100 -5.9034 -5.3505 -5.3499 -5.2833 -5.2793 -3.8220 -3.7983 -3.7737 -3.7651 -3.7139 -3.6881 -3.6850 -3.6486 -3.6069 -3.5903 -3.4024 -3.3804 -3.3783 -3.3717 -3.3331 -3.3329 -3.3062 -3.2749 -3.2450 -3.2309 -3.2240 -3.2152 -3.1153 -3.1022 -3.0910 -3.0877 -1.6015 -1.5999 -1.5114 -1.4974 3.4686 3.4725 3.7708 3.7762 5.1860 5.1955 5.3108 5.3458 6.0004 6.0017 6.0407 6.0505 6.1704 6.1845 6.1964 6.2163 7.8073 7.8227 7.8481 7.8551 8.1660 8.1940 8.2164 8.2321 14.2082 14.2165 15.1648 15.1737 16.2052 16.2078 16.2298 16.2351 16.3543 16.3580 17.2036 17.2085 k = 0.1081 0.5000-0.0000 ( 2732 PWs) bands (ev): -5.9581 -5.9487 -5.9040 -5.8964 -5.3532 -5.3527 -5.2863 -5.2820 -3.8237 -3.7966 -3.7753 -3.7662 -3.7150 -3.6919 -3.6823 -3.6496 -3.6006 -3.5818 -3.4037 -3.3788 -3.3784 -3.3708 -3.3332 -3.3327 -3.3089 -3.2771 -3.2464 -3.2313 -3.2212 -3.2128 -3.1150 -3.0994 -3.0849 -3.0790 -1.6176 -1.6143 -1.5254 -1.5082 3.4626 3.4670 3.7595 3.7655 5.1632 5.1722 5.2825 5.3169 5.9898 6.0001 6.0063 6.0153 6.2094 6.2094 6.2725 6.2992 7.7850 7.8002 7.8301 7.8374 8.1834 8.2134 8.2385 8.2561 14.2501 14.2593 15.1860 15.1957 16.2148 16.2178 16.2310 16.2370 16.3822 16.3865 17.2198 17.2254 k = 0.1216 0.5000-0.0000 ( 2728 PWs) bands (ev): -5.9530 -5.9424 -5.8971 -5.8887 -5.3562 -5.3560 -5.2896 -5.2851 -3.8254 -3.7948 -3.7769 -3.7674 -3.7158 -3.6952 -3.6795 -3.6504 -3.5938 -3.5732 -3.4048 -3.3784 -3.3774 -3.3699 -3.3331 -3.3324 -3.3113 -3.2796 -3.2479 -3.2318 -3.2187 -3.2102 -3.1146 -3.0962 -3.0781 -3.0689 -1.6360 -1.6307 -1.5411 -1.5204 3.4564 3.4614 3.7477 3.7543 5.1450 5.1535 5.2590 5.2928 5.9347 5.9455 5.9740 5.9873 6.2724 6.2762 6.3586 6.3854 7.7575 7.7725 7.8057 7.8135 8.2057 8.2369 8.2645 8.2837 14.2967 14.3068 15.2090 15.2193 16.2272 16.2306 16.2325 16.2392 16.4117 16.4166 17.2373 17.2436 k = 0.1351 0.5000-0.0000 ( 2728 PWs) bands (ev): -5.9472 -5.9356 -5.8895 -5.8802 -5.3596 -5.3595 -5.2931 -5.2886 -3.8270 -3.7930 -3.7785 -3.7689 -3.7167 -3.6981 -3.6768 -3.6511 -3.5864 -3.5648 -3.4058 -3.3784 -3.3762 -3.3687 -3.3330 -3.3318 -3.3134 -3.2823 -3.2493 -3.2323 -3.2165 -3.2075 -3.1140 -3.0925 -3.0706 -3.0575 -1.6567 -1.6490 -1.5582 -1.5339 3.4503 3.4559 3.7358 3.7429 5.1314 5.1394 5.2402 5.2735 5.8761 5.8870 5.9258 5.9408 6.3523 6.3569 6.4467 6.4730 7.7253 7.7399 7.7754 7.7840 8.2318 8.2638 8.2935 8.3141 14.3479 14.3587 15.2334 15.2440 16.2338 16.2414 16.2427 16.2468 16.4424 16.4480 17.2556 17.2627 k = 0.1486 0.5000-0.0000 ( 2728 PWs) bands (ev): -5.9409 -5.9281 -5.8812 -5.8709 -5.3638 -5.3632 -5.2970 -5.2926 -3.8285 -3.7912 -3.7801 -3.7706 -3.7175 -3.7005 -3.6742 -3.6518 -3.5787 -3.5566 -3.4068 -3.3784 -3.3755 -3.3673 -3.3329 -3.3309 -3.3152 -3.2852 -3.2508 -3.2329 -3.2148 -3.2046 -3.1132 -3.0882 -3.0622 -3.0446 -1.6797 -1.6694 -1.5767 -1.5486 3.4446 3.4507 3.7241 3.7316 5.1222 5.1296 5.2260 5.2589 5.8144 5.8253 5.8704 5.8864 6.4385 6.4431 6.5359 6.5614 7.6889 7.7033 7.7402 7.7496 8.2608 8.2933 8.3247 8.3465 14.4033 14.4147 15.2585 15.2694 16.2355 16.2438 16.2612 16.2659 16.4740 16.4803 17.2744 17.2822 k = 0.1622 0.5000-0.0000 ( 2732 PWs) bands (ev): -5.9340 -5.9201 -5.8722 -5.8610 -5.3684 -5.3672 -5.3012 -5.2970 -3.8299 -3.7893 -3.7818 -3.7725 -3.7182 -3.7026 -3.6715 -3.6524 -3.5705 -3.5487 -3.4076 -3.3784 -3.3751 -3.3658 -3.3326 -3.3296 -3.3168 -3.2882 -3.2523 -3.2335 -3.2136 -3.2016 -3.1122 -3.0832 -3.0532 -3.0305 -1.7049 -1.6918 -1.5966 -1.5646 3.4394 3.4460 3.7130 3.7208 5.1170 5.1238 5.2164 5.2488 5.7501 5.7608 5.8110 5.8276 6.5275 6.5317 6.6255 6.6501 7.6492 7.6633 7.7008 7.7112 8.2919 8.3246 8.3573 8.3801 14.4624 14.4744 15.2841 15.2951 16.2372 16.2463 16.2828 16.2880 16.5062 16.5133 17.2929 17.3015 k = 0.1757 0.5000-0.0000 ( 2732 PWs) bands (ev): -5.9265 -5.9116 -5.8625 -5.8504 -5.3735 -5.3716 -5.3056 -5.3018 -3.8313 -3.7873 -3.7834 -3.7745 -3.7190 -3.7043 -3.6690 -3.6531 -3.5619 -3.5409 -3.4082 -3.3782 -3.3750 -3.3642 -3.3324 -3.3279 -3.3181 -3.2910 -3.2537 -3.2342 -3.2127 -3.1986 -3.1109 -3.0773 -3.0433 -3.0151 -1.7323 -1.7161 -1.6177 -1.5819 3.4350 3.4422 3.7028 3.7108 5.1155 5.1217 5.2112 5.2432 5.6838 5.6941 5.7492 5.7663 6.6175 6.6211 6.7149 6.7385 7.6067 7.6207 7.6583 7.6696 8.3242 8.3570 8.3908 8.4144 14.5249 14.5373 15.3097 15.3205 16.2392 16.2490 16.3077 16.3134 16.5386 16.5465 17.3107 17.3200 k = 0.1892 0.5000-0.0000 ( 2728 PWs) bands (ev): -5.9185 -5.9025 -5.8521 -5.8392 -5.3790 -5.3763 -5.3103 -5.3070 -3.8324 -3.7854 -3.7849 -3.7766 -3.7198 -3.7056 -3.6664 -3.6536 -3.5530 -3.5335 -3.4086 -3.3781 -3.3752 -3.3628 -3.3321 -3.3259 -3.3191 -3.2935 -3.2551 -3.2349 -3.2122 -3.1956 -3.1092 -3.0705 -3.0325 -2.9985 -1.7616 -1.7423 -1.6402 -1.6005 3.4318 3.4394 3.6938 3.7020 5.1172 5.1227 5.2101 5.2417 5.6159 5.6258 5.6862 5.7037 6.7072 6.7101 6.8034 6.8259 7.5625 7.5765 7.6135 7.6258 8.3571 8.3898 8.4244 8.4487 14.5904 14.6031 15.3349 15.3454 16.2416 16.2520 16.3357 16.3419 16.5709 16.5796 17.3270 17.3369 k = 0.2027 0.5000-0.0000 ( 2728 PWs) bands (ev): -5.9100 -5.8930 -5.8412 -5.8274 -5.3849 -5.3813 -5.3153 -5.3126 -3.8335 -3.7867 -3.7831 -3.7787 -3.7206 -3.7067 -3.6640 -3.6542 -3.5440 -3.5264 -3.4088 -3.3779 -3.3755 -3.3617 -3.3320 -3.3239 -3.3199 -3.2953 -3.2564 -3.2357 -3.2120 -3.1926 -3.1072 -3.0628 -3.0209 -2.9808 -1.7929 -1.7704 -1.6638 -1.6203 3.4299 3.4379 3.6863 3.6946 5.1215 5.1263 5.2127 5.2441 5.5470 5.5562 5.6228 5.6409 6.7950 6.7970 6.8898 6.9111 7.5178 7.5317 7.5679 7.5810 8.3901 8.4225 8.4578 8.4825 14.6583 14.6711 15.3591 15.3692 16.2444 16.2556 16.3669 16.3736 16.6027 16.6123 17.3410 17.3515 k = 0.2162 0.5000-0.0000 ( 2728 PWs) bands (ev): -5.9009 -5.8830 -5.8296 -5.8150 -5.3913 -5.3867 -5.3205 -5.3186 -3.8344 -3.7882 -3.7811 -3.7808 -3.7214 -3.7076 -3.6616 -3.6548 -3.5348 -3.5197 -3.4089 -3.3777 -3.3760 -3.3608 -3.3320 -3.3221 -3.3203 -3.2960 -3.2576 -3.2366 -3.2122 -3.1896 -3.1047 -3.0539 -3.0083 -2.9620 -1.8259 -1.8002 -1.6886 -1.6415 3.4296 3.4380 3.6805 3.6889 5.1273 5.1313 5.2185 5.2497 5.4778 5.4862 5.5604 5.5791 6.8789 6.8800 6.9724 6.9922 7.4747 7.4883 7.5235 7.5373 8.4226 8.4547 8.4905 8.5155 14.7280 14.7408 15.3821 15.3917 16.2480 16.2599 16.4013 16.4082 16.6337 16.6444 17.3522 17.3629 k = 0.2297 0.5000-0.0000 ( 2720 PWs) bands (ev): -5.8914 -5.8725 -5.8176 -5.8022 -5.3982 -5.3925 -5.3260 -5.3250 -3.8351 -3.7898 -3.7830 -3.7789 -3.7223 -3.7083 -3.6593 -3.6553 -3.5256 -3.5134 -3.4087 -3.3775 -3.3765 -3.3602 -3.3321 -3.3214 -3.3203 -3.2949 -3.2586 -3.2374 -3.2127 -3.1868 -3.1017 -3.0440 -2.9945 -2.9421 -1.8605 -1.8316 -1.7146 -1.6640 3.4310 3.4398 3.6768 3.6851 5.1331 5.1361 5.2259 5.2571 5.4098 5.4174 5.5008 5.5203 6.9549 6.9549 7.0472 7.0652 7.4370 7.4497 7.4844 7.4987 8.4544 8.4861 8.5222 8.5474 14.7990 14.8116 15.4037 15.4126 16.2526 16.2651 16.4384 16.4456 16.6639 16.6757 17.3599 17.3708 k = 0.2432 0.5000-0.0000 ( 2720 PWs) bands (ev): -5.8815 -5.8616 -5.8051 -5.7889 -5.4055 -5.3986 -5.3319 -5.3318 -3.8356 -3.7913 -3.7850 -3.7769 -3.7232 -3.7089 -3.6571 -3.6558 -3.5164 -3.5074 -3.4083 -3.3772 -3.3772 -3.3600 -3.3326 -3.3219 -3.3199 -3.2916 -3.2596 -3.2383 -3.2135 -3.1842 -3.0981 -3.0329 -2.9798 -2.9213 -1.8967 -1.8645 -1.7416 -1.6877 3.4345 3.4435 3.6752 3.6834 5.1361 5.1379 5.2301 5.2601 5.3479 5.3558 5.4468 5.4672 7.0151 7.0158 7.1068 7.1224 7.4119 7.4224 7.4585 7.4727 8.4851 8.5162 8.5525 8.5779 14.8703 14.8827 15.4234 15.4317 16.2586 16.2717 16.4781 16.4852 16.6932 16.7061 17.3639 17.3747 k = 0.2568 0.5000-0.0000 ( 2720 PWs) bands (ev): -5.8712 -5.8504 -5.7922 -5.7752 -5.4132 -5.4051 -5.3390 -5.3380 -3.8359 -3.7928 -3.7870 -3.7749 -3.7241 -3.7093 -3.6563 -3.6551 -3.5075 -3.5017 -3.4078 -3.3778 -3.3769 -3.3601 -3.3332 -3.3235 -3.3192 -3.2864 -3.2605 -3.2392 -3.2145 -3.1818 -3.0938 -3.0207 -2.9638 -2.8995 -1.9342 -1.8986 -1.7697 -1.7126 3.4401 3.4494 3.6760 3.6841 5.1315 5.1323 5.2125 5.2337 5.3108 5.3267 5.4035 5.4247 7.0503 7.0507 7.1380 7.1511 7.4108 7.4178 7.4578 7.4715 8.5145 8.5449 8.5813 8.6066 14.9414 14.9534 15.4412 15.4488 16.2665 16.2802 16.5198 16.5266 16.7216 16.7359 17.3644 17.3747 k = 0.2703 0.5000-0.0000 ( 2720 PWs) bands (ev): -5.8605 -5.8389 -5.7789 -5.7611 -5.4212 -5.4120 -5.3465 -5.3444 -3.8361 -3.7942 -3.7890 -3.7731 -3.7250 -3.7097 -3.6567 -3.6532 -3.4988 -3.4964 -3.4070 -3.3785 -3.3767 -3.3606 -3.3341 -3.3256 -3.3183 -3.2798 -3.2612 -3.2401 -3.2157 -3.1797 -3.0886 -3.0074 -2.9466 -2.8769 -1.9730 -1.9340 -1.7989 -1.7387 3.4481 3.4575 3.6793 3.6872 5.1133 5.1138 5.1597 5.1731 5.3119 5.3343 5.3773 5.3981 7.0519 7.0531 7.1321 7.1443 7.4409 7.4448 7.4890 7.5024 8.5423 8.5719 8.6083 8.6333 15.0114 15.0227 15.4570 15.4639 16.2768 16.2912 16.5626 16.5688 16.7499 16.7657 17.3618 17.3713 k = 0.2838 0.5000-0.0000 ( 2722 PWs) bands (ev): -5.8495 -5.8271 -5.7653 -5.7468 -5.4297 -5.4192 -5.3545 -5.3512 -3.8360 -3.7956 -3.7908 -3.7716 -3.7259 -3.7100 -3.6570 -3.6514 -3.4914 -3.4904 -3.4061 -3.3792 -3.3764 -3.3614 -3.3351 -3.3280 -3.3170 -3.2725 -3.2617 -3.2408 -3.2172 -3.1778 -3.0824 -2.9931 -2.9281 -2.8534 -2.0128 -1.9704 -1.8289 -1.7659 3.4585 3.4680 3.6853 3.6928 5.0785 5.0799 5.0931 5.1033 5.3299 5.3518 5.3731 5.3902 7.0252 7.0285 7.0981 7.1107 7.4958 7.4975 7.5443 7.5572 8.5682 8.5969 8.6331 8.6579 15.0791 15.0898 15.4708 15.4770 16.2904 16.3052 16.6054 16.6108 16.7789 16.7964 17.3566 17.3653 k = 0.2973 0.5000-0.0000 ( 2720 PWs) bands (ev): -5.8382 -5.8151 -5.7514 -5.7322 -5.4385 -5.4268 -5.3628 -5.3582 -3.8357 -3.7969 -3.7926 -3.7703 -3.7267 -3.7102 -3.6573 -3.6498 -3.4866 -3.4825 -3.4049 -3.3798 -3.3762 -3.3626 -3.3362 -3.3305 -3.3155 -3.2647 -3.2621 -3.2413 -3.2186 -3.1761 -3.0749 -2.9777 -2.9082 -2.8290 -2.0535 -2.0076 -1.8599 -1.7941 3.4714 3.4810 3.6939 3.7011 5.0227 5.0287 5.0330 5.0331 5.3546 5.3695 5.3905 5.3984 6.9819 6.9867 7.0491 7.0625 7.5642 7.5642 7.6118 7.6238 8.5922 8.6199 8.6559 8.6802 15.1438 15.1536 15.4825 15.4881 16.3078 16.3230 16.6464 16.6507 16.8103 16.8294 17.3500 17.3575 k = 0.3108 0.5000-0.0000 ( 2722 PWs) bands (ev): -5.8266 -5.8028 -5.7373 -5.7174 -5.4476 -5.4347 -5.3715 -5.3656 -3.8351 -3.7982 -3.7942 -3.7695 -3.7272 -3.7104 -3.6575 -3.6483 -3.4821 -3.4750 -3.4035 -3.3803 -3.3760 -3.3642 -3.3374 -3.3329 -3.3138 -3.2624 -3.2576 -3.2409 -3.2203 -3.1747 -3.0659 -2.9613 -2.8870 -2.8040 -2.0949 -2.0456 -1.8916 -1.8233 3.4870 3.4965 3.7052 3.7122 4.9515 4.9582 4.9749 4.9777 5.3835 5.3914 5.4181 5.4187 6.9294 6.9352 6.9923 7.0065 7.6369 7.6385 7.6842 7.6949 8.6139 8.6406 8.6762 8.7000 15.2042 15.2131 15.4924 15.4974 16.3297 16.3452 16.6835 16.6868 16.8460 16.8665 17.3425 17.3488 k = 0.3243 0.5000-0.0000 ( 2718 PWs) bands (ev): -5.8148 -5.7905 -5.7230 -5.7024 -5.4570 -5.4430 -5.3805 -5.3734 -3.8343 -3.7993 -3.7957 -3.7691 -3.7275 -3.7105 -3.6575 -3.6471 -3.4778 -3.4681 -3.4020 -3.3807 -3.3759 -3.3660 -3.3387 -3.3352 -3.3118 -3.2626 -3.2527 -3.2385 -3.2219 -3.1735 -3.0553 -2.9440 -2.8645 -2.7782 -2.1369 -2.0840 -1.9239 -1.8534 3.5052 3.5147 3.7194 3.7260 4.8803 4.8860 4.9143 4.9178 5.4158 5.4192 5.4455 5.4517 6.8718 6.8783 6.9314 6.9463 7.7117 7.7148 7.7578 7.7670 8.6335 8.6590 8.6940 8.7172 15.2596 15.2676 15.5005 15.5050 16.3568 16.3725 16.7150 16.7178 16.8875 16.9087 17.3351 17.3400 k = 0.3378 0.5000-0.0000 ( 2712 PWs) bands (ev): -5.8028 -5.7779 -5.7085 -5.6873 -5.4665 -5.4515 -5.3898 -5.3815 -3.8333 -3.8004 -3.7971 -3.7693 -3.7274 -3.7106 -3.6575 -3.6460 -3.4737 -3.4618 -3.4004 -3.3810 -3.3759 -3.3681 -3.3401 -3.3373 -3.3096 -3.2625 -3.2510 -3.2336 -3.2230 -3.1725 -3.0427 -2.9258 -2.8408 -2.7519 -2.1793 -2.1228 -1.9568 -1.8842 3.5261 3.5354 3.7364 3.7426 4.8094 4.8142 4.8517 4.8555 5.4512 5.4517 5.4784 5.4881 6.8112 6.8182 6.8680 6.8834 7.7864 7.7908 7.8307 7.8383 8.6506 8.6748 8.7093 8.7317 15.3092 15.3161 15.5070 15.5110 16.3894 16.4050 16.7406 16.7432 16.9351 16.9566 17.3285 17.3318 k = 0.3514 0.5000-0.0000 ( 2718 PWs) bands (ev): -5.7907 -5.7655 -5.6940 -5.6723 -5.4763 -5.4604 -5.3995 -5.3899 -3.8320 -3.8015 -3.7984 -3.7701 -3.7271 -3.7108 -3.6573 -3.6452 -3.4699 -3.4561 -3.3988 -3.3812 -3.3759 -3.3704 -3.3416 -3.3393 -3.3072 -3.2624 -3.2512 -3.2305 -3.2212 -3.1717 -3.0281 -2.9067 -2.8159 -2.7251 -2.2218 -2.1618 -1.9900 -1.9157 3.5496 3.5588 3.7563 3.7620 4.7393 4.7431 4.7882 4.7921 5.4881 5.4895 5.5152 5.5274 6.7487 6.7560 6.8030 6.8188 7.8594 7.8652 7.9018 7.9077 8.6650 8.6878 8.7216 8.7432 15.3524 15.3584 15.5120 15.5156 16.4275 16.4428 16.7607 16.7636 16.9881 17.0093 17.3231 17.3247 k = 0.3649 0.5000-0.0000 ( 2712 PWs) bands (ev): -5.7785 -5.7530 -5.6795 -5.6572 -5.4860 -5.4695 -5.4095 -5.3987 -3.8306 -3.8025 -3.7995 -3.7715 -3.7264 -3.7109 -3.6570 -3.6445 -3.4661 -3.4510 -3.3970 -3.3812 -3.3760 -3.3728 -3.3432 -3.3412 -3.3046 -3.2621 -3.2520 -3.2312 -3.2157 -3.1712 -3.0112 -2.8868 -2.7898 -2.6980 -2.2642 -2.2008 -2.0233 -1.9476 3.5758 3.5847 3.7790 3.7842 4.6702 4.6732 4.7246 4.7284 5.5277 5.5304 5.5555 5.5692 6.6852 6.6926 6.7371 6.7532 7.9301 7.9371 7.9703 7.9745 8.6769 8.6982 8.7313 8.7519 15.3892 15.3943 15.5159 15.5190 16.4708 16.4854 16.7769 16.7800 17.0453 17.0659 17.3195 17.3197 k = 0.3784 0.5000-0.0000 ( 2716 PWs) bands (ev): -5.7663 -5.7408 -5.6650 -5.6423 -5.4958 -5.4788 -5.4198 -5.4079 -3.8289 -3.8034 -3.8006 -3.7734 -3.7254 -3.7111 -3.6566 -3.6441 -3.4625 -3.4466 -3.3953 -3.3811 -3.3762 -3.3752 -3.3448 -3.3430 -3.3018 -3.2617 -3.2532 -3.2331 -3.2094 -3.1708 -2.9921 -2.8662 -2.7629 -2.6708 -2.3064 -2.2396 -2.0566 -1.9798 3.6045 3.6131 3.8044 3.8092 4.6024 4.6045 4.6615 4.6651 5.5699 5.5737 5.5985 5.6135 6.6211 6.6285 6.6707 6.6870 7.9974 8.0057 8.0355 8.0379 8.6861 8.7059 8.7381 8.7577 15.4196 15.4240 15.5186 15.5214 16.5182 16.5319 16.7897 16.7930 17.1053 17.1254 17.3168 17.3189 k = 0.3919 0.5000-0.0000 ( 2720 PWs) bands (ev): -5.7542 -5.7289 -5.6507 -5.6275 -5.5054 -5.4883 -5.4303 -5.4175 -3.8270 -3.8043 -3.8015 -3.7757 -3.7243 -3.7113 -3.6560 -3.6438 -3.4591 -3.4428 -3.3936 -3.3809 -3.3776 -3.3764 -3.3464 -3.3447 -3.2989 -3.2612 -3.2546 -3.2354 -3.2035 -3.1706 -2.9707 -2.8450 -2.7351 -2.6438 -2.3480 -2.2780 -2.0894 -2.0123 3.6356 3.6439 3.8326 3.8369 4.5360 4.5374 4.5991 4.6024 5.6144 5.6191 5.6441 5.6600 6.5567 6.5640 6.6041 6.6205 8.0611 8.0706 8.0970 8.0976 8.6927 8.7108 8.7422 8.7606 15.4443 15.4479 15.5205 15.5229 16.5684 16.5808 16.8003 16.8036 17.1674 17.1868 17.3172 17.3214 k = 0.4054 0.5000-0.0000 ( 2714 PWs) bands (ev): -5.7421 -5.7173 -5.6366 -5.6129 -5.5147 -5.4978 -5.4411 -5.4274 -3.8249 -3.8050 -3.8022 -3.7783 -3.7231 -3.7115 -3.6553 -3.6438 -3.4558 -3.4397 -3.3919 -3.3807 -3.3795 -3.3765 -3.3480 -3.3464 -3.2957 -3.2606 -3.2562 -3.2378 -3.1982 -3.1706 -2.9473 -2.8233 -2.7068 -2.6173 -2.3886 -2.3158 -2.1213 -2.0446 3.6689 3.6768 3.8636 3.8674 4.4715 4.4721 4.5377 4.5407 5.6611 5.6666 5.6920 5.7087 6.4925 6.4997 6.5375 6.5541 8.1204 8.1309 8.1532 8.1543 8.6968 8.7131 8.7437 8.7608 15.4638 15.4668 15.5217 15.5238 16.6196 16.6304 16.8090 16.8122 17.2306 17.2494 17.3219 17.3282 k = 0.4189 0.5000-0.0000 ( 2714 PWs) bands (ev): -5.7304 -5.7065 -5.6228 -5.5986 -5.5233 -5.5073 -5.4522 -5.4377 -3.8226 -3.8057 -3.8028 -3.7813 -3.7218 -3.7117 -3.6545 -3.6440 -3.4526 -3.4373 -3.3905 -3.3820 -3.3797 -3.3766 -3.3496 -3.3480 -3.2925 -3.2598 -3.2579 -3.2402 -3.1935 -3.1708 -2.9221 -2.8017 -2.6780 -2.5919 -2.4277 -2.3528 -2.1517 -2.0766 3.7041 3.7115 3.8972 3.9005 4.4091 4.4092 4.4776 4.4802 5.7097 5.7158 5.7419 5.7594 6.4287 6.4356 6.4713 6.4879 8.1748 8.1860 8.2041 8.2068 8.6985 8.7130 8.7429 8.7584 15.4788 15.4813 15.5225 15.5242 16.6697 16.6786 16.8162 16.8192 17.2939 17.3112 17.3326 17.3403 k = 0.4324 0.5000-0.0000 ( 2714 PWs) bands (ev): -5.7191 -5.6966 -5.6095 -5.5850 -5.5309 -5.5164 -5.4634 -5.4483 -3.8202 -3.8064 -3.8031 -3.7844 -3.7205 -3.7121 -3.6536 -3.6443 -3.4495 -3.4356 -3.3893 -3.3836 -3.3791 -3.3766 -3.3511 -3.3495 -3.2891 -3.2599 -3.2589 -3.2426 -3.1894 -3.1712 -2.8953 -2.7808 -2.6493 -2.5685 -2.4644 -2.3887 -2.1797 -2.1080 3.7408 3.7476 3.9333 3.9361 4.3488 4.3496 4.4189 4.4211 5.7598 5.7666 5.7938 5.8118 6.3657 6.3721 6.4057 6.4221 8.2236 8.2349 8.2501 8.2539 8.6983 8.7107 8.7401 8.7538 15.4902 15.4922 15.5228 15.5242 16.7164 16.7233 16.8221 16.8247 17.3442 17.3499 17.3650 17.3773 k = 0.4459 0.5000-0.0000 ( 2706 PWs) bands (ev): -5.7083 -5.6881 -5.5970 -5.5723 -5.5368 -5.5247 -5.4746 -5.4592 -3.8178 -3.8070 -3.8033 -3.7875 -3.7192 -3.7125 -3.6526 -3.6448 -3.4466 -3.4347 -3.3884 -3.3849 -3.3784 -3.3765 -3.3524 -3.3509 -3.2858 -3.2620 -3.2579 -3.2449 -3.1859 -3.1717 -2.8672 -2.7619 -2.6210 -2.5485 -2.4973 -2.4231 -2.2040 -2.1381 3.7781 3.7843 3.9721 3.9744 4.2923 4.2935 4.3618 4.3635 5.8112 5.8185 5.8473 5.8660 6.3038 6.3096 6.3410 6.3570 8.2661 8.2766 8.2907 8.2947 8.6965 8.7067 8.7360 8.7476 15.4986 15.5002 15.5229 15.5240 16.7574 16.7624 16.8268 16.8291 17.3663 17.3781 17.4222 17.4377 k = 0.4595 0.5000-0.0000 ( 2702 PWs) bands (ev): -5.6984 -5.6815 -5.5860 -5.5620 -5.5401 -5.5309 -5.4856 -5.4703 -3.8153 -3.8075 -3.8031 -3.7908 -3.7180 -3.7129 -3.6515 -3.6455 -3.4439 -3.4344 -3.3878 -3.3859 -3.3777 -3.3763 -3.3534 -3.3522 -3.2824 -3.2643 -3.2568 -3.2471 -3.1829 -3.1725 -2.8386 -2.7473 -2.5939 -2.5336 -2.5239 -2.4553 -2.2228 -2.1665 3.8147 3.8200 4.0132 4.0150 4.2409 4.2425 4.3063 4.3076 5.8631 5.8710 5.9022 5.9215 6.2438 6.2485 6.2776 6.2928 8.3012 8.3099 8.3249 8.3284 8.6938 8.7017 8.7313 8.7405 15.5046 15.5057 15.5229 15.5238 16.7908 16.7941 16.8305 16.8323 17.3945 17.4078 17.4803 17.4945 k = 0.4730 0.5000-0.0000 ( 2704 PWs) bands (ev): -5.6898 -5.6774 -5.5770 -5.5576 -5.5396 -5.5317 -5.4957 -5.4814 -3.8131 -3.8081 -3.8025 -3.7939 -3.7169 -3.7135 -3.6504 -3.6463 -3.4414 -3.4348 -3.3874 -3.3865 -3.3770 -3.3761 -3.3542 -3.3533 -3.2791 -3.2669 -3.2555 -3.2491 -3.1804 -3.1735 -2.8102 -2.7406 -2.5691 -2.5403 -2.5263 -2.4842 -2.2340 -2.1920 3.8480 3.8521 4.0568 4.0580 4.1974 4.1990 4.2527 4.2535 5.9144 5.9225 5.9579 5.9778 6.1876 6.1898 6.2163 6.2299 8.3280 8.3342 8.3512 8.3537 8.6913 8.6967 8.7272 8.7336 15.5086 15.5093 15.5229 15.5235 16.8154 16.8173 16.8332 16.8344 17.4280 17.4416 17.5320 17.5435 k = 0.4865 0.5000-0.0000 ( 2704 PWs) bands (ev): -5.6828 -5.6762 -5.5703 -5.5600 -5.5353 -5.5283 -5.5024 -5.4921 -3.8112 -3.8089 -3.8012 -3.7968 -3.7159 -3.7142 -3.6493 -3.6473 -3.4392 -3.4358 -3.3872 -3.3869 -3.3765 -3.3760 -3.3546 -3.3541 -3.2758 -3.2697 -3.2542 -3.2510 -3.1782 -3.1748 -2.7834 -2.7451 -2.5507 -2.5404 -2.5290 -2.5076 -2.2361 -2.2134 3.8733 3.8756 4.1025 4.1032 4.1667 4.1678 4.2011 4.2015 5.9609 5.9677 6.0126 6.0324 6.1371 6.1408 6.1605 6.1695 8.3453 8.3485 8.3681 8.3694 8.6897 8.6925 8.7248 8.7281 15.5109 15.5113 15.5229 15.5232 16.8303 16.8312 16.8349 16.8356 17.4633 17.4744 17.5707 17.5776 k = 0.5000 0.5000-0.0000 ( 2704 PWs) bands (ev): -5.6781 -5.6781 -5.5649 -5.5649 -5.5296 -5.5296 -5.5007 -5.5007 -3.8098 -3.8098 -3.7993 -3.7993 -3.7150 -3.7150 -3.6483 -3.6483 -3.4373 -3.4373 -3.3871 -3.3871 -3.3761 -3.3761 -3.3545 -3.3545 -3.2727 -3.2727 -3.2526 -3.2526 -3.1763 -3.1763 -2.7605 -2.7605 -2.5400 -2.5400 -2.5250 -2.5250 -2.2288 -2.2288 3.8839 3.8839 4.1462 4.1462 4.1530 4.1530 4.1586 4.1586 5.9869 5.9869 6.0558 6.0558 6.1187 6.1187 6.1269 6.1269 8.3523 8.3523 8.3743 8.3743 8.6900 8.6900 8.7250 8.7250 15.5118 15.5118 15.5230 15.5230 16.8351 16.8351 16.8362 16.8362 17.4869 17.4869 17.5880 17.5880 k = 0.5000 0.5000-0.0000 ( 2704 PWs) bands (ev): -5.6781 -5.6781 -5.5649 -5.5649 -5.5296 -5.5296 -5.5007 -5.5007 -3.8098 -3.8098 -3.7993 -3.7993 -3.7150 -3.7150 -3.6483 -3.6483 -3.4373 -3.4373 -3.3871 -3.3871 -3.3761 -3.3761 -3.3545 -3.3545 -3.2727 -3.2727 -3.2526 -3.2526 -3.1763 -3.1763 -2.7605 -2.7605 -2.5400 -2.5400 -2.5250 -2.5250 -2.2288 -2.2288 3.8839 3.8839 4.1462 4.1462 4.1530 4.1530 4.1586 4.1586 5.9869 5.9869 6.0558 6.0558 6.1187 6.1187 6.1269 6.1269 8.3523 8.3523 8.3743 8.3743 8.6900 8.6900 8.7250 8.7250 15.5118 15.5118 15.5230 15.5230 16.8351 16.8351 16.8362 16.8362 17.4869 17.4869 17.5880 17.5880 k = 0.4904 0.4904-0.0000 ( 2704 PWs) bands (ev): -5.6829 -5.6762 -5.5702 -5.5600 -5.5366 -5.5268 -5.5034 -5.4915 -3.8111 -3.8090 -3.8012 -3.7968 -3.7159 -3.7142 -3.6493 -3.6473 -3.4392 -3.4358 -3.3872 -3.3869 -3.3765 -3.3760 -3.3546 -3.3541 -3.2758 -3.2697 -3.2541 -3.2510 -3.1782 -3.1748 -2.7839 -2.7446 -2.5506 -2.5416 -2.5267 -2.5089 -2.2363 -2.2131 3.8729 3.8753 4.1083 4.1083 4.1559 4.1561 4.2074 4.2078 5.9521 5.9652 6.0301 6.0403 6.1206 6.1230 6.1649 6.1854 8.3452 8.3484 8.3682 8.3694 8.6889 8.6918 8.7256 8.7288 15.5097 15.5099 15.5241 15.5246 16.8314 16.8322 16.8338 16.8344 17.4601 17.4729 17.5856 17.5892 k = 0.4808 0.4808-0.0000 ( 2704 PWs) bands (ev): -5.6906 -5.6773 -5.5753 -5.5565 -5.5457 -5.5255 -5.5004 -5.4790 -3.8125 -3.8094 -3.8017 -3.7940 -3.7168 -3.7136 -3.6504 -3.6463 -3.4416 -3.4347 -3.3872 -3.3868 -3.3770 -3.3761 -3.3542 -3.3532 -3.2790 -3.2671 -3.2552 -3.2492 -3.1803 -3.1736 -2.8129 -2.7380 -2.5582 -2.5562 -2.5117 -2.4941 -2.2351 -2.1902 3.8448 3.8493 4.0808 4.0809 4.1567 4.1570 4.2742 4.2743 5.8804 5.9010 6.0254 6.0297 6.1228 6.1240 6.2451 6.2679 8.3272 8.3329 8.3526 8.3552 8.6813 8.6879 8.7364 8.7415 15.4982 15.4984 15.5334 15.5345 16.8200 16.8218 16.8276 16.8290 17.4083 17.4264 17.5910 17.5968 k = 0.4712 0.4712-0.0000 ( 2706 PWs) bands (ev): -5.7011 -5.6819 -5.5795 -5.5595 -5.5489 -5.5241 -5.4942 -5.4656 -3.8138 -3.8110 -3.8008 -3.7911 -3.7178 -3.7132 -3.6515 -3.6455 -3.4443 -3.4340 -3.3870 -3.3867 -3.3778 -3.3764 -3.3535 -3.3521 -3.2822 -3.2655 -3.2553 -3.2475 -3.1827 -3.1727 -2.8457 -2.7417 -2.5669 -2.5631 -2.4962 -2.4810 -2.2253 -2.1615 3.8054 3.8114 4.0650 4.0651 4.1579 4.1585 4.3488 4.3491 5.8024 5.8252 6.0268 6.0292 6.1251 6.1259 6.3317 6.3547 8.2994 8.3068 8.3298 8.3342 8.6627 8.6732 8.7592 8.7655 15.4770 15.4772 15.5511 15.5528 16.8012 16.8039 16.8162 16.8187 17.3449 17.3642 17.5963 17.6020 k = 0.4615 0.4615-0.0000 ( 2712 PWs) bands (ev): -5.7145 -5.6905 -5.5826 -5.5669 -5.5463 -5.5221 -5.4864 -5.4521 -3.8149 -3.8132 -3.7992 -3.7882 -3.7188 -3.7130 -3.6524 -3.6449 -3.4475 -3.4338 -3.3868 -3.3867 -3.3786 -3.3766 -3.3525 -3.3506 -3.2854 -3.2654 -3.2541 -3.2458 -3.1853 -3.1722 -2.8807 -2.7551 -2.5724 -2.5656 -2.4816 -2.4695 -2.2073 -2.1283 3.7608 3.7680 4.0565 4.0568 4.1597 4.1604 4.4292 4.4300 5.7242 5.7482 6.0301 6.0318 6.1280 6.1287 6.4208 6.4435 8.2644 8.2726 8.3004 8.3068 8.6350 8.6492 8.7893 8.7964 15.4477 15.4479 15.5759 15.5781 16.7752 16.7787 16.7972 16.8014 17.2770 17.2955 17.5980 17.6023 k = 0.4519 0.4519-0.0000 ( 2708 PWs) bands (ev): -5.7305 -5.7033 -5.5843 -5.5724 -5.5430 -5.5194 -5.4778 -5.4389 -3.8159 -3.8156 -3.7973 -3.7852 -3.7198 -3.7132 -3.6531 -3.6443 -3.4512 -3.4338 -3.3873 -3.3862 -3.3794 -3.3768 -3.3512 -3.3489 -3.2885 -3.2663 -3.2517 -3.2440 -3.1882 -3.1720 -2.9166 -2.7761 -2.5731 -2.5659 -2.4683 -2.4591 -2.1825 -2.0920 3.7152 3.7234 4.0521 4.0527 4.1619 4.1628 4.5144 4.5159 5.6475 5.6722 6.0349 6.0360 6.1316 6.1323 6.5112 6.5337 8.2246 8.2334 8.2646 8.2730 8.5994 8.6172 8.8235 8.8311 15.4111 15.4113 15.6068 15.6094 16.7420 16.7465 16.7684 16.7748 17.2089 17.2252 17.5981 17.6010 k = 0.4423 0.4423-0.0000 ( 2708 PWs) bands (ev): -5.7490 -5.7201 -5.5847 -5.5753 -5.5394 -5.5159 -5.4689 -5.4263 -3.8179 -3.8166 -3.7953 -3.7822 -3.7207 -3.7138 -3.6537 -3.6440 -3.4554 -3.4343 -3.3882 -3.3857 -3.3800 -3.3769 -3.3497 -3.3471 -3.2914 -3.2677 -3.2487 -3.2424 -3.1913 -3.1722 -2.9525 -2.8020 -2.5703 -2.5645 -2.4566 -2.4493 -2.1523 -2.0536 3.6710 3.6801 4.0500 4.0510 4.1644 4.1655 4.6038 4.6059 5.5727 5.5981 6.0408 6.0416 6.1360 6.1367 6.6026 6.6246 8.1815 8.1908 8.2227 8.2329 8.5568 8.5781 8.8599 8.8679 15.3681 15.3684 15.6427 15.6457 16.7018 16.7071 16.7277 16.7370 17.1429 17.1562 17.5989 17.6006 k = 0.4327 0.4327-0.0000 ( 2710 PWs) bands (ev): -5.7696 -5.7403 -5.5839 -5.5758 -5.5356 -5.5118 -5.4600 -5.4142 -3.8203 -3.8170 -3.7933 -3.7792 -3.7215 -3.7148 -3.6539 -3.6437 -3.4602 -3.4350 -3.3895 -3.3853 -3.3804 -3.3768 -3.3481 -3.3451 -3.2943 -3.2692 -3.2456 -3.2408 -3.1945 -3.1728 -2.9874 -2.8307 -2.5651 -2.5615 -2.4461 -2.4400 -2.1183 -2.0141 3.6295 3.6394 4.0492 4.0507 4.1673 4.1686 4.6968 4.6995 5.5002 5.5263 6.0479 6.0484 6.1412 6.1419 6.6946 6.7161 8.1361 8.1460 8.1753 8.1871 8.5078 8.5322 8.8974 8.9056 15.3195 15.3197 15.6825 15.6858 16.6545 16.6608 16.6744 16.6869 17.0796 17.0896 17.6022 17.6028 k = 0.4231 0.4231-0.0000 ( 2712 PWs) bands (ev): -5.7922 -5.7634 -5.5821 -5.5745 -5.5315 -5.5072 -5.4513 -5.4027 -3.8225 -3.8172 -3.7913 -3.7764 -3.7222 -3.7163 -3.6538 -3.6437 -3.4657 -3.4360 -3.3914 -3.3853 -3.3803 -3.3766 -3.3463 -3.3431 -3.2970 -3.2709 -3.2424 -3.2392 -3.1978 -3.1739 -3.0207 -2.8605 -2.5582 -2.5571 -2.4362 -2.4307 -2.0820 -1.9742 3.5915 3.6021 4.0493 4.0512 4.1705 4.1719 4.7931 4.7961 5.4302 5.4572 6.0561 6.0564 6.1471 6.1478 6.7866 6.8076 8.0887 8.0997 8.1235 8.1363 8.4528 8.4804 8.9353 8.9437 15.2661 15.2662 15.7246 15.7281 16.6006 16.6079 16.6096 16.6249 17.0181 17.0251 17.6092 17.6094 k = 0.4135 0.4135-0.0000 ( 2710 PWs) bands (ev): -5.8165 -5.7887 -5.5793 -5.5716 -5.5270 -5.5020 -5.4428 -5.3919 -3.8247 -3.8170 -3.7893 -3.7737 -3.7228 -3.7182 -3.6533 -3.6438 -3.4720 -3.4372 -3.3938 -3.3855 -3.3798 -3.3762 -3.3445 -3.3410 -3.2995 -3.2724 -3.2392 -3.2377 -3.2012 -3.1754 -3.0516 -2.8905 -2.5513 -2.5500 -2.4267 -2.4213 -2.0444 -1.9347 3.5573 3.5686 4.0499 4.0521 4.1737 4.1753 4.8920 4.8953 5.3634 5.3914 6.0654 6.0655 6.1537 6.1545 6.8784 6.8987 8.0394 8.0523 8.0685 8.0816 8.3926 8.4231 8.9732 8.9818 15.2084 15.2085 15.7673 15.7710 16.5350 16.5398 16.5486 16.5532 16.9573 16.9620 17.6206 17.6213 k = 0.4038 0.4038-0.0000 ( 2710 PWs) bands (ev): -5.8424 -5.8160 -5.5758 -5.5676 -5.5221 -5.4963 -5.4347 -5.3817 -3.8268 -3.8166 -3.7874 -3.7711 -3.7231 -3.7207 -3.6525 -3.6440 -3.4793 -3.4386 -3.3966 -3.3858 -3.3790 -3.3757 -3.3426 -3.3389 -3.3019 -3.2738 -3.2363 -3.2361 -3.2047 -3.1777 -3.0797 -2.9200 -2.5442 -2.5408 -2.4172 -2.4117 -2.0067 -1.8959 3.5273 3.5392 4.0507 4.0533 4.1770 4.1788 4.9928 4.9957 5.3004 5.3300 6.0758 6.0759 6.1611 6.1620 6.9693 6.9887 7.9873 8.0040 8.0127 8.0241 8.3276 8.3610 9.0108 9.0195 15.1471 15.1472 15.8084 15.8121 16.4533 16.4692 16.4772 16.4831 16.8961 16.8994 17.6371 17.6383 k = 0.3942 0.3942-0.0000 ( 2710 PWs) bands (ev): -5.8696 -5.8448 -5.5715 -5.5627 -5.5169 -5.4901 -5.4270 -5.3721 -3.8288 -3.8158 -3.7856 -3.7688 -3.7236 -3.7231 -3.6513 -3.6443 -3.4876 -3.4402 -3.3999 -3.3862 -3.3782 -3.3752 -3.3405 -3.3368 -3.3040 -3.2750 -3.2350 -3.2332 -3.2080 -3.1809 -3.1043 -2.9485 -2.5360 -2.5307 -2.4075 -2.4017 -1.9694 -1.8584 3.5015 3.5139 4.0515 4.0546 4.1802 4.1821 5.0923 5.0933 5.2443 5.2772 6.0873 6.0876 6.1692 6.1701 7.0581 7.0764 7.9313 7.9544 7.9588 7.9661 8.2585 8.2946 9.0479 9.0567 15.0829 15.0829 15.8451 15.8490 16.3665 16.3850 16.4032 16.4117 16.8349 16.8375 17.6589 17.6601 k = 0.3846 0.3846-0.0000 ( 2710 PWs) bands (ev): -5.8981 -5.8750 -5.5666 -5.5570 -5.5113 -5.4836 -5.4196 -5.3632 -3.8306 -3.8147 -3.7839 -3.7668 -3.7270 -3.7228 -3.6498 -3.6448 -3.4972 -3.4418 -3.4036 -3.3865 -3.3776 -3.3746 -3.3384 -3.3348 -3.3059 -3.2760 -3.2339 -3.2306 -3.2111 -3.1855 -3.1246 -2.9758 -2.5266 -2.5198 -2.3974 -2.3912 -1.9332 -1.8225 3.4798 3.4927 4.0523 4.0557 4.1831 4.1852 5.1509 5.1567 5.2350 5.2644 6.1000 6.1005 6.1781 6.1790 7.1434 7.1602 7.8733 7.9021 7.9074 7.9114 8.1861 8.2246 9.0843 9.0931 15.0160 15.0161 15.8742 15.8782 16.2764 16.2955 16.3251 16.3349 16.7751 16.7776 17.6856 17.6866 k = 0.3750 0.3750-0.0000 ( 2710 PWs) bands (ev): -5.9278 -5.9063 -5.5612 -5.5506 -5.5053 -5.4767 -5.4127 -5.3549 -3.8324 -3.8133 -3.7824 -3.7652 -3.7307 -3.7222 -3.6479 -3.6453 -3.5080 -3.4436 -3.4075 -3.3866 -3.3772 -3.3739 -3.3362 -3.3328 -3.3077 -3.2767 -3.2329 -3.2288 -3.2135 -3.1918 -3.1400 -3.0017 -2.5161 -2.5082 -2.3868 -2.3803 -1.8985 -1.7886 3.4622 3.4754 4.0528 4.0566 4.1856 4.1879 5.1142 5.1342 5.3265 5.3431 6.1141 6.1148 6.1876 6.1886 7.2219 7.2368 7.8181 7.8501 7.8575 7.8610 8.1110 8.1518 9.1199 9.1288 14.9470 14.9470 15.8915 15.8959 16.1845 16.2033 16.2422 16.2529 16.7193 16.7220 17.7168 17.7174 k = 0.3654 0.3654-0.0000 ( 2714 PWs) bands (ev): -5.9584 -5.9386 -5.5552 -5.5437 -5.4991 -5.4694 -5.4062 -5.3471 -3.8340 -3.8116 -3.7810 -3.7639 -3.7347 -3.7212 -3.6458 -3.6458 -3.5202 -3.4454 -3.4115 -3.3866 -3.3772 -3.3731 -3.3338 -3.3310 -3.3092 -3.2771 -3.2323 -3.2283 -3.2147 -3.1997 -3.1506 -3.0259 -2.5046 -2.4958 -2.3756 -2.3688 -1.8658 -1.7568 3.4485 3.4619 4.0529 4.0570 4.1876 4.1900 5.0670 5.0910 5.4341 5.4482 6.1297 6.1307 6.1978 6.1988 7.2877 7.3002 7.7725 7.8068 7.8088 7.8130 8.0339 8.0767 9.1547 9.1635 14.8762 14.8762 15.8924 15.8976 16.0926 16.1102 16.1546 16.1662 16.6703 16.6735 17.7521 17.7521 k = 0.3558 0.3558-0.0000 ( 2712 PWs) bands (ev): -5.9900 -5.9719 -5.5487 -5.5363 -5.4926 -5.4620 -5.4000 -5.3399 -3.8356 -3.8096 -3.7798 -3.7631 -3.7390 -3.7197 -3.6464 -3.6434 -3.5334 -3.4472 -3.4155 -3.3865 -3.3776 -3.3723 -3.3312 -3.3292 -3.3106 -3.2772 -3.2323 -3.2296 -3.2140 -3.2078 -3.1575 -3.0484 -2.4920 -2.4828 -2.3638 -2.3568 -1.8352 -1.7275 3.4384 3.4519 4.0524 4.0569 4.1888 4.1913 5.0223 5.0483 5.5446 5.5582 6.1472 6.1485 6.2088 6.2098 7.3301 7.3407 7.7438 7.7612 7.7652 7.7886 7.9556 8.0000 9.1885 9.1973 14.8038 14.8039 15.8714 15.8789 16.0033 16.0182 16.0628 16.0751 16.6309 16.6346 17.7901 17.7913 k = 0.3462 0.3462-0.0000 ( 2702 PWs) bands (ev): -6.0223 -6.0058 -5.5418 -5.5285 -5.4858 -5.4542 -5.3942 -5.3332 -3.8369 -3.8073 -3.7788 -3.7626 -3.7434 -3.7178 -3.6470 -3.6407 -3.5476 -3.4490 -3.4195 -3.3861 -3.3785 -3.3713 -3.3285 -3.3276 -3.3118 -3.2768 -3.2336 -3.2321 -3.2143 -3.2122 -3.1620 -3.0692 -2.4785 -2.4689 -2.3514 -2.3442 -1.8071 -1.7007 3.4314 3.4450 4.0513 4.0561 4.1890 4.1917 4.9820 5.0093 5.6558 5.6695 6.1672 6.1690 6.2207 6.2215 7.3381 7.3487 7.7059 7.7121 7.7647 7.7991 7.8772 7.9228 9.2213 9.2300 14.7302 14.7303 15.8234 15.8354 15.9209 15.9307 15.9672 15.9802 16.6018 16.6060 17.8308 17.8334 k = 0.3365 0.3365-0.0000 ( 2706 PWs) bands (ev): -6.0554 -6.0404 -5.5346 -5.5203 -5.4788 -5.4464 -5.3887 -5.3271 -3.8383 -3.8049 -3.7779 -3.7626 -3.7480 -3.7156 -3.6475 -3.6380 -3.5625 -3.4509 -3.4233 -3.3855 -3.3800 -3.3703 -3.3262 -3.3255 -3.3129 -3.2761 -3.2368 -3.2352 -3.2180 -3.2098 -3.1651 -3.0884 -2.4640 -2.4545 -2.3383 -2.3309 -1.7816 -1.6766 3.4271 3.4406 4.0492 4.0543 4.1880 4.1908 4.9467 4.9752 5.7657 5.7797 6.1904 6.1931 6.2339 6.2341 7.3124 7.3250 7.6583 7.6622 7.7984 7.8069 7.8418 7.8454 9.2530 9.2617 14.6555 14.6556 15.7495 15.7660 15.8452 15.8500 15.8682 15.8819 16.5818 16.5863 17.8728 17.8775 k = 0.3269 0.3269-0.0000 ( 2702 PWs) bands (ev): -6.0890 -6.0754 -5.5270 -5.5118 -5.4716 -5.4384 -5.3836 -5.3214 -3.8394 -3.8023 -3.7772 -3.7628 -3.7527 -3.7129 -3.6479 -3.6350 -3.5777 -3.4528 -3.4269 -3.3848 -3.3820 -3.3693 -3.3250 -3.3224 -3.3137 -3.2751 -3.2411 -3.2384 -3.2193 -3.2072 -3.1674 -3.1057 -2.4486 -2.4393 -2.3245 -2.3171 -1.7587 -1.6554 3.4250 3.4382 4.0460 4.0515 4.1857 4.1885 4.9172 4.9467 5.8716 5.8859 6.2177 6.2222 6.2488 6.2503 7.2651 7.2801 7.6095 7.6112 7.7228 7.7691 7.8719 7.9047 9.2836 9.2923 14.5800 14.5801 15.6607 15.6790 15.7659 15.7685 15.7714 15.7805 16.5679 16.5726 17.9143 17.9215 k = 0.3173 0.3173-0.0000 ( 2702 PWs) bands (ev): -6.1230 -6.1108 -5.5191 -5.5031 -5.4642 -5.4303 -5.3788 -5.3162 -3.8405 -3.7997 -3.7768 -3.7634 -3.7574 -3.7100 -3.6484 -3.6320 -3.5928 -3.4547 -3.4304 -3.3847 -3.3837 -3.3682 -3.3242 -3.3190 -3.3144 -3.2737 -3.2453 -3.2416 -3.2193 -3.2046 -3.1691 -3.1215 -2.4323 -2.4234 -2.3100 -2.3027 -1.7387 -1.6369 3.4244 3.4372 4.0414 4.0473 4.1817 4.1846 4.8941 4.9246 5.9687 5.9825 6.2442 6.2508 6.2755 6.2797 7.2069 7.2240 7.5577 7.5600 7.6508 7.6947 7.9486 7.9796 9.3133 9.3218 14.5038 14.5039 15.5659 15.5842 15.6618 15.6765 15.6857 15.6876 16.5565 16.5614 17.9518 17.9619 k = 0.3077 0.3077-0.0000 ( 2702 PWs) bands (ev): -6.1574 -6.1464 -5.5109 -5.4941 -5.4568 -5.4222 -5.3743 -5.3115 -3.8414 -3.7971 -3.7766 -3.7642 -3.7621 -3.7068 -3.6490 -3.6288 -3.6074 -3.4566 -3.4336 -3.3876 -3.3827 -3.3670 -3.3238 -3.3155 -3.3148 -3.2720 -3.2488 -3.2448 -3.2188 -3.2020 -3.1703 -3.1356 -2.4152 -2.4068 -2.2950 -2.2877 -1.7214 -1.6213 3.4247 3.4369 4.0353 4.0415 4.1759 4.1788 4.8779 4.9094 6.0498 6.0622 6.2627 6.2681 6.3318 6.3364 7.1442 7.1629 7.5000 7.5090 7.5853 7.6237 8.0310 8.0605 9.3417 9.3502 14.4270 14.4271 15.4682 15.4861 15.5553 15.5704 15.5966 15.5981 16.5446 16.5496 17.9807 17.9926 k = 0.2981 0.2981-0.0000 ( 2710 PWs) bands (ev): -6.1920 -6.1822 -5.5026 -5.4850 -5.4493 -5.4141 -5.3701 -5.3072 -3.8423 -3.7946 -3.7766 -3.7666 -3.7652 -3.7033 -3.6504 -3.6256 -3.6206 -3.4586 -3.4366 -3.3911 -3.3814 -3.3657 -3.3238 -3.3149 -3.3118 -3.2700 -3.2515 -3.2479 -3.2180 -3.1995 -3.1712 -3.1483 -2.3973 -2.3895 -2.2792 -2.2721 -1.7068 -1.6084 3.4251 3.4367 4.0272 4.0339 4.1680 4.1708 4.8692 4.9017 6.1108 6.1208 6.2779 6.2827 6.4130 6.4195 7.0804 7.1004 7.4375 7.4558 7.5275 7.5578 8.1161 8.1445 9.3690 9.3774 14.3497 14.3498 15.3692 15.3863 15.4473 15.4626 15.5026 15.5039 16.5300 16.5350 17.9972 18.0081 k = 0.2885 0.2885-0.0000 ( 2714 PWs) bands (ev): -6.2266 -6.2179 -5.4941 -5.4757 -5.4417 -5.4061 -5.3661 -5.3033 -3.8430 -3.7924 -3.7769 -3.7711 -3.7664 -3.6994 -3.6544 -3.6304 -3.6222 -3.4605 -3.4395 -3.3949 -3.3799 -3.3644 -3.3242 -3.3148 -3.3080 -3.2678 -3.2534 -3.2508 -3.2170 -3.1971 -3.1719 -3.1594 -2.3786 -2.3715 -2.2629 -2.2559 -1.6950 -1.5983 3.4251 3.4359 4.0170 4.0240 4.1577 4.1605 4.8687 4.9020 6.1547 6.1626 6.2924 6.2970 6.5131 6.5215 7.0179 7.0386 7.3719 7.3997 7.4762 7.4980 8.2022 8.2297 9.3952 9.4034 14.2721 14.2722 15.2694 15.2855 15.3382 15.3534 15.4051 15.4061 16.5112 16.5162 18.0025 18.0106 k = 0.2788 0.2788-0.0000 ( 2710 PWs) bands (ev): -6.2613 -6.2536 -5.4854 -5.4664 -5.4341 -5.3982 -5.3623 -5.2998 -3.8436 -3.7904 -3.7778 -3.7749 -3.7677 -3.6951 -3.6626 -3.6348 -3.6188 -3.4624 -3.4421 -3.3990 -3.3782 -3.3631 -3.3248 -3.3144 -3.3040 -3.2654 -3.2545 -3.2534 -3.2159 -3.1950 -3.1723 -3.1690 -2.3592 -2.3528 -2.2460 -2.2391 -1.6857 -1.5909 3.4241 3.4341 4.0044 4.0117 4.1450 4.1477 4.8767 4.9108 6.1879 6.1943 6.3067 6.3113 6.6244 6.6340 6.9589 6.9799 7.3060 7.3412 7.4295 7.4446 8.2885 8.3151 9.4202 9.4283 14.1943 14.1943 15.1690 15.1839 15.2285 15.2434 15.3054 15.3060 16.4876 16.4925 18.0015 18.0067 k = 0.2692 0.2692-0.0000 ( 2714 PWs) bands (ev): -6.2958 -6.2890 -5.4766 -5.4570 -5.4266 -5.3904 -5.3588 -5.2966 -3.8441 -3.7889 -3.7806 -3.7770 -3.7692 -3.6907 -3.6734 -3.6354 -3.6153 -3.4644 -3.4447 -3.4033 -3.3764 -3.3617 -3.3256 -3.3140 -3.2999 -3.2631 -3.2558 -3.2550 -3.2147 -3.1936 -3.1768 -3.1725 -2.3391 -2.3334 -2.2285 -2.2218 -1.6789 -1.5859 3.4216 3.4308 3.9890 3.9966 4.1296 4.1320 4.8936 4.9282 6.2150 6.2204 6.3210 6.3256 6.7387 6.7474 6.9089 6.9281 7.2417 7.2819 7.3858 7.3965 8.3742 8.4001 9.4442 9.4521 14.1162 14.1163 15.0682 15.0817 15.1186 15.1329 15.2044 15.2044 16.4587 16.4634 17.9982 18.0012 k = 0.2596 0.2596-0.0000 ( 2718 PWs) bands (ev): -6.3301 -6.3241 -5.4678 -5.4476 -5.4191 -5.3828 -5.3554 -5.2938 -3.8445 -3.7878 -3.7844 -3.7781 -3.7709 -3.6883 -3.6823 -3.6342 -3.6118 -3.4663 -3.4471 -3.4078 -3.3745 -3.3604 -3.3264 -3.3136 -3.2958 -3.2613 -3.2573 -3.2550 -3.2134 -3.1939 -3.1819 -3.1726 -2.3183 -2.3133 -2.2105 -2.2039 -1.6745 -1.5834 3.4174 3.4258 3.9708 3.9787 4.1113 4.1135 4.9192 4.9544 6.2386 6.2431 6.3352 6.3399 6.8089 6.8198 6.9176 6.9186 7.1803 7.2235 7.3444 7.3523 8.4589 8.4841 9.4670 9.4747 14.0380 14.0381 14.9673 14.9787 15.0092 15.0222 15.1022 15.1029 16.4245 16.4290 17.9952 17.9965 k = 0.2500 0.2500-0.0000 ( 2712 PWs) bands (ev): -6.3641 -6.3588 -5.4589 -5.4383 -5.4118 -5.3754 -5.3522 -5.2912 -3.8448 -3.7882 -3.7872 -3.7792 -3.7727 -3.6976 -3.6788 -3.6320 -3.6082 -3.4683 -3.4494 -3.4124 -3.3723 -3.3590 -3.3272 -3.3131 -3.2917 -3.2616 -3.2562 -3.2545 -3.2121 -3.1970 -3.1832 -3.1724 -2.2969 -2.2926 -2.1920 -2.1856 -1.6722 -1.5830 3.4112 3.4188 3.9496 3.9577 4.0901 4.0920 4.9537 4.9892 6.2598 6.2637 6.3492 6.3540 6.7775 6.7983 7.0166 7.0284 7.1227 7.1677 7.3051 7.3112 8.5424 8.5668 9.4887 9.4963 13.9597 13.9599 14.8662 14.8748 14.9010 14.9118 14.9998 15.0013 16.3854 16.3896 17.9935 17.9936 k = 0.2404 0.2404-0.0000 ( 2720 PWs) bands (ev): -6.3976 -6.3930 -5.4501 -5.4290 -5.4045 -5.3682 -5.3492 -5.2890 -3.8450 -3.7919 -3.7871 -3.7804 -3.7746 -3.7083 -3.6730 -3.6292 -3.6045 -3.4704 -3.4516 -3.4170 -3.3701 -3.3575 -3.3280 -3.3126 -3.2878 -3.2631 -3.2541 -3.2536 -3.2107 -3.2013 -3.1823 -3.1722 -2.2750 -2.2713 -2.1731 -2.1668 -1.6719 -1.5847 3.4030 3.4099 3.9254 3.9337 4.0659 4.0674 4.9963 5.0322 6.2792 6.2825 6.3630 6.3678 6.7359 6.7574 7.0683 7.1149 7.1426 7.1554 7.2675 7.2725 8.6241 8.6479 9.5091 9.5166 13.8814 13.8817 14.7652 14.7699 14.7945 14.8019 14.8976 14.9000 16.3416 16.3456 17.9926 17.9940 k = 0.2308 0.2308-0.0000 ( 2720 PWs) bands (ev): -6.4305 -6.4266 -5.4413 -5.4199 -5.3974 -5.3613 -5.3463 -5.2871 -3.8451 -3.7953 -3.7874 -3.7818 -3.7767 -3.7185 -3.6665 -3.6259 -3.6008 -3.4724 -3.4537 -3.4216 -3.3677 -3.3561 -3.3286 -3.3121 -3.2840 -3.2642 -3.2523 -3.2519 -3.2093 -3.2052 -3.1808 -3.1719 -2.2526 -2.2494 -2.1539 -2.1476 -1.6735 -1.5883 3.3929 3.3990 3.8984 3.9067 4.0386 4.0398 5.0468 5.0827 6.2969 6.2997 6.3763 6.3812 6.6972 6.7184 7.0198 7.0665 7.2315 7.2361 7.2725 7.2859 8.7040 8.7272 9.5287 9.5359 13.8032 13.8036 14.6644 14.6645 14.6900 14.6930 14.7959 14.7993 16.2938 16.2975 17.9941 17.9965 k = 0.2212 0.2212-0.0000 ( 2726 PWs) bands (ev): -6.4628 -6.4594 -5.4326 -5.4108 -5.3905 -5.3546 -5.3436 -5.2855 -3.8451 -3.7986 -3.7882 -3.7834 -3.7788 -3.7281 -3.6597 -3.6223 -3.5971 -3.4745 -3.4558 -3.4261 -3.3654 -3.3547 -3.3291 -3.3116 -3.2809 -3.2647 -3.2507 -3.2501 -3.2082 -3.2077 -3.1792 -3.1715 -2.2298 -2.2269 -2.1343 -2.1280 -1.6767 -1.5936 3.3809 3.3864 3.8686 3.8769 4.0085 4.0092 5.1044 5.1402 6.3131 6.3152 6.3890 6.3940 6.6636 6.6840 6.9759 7.0224 7.1976 7.2016 7.4042 7.4182 8.7819 8.8045 9.5471 9.5542 13.7251 13.7255 14.5589 14.5643 14.5855 14.5872 14.6947 14.6992 16.2425 16.2458 17.9977 18.0011 k = 0.2115 0.2115-0.0000 ( 2724 PWs) bands (ev): -6.4944 -6.4915 -5.4239 -5.4020 -5.3838 -5.3483 -5.3409 -5.2841 -3.8450 -3.8016 -3.7894 -3.7850 -3.7809 -3.7369 -3.6526 -3.6183 -3.5933 -3.4766 -3.4578 -3.4305 -3.3629 -3.3532 -3.3295 -3.3111 -3.2787 -3.2640 -3.2488 -3.2488 -3.2101 -3.2061 -3.1775 -3.1711 -2.2066 -2.2040 -2.1145 -2.1081 -1.6813 -1.6004 3.3675 3.3724 3.8363 3.8446 3.9755 3.9758 5.1683 5.2039 6.3274 6.3288 6.4007 6.4059 6.6360 6.6551 6.9372 6.9830 7.1654 7.1692 7.5371 7.5514 8.8576 8.8795 9.5646 9.5714 13.6471 13.6477 14.4543 14.4648 14.4795 14.4859 14.5945 14.6001 16.1884 16.1914 18.0033 18.0075 k = 0.2019 0.2019-0.0000 ( 2716 PWs) bands (ev): -6.5251 -6.5226 -5.4155 -5.3934 -5.3773 -5.3423 -5.3384 -5.2830 -3.8447 -3.8044 -3.7910 -3.7868 -3.7831 -3.7450 -3.6452 -3.6139 -3.5895 -3.4787 -3.4597 -3.4348 -3.3603 -3.3517 -3.3297 -3.3105 -3.2777 -3.2620 -3.2483 -3.2467 -3.2108 -3.2044 -3.1759 -3.1705 -2.1831 -2.1806 -2.0945 -2.0879 -1.6871 -1.6086 3.3527 3.3570 3.8018 3.8100 3.9397 3.9399 5.2378 5.2729 6.3397 6.3401 6.4114 6.4169 6.6149 6.6321 6.9038 6.9485 7.1351 7.1388 7.6705 7.6850 8.9309 8.9521 9.5810 9.5876 13.5693 13.5701 14.3513 14.3662 14.3754 14.3861 14.4952 14.5019 16.1321 16.1347 18.0102 18.0152 k = 0.1923 0.1923-0.0000 ( 2722 PWs) bands (ev): -6.5550 -6.5528 -5.4072 -5.3851 -5.3711 -5.3366 -5.3359 -5.2822 -3.8444 -3.8070 -3.7930 -3.7887 -3.7852 -3.7525 -3.6377 -3.6094 -3.5857 -3.4809 -3.4616 -3.4391 -3.3578 -3.3502 -3.3298 -3.3098 -3.2777 -3.2591 -3.2484 -3.2444 -3.2104 -3.2027 -3.1745 -3.1701 -2.1595 -2.1570 -2.0744 -2.0676 -1.6939 -1.6178 3.3368 3.3406 3.7654 3.7734 3.9012 3.9019 5.3119 5.3464 6.3490 6.3495 6.4206 6.4265 6.6006 6.6152 6.8757 6.9189 7.1066 7.1103 7.8041 7.8187 9.0017 9.0221 9.5965 9.6028 13.4918 13.4926 14.2502 14.2688 14.2735 14.2876 14.3969 14.4047 16.0741 16.0765 18.0171 18.0226 k = 0.1827 0.1827-0.0000 ( 2722 PWs) bands (ev): -6.5838 -6.5820 -5.3991 -5.3770 -5.3652 -5.3334 -5.3313 -5.2815 -3.8440 -3.8093 -3.7952 -3.7907 -3.7873 -3.7594 -3.6302 -3.6047 -3.5819 -3.4831 -3.4635 -3.4431 -3.3553 -3.3487 -3.3297 -3.3091 -3.2782 -3.2557 -3.2489 -3.2420 -3.2090 -3.2010 -3.1732 -3.1696 -2.1358 -2.1331 -2.0543 -2.0472 -1.7016 -1.6281 3.3200 3.3234 3.7275 3.7354 3.8606 3.8618 5.3897 5.4234 6.3553 6.3571 6.4282 6.4346 6.5931 6.6046 6.8530 6.8943 7.0800 7.0839 7.9375 7.9521 9.0697 9.0894 9.6110 9.6171 13.4145 13.4154 14.1515 14.1728 14.1745 14.1909 14.2998 14.3086 16.0152 16.0172 18.0075 18.0094 k = 0.1731 0.1731-0.0000 ( 2722 PWs) bands (ev): -6.6116 -6.6101 -5.3913 -5.3692 -5.3596 -5.3309 -5.3263 -5.2810 -3.8435 -3.8115 -3.7977 -3.7928 -3.7894 -3.7657 -3.6227 -3.5998 -3.5781 -3.4853 -3.4653 -3.4471 -3.3528 -3.3471 -3.3294 -3.3084 -3.2790 -3.2533 -3.2486 -3.2394 -3.2070 -3.1992 -3.1720 -3.1692 -2.1121 -2.1090 -2.0342 -2.0268 -1.7099 -1.6390 3.3025 3.3055 3.6887 3.6963 3.8183 3.8200 5.4704 5.5031 6.3593 6.3624 6.4342 6.4409 6.5919 6.5999 6.8355 6.8745 7.0555 7.0594 8.0704 8.0850 9.1349 9.1539 9.6245 9.6304 13.3375 13.3385 14.0556 14.0774 14.0795 14.0961 14.2040 14.2138 15.9559 15.9576 17.9635 17.9646 k = 0.1635 0.1635-0.0000 ( 2714 PWs) bands (ev): -6.6382 -6.6370 -5.3837 -5.3617 -5.3543 -5.3284 -5.3216 -5.2807 -3.8430 -3.8135 -3.8003 -3.7948 -3.7913 -3.7715 -3.6152 -3.5947 -3.5743 -3.4875 -3.4672 -3.4509 -3.3504 -3.3455 -3.3289 -3.3076 -3.2798 -3.2536 -3.2457 -3.2367 -3.2045 -3.1974 -3.1709 -3.1688 -2.0885 -2.0849 -2.0143 -2.0064 -1.7187 -1.6506 3.2846 3.2872 3.6492 3.6565 3.7748 3.7770 5.5530 5.5845 6.3616 6.3659 6.4387 6.4455 6.5960 6.6006 6.8231 6.8594 7.0330 7.0370 8.2025 8.2170 9.1972 9.2154 9.6372 9.6428 13.2608 13.2619 13.9629 13.9842 13.9876 14.0035 14.1098 14.1204 15.8967 15.8982 17.9164 17.9172 k = 0.1538 0.1538-0.0000 ( 2718 PWs) bands (ev): -6.6637 -6.6626 -5.3764 -5.3546 -5.3494 -5.3259 -5.3174 -5.2806 -3.8423 -3.8152 -3.8029 -3.7970 -3.7933 -3.7768 -3.6080 -3.5896 -3.5705 -3.4898 -3.4691 -3.4546 -3.3480 -3.3439 -3.3282 -3.3068 -3.2807 -3.2551 -3.2418 -3.2339 -3.2017 -3.1956 -3.1700 -3.1685 -2.0651 -2.0610 -1.9947 -1.9862 -1.7278 -1.6626 3.2663 3.2685 3.6097 3.6167 3.7304 3.7330 5.6366 5.6667 6.3627 6.3681 6.4416 6.4482 6.6044 6.6058 6.8153 6.8486 7.0124 7.0166 8.3334 8.3478 9.2565 9.2738 9.6490 9.6543 13.1843 13.1855 13.8735 13.8942 13.8983 13.9135 14.0172 14.0286 15.8383 15.8395 17.8687 17.8693 k = 0.1442 0.1442-0.0000 ( 2722 PWs) bands (ev): -6.6878 -6.6870 -5.3694 -5.3480 -5.3449 -5.3233 -5.3134 -5.2806 -3.8416 -3.8169 -3.8055 -3.7991 -3.7953 -3.7817 -3.6010 -3.5844 -3.5668 -3.4921 -3.4710 -3.4582 -3.3457 -3.3423 -3.3273 -3.3059 -3.2816 -3.2570 -3.2377 -3.2310 -3.1988 -3.1938 -3.1693 -3.1682 -2.0421 -2.0373 -1.9755 -1.9664 -1.7369 -1.6749 3.2477 3.2496 3.5705 3.5773 3.6857 3.6886 5.7201 5.7487 6.3636 6.3698 6.4430 6.4490 6.6148 6.6163 6.8115 6.8418 6.9938 6.9981 8.4627 8.4768 9.3126 9.3291 9.6598 9.6650 13.1081 13.1094 13.7877 13.8079 13.8120 13.8264 13.9267 13.9387 15.7810 15.7820 17.8212 17.8217 k = 0.1346 0.1346-0.0000 ( 2726 PWs) bands (ev): -6.7107 -6.7101 -5.3628 -5.3423 -5.3403 -5.3206 -5.3099 -5.2808 -3.8407 -3.8183 -3.8080 -3.8013 -3.7973 -3.7861 -3.5942 -3.5792 -3.5631 -3.4943 -3.4729 -3.4617 -3.3435 -3.3408 -3.3262 -3.3050 -3.2824 -3.2589 -3.2335 -3.2280 -3.1958 -3.1920 -3.1687 -3.1681 -2.0197 -2.0141 -1.9568 -1.9470 -1.7460 -1.6872 3.2290 3.2305 3.5323 3.5387 3.6410 3.6442 5.8026 5.8294 6.3646 6.3713 6.4430 6.4483 6.6269 6.6308 6.8113 6.8385 6.9772 6.9816 8.5901 8.6039 9.3654 9.3811 9.6699 9.6748 13.0323 13.0336 13.7060 13.7255 13.7289 13.7425 13.8385 13.8510 15.7254 15.7262 17.7747 17.7750 k = 0.1250 0.1250-0.0000 ( 2718 PWs) bands (ev): -6.7322 -6.7317 -5.3566 -5.3381 -5.3350 -5.3177 -5.3067 -5.2810 -3.8398 -3.8196 -3.8103 -3.8034 -3.7992 -3.7902 -3.5877 -3.5741 -3.5593 -3.4966 -3.4748 -3.4651 -3.3414 -3.3392 -3.3249 -3.3041 -3.2832 -3.2609 -3.2294 -3.2249 -3.1929 -3.1902 -3.1683 -3.1680 -1.9979 -1.9914 -1.9387 -1.9281 -1.7548 -1.6995 3.2102 3.2115 3.4955 3.5016 3.5970 3.6004 5.8832 5.9079 6.3662 6.3732 6.4419 6.4463 6.6416 6.6475 6.8140 6.8381 6.9625 6.9669 8.7151 8.7285 9.4151 9.4298 9.6794 9.6839 12.9569 12.9582 13.6284 13.6473 13.6498 13.6626 13.7532 13.7659 15.6719 15.6726 17.7296 17.7298 k = 0.1154 0.1154-0.0000 ( 2731 PWs) bands (ev): -6.7524 -6.7520 -5.3507 -5.3348 -5.3295 -5.3148 -5.3038 -5.2814 -3.8388 -3.8207 -3.8125 -3.8055 -3.8012 -3.7940 -3.5816 -3.5691 -3.5557 -3.4989 -3.4767 -3.4684 -3.3395 -3.3377 -3.3234 -3.3032 -3.2840 -3.2631 -3.2254 -3.2218 -3.1902 -3.1885 -3.1681 -3.1681 -1.9768 -1.9695 -1.9212 -1.9099 -1.7633 -1.7117 3.1914 3.1923 3.4605 3.4663 3.5540 3.5575 5.9604 5.9830 6.3684 6.3755 6.4398 6.4433 6.6584 6.6662 6.8189 6.8401 6.9496 6.9540 8.8370 8.8499 9.4612 9.4751 9.6878 9.6921 12.8820 12.8833 13.5554 13.5732 13.5752 13.5868 13.6709 13.6837 15.6209 15.6214 17.6864 17.6865 k = 0.1058 0.1058-0.0000 ( 2727 PWs) bands (ev): -6.7710 -6.7707 -5.3453 -5.3320 -5.3244 -5.3119 -5.3012 -5.2818 -3.8377 -3.8217 -3.8145 -3.8075 -3.8032 -3.7975 -3.5756 -3.5642 -3.5521 -3.5012 -3.4787 -3.4716 -3.3377 -3.3362 -3.3216 -3.3022 -3.2847 -3.2652 -3.2214 -3.2186 -3.1875 -3.1868 -3.1683 -3.1680 -1.9568 -1.9486 -1.9046 -1.8926 -1.7713 -1.7235 3.1726 3.1733 3.4279 3.4333 3.5125 3.5161 6.0336 6.0537 6.3713 6.3782 6.4369 6.4397 6.6772 6.6866 6.8254 6.8439 6.9387 6.9430 8.9554 8.9677 9.5040 9.5168 9.6956 9.6996 12.8078 12.8091 13.4872 13.5033 13.5059 13.5158 13.5923 13.6049 15.5728 15.5732 17.6455 17.6455 k = 0.0962 0.0962-0.0000 ( 2727 PWs) bands (ev): -6.7882 -6.7879 -5.3403 -5.3296 -5.3197 -5.3090 -5.2990 -5.2823 -3.8366 -3.8225 -3.8163 -3.8095 -3.8053 -3.8006 -3.5698 -3.5595 -3.5486 -3.5034 -3.4808 -3.4748 -3.3360 -3.3348 -3.3195 -3.3012 -3.2854 -3.2674 -3.2175 -3.2154 -3.1851 -3.1851 -3.1685 -3.1681 -1.9378 -1.9290 -1.8889 -1.8762 -1.7785 -1.7348 3.1541 3.1546 3.3980 3.4029 3.4729 3.4765 6.1017 6.1192 6.3748 6.3814 6.4335 6.4356 6.6979 6.7086 6.8330 6.8489 6.9294 6.9335 9.0694 9.0811 9.5432 9.5550 9.7026 9.7063 12.7348 12.7360 13.4238 13.4380 13.4419 13.4498 13.5179 13.5301 15.5278 15.5281 17.6070 17.6070 k = 0.0865 0.0865-0.0000 ( 2721 PWs) bands (ev): -6.8038 -6.8036 -5.3358 -5.3274 -5.3153 -5.3061 -5.2971 -5.2828 -3.8354 -3.8231 -3.8178 -3.8113 -3.8073 -3.8035 -3.5644 -3.5549 -3.5452 -3.5056 -3.4828 -3.4779 -3.3344 -3.3335 -3.3173 -3.3003 -3.2861 -3.2696 -3.2137 -3.2122 -3.1835 -3.1829 -3.1689 -3.1684 -1.9201 -1.9108 -1.8742 -1.8610 -1.7849 -1.7455 3.1358 3.1362 3.3710 3.3755 3.4358 3.4393 6.1634 6.1783 6.3788 6.3850 6.4297 6.4314 6.7202 6.7321 6.8412 6.8548 6.9218 6.9257 9.1783 9.1893 9.5788 9.5897 9.7089 9.7124 12.6635 12.6646 13.3659 13.3781 13.3832 13.3893 13.4482 13.4597 15.4864 15.4866 17.5715 17.5716 k = 0.0769 0.0769-0.0000 ( 2723 PWs) bands (ev): -6.8179 -6.8178 -5.3317 -5.3255 -5.3113 -5.3035 -5.2955 -5.2835 -3.8341 -3.8236 -3.8191 -3.8130 -3.8094 -3.8061 -3.5592 -3.5506 -3.5419 -3.5079 -3.4849 -3.4809 -3.3330 -3.3323 -3.3149 -3.2993 -3.2868 -3.2719 -3.2102 -3.2091 -3.1820 -3.1809 -3.1694 -3.1688 -1.9039 -1.8945 -1.8605 -1.8471 -1.7903 -1.7554 3.1182 3.1184 3.3471 3.3512 3.4015 3.4048 6.2182 6.2305 6.3831 6.3887 6.4259 6.4271 6.7439 6.7566 6.8494 6.8608 6.9158 6.9193 9.2811 9.2913 9.6109 9.6207 9.7145 9.7177 12.5946 12.5955 13.3134 13.3239 13.3301 13.3345 13.3838 13.3944 15.4486 15.4488 17.5391 17.5392 k = 0.0673 0.0673-0.0000 ( 2735 PWs) bands (ev): -6.8304 -6.8303 -5.3283 -5.3238 -5.3078 -5.3010 -5.2942 -5.2842 -3.8328 -3.8240 -3.8203 -3.8147 -3.8115 -3.8085 -3.5543 -3.5466 -3.5388 -3.5102 -3.4870 -3.4839 -3.3318 -3.3314 -3.3123 -3.2984 -3.2876 -3.2742 -3.2068 -3.2061 -3.1806 -3.1792 -3.1700 -3.1695 -1.8893 -1.8803 -1.8479 -1.8345 -1.7945 -1.7645 3.1014 3.1015 3.3263 3.3299 3.3703 3.3733 6.2656 6.2754 6.3874 6.3923 6.4221 6.4231 6.7684 6.7815 6.8572 6.8666 6.9113 6.9143 9.3768 9.3861 9.6393 9.6481 9.7195 9.7224 12.5290 12.5297 13.2666 13.2755 13.2824 13.2854 13.3254 13.3349 15.4147 15.4148 17.5100 17.5101 k = 0.0577 0.0577-0.0000 ( 2731 PWs) bands (ev): -6.8412 -6.8412 -5.3253 -5.3223 -5.3046 -5.2988 -5.2931 -5.2850 -3.8314 -3.8242 -3.8211 -3.8162 -3.8135 -3.8106 -3.5496 -3.5428 -3.5359 -3.5124 -3.4890 -3.4867 -3.3307 -3.3305 -3.3096 -3.2975 -3.2882 -3.2766 -3.2036 -3.2032 -3.1793 -3.1778 -3.1708 -3.1702 -1.8764 -1.8685 -1.8364 -1.8236 -1.7974 -1.7726 3.0858 3.0859 3.3088 3.3119 3.3426 3.3453 6.3054 6.3130 6.3916 6.3959 6.4185 6.4194 6.7929 6.8061 6.8642 6.8718 6.9085 6.9109 9.4642 9.4725 9.6641 9.6719 9.7238 9.7265 12.4679 12.4684 13.2258 13.2333 13.2407 13.2424 13.2738 13.2818 15.3851 15.3852 17.4845 17.4846 k = 0.0481 0.0481-0.0000 ( 2739 PWs) bands (ev): -6.8505 -6.8504 -5.3228 -5.3210 -5.3017 -5.2968 -5.2922 -5.2858 -3.8300 -3.8243 -3.8218 -3.8176 -3.8153 -3.8127 -3.5453 -3.5393 -3.5332 -3.5148 -3.4910 -3.4895 -3.3299 -3.3297 -3.3068 -3.2966 -3.2889 -3.2791 -3.2007 -3.2005 -3.1782 -3.1766 -3.1716 -3.1711 -1.8656 -1.8594 -1.8259 -1.8143 -1.7989 -1.7795 3.0718 3.0718 3.2942 3.2968 3.3187 3.3210 6.3378 6.3435 6.3957 6.3991 6.4154 6.4161 6.8164 6.8290 6.8701 6.8760 6.9074 6.9091 9.5417 9.5489 9.6851 9.6919 9.7275 9.7299 12.4126 12.4129 13.1911 13.1973 13.2047 13.2051 13.2297 13.2358 15.3597 15.3597 17.4627 17.4628 k = 0.0385 0.0385-0.0000 ( 2747 PWs) bands (ev): -6.8580 -6.8580 -5.3209 -5.3200 -5.2991 -5.2952 -5.2916 -5.2867 -3.8285 -3.8241 -3.8223 -3.8188 -3.8170 -3.8147 -3.5412 -3.5361 -3.5309 -3.5172 -3.4929 -3.4920 -3.3292 -3.3291 -3.3040 -3.2957 -3.2896 -3.2817 -3.1982 -3.1981 -3.1771 -3.1758 -3.1725 -3.1720 -1.8570 -1.8529 -1.8168 -1.8068 -1.7992 -1.7851 3.0597 3.0598 3.2826 3.2847 3.2988 3.3007 6.3633 6.3673 6.3992 6.4016 6.4128 6.4136 6.8375 6.8489 6.8744 6.8788 6.9080 6.9090 9.6082 9.6141 9.7024 9.7081 9.7306 9.7328 12.3644 12.3646 13.1627 13.1677 13.1735 13.1745 13.1939 13.1978 15.3387 15.3387 17.4446 17.4447 k = 0.0288 0.0288-0.0000 ( 2747 PWs) bands (ev): -6.8639 -6.8639 -5.3194 -5.3190 -5.2968 -5.2937 -5.2912 -5.2876 -3.8270 -3.8239 -3.8225 -3.8199 -3.8185 -3.8166 -3.5374 -3.5332 -3.5290 -3.5196 -3.4946 -3.4941 -3.3286 -3.3286 -3.3011 -3.2949 -3.2903 -3.2843 -3.1959 -3.1959 -3.1763 -3.1751 -3.1733 -3.1730 -1.8506 -1.8485 -1.8090 -1.8012 -1.7986 -1.7893 3.0500 3.0500 3.2738 3.2754 3.2831 3.2847 6.3823 6.3849 6.4020 6.4034 6.4110 6.4119 6.8551 6.8646 6.8772 6.8804 6.9102 6.9106 9.6618 9.6663 9.7159 9.7205 9.7334 9.7353 12.3250 12.3250 13.1406 13.1444 13.1477 13.1498 13.1668 13.1686 15.3224 15.3224 17.4305 17.4305 k = 0.0192 0.0192-0.0000 ( 2751 PWs) bands (ev): -6.8682 -6.8682 -5.3185 -5.3183 -5.2947 -5.2926 -5.2910 -5.2887 -3.8254 -3.8234 -3.8225 -3.8208 -3.8199 -3.8185 -3.5338 -3.5307 -3.5278 -3.5221 -3.4961 -3.4959 -3.3282 -3.3282 -3.2982 -3.2941 -3.2910 -3.2870 -3.1942 -3.1942 -3.1755 -3.1747 -3.1741 -3.1738 -1.8464 -1.8457 -1.8029 -1.7976 -1.7975 -1.7922 3.0429 3.0429 3.2677 3.2688 3.2720 3.2730 6.3953 6.3966 6.4038 6.4043 6.4106 6.4113 6.8683 6.8751 6.8789 6.8809 6.9133 6.9133 9.7009 9.7039 9.7259 9.7291 9.7361 9.7375 12.2956 12.2956 13.1250 13.1276 13.1286 13.1307 13.1480 13.1485 15.3106 15.3106 17.4204 17.4204 k = 0.0096 0.0096-0.0000 ( 2751 PWs) bands (ev): -6.8707 -6.8707 -5.3179 -5.3179 -5.2929 -5.2918 -5.2910 -5.2899 -3.8238 -3.8228 -3.8224 -3.8215 -3.8211 -3.8203 -3.5306 -3.5288 -3.5272 -3.5248 -3.4970 -3.4970 -3.3280 -3.3280 -3.2954 -3.2933 -3.2918 -3.2897 -3.1931 -3.1931 -3.1750 -3.1746 -3.1746 -3.1744 -1.8442 -1.8441 -1.7985 -1.7966 -1.7958 -1.7941 3.0385 3.0385 3.2642 3.2647 3.2653 3.2658 6.4024 6.4027 6.4044 6.4044 6.4116 6.4118 6.8767 6.8799 6.8802 6.8809 6.9159 6.9159 9.7228 9.7235 9.7347 9.7355 9.7387 9.7393 12.2774 12.2774 13.1159 13.1170 13.1172 13.1183 13.1369 13.1370 15.3035 15.3035 17.4143 17.4143 k = 0.0000 0.0000 0.0000 ( 2777 PWs) bands (ev): -6.8716 -6.8716 -5.3178 -5.3178 -5.2914 -5.2914 -5.2914 -5.2914 -3.8223 -3.8223 -3.8223 -3.8223 -3.8220 -3.8220 -3.5276 -3.5276 -3.5276 -3.5276 -3.4977 -3.4977 -3.3279 -3.3279 -3.2926 -3.2926 -3.2926 -3.2926 -3.1927 -3.1927 -3.1748 -3.1748 -3.1748 -3.1748 -1.8436 -1.8436 -1.7958 -1.7958 -1.7958 -1.7958 3.0370 3.0370 3.2632 3.2632 3.2632 3.2632 6.4044 6.4044 6.4044 6.4044 6.4123 6.4123 6.8806 6.8806 6.8806 6.8806 6.9170 6.9170 9.7270 9.7270 9.7393 9.7393 9.7393 9.7393 12.2712 12.2712 13.1134 13.1134 13.1134 13.1134 13.1333 13.1333 15.3012 15.3012 17.4122 17.4122 k = 0.0000 0.0000 0.0000 ( 2777 PWs) bands (ev): -6.8716 -6.8716 -5.3178 -5.3178 -5.2914 -5.2914 -5.2914 -5.2914 -3.8223 -3.8223 -3.8223 -3.8223 -3.8220 -3.8220 -3.5276 -3.5276 -3.5276 -3.5276 -3.4977 -3.4977 -3.3279 -3.3279 -3.2926 -3.2926 -3.2926 -3.2926 -3.1927 -3.1927 -3.1748 -3.1748 -3.1748 -3.1748 -1.8436 -1.8436 -1.7958 -1.7958 -1.7958 -1.7958 3.0370 3.0370 3.2632 3.2632 3.2632 3.2632 6.4044 6.4044 6.4044 6.4044 6.4123 6.4123 6.8806 6.8806 6.8806 6.8806 6.9170 6.9170 9.7270 9.7270 9.7393 9.7393 9.7393 9.7393 12.2712 12.2712 13.1134 13.1134 13.1134 13.1134 13.1333 13.1333 15.3012 15.3012 17.4122 17.4122 k = 0.0079 0.0079 0.0079 ( 2749 PWs) bands (ev): -6.8707 -6.8707 -5.3179 -5.3179 -5.2930 -5.2914 -5.2914 -5.2898 -3.8238 -3.8226 -3.8226 -3.8213 -3.8213 -3.8202 -3.5307 -3.5280 -3.5280 -3.5246 -3.4970 -3.4970 -3.3280 -3.3280 -3.2955 -3.2925 -3.2925 -3.2896 -3.1931 -3.1931 -3.1750 -3.1746 -3.1745 -3.1745 -1.8441 -1.8441 -1.7985 -1.7962 -1.7962 -1.7943 3.0385 3.0385 3.2646 3.2650 3.2650 3.2655 6.4023 6.4023 6.4045 6.4045 6.4117 6.4117 6.8764 6.8801 6.8805 6.8805 6.9159 6.9159 9.7228 9.7228 9.7351 9.7351 9.7389 9.7394 12.2775 12.2775 13.1161 13.1172 13.1172 13.1183 13.1370 13.1370 15.3036 15.3036 17.4147 17.4147 k = 0.0159 0.0159 0.0159 ( 2749 PWs) bands (ev): -6.8681 -6.8681 -5.3184 -5.3184 -5.2948 -5.2918 -5.2918 -5.2886 -3.8255 -3.8229 -3.8229 -3.8203 -3.8203 -3.8184 -3.5340 -3.5293 -3.5293 -3.5218 -3.4960 -3.4960 -3.3282 -3.3282 -3.2985 -3.2925 -3.2925 -3.2867 -3.1942 -3.1942 -3.1756 -3.1747 -3.1739 -3.1739 -1.8459 -1.8459 -1.8022 -1.7973 -1.7973 -1.7938 3.0430 3.0430 3.2696 3.2705 3.2705 3.2713 6.3949 6.3949 6.4049 6.4049 6.4109 6.4109 6.8678 6.8752 6.8795 6.8795 6.9136 6.9136 9.6997 9.6997 9.7295 9.7295 9.7361 9.7372 12.2961 12.2961 13.1263 13.1284 13.1284 13.1306 13.1483 13.1483 15.3108 15.3108 17.4222 17.4223 k = 0.0238 0.0238 0.0238 ( 2749 PWs) bands (ev): -6.8638 -6.8638 -5.3193 -5.3193 -5.2969 -5.2925 -5.2925 -5.2875 -3.8272 -3.8231 -3.8231 -3.8192 -3.8192 -3.8165 -3.5375 -3.5314 -3.5314 -3.5191 -3.4944 -3.4944 -3.3286 -3.3286 -3.3015 -3.2926 -3.2926 -3.2839 -3.1960 -3.1960 -3.1763 -3.1751 -3.1731 -3.1731 -1.8489 -1.8489 -1.8070 -1.7992 -1.7992 -1.7945 3.0505 3.0505 3.2782 3.2795 3.2795 3.2808 6.3816 6.3816 6.4052 6.4053 6.4104 6.4104 6.8551 6.8660 6.8753 6.8753 6.9128 6.9128 9.6578 9.6578 9.7246 9.7246 9.7316 9.7333 12.3260 12.3260 13.1439 13.1470 13.1470 13.1502 13.1669 13.1669 15.3229 15.3229 17.4347 17.4348 k = 0.0317 0.0317 0.0317 ( 2749 PWs) bands (ev): -6.8577 -6.8577 -5.3205 -5.3205 -5.2991 -5.2935 -5.2935 -5.2867 -3.8289 -3.8231 -3.8231 -3.8179 -3.8179 -3.8146 -3.5412 -3.5340 -3.5340 -3.5164 -3.4924 -3.4924 -3.3292 -3.3292 -3.3045 -3.2927 -3.2927 -3.2812 -3.1982 -3.1982 -3.1772 -3.1757 -3.1723 -3.1723 -1.8530 -1.8530 -1.8129 -1.8019 -1.8019 -1.7962 3.0608 3.0608 3.2903 3.2920 3.2920 3.2937 6.3629 6.3629 6.4051 6.4055 6.4096 6.4096 6.8390 6.8531 6.8657 6.8657 6.9159 6.9159 9.6001 9.6001 9.7184 9.7184 9.7255 9.7277 12.3661 12.3661 13.1687 13.1729 13.1729 13.1770 13.1927 13.1927 15.3396 15.3396 17.4520 17.4522 k = 0.0397 0.0397 0.0397 ( 2746 PWs) bands (ev): -6.8500 -6.8500 -5.3220 -5.3220 -5.3015 -5.2947 -5.2947 -5.2860 -3.8305 -3.8229 -3.8229 -3.8164 -3.8164 -3.8127 -3.5452 -3.5369 -3.5369 -3.5139 -3.4902 -3.4902 -3.3299 -3.3299 -3.3075 -3.2928 -3.2928 -3.2785 -3.2008 -3.2008 -3.1783 -3.1765 -3.1713 -3.1713 -1.8582 -1.8582 -1.8198 -1.8052 -1.8052 -1.7989 3.0739 3.0739 3.3058 3.3078 3.3078 3.3099 6.3393 6.3393 6.4040 6.4049 6.4079 6.4079 6.8203 6.8374 6.8518 6.8518 6.9231 6.9231 9.5282 9.5282 9.7107 9.7107 9.7177 9.7205 12.4148 12.4148 13.2005 13.2059 13.2059 13.2107 13.2255 13.2255 15.3611 15.3611 17.4742 17.4744 k = 0.0476 0.0476 0.0476 ( 2734 PWs) bands (ev): -6.8405 -6.8405 -5.3238 -5.3238 -5.3040 -5.2960 -5.2960 -5.2856 -3.8321 -3.8224 -3.8224 -3.8146 -3.8146 -3.8107 -3.5495 -3.5402 -3.5402 -3.5113 -3.4879 -3.4879 -3.3306 -3.3306 -3.3104 -3.2929 -3.2929 -3.2760 -3.2036 -3.2036 -3.1794 -3.1777 -3.1705 -3.1705 -1.8644 -1.8644 -1.8277 -1.8092 -1.8092 -1.8026 3.0897 3.0897 3.3244 3.3268 3.3268 3.3292 6.3110 6.3110 6.4013 6.4030 6.4046 6.4046 6.8003 6.8199 6.8354 6.8354 6.9333 6.9333 9.4442 9.4442 9.7015 9.7015 9.7084 9.7117 12.4705 12.4705 13.2390 13.2458 13.2458 13.2509 13.2651 13.2651 15.3874 15.3874 17.5012 17.5014 k = 0.0556 0.0556 0.0556 ( 2731 PWs) bands (ev): -6.8294 -6.8294 -5.3261 -5.3261 -5.3068 -5.2977 -5.2977 -5.2854 -3.8337 -3.8217 -3.8217 -3.8127 -3.8127 -3.8088 -3.5540 -3.5437 -3.5437 -3.5089 -3.4854 -3.4854 -3.3316 -3.3316 -3.3132 -3.2930 -3.2930 -3.2735 -3.2067 -3.2067 -3.1807 -3.1791 -3.1698 -3.1698 -1.8717 -1.8717 -1.8365 -1.8139 -1.8139 -1.8073 3.1079 3.1079 3.3460 3.3487 3.3487 3.3515 6.2785 6.2785 6.3957 6.3988 6.3988 6.3988 6.7803 6.8019 6.8183 6.8183 6.9462 6.9462 9.3492 9.3492 9.6906 9.6906 9.6975 9.7013 12.5316 12.5316 13.2838 13.2922 13.2922 13.2972 13.3112 13.3112 15.4182 15.4182 17.5327 17.5328 k = 0.0635 0.0635 0.0635 ( 2725 PWs) bands (ev): -6.8167 -6.8167 -5.3287 -5.3287 -5.3098 -5.2997 -5.2997 -5.2854 -3.8352 -3.8209 -3.8209 -3.8106 -3.8106 -3.8067 -3.5589 -3.5474 -3.5474 -3.5064 -3.4829 -3.4829 -3.3327 -3.3327 -3.3158 -3.2931 -3.2931 -3.2711 -3.2100 -3.2100 -3.1821 -3.1808 -3.1691 -3.1691 -1.8799 -1.8799 -1.8462 -1.8191 -1.8191 -1.8128 3.1283 3.1283 3.3703 3.3733 3.3733 3.3763 6.2424 6.2424 6.3862 6.3894 6.3894 6.3913 6.7624 6.7850 6.8024 6.8024 6.9615 6.9615 9.2448 9.2448 9.6783 9.6783 9.6851 9.6895 12.5965 12.5965 13.3345 13.3447 13.3447 13.3492 13.3635 13.3635 15.4533 15.4533 17.5685 17.5686 k = 0.0714 0.0714 0.0714 ( 2731 PWs) bands (ev): -6.8023 -6.8023 -5.3317 -5.3317 -5.3130 -5.3018 -5.3018 -5.2857 -3.8367 -3.8198 -3.8198 -3.8084 -3.8084 -3.8047 -3.5642 -3.5513 -3.5513 -3.5041 -3.4804 -3.4804 -3.3340 -3.3340 -3.3184 -3.2933 -3.2933 -3.2688 -3.2134 -3.2134 -3.1837 -3.1828 -3.1686 -3.1686 -1.8890 -1.8890 -1.8567 -1.8250 -1.8250 -1.8191 3.1507 3.1507 3.3970 3.4002 3.4002 3.4035 6.2030 6.2030 6.3715 6.3754 6.3754 6.3794 6.7481 6.7709 6.7893 6.7893 6.9788 6.9788 9.1321 9.1321 9.6645 9.6645 9.6713 9.6762 12.6641 12.6641 13.3906 13.4028 13.4028 13.4065 13.4218 13.4218 15.4926 15.4926 17.6083 17.6085 k = 0.0794 0.0794 0.0794 ( 2734 PWs) bands (ev): -6.7863 -6.7863 -5.3350 -5.3350 -5.3164 -5.3042 -5.3042 -5.2861 -3.8382 -3.8186 -3.8186 -3.8060 -3.8060 -3.8026 -3.5699 -3.5553 -3.5553 -3.5018 -3.4778 -3.4778 -3.3353 -3.3353 -3.3207 -3.2935 -3.2935 -3.2666 -3.2169 -3.2169 -3.1853 -3.1851 -3.1683 -3.1683 -1.8989 -1.8989 -1.8679 -1.8313 -1.8313 -1.8262 3.1748 3.1748 3.4257 3.4291 3.4291 3.4326 6.1612 6.1612 6.3510 6.3564 6.3564 6.3624 6.7389 6.7610 6.7804 6.7804 6.9982 6.9982 9.0122 9.0122 9.6492 9.6492 9.6562 9.6614 12.7331 12.7331 13.4517 13.4659 13.4659 13.4688 13.4861 13.4861 15.5361 15.5361 17.6521 17.6521 k = 0.0873 0.0873 0.0873 ( 2722 PWs) bands (ev): -6.7688 -6.7688 -5.3387 -5.3387 -5.3199 -5.3068 -5.3068 -5.2868 -3.8396 -3.8170 -3.8170 -3.8034 -3.8034 -3.8005 -3.5759 -3.5593 -3.5593 -3.4994 -3.4753 -3.4753 -3.3367 -3.3367 -3.3228 -3.2937 -3.2937 -3.2644 -3.2204 -3.2204 -3.1876 -3.1868 -3.1681 -3.1681 -1.9095 -1.9095 -1.8797 -1.8380 -1.8380 -1.8339 3.2004 3.2004 3.4560 3.4596 3.4596 3.4633 6.1174 6.1174 6.3245 6.3320 6.3320 6.3399 6.7357 6.7564 6.7767 6.7767 7.0197 7.0197 8.8861 8.8861 9.6327 9.6327 9.6397 9.6454 12.8027 12.8027 13.5175 13.5333 13.5333 13.5354 13.5561 13.5561 15.5835 15.5835 17.6993 17.6994 k = 0.0952 0.0952 0.0952 ( 2713 PWs) bands (ev): -6.7498 -6.7498 -5.3427 -5.3427 -5.3236 -5.3096 -5.3096 -5.2877 -3.8410 -3.8153 -3.8153 -3.8006 -3.8006 -3.7984 -3.5822 -3.5634 -3.5634 -3.4970 -3.4727 -3.4727 -3.3383 -3.3383 -3.3246 -3.2939 -3.2939 -3.2623 -3.2239 -3.2239 -3.1903 -3.1885 -3.1680 -3.1680 -1.9207 -1.9207 -1.8921 -1.8451 -1.8451 -1.8422 3.2269 3.2269 3.4875 3.4912 3.4912 3.4950 6.0724 6.0724 6.2927 6.3029 6.3029 6.3123 6.7385 6.7575 6.7785 6.7785 7.0431 7.0431 8.7546 8.7546 9.6148 9.6148 9.6219 9.6281 12.8721 12.8721 13.5875 13.6044 13.6044 13.6060 13.6315 13.6315 15.6345 15.6345 17.7495 17.7495 k = 0.1032 0.1032 0.1032 ( 2713 PWs) bands (ev): -6.7292 -6.7292 -5.3471 -5.3471 -5.3275 -5.3126 -5.3126 -5.2889 -3.8424 -3.8133 -3.8133 -3.7977 -3.7977 -3.7962 -3.5889 -3.5675 -3.5675 -3.4947 -3.4702 -3.4702 -3.3399 -3.3399 -3.3263 -3.2941 -3.2941 -3.2603 -3.2274 -3.2274 -3.1933 -3.1902 -3.1680 -3.1680 -1.9325 -1.9325 -1.9051 -1.8526 -1.8526 -1.8511 3.2539 3.2539 3.5195 3.5233 3.5233 3.5272 6.0267 6.0267 6.2569 6.2699 6.2699 6.2807 6.7468 6.7641 6.7854 6.7854 7.0684 7.0684 8.6182 8.6182 9.5958 9.5958 9.6029 9.6095 12.9409 12.9409 13.6612 13.6789 13.6789 13.6802 13.7117 13.7117 15.6888 15.6888 17.8021 17.8022 k = 0.1111 0.1111 0.1111 ( 2719 PWs) bands (ev): -6.7073 -6.7073 -5.3519 -5.3519 -5.3316 -5.3159 -5.3159 -5.2904 -3.8438 -3.8112 -3.8112 -3.7947 -3.7947 -3.7941 -3.5960 -3.5716 -3.5716 -3.4925 -3.4676 -3.4676 -3.3417 -3.3417 -3.3276 -3.2944 -3.2944 -3.2584 -3.2308 -3.2308 -3.1965 -3.1919 -3.1681 -3.1681 -1.9448 -1.9448 -1.9184 -1.8604 -1.8604 -1.8604 3.2811 3.2811 3.5515 3.5554 3.5554 3.5593 5.9812 5.9812 6.2187 6.2343 6.2343 6.2462 6.7599 6.7756 6.7972 6.7972 7.0956 7.0956 8.4777 8.4777 9.5755 9.5755 9.5828 9.5898 13.0085 13.0085 13.7381 13.7562 13.7562 13.7574 13.7961 13.7961 15.7459 15.7459 17.8566 17.8567 k = 0.1190 0.1190 0.1190 ( 2725 PWs) bands (ev): -6.6840 -6.6840 -5.3570 -5.3570 -5.3358 -5.3193 -5.3193 -5.2921 -3.8451 -3.8089 -3.8089 -3.7919 -3.7915 -3.7915 -3.6035 -3.5758 -3.5758 -3.4902 -3.4651 -3.4651 -3.3435 -3.3435 -3.3287 -3.2947 -3.2947 -3.2566 -3.2342 -3.2342 -3.1998 -3.1936 -3.1684 -3.1684 -1.9575 -1.9575 -1.9321 -1.8702 -1.8684 -1.8684 3.3078 3.3078 3.5828 3.5867 3.5867 3.5906 5.9368 5.9368 6.1796 6.1979 6.1979 6.2106 6.7772 6.7915 6.8131 6.8131 7.1244 7.1244 8.3336 8.3336 9.5543 9.5543 9.5617 9.5691 13.0747 13.0747 13.8179 13.8363 13.8363 13.8374 13.8840 13.8840 15.8057 15.8057 17.9122 17.9123 k = 0.1270 0.1270 0.1270 ( 2713 PWs) bands (ev): -6.6593 -6.6593 -5.3624 -5.3624 -5.3402 -5.3230 -5.3230 -5.2940 -3.8463 -3.8063 -3.8063 -3.7897 -3.7879 -3.7879 -3.6112 -3.5798 -3.5798 -3.4880 -3.4625 -3.4625 -3.3452 -3.3452 -3.3293 -3.2951 -3.2951 -3.2548 -3.2374 -3.2374 -3.2032 -3.1953 -3.1687 -3.1687 -1.9706 -1.9706 -1.9461 -1.8803 -1.8765 -1.8765 3.3335 3.3335 3.6127 3.6167 3.6167 3.6204 5.8941 5.8941 6.1413 6.1619 6.1619 6.1754 6.7980 6.8112 6.8327 6.8327 7.1551 7.1551 8.1863 8.1863 9.5321 9.5321 9.5397 9.5474 13.1394 13.1394 13.9003 13.9187 13.9187 13.9198 13.9750 13.9750 15.8676 15.8676 17.9681 17.9681 k = 0.1349 0.1349 0.1349 ( 2713 PWs) bands (ev): -6.6334 -6.6334 -5.3681 -5.3681 -5.3447 -5.3268 -5.3268 -5.2962 -3.8476 -3.8036 -3.8036 -3.7875 -3.7843 -3.7843 -3.6192 -3.5837 -3.5837 -3.4858 -3.4600 -3.4600 -3.3471 -3.3471 -3.3298 -3.2955 -3.2955 -3.2533 -3.2404 -3.2404 -3.2067 -3.1969 -3.1690 -3.1690 -1.9838 -1.9838 -1.9602 -1.8906 -1.8848 -1.8848 3.3576 3.3576 3.6403 3.6443 3.6443 3.6479 5.8541 5.8541 6.1053 6.1278 6.1278 6.1421 6.8219 6.8341 6.8555 6.8555 7.1874 7.1874 8.0361 8.0361 9.5089 9.5089 9.5167 9.5248 13.2024 13.2024 13.9849 14.0031 14.0031 14.0043 14.0682 14.0682 15.9309 15.9309 18.0229 18.0230 k = 0.1429 0.1429 0.1429 ( 2713 PWs) bands (ev): -6.6063 -6.6063 -5.3741 -5.3741 -5.3494 -5.3308 -5.3308 -5.2986 -3.8488 -3.8008 -3.8008 -3.7853 -3.7803 -3.7803 -3.6274 -3.5876 -3.5876 -3.4836 -3.4575 -3.4575 -3.3490 -3.3490 -3.3299 -3.2959 -3.2959 -3.2521 -3.2431 -3.2431 -3.2101 -3.1985 -3.1694 -3.1694 -1.9973 -1.9973 -1.9745 -1.9012 -1.8931 -1.8931 3.3794 3.3794 3.6648 3.6689 3.6689 3.6722 5.8177 5.8177 6.0728 6.0971 6.0971 6.1120 6.8484 6.8599 6.8811 6.8811 7.2214 7.2214 7.8835 7.8835 9.4849 9.4849 9.4930 9.5013 13.2636 13.2636 14.0714 14.0893 14.0893 14.0906 14.1632 14.1632 15.9951 15.9951 18.0752 18.0756 k = 0.1508 0.1508 0.1508 ( 2725 PWs) bands (ev): -6.5781 -6.5781 -5.3804 -5.3804 -5.3543 -5.3351 -5.3351 -5.3013 -3.8500 -3.7980 -3.7980 -3.7832 -3.7761 -3.7761 -3.6358 -3.5913 -3.5913 -3.4815 -3.4550 -3.4550 -3.3509 -3.3509 -3.3298 -3.2965 -3.2965 -3.2512 -3.2455 -3.2455 -3.2133 -3.2001 -3.1699 -3.1699 -2.0109 -2.0109 -1.9889 -1.9120 -1.9014 -1.9014 3.3981 3.3981 3.6853 3.6896 3.6896 3.6926 5.7856 5.7856 6.0453 6.0710 6.0710 6.0865 6.8772 6.8881 6.9092 6.9092 7.2568 7.2568 7.7287 7.7287 9.4602 9.4602 9.4685 9.4771 13.3230 13.3230 14.1594 14.1770 14.1770 14.1782 14.2594 14.2594 16.0596 16.0596 18.1222 18.1223 k = 0.1587 0.1587 0.1587 ( 2731 PWs) bands (ev): -6.5488 -6.5488 -5.3870 -5.3870 -5.3593 -5.3396 -5.3396 -5.3043 -3.8511 -3.7952 -3.7952 -3.7811 -3.7715 -3.7715 -3.6442 -3.5947 -3.5947 -3.4795 -3.4524 -3.4524 -3.3528 -3.3528 -3.3294 -3.2972 -3.2972 -3.2508 -3.2474 -3.2474 -3.2161 -3.2017 -3.1704 -3.1704 -2.0246 -2.0246 -2.0032 -1.9228 -1.9097 -1.9097 3.4132 3.4132 3.7011 3.7055 3.7055 3.7083 5.7587 5.7587 6.0239 6.0507 6.0507 6.0667 6.9082 6.9186 6.9395 6.9395 7.2938 7.2938 7.5721 7.5721 9.4348 9.4348 9.4434 9.4523 13.3805 13.3805 14.2487 14.2658 14.2658 14.2671 14.3562 14.3562 16.1236 16.1236 18.1501 18.1501 k = 0.1667 0.1667 0.1667 ( 2731 PWs) bands (ev): -6.5186 -6.5186 -5.3938 -5.3938 -5.3644 -5.3442 -5.3442 -5.3075 -3.8522 -3.7926 -3.7926 -3.7790 -3.7664 -3.7664 -3.6527 -3.5979 -3.5979 -3.4775 -3.4499 -3.4499 -3.3547 -3.3547 -3.3288 -3.2980 -3.2980 -3.2512 -3.2488 -3.2488 -3.2182 -3.2031 -3.1709 -3.1709 -2.0383 -2.0383 -2.0175 -1.9338 -1.9179 -1.9179 3.4239 3.4239 3.7112 3.7159 3.7159 3.7184 5.7378 5.7378 6.0097 6.0373 6.0373 6.0538 6.9411 6.9510 6.9718 6.9718 7.3322 7.3322 7.4141 7.4141 9.4089 9.4089 9.4178 9.4269 13.4361 13.4361 14.3390 14.3556 14.3556 14.3569 14.4534 14.4534 16.1864 16.1864 18.1561 18.1561 k = 0.1746 0.1746 0.1746 ( 2731 PWs) bands (ev): -6.4875 -6.4875 -5.4008 -5.4008 -5.3696 -5.3490 -5.3490 -5.3110 -3.8533 -3.7902 -3.7902 -3.7771 -3.7608 -3.7608 -3.6611 -3.6008 -3.6008 -3.4755 -3.4474 -3.4474 -3.3566 -3.3566 -3.3279 -3.2990 -3.2990 -3.2524 -3.2496 -3.2496 -3.2194 -3.2044 -3.1713 -3.1713 -2.0519 -2.0519 -2.0317 -1.9448 -1.9260 -1.9260 3.4298 3.4298 3.7152 3.7203 3.7203 3.7224 5.7236 5.7236 6.0035 6.0317 6.0317 6.0487 6.9757 6.9853 7.0059 7.0059 7.2547 7.2547 7.3720 7.3720 9.3825 9.3825 9.3917 9.4010 13.4898 13.4898 14.4302 14.4462 14.4462 14.4475 14.5504 14.5504 16.2470 16.2470 18.1617 18.1617 k = 0.1825 0.1825 0.1825 ( 2719 PWs) bands (ev): -6.4556 -6.4556 -5.4080 -5.4080 -5.3750 -5.3539 -5.3539 -5.3147 -3.8542 -3.7880 -3.7880 -3.7752 -3.7546 -3.7546 -3.6694 -3.6033 -3.6033 -3.4736 -3.4448 -3.4448 -3.3583 -3.3583 -3.3268 -3.3001 -3.3001 -3.2546 -3.2497 -3.2497 -3.2196 -3.2056 -3.1717 -3.1717 -2.0655 -2.0655 -2.0457 -1.9557 -1.9338 -1.9338 3.4303 3.4303 3.7125 3.7180 3.7180 3.7197 5.7166 5.7166 6.0061 6.0346 6.0346 6.0520 7.0118 7.0212 7.0416 7.0416 7.0947 7.0947 7.4130 7.4130 9.3558 9.3558 9.3653 9.3748 13.5414 13.5414 14.5219 14.5373 14.5373 14.5385 14.6470 14.6470 16.3048 16.3048 18.1707 18.1707 k = 0.1905 0.1905 0.1905 ( 2713 PWs) bands (ev): -6.4230 -6.4230 -5.4153 -5.4153 -5.3804 -5.3590 -5.3590 -5.3187 -3.8552 -3.7862 -3.7862 -3.7735 -3.7478 -3.7478 -3.6774 -3.6053 -3.6053 -3.4718 -3.4423 -3.4423 -3.3601 -3.3601 -3.3255 -3.3013 -3.3013 -3.2577 -3.2490 -3.2490 -3.2190 -3.2067 -3.1720 -3.1720 -2.0789 -2.0789 -2.0596 -1.9667 -1.9415 -1.9415 3.4250 3.4250 3.7029 3.7089 3.7089 3.7103 5.7170 5.7170 6.0178 6.0463 6.0463 6.0641 6.9339 6.9339 7.0494 7.0587 7.0790 7.0790 7.4552 7.4552 9.3287 9.3287 9.3386 9.3482 13.5910 13.5910 14.6139 14.6287 14.6287 14.6299 14.7427 14.7427 16.3588 16.3588 18.1838 18.1838 k = 0.1984 0.1984 0.1984 ( 2713 PWs) bands (ev): -6.3898 -6.3898 -5.4229 -5.4229 -5.3859 -5.3643 -5.3643 -5.3229 -3.8561 -3.7848 -3.7848 -3.7721 -3.7405 -3.7405 -3.6851 -3.6069 -3.6069 -3.4701 -3.4398 -3.4398 -3.3619 -3.3619 -3.3241 -3.3027 -3.3027 -3.2614 -3.2476 -3.2476 -3.2178 -3.2077 -3.1723 -3.1723 -2.0922 -2.0922 -2.0732 -1.9776 -1.9489 -1.9489 3.4138 3.4138 3.6863 3.6928 3.6928 3.6939 5.7249 5.7249 6.0388 6.0671 6.0671 6.0852 6.7732 6.7732 7.0883 7.0975 7.1176 7.1176 7.4985 7.4985 9.3014 9.3014 9.3116 9.3214 13.6384 13.6384 14.7060 14.7202 14.7202 14.7213 14.8373 14.8373 16.4081 16.4081 18.2014 18.2014 k = 0.2063 0.2063 0.2063 ( 2719 PWs) bands (ev): -6.3562 -6.3562 -5.4306 -5.4306 -5.3916 -5.3698 -5.3698 -5.3274 -3.8570 -3.7839 -3.7839 -3.7710 -3.7326 -3.7326 -3.6923 -3.6080 -3.6080 -3.4686 -3.4374 -3.4374 -3.3636 -3.3636 -3.3226 -3.3043 -3.3043 -3.2656 -3.2453 -3.2453 -3.2159 -3.2085 -3.1725 -3.1725 -2.1052 -2.1052 -2.0865 -1.9884 -1.9560 -1.9560 3.3966 3.3966 3.6629 3.6701 3.6701 3.6709 5.7399 5.7399 6.0690 6.0968 6.0968 6.1151 6.6132 6.6132 7.1284 7.1375 7.1574 7.1574 7.5429 7.5429 9.2740 9.2740 9.2846 9.2944 13.6836 13.6836 14.7979 14.8114 14.8114 14.8125 14.9306 14.9306 16.4520 16.4520 18.2236 18.2236 k = 0.2143 0.2143 0.2143 ( 2731 PWs) bands (ev): -6.3222 -6.3222 -5.4384 -5.4384 -5.3973 -5.3754 -5.3754 -5.3321 -3.8578 -3.7834 -3.7834 -3.7704 -3.7243 -3.7243 -3.6989 -3.6085 -3.6085 -3.4671 -3.4349 -3.4349 -3.3653 -3.3653 -3.3210 -3.3059 -3.3059 -3.2701 -3.2420 -3.2420 -3.2138 -3.2093 -3.1726 -3.1726 -2.1181 -2.1181 -2.0996 -1.9991 -1.9629 -1.9629 3.3737 3.3737 3.6331 3.6409 3.6409 3.6414 5.7607 5.7607 6.1080 6.1352 6.1352 6.1538 6.4550 6.4550 7.1695 7.1786 7.1983 7.1983 7.5881 7.5881 9.2465 9.2465 9.2574 9.2673 13.7263 13.7263 14.8895 14.9024 14.9024 14.9034 15.0221 15.0221 16.4898 16.4898 18.2500 18.2500 k = 0.2222 0.2222 0.2222 ( 2725 PWs) bands (ev): -6.2879 -6.2879 -5.4463 -5.4463 -5.4030 -5.3811 -5.3811 -5.3370 -3.8585 -3.7833 -3.7833 -3.7704 -3.7155 -3.7155 -3.7045 -3.6082 -3.6082 -3.4658 -3.4325 -3.4325 -3.3668 -3.3668 -3.3193 -3.3076 -3.3076 -3.2748 -3.2377 -3.2377 -3.2112 -3.2097 -3.1726 -3.1726 -2.1306 -2.1306 -2.1123 -2.0097 -1.9694 -1.9694 3.3454 3.3454 3.5974 3.6059 3.6059 3.6062 5.7846 5.7846 6.1555 6.1812 6.1812 6.2006 6.3023 6.3023 7.2116 7.2208 7.2403 7.2403 7.6343 7.6343 9.2190 9.2190 9.2304 9.2403 13.7667 13.7667 14.9805 14.9927 14.9927 14.9937 15.1119 15.1119 16.5212 16.5212 18.2766 18.2766 k = 0.2302 0.2302 0.2302 ( 2719 PWs) bands (ev): -6.2535 -6.2535 -5.4542 -5.4542 -5.4088 -5.3869 -5.3869 -5.3421 -3.8592 -3.7836 -3.7836 -3.7711 -3.7091 -3.7063 -3.7063 -3.6073 -3.6073 -3.4646 -3.4301 -3.4301 -3.3683 -3.3683 -3.3175 -3.3092 -3.3092 -3.2795 -3.2322 -3.2322 -3.2100 -3.2084 -3.1724 -3.1724 -2.1429 -2.1429 -2.1247 -2.0202 -1.9755 -1.9755 3.3120 3.3120 3.5565 3.5657 3.5657 3.5658 5.8030 5.8030 6.1587 6.1587 6.2108 6.2389 6.2389 6.2551 7.2545 7.2638 7.2832 7.2832 7.6811 7.6811 9.1917 9.1917 9.2035 9.2133 13.8045 13.8045 15.0705 15.0820 15.0820 15.0830 15.1996 15.1996 16.5457 16.5457 18.2779 18.2781 k = 0.2381 0.2381 0.2381 ( 2725 PWs) bands (ev): -6.2191 -6.2191 -5.4622 -5.4622 -5.4146 -5.3928 -5.3928 -5.3475 -3.8599 -3.7845 -3.7845 -3.7728 -3.7125 -3.6970 -3.6970 -3.6056 -3.6056 -3.4636 -3.4278 -3.4278 -3.3697 -3.3697 -3.3158 -3.3109 -3.3109 -3.2844 -3.2256 -3.2256 -3.2101 -3.2053 -3.1721 -3.1721 -2.1550 -2.1550 -2.1367 -2.0305 -1.9813 -1.9813 3.2741 3.2741 3.5111 3.5207 3.5210 3.5210 5.7879 5.7879 6.0601 6.0601 6.2731 6.2990 6.2990 6.3165 7.2982 7.3076 7.3267 7.3267 7.7285 7.7285 9.1646 9.1646 9.1768 9.1866 13.8395 13.8395 15.1592 15.1701 15.1701 15.1711 15.2848 15.2848 16.5632 16.5632 18.2627 18.2631 k = 0.2460 0.2460 0.2460 ( 2722 PWs) bands (ev): -6.1848 -6.1848 -5.4702 -5.4702 -5.4204 -5.3988 -5.3988 -5.3530 -3.8605 -3.7857 -3.7857 -3.7753 -3.7146 -3.6876 -3.6876 -3.6030 -3.6030 -3.4628 -3.4256 -3.4256 -3.3709 -3.3709 -3.3141 -3.3125 -3.3125 -3.2892 -3.2177 -3.2177 -3.2099 -3.2021 -3.1715 -3.1715 -2.1667 -2.1667 -2.1484 -2.0407 -1.9867 -1.9867 3.2322 3.2322 3.4619 3.4719 3.4723 3.4723 5.7008 5.7008 6.0394 6.0394 6.3418 6.3666 6.3666 6.3842 7.3425 7.3520 7.3710 7.3710 7.7765 7.7765 9.1377 9.1377 9.1504 9.1601 13.8717 13.8717 15.2463 15.2565 15.2565 15.2576 15.3674 15.3674 16.5740 16.5740 18.2417 18.2423 k = 0.2540 0.2540 0.2540 ( 2722 PWs) bands (ev): -6.1507 -6.1507 -5.4781 -5.4781 -5.4262 -5.4049 -5.4049 -5.3587 -3.8610 -3.7874 -3.7874 -3.7787 -3.7155 -3.6784 -3.6784 -3.5995 -3.5995 -3.4621 -3.4235 -3.4235 -3.3720 -3.3720 -3.3141 -3.3141 -3.3125 -3.2939 -3.2095 -3.2084 -3.2084 -3.1987 -3.1706 -3.1706 -2.1781 -2.1781 -2.1596 -2.0507 -1.9917 -1.9917 3.1869 3.1869 3.4095 3.4199 3.4205 3.4205 5.5662 5.5662 6.0725 6.0725 6.4162 6.4400 6.4400 6.4574 7.3872 7.3970 7.4157 7.4157 7.8250 7.8250 9.1113 9.1113 9.1244 9.1340 13.9009 13.9009 15.3313 15.3409 15.3409 15.3421 15.4469 15.4469 16.5783 16.5783 18.2158 18.2171 k = 0.2619 0.2619 0.2619 ( 2725 PWs) bands (ev): -6.1171 -6.1171 -5.4861 -5.4861 -5.4320 -5.4111 -5.4111 -5.3646 -3.8615 -3.7894 -3.7894 -3.7828 -3.7153 -3.6696 -3.6696 -3.5951 -3.5951 -3.4617 -3.4215 -3.4215 -3.3729 -3.3729 -3.3156 -3.3156 -3.3110 -3.2985 -3.2088 -3.1980 -3.1980 -3.1952 -3.1692 -3.1692 -2.1892 -2.1892 -2.1705 -2.0606 -1.9962 -1.9962 3.1388 3.1388 3.3547 3.3653 3.3662 3.3662 5.4160 5.4160 6.1272 6.1272 6.4955 6.5183 6.5183 6.5355 7.4324 7.4425 7.4609 7.4609 7.8737 7.8737 9.0852 9.0852 9.0988 9.1082 13.9269 13.9269 15.4136 15.4226 15.4226 15.4240 15.5226 15.5226 16.5771 16.5771 18.1854 18.1856 k = 0.2698 0.2698 0.2698 ( 2719 PWs) bands (ev): -6.0839 -6.0839 -5.4939 -5.4939 -5.4378 -5.4172 -5.4172 -5.3706 -3.8619 -3.7916 -3.7916 -3.7872 -3.7143 -3.6613 -3.6613 -3.5896 -3.5896 -3.4614 -3.4196 -3.4196 -3.3735 -3.3735 -3.3170 -3.3170 -3.3096 -3.3030 -3.2078 -3.1916 -3.1870 -3.1870 -3.1662 -3.1662 -2.1999 -2.1999 -2.1809 -2.0703 -2.0004 -2.0004 3.0884 3.0884 3.2980 3.3088 3.3099 3.3099 5.2609 5.2609 6.1925 6.1925 6.5793 6.6010 6.6010 6.6179 7.4778 7.4882 7.5064 7.5064 7.9227 7.9227 9.0597 9.0597 9.0737 9.0830 13.9496 13.9496 15.4929 15.5013 15.5013 15.5028 15.5938 15.5938 16.5713 16.5713 18.1511 18.1511 k = 0.2778 0.2778 0.2778 ( 2725 PWs) bands (ev): -6.0513 -6.0513 -5.5016 -5.5016 -5.4435 -5.4234 -5.4234 -5.3767 -3.8623 -3.7942 -3.7942 -3.7919 -3.7125 -3.6537 -3.6537 -3.5834 -3.5834 -3.4614 -3.4180 -3.4180 -3.3740 -3.3740 -3.3183 -3.3183 -3.3083 -3.3072 -3.2066 -3.1879 -3.1781 -3.1781 -3.1590 -3.1590 -2.2103 -2.2103 -2.1909 -2.0799 -2.0041 -2.0041 3.0362 3.0362 3.2399 3.2509 3.2523 3.2523 5.1041 5.1041 6.2646 6.2646 6.6666 6.6873 6.6873 6.7038 7.5234 7.5342 7.5521 7.5521 7.9717 7.9717 9.0348 9.0348 9.0493 9.0583 13.9688 13.9688 15.5683 15.5761 15.5761 15.5779 15.6593 15.6593 16.5626 16.5626 18.1133 18.1136 k = 0.2857 0.2857 0.2857 ( 2731 PWs) bands (ev): -6.0195 -6.0195 -5.5092 -5.5092 -5.4491 -5.4297 -5.4297 -5.3830 -3.8626 -3.7970 -3.7970 -3.7967 -3.7103 -3.6467 -3.6467 -3.5764 -3.5764 -3.4616 -3.4165 -3.4165 -3.3741 -3.3741 -3.3195 -3.3195 -3.3114 -3.3072 -3.2050 -3.1842 -3.1734 -3.1734 -3.1453 -3.1453 -2.2204 -2.2204 -2.2005 -2.0893 -2.0075 -2.0075 2.9827 2.9827 3.1810 3.1921 3.1937 3.1937 4.9474 4.9474 6.3417 6.3417 6.7571 6.7766 6.7766 6.7928 7.5689 7.5803 7.5979 7.5979 8.0207 8.0207 9.0105 9.0105 9.0255 9.0343 13.9843 13.9843 15.6390 15.6463 15.6463 15.6484 15.7178 15.7178 16.5529 16.5529 18.0725 18.0728 k = 0.2937 0.2937 0.2937 ( 2731 PWs) bands (ev): -5.9885 -5.9885 -5.5166 -5.5166 -5.4546 -5.4358 -5.4358 -5.3893 -3.8629 -3.8014 -3.7999 -3.7999 -3.7075 -3.6404 -3.6404 -3.5689 -3.5689 -3.4621 -3.4152 -3.4152 -3.3740 -3.3740 -3.3206 -3.3206 -3.3152 -3.3063 -3.2032 -3.1804 -3.1709 -3.1709 -3.1269 -3.1269 -2.2302 -2.2302 -2.2096 -2.0985 -2.0104 -2.0104 2.9284 2.9284 3.1218 3.1328 3.1348 3.1348 4.7913 4.7913 6.4229 6.4229 6.8501 6.8685 6.8685 6.8842 7.6144 7.6263 7.6436 7.6436 8.0696 8.0696 8.9871 8.9871 9.0026 9.0110 13.9960 13.9960 15.7042 15.7110 15.7110 15.7135 15.7673 15.7673 16.5451 16.5451 18.0296 18.0301 k = 0.3016 0.3016 0.3016 ( 2722 PWs) bands (ev): -5.9585 -5.9585 -5.5237 -5.5237 -5.4600 -5.4420 -5.4420 -5.3957 -3.8631 -3.8060 -3.8030 -3.8030 -3.7044 -3.6347 -3.6347 -3.5611 -3.5611 -3.4628 -3.4141 -3.4141 -3.3736 -3.3736 -3.3216 -3.3216 -3.3188 -3.3055 -3.2011 -3.1765 -3.1689 -3.1689 -3.1053 -3.1053 -2.2395 -2.2395 -2.2183 -2.1076 -2.0128 -2.0128 2.8736 2.8736 3.0626 3.0735 3.0757 3.0757 4.6364 4.6364 6.5073 6.5073 6.9452 6.9624 6.9624 6.9775 7.6597 7.6723 7.6891 7.6891 8.1182 8.1182 8.9644 8.9644 8.9804 8.9886 14.0038 14.0038 15.7630 15.7692 15.7692 15.7722 15.8056 15.8056 16.5423 16.5423 17.9854 17.9858 k = 0.3095 0.3095 0.3095 ( 2722 PWs) bands (ev): -5.9297 -5.9297 -5.5306 -5.5306 -5.4653 -5.4481 -5.4481 -5.4022 -3.8633 -3.8105 -3.8062 -3.8062 -3.7010 -3.6295 -3.6295 -3.5534 -3.5534 -3.4638 -3.4131 -3.4131 -3.3730 -3.3730 -3.3225 -3.3225 -3.3221 -3.3049 -3.1988 -3.1727 -3.1671 -3.1671 -3.0808 -3.0808 -2.2486 -2.2486 -2.2265 -2.1166 -2.0149 -2.0149 2.8187 2.8187 3.0037 3.0146 3.0170 3.0170 4.4831 4.4831 6.5943 6.5943 7.0416 7.0576 7.0576 7.0721 7.7046 7.7181 7.7344 7.7344 8.1664 8.1664 8.9427 8.9427 8.9592 8.9670 14.0075 14.0075 15.8144 15.8185 15.8185 15.8236 15.8316 15.8316 16.5474 16.5474 17.9410 17.9411 k = 0.3175 0.3175 0.3175 ( 2707 PWs) bands (ev): -5.9020 -5.9020 -5.5371 -5.5371 -5.4704 -5.4540 -5.4540 -5.4086 -3.8634 -3.8147 -3.8094 -3.8094 -3.6973 -3.6247 -3.6247 -3.5458 -3.5458 -3.4651 -3.4123 -3.4123 -3.3721 -3.3721 -3.3251 -3.3232 -3.3232 -3.3045 -3.1962 -3.1688 -3.1652 -3.1652 -3.0537 -3.0537 -2.2572 -2.2572 -2.2343 -2.1253 -2.0165 -2.0165 2.7641 2.7641 2.9456 2.9562 2.9590 2.9590 4.3316 4.3316 6.6835 6.6835 7.1391 7.1538 7.1538 7.1676 7.7492 7.7636 7.7794 7.7794 8.2141 8.2141 8.9220 8.9220 8.9390 8.9465 14.0069 14.0069 15.8377 15.8377 15.8572 15.8644 15.8644 15.8665 16.5629 16.5629 17.8964 17.8976 k = 0.3254 0.3254 0.3254 ( 2707 PWs) bands (ev): -5.8756 -5.8756 -5.5433 -5.5433 -5.4754 -5.4599 -5.4599 -5.4151 -3.8634 -3.8187 -3.8127 -3.8127 -3.6934 -3.6202 -3.6202 -3.5387 -3.5387 -3.4667 -3.4117 -3.4117 -3.3710 -3.3710 -3.3278 -3.3238 -3.3238 -3.3043 -3.1934 -3.1650 -3.1634 -3.1634 -3.0240 -3.0240 -2.2655 -2.2655 -2.2416 -2.1340 -2.0178 -2.0178 2.7100 2.7100 2.8884 2.8988 2.9019 2.9019 4.1823 4.1823 6.7741 6.7741 7.2370 7.2502 7.2502 7.2632 7.7932 7.8088 7.8239 7.8239 8.2611 8.2611 8.9024 8.9024 8.9199 8.9269 14.0019 14.0019 15.8330 15.8330 15.8905 15.8969 15.8969 15.8999 16.5894 16.5894 17.8538 17.8561 k = 0.3333 0.3333 0.3333 ( 2719 PWs) bands (ev): -5.8508 -5.8508 -5.5490 -5.5490 -5.4803 -5.4657 -5.4657 -5.4216 -3.8636 -3.8225 -3.8160 -3.8160 -3.6892 -3.6160 -3.6160 -3.5321 -3.5321 -3.4686 -3.4112 -3.4112 -3.3699 -3.3699 -3.3302 -3.3244 -3.3244 -3.3042 -3.1905 -3.1615 -3.1615 -3.1614 -2.9919 -2.9919 -2.2735 -2.2735 -2.2484 -2.1425 -2.0187 -2.0187 2.6567 2.6567 2.8324 2.8425 2.8459 2.8459 4.0354 4.0354 6.8658 6.8658 7.3347 7.3463 7.3463 7.3583 7.8366 7.8537 7.8680 7.8680 8.3072 8.3072 8.8838 8.8838 8.9018 8.9083 13.9924 13.9924 15.8147 15.8147 15.9135 15.9195 15.9195 15.9230 16.6260 16.6260 17.8141 17.8174 k = 0.3413 0.3413 0.3413 ( 2710 PWs) bands (ev): -5.8274 -5.8274 -5.5541 -5.5541 -5.4849 -5.4714 -5.4714 -5.4280 -3.8635 -3.8260 -3.8192 -3.8192 -3.6848 -3.6119 -3.6119 -3.5261 -3.5261 -3.4708 -3.4107 -3.4107 -3.3687 -3.3687 -3.3323 -3.3248 -3.3248 -3.3043 -3.1873 -3.1595 -3.1595 -3.1576 -2.9573 -2.9573 -2.2811 -2.2811 -2.2548 -2.1508 -2.0192 -2.0192 2.6044 2.6044 2.7779 2.7877 2.7914 2.7914 3.8914 3.8914 6.9582 6.9582 7.4316 7.4416 7.4416 7.4524 7.8795 7.8984 7.9117 7.9117 8.3525 8.3525 8.8667 8.8667 8.8852 8.8912 13.9785 13.9785 15.7863 15.7863 15.9255 15.9313 15.9313 15.9353 16.6711 16.6711 17.7781 17.7824 k = 0.3492 0.3492 0.3492 ( 2710 PWs) bands (ev): -5.8057 -5.8057 -5.5587 -5.5587 -5.4893 -5.4769 -5.4769 -5.4344 -3.8635 -3.8292 -3.8225 -3.8225 -3.6803 -3.6081 -3.6081 -3.5207 -3.5207 -3.4733 -3.4103 -3.4103 -3.3674 -3.3674 -3.3340 -3.3252 -3.3252 -3.3045 -3.1840 -3.1575 -3.1575 -3.1541 -2.9206 -2.9206 -2.2883 -2.2883 -2.2606 -2.1590 -2.0194 -2.0194 2.5534 2.5534 2.7250 2.7345 2.7385 2.7385 3.7504 3.7504 7.0509 7.0509 7.5271 7.5351 7.5351 7.5446 7.9220 7.9431 7.9551 7.9551 8.3967 8.3967 8.8509 8.8509 8.8699 8.8753 13.9599 13.9599 15.7505 15.7505 15.9265 15.9321 15.9321 15.9364 16.7223 16.7223 17.7460 17.7512 k = 0.3571 0.3571 0.3571 ( 2719 PWs) bands (ev): -5.7858 -5.7858 -5.5625 -5.5625 -5.4935 -5.4822 -5.4822 -5.4407 -3.8634 -3.8322 -3.8257 -3.8257 -3.6755 -3.6044 -3.6044 -3.5159 -3.5159 -3.4762 -3.4099 -3.4099 -3.3662 -3.3662 -3.3355 -3.3255 -3.3255 -3.3049 -3.1807 -3.1554 -3.1554 -3.1507 -2.8820 -2.8820 -2.2951 -2.2951 -2.2660 -2.1670 -2.0192 -2.0192 2.5038 2.5038 2.6740 2.6830 2.6873 2.6873 3.6128 3.6128 7.1433 7.1433 7.6202 7.6261 7.6261 7.6338 7.9643 7.9881 7.9985 7.9985 8.4396 8.4396 8.8365 8.8365 8.8560 8.8608 13.9369 13.9369 15.7100 15.7100 15.9166 15.9221 15.9221 15.9266 16.7778 16.7778 17.7178 17.7239 k = 0.3651 0.3651 0.3651 ( 2713 PWs) bands (ev): -5.7678 -5.7678 -5.5655 -5.5655 -5.4975 -5.4874 -5.4874 -5.4468 -3.8633 -3.8349 -3.8287 -3.8287 -3.6705 -3.6008 -3.6008 -3.5116 -3.5116 -3.4793 -3.4095 -3.4095 -3.3649 -3.3649 -3.3366 -3.3256 -3.3256 -3.3054 -3.1772 -3.1532 -3.1532 -3.1474 -2.8419 -2.8419 -2.3015 -2.3015 -2.2709 -2.1749 -2.0187 -2.0187 2.4558 2.4558 2.6249 2.6335 2.6381 2.6381 3.4789 3.4789 7.2351 7.2351 7.7099 7.7135 7.7135 7.7190 8.0069 8.0342 8.0425 8.0425 8.4812 8.4812 8.8237 8.8237 8.8435 8.8478 13.9095 13.9095 15.6672 15.6672 15.8964 15.9019 15.9019 15.9065 16.8359 16.8359 17.6933 17.7004 k = 0.3730 0.3730 0.3730 ( 2713 PWs) bands (ev): -5.7518 -5.7518 -5.5675 -5.5675 -5.5012 -5.4922 -5.4922 -5.4529 -3.8631 -3.8374 -3.8317 -3.8317 -3.6654 -3.5975 -3.5975 -3.5079 -3.5079 -3.4828 -3.4091 -3.4091 -3.3637 -3.3637 -3.3375 -3.3258 -3.3258 -3.3061 -3.1737 -3.1511 -3.1511 -3.1443 -2.8005 -2.8005 -2.3074 -2.3074 -2.2752 -2.1826 -2.0179 -2.0179 2.4096 2.4096 2.5780 2.5862 2.5911 2.5911 3.3491 3.3491 7.3259 7.3259 7.7944 7.7957 7.7957 7.7985 8.0509 8.0821 8.0878 8.0878 8.5214 8.5214 8.8124 8.8124 8.8327 8.8363 13.8780 13.8780 15.6237 15.6237 15.8671 15.8725 15.8725 15.8772 16.8955 16.8955 17.6719 17.6799 k = 0.3810 0.3810 0.3810 ( 2713 PWs) bands (ev): -5.7379 -5.7379 -5.5684 -5.5684 -5.5046 -5.4969 -5.4969 -5.4588 -3.8629 -3.8397 -3.8346 -3.8346 -3.6601 -3.5942 -3.5942 -3.5047 -3.5047 -3.4865 -3.4087 -3.4087 -3.3625 -3.3625 -3.3380 -3.3259 -3.3259 -3.3068 -3.1702 -3.1490 -3.1490 -3.1414 -2.7583 -2.7583 -2.3129 -2.3129 -2.2791 -2.1902 -2.0168 -2.0168 2.3654 2.3654 2.5333 2.5411 2.5463 2.5463 3.2237 3.2237 7.4151 7.4151 7.8706 7.8710 7.8710 7.8718 8.0978 8.1329 8.1356 8.1356 8.5599 8.5599 8.8029 8.8029 8.8235 8.8264 13.8428 13.8428 15.5808 15.5808 15.8300 15.8353 15.8353 15.8400 16.9554 16.9554 17.6529 17.6618 k = 0.3889 0.3889 0.3889 ( 2716 PWs) bands (ev): -5.7262 -5.7262 -5.5683 -5.5683 -5.5078 -5.5013 -5.5013 -5.4645 -3.8627 -3.8418 -3.8373 -3.8373 -3.6547 -3.5911 -3.5911 -3.5020 -3.5020 -3.4905 -3.4083 -3.4083 -3.3613 -3.3613 -3.3384 -3.3259 -3.3259 -3.3076 -3.1667 -3.1468 -3.1468 -3.1387 -2.7156 -2.7156 -2.3178 -2.3178 -2.2825 -2.1976 -2.0155 -2.0155 2.3231 2.3231 2.4911 2.4983 2.5039 2.5039 3.1032 3.1032 7.5023 7.5023 7.9338 7.9375 7.9375 7.9394 8.1492 8.1870 8.1870 8.1876 8.5967 8.5967 8.7951 8.7951 8.8160 8.8183 13.8043 13.8043 15.5395 15.5395 15.7866 15.7918 15.7918 15.7964 17.0149 17.0149 17.6358 17.6455 k = 0.3968 0.3968 0.3968 ( 2710 PWs) bands (ev): -5.7167 -5.7167 -5.5670 -5.5670 -5.5107 -5.5054 -5.5054 -5.4700 -3.8625 -3.8437 -3.8399 -3.8399 -3.6490 -3.5882 -3.5882 -3.4997 -3.4997 -3.4948 -3.4079 -3.4079 -3.3602 -3.3602 -3.3384 -3.3259 -3.3259 -3.3085 -3.1631 -3.1447 -3.1447 -3.1362 -2.6731 -2.6731 -2.3222 -2.3222 -2.2853 -2.2048 -2.0139 -2.0139 2.2831 2.2831 2.4514 2.4581 2.4639 2.4639 2.9881 2.9881 7.5870 7.5870 7.9874 7.9942 7.9942 7.9958 8.2063 8.2426 8.2426 8.2461 8.6316 8.6316 8.7891 8.7891 8.8102 8.8118 13.7631 13.7631 15.5006 15.5006 15.7384 15.7435 15.7435 15.7480 17.0733 17.0733 17.6200 17.6305 k = 0.4048 0.4048 0.4048 ( 2716 PWs) bands (ev): -5.7092 -5.7092 -5.5647 -5.5647 -5.5133 -5.5092 -5.5092 -5.4754 -3.8622 -3.8455 -3.8424 -3.8424 -3.6433 -3.5854 -3.5854 -3.4993 -3.4978 -3.4978 -3.4075 -3.4075 -3.3591 -3.3591 -3.3382 -3.3258 -3.3258 -3.3095 -3.1597 -3.1426 -3.1426 -3.1340 -2.6311 -2.6311 -2.3260 -2.3260 -2.2876 -2.2118 -2.0120 -2.0120 2.2452 2.2452 2.4142 2.4204 2.4265 2.4265 2.8787 2.8787 7.6686 7.6686 8.0320 8.0409 8.0409 8.0412 8.2681 8.3017 8.3017 8.3072 8.6645 8.6645 8.7850 8.7850 8.8063 8.8072 13.7199 13.7199 15.4644 15.4644 15.6871 15.6921 15.6921 15.6965 17.1299 17.1299 17.6050 17.6160 k = 0.4127 0.4127 0.4127 ( 2722 PWs) bands (ev): -5.7035 -5.7035 -5.5617 -5.5617 -5.5156 -5.5126 -5.5126 -5.4806 -3.8620 -3.8471 -3.8447 -3.8447 -3.6374 -3.5828 -3.5828 -3.5041 -3.4961 -3.4961 -3.4071 -3.4071 -3.3581 -3.3581 -3.3379 -3.3258 -3.3258 -3.3106 -3.1563 -3.1407 -3.1407 -3.1320 -2.5905 -2.5905 -2.3289 -2.3289 -2.2895 -2.2187 -2.0100 -2.0100 2.2097 2.2097 2.3797 2.3855 2.3919 2.3919 2.7756 2.7756 7.7467 7.7467 8.0688 8.0774 8.0790 8.0790 8.3321 8.3625 8.3625 8.3690 8.6952 8.6952 8.7828 8.7828 8.8041 8.8044 13.6755 13.6755 15.4313 15.4313 15.6342 15.6391 15.6391 15.6432 17.1842 17.1842 17.5908 17.6013 k = 0.4206 0.4206 0.4206 ( 2722 PWs) bands (ev): -5.6994 -5.6994 -5.5581 -5.5581 -5.5175 -5.5157 -5.5157 -5.4854 -3.8617 -3.8485 -3.8469 -3.8469 -3.6314 -3.5804 -3.5804 -3.5091 -3.4948 -3.4948 -3.4068 -3.4068 -3.3572 -3.3572 -3.3373 -3.3258 -3.3258 -3.3118 -3.1529 -3.1388 -3.1388 -3.1302 -2.5518 -2.5518 -2.3308 -2.3308 -2.2908 -2.2253 -2.0077 -2.0077 2.1765 2.1765 2.3481 2.3533 2.3599 2.3599 2.6794 2.6794 7.8207 7.8207 8.0993 8.1067 8.1099 8.1099 8.3955 8.4227 8.4227 8.4296 8.7237 8.7237 8.7825 8.7825 8.8036 8.8038 13.6307 13.6307 15.4014 15.4014 15.5811 15.5858 15.5858 15.5897 17.2357 17.2357 17.5772 17.5870 k = 0.4286 0.4286 0.4286 ( 2728 PWs) bands (ev): -5.6967 -5.6967 -5.5543 -5.5543 -5.5191 -5.5182 -5.5182 -5.4901 -3.8613 -3.8498 -3.8488 -3.8488 -3.6254 -3.5781 -3.5781 -3.5144 -3.4937 -3.4937 -3.4064 -3.4064 -3.3563 -3.3563 -3.3366 -3.3257 -3.3257 -3.3130 -3.1498 -3.1371 -3.1371 -3.1288 -2.5159 -2.5159 -2.3315 -2.3315 -2.2916 -2.2318 -2.0053 -2.0053 2.1457 2.1457 2.3192 2.3239 2.3308 2.3308 2.5905 2.5905 7.8900 7.8900 8.1245 8.1306 8.1351 8.1351 8.4561 8.4804 8.4804 8.4871 8.7497 8.7497 8.7844 8.7844 8.8047 8.8054 13.5864 13.5864 15.3747 15.3747 15.5292 15.5336 15.5336 15.5372 17.2838 17.2838 17.5642 17.5733 k = 0.4365 0.4365 0.4365 ( 2722 PWs) bands (ev): -5.6948 -5.6948 -5.5506 -5.5506 -5.5204 -5.5202 -5.5202 -5.4944 -3.8610 -3.8509 -3.8505 -3.8505 -3.6192 -3.5760 -3.5760 -3.5198 -3.4927 -3.4927 -3.4061 -3.4061 -3.3555 -3.3555 -3.3357 -3.3256 -3.3256 -3.3142 -3.1467 -3.1354 -3.1354 -3.1276 -2.4837 -2.4837 -2.3304 -2.3304 -2.2919 -2.2380 -2.0027 -2.0027 2.1174 2.1174 2.2932 2.2974 2.3045 2.3045 2.5097 2.5097 7.9542 7.9542 8.1454 8.1503 8.1557 8.1557 8.5121 8.5337 8.5337 8.5397 8.7727 8.7727 8.7890 8.7890 8.8080 8.8090 13.5437 13.5437 15.3512 15.3512 15.4795 15.4837 15.4837 15.4869 17.3283 17.3283 17.5521 17.5603 k = 0.4444 0.4444 0.4444 ( 2722 PWs) bands (ev): -5.6937 -5.6937 -5.5473 -5.5473 -5.5215 -5.5215 -5.5213 -5.4985 -3.8606 -3.8521 -3.8521 -3.8520 -3.6129 -3.5742 -3.5742 -3.5253 -3.4920 -3.4920 -3.4059 -3.4059 -3.3547 -3.3547 -3.3347 -3.3256 -3.3256 -3.3155 -3.1437 -3.1340 -3.1340 -3.1267 -2.4563 -2.4563 -2.3271 -2.3271 -2.2917 -2.2439 -2.0000 -2.0000 2.0915 2.0915 2.2702 2.2739 2.2812 2.2812 2.4375 2.4375 8.0124 8.0124 8.1626 8.1665 8.1725 8.1725 8.5620 8.5809 8.5809 8.5862 8.7898 8.7898 8.7992 8.7992 8.8135 8.8146 13.5033 13.5033 15.3309 15.3309 15.4332 15.4370 15.4370 15.4399 17.3685 17.3685 17.5408 17.5481 k = 0.4524 0.4524 0.4524 ( 2728 PWs) bands (ev): -5.6932 -5.6932 -5.5448 -5.5448 -5.5220 -5.5220 -5.5220 -5.5023 -3.8602 -3.8535 -3.8535 -3.8530 -3.6066 -3.5726 -3.5726 -3.5311 -3.4914 -3.4914 -3.4057 -3.4057 -3.3541 -3.3541 -3.3336 -3.3256 -3.3256 -3.3169 -3.1410 -3.1327 -3.1327 -3.1261 -2.4348 -2.4348 -2.3211 -2.3211 -2.2910 -2.2496 -1.9973 -1.9973 2.0681 2.0681 2.2502 2.2534 2.2609 2.2609 2.3744 2.3744 8.0642 8.0642 8.1766 8.1796 8.1860 8.1860 8.6048 8.6209 8.6209 8.6252 8.8004 8.8004 8.8157 8.8157 8.8214 8.8223 13.4662 13.4662 15.3136 15.3136 15.3912 15.3947 15.3947 15.3971 17.4042 17.4042 17.5306 17.5369 k = 0.4603 0.4603 0.4603 ( 2728 PWs) bands (ev): -5.6929 -5.6929 -5.5432 -5.5432 -5.5222 -5.5218 -5.5218 -5.5057 -3.8598 -3.8547 -3.8547 -3.8539 -3.6002 -3.5712 -3.5712 -3.5370 -3.4909 -3.4909 -3.4055 -3.4055 -3.3535 -3.3535 -3.3324 -3.3256 -3.3256 -3.3183 -3.1384 -3.1315 -3.1315 -3.1259 -2.4193 -2.4193 -2.3124 -2.3124 -2.2899 -2.2551 -1.9947 -1.9947 2.0474 2.0474 2.2333 2.2359 2.2435 2.2435 2.3209 2.3209 8.1091 8.1091 8.1879 8.1902 8.1968 8.1968 8.6397 8.6527 8.6527 8.6563 8.8114 8.8114 8.8315 8.8315 8.8315 8.8319 13.4332 13.4332 15.2992 15.2992 15.3543 15.3574 15.3574 15.3593 17.4349 17.4349 17.5218 17.5270 k = 0.4683 0.4683 0.4683 ( 2728 PWs) bands (ev): -5.6929 -5.6929 -5.5423 -5.5423 -5.5221 -5.5211 -5.5211 -5.5089 -3.8594 -3.8556 -3.8556 -3.8547 -3.5937 -3.5700 -3.5700 -3.5430 -3.4906 -3.4906 -3.4053 -3.4053 -3.3530 -3.3530 -3.3311 -3.3255 -3.3255 -3.3197 -3.1360 -3.1306 -3.1306 -3.1259 -2.4092 -2.4092 -2.3023 -2.3023 -2.2883 -2.2602 -1.9922 -1.9922 2.0295 2.0295 2.2194 2.2215 2.2290 2.2290 2.2776 2.2776 8.1465 8.1465 8.1968 8.1984 8.2053 8.2053 8.6667 8.6764 8.6764 8.6794 8.8234 8.8234 8.8426 8.8429 8.8450 8.8450 13.4050 13.4050 15.2876 15.2876 15.3232 15.3259 15.3259 15.3274 17.4602 17.4602 17.5144 17.5186 k = 0.4762 0.4762 0.4762 ( 2728 PWs) bands (ev): -5.6929 -5.6929 -5.5420 -5.5420 -5.5217 -5.5201 -5.5201 -5.5118 -3.8589 -3.8564 -3.8564 -3.8555 -3.5873 -3.5691 -3.5691 -3.5491 -3.4903 -3.4903 -3.4052 -3.4052 -3.3526 -3.3526 -3.3298 -3.3255 -3.3255 -3.3211 -3.1339 -3.1298 -3.1298 -3.1262 -2.4031 -2.4031 -2.2924 -2.2924 -2.2862 -2.2650 -1.9901 -1.9901 2.0147 2.0147 2.2087 2.2102 2.2172 2.2172 2.2446 2.2446 8.1760 8.1760 8.2034 8.2046 8.2118 8.2118 8.6863 8.6928 8.6928 8.6953 8.8350 8.8350 8.8535 8.8541 8.8560 8.8560 13.3824 13.3824 15.2786 15.2786 15.2986 15.3008 15.3008 15.3017 17.4798 17.4798 17.5086 17.5117 k = 0.4841 0.4841 0.4841 ( 2758 PWs) bands (ev): -5.6930 -5.6930 -5.5420 -5.5420 -5.5210 -5.5192 -5.5192 -5.5143 -3.8586 -3.8570 -3.8570 -3.8563 -3.5809 -3.5686 -3.5686 -3.5554 -3.4903 -3.4903 -3.4053 -3.4053 -3.3524 -3.3524 -3.3285 -3.3257 -3.3257 -3.3227 -3.1321 -3.1294 -3.1294 -3.1269 -2.3996 -2.3996 -2.2844 -2.2844 -2.2837 -2.2695 -1.9884 -1.9884 2.0036 2.0036 2.2010 2.2021 2.2071 2.2071 2.2229 2.2229 8.1968 8.1968 8.2079 8.2087 8.2165 8.2165 8.6995 8.7032 8.7032 8.7051 8.8444 8.8444 8.8626 8.8633 8.8642 8.8642 13.3658 13.3658 15.2723 15.2723 15.2808 15.2825 15.2825 15.2829 17.4930 17.4930 17.5044 17.5065 k = 0.4921 0.4921 0.4921 ( 2800 PWs) bands (ev): -5.6931 -5.6931 -5.5421 -5.5421 -5.5199 -5.5186 -5.5186 -5.5166 -3.8582 -3.8575 -3.8575 -3.8571 -3.5747 -3.5684 -3.5684 -3.5619 -3.4903 -3.4903 -3.4054 -3.4054 -3.3524 -3.3524 -3.3272 -3.3258 -3.3258 -3.3243 -3.1305 -3.1292 -3.1292 -3.1280 -2.3979 -2.3979 -2.2808 -2.2792 -2.2792 -2.2736 -1.9874 -1.9874 1.9967 1.9967 2.1965 2.1970 2.1987 2.1987 2.2124 2.2124 8.2082 8.2082 8.2106 8.2110 8.2201 8.2201 8.7071 8.7087 8.7087 8.7099 8.8501 8.8501 8.8687 8.8691 8.8692 8.8692 13.3557 13.3557 15.2685 15.2685 15.2702 15.2712 15.2714 15.2714 17.4998 17.4998 17.5020 17.5031 k = 0.5000 0.5000 0.5000 ( 2800 PWs) bands (ev): -5.6932 -5.6932 -5.5421 -5.5421 -5.5184 -5.5184 -5.5184 -5.5184 -3.8576 -3.8576 -3.8576 -3.8576 -3.5682 -3.5682 -3.5682 -3.5682 -3.4903 -3.4903 -3.4053 -3.4053 -3.3523 -3.3523 -3.3258 -3.3258 -3.3258 -3.3258 -3.1291 -3.1291 -3.1291 -3.1291 -2.3974 -2.3974 -2.2774 -2.2774 -2.2774 -2.2774 -1.9870 -1.9870 1.9943 1.9943 2.1952 2.1952 2.1952 2.1952 2.2096 2.2096 8.2116 8.2116 8.2116 8.2116 8.2218 8.2218 8.7106 8.7106 8.7106 8.7106 8.8522 8.8522 8.8711 8.8711 8.8711 8.8711 13.3523 13.3523 15.2670 15.2670 15.2670 15.2670 15.2679 15.2679 17.5016 17.5016 17.5016 17.5016 k = 0.5000 0.5000 0.5000 ( 2800 PWs) bands (ev): -5.6932 -5.6932 -5.5421 -5.5421 -5.5184 -5.5184 -5.5184 -5.5184 -3.8576 -3.8576 -3.8576 -3.8576 -3.5682 -3.5682 -3.5682 -3.5682 -3.4903 -3.4903 -3.4053 -3.4053 -3.3523 -3.3523 -3.3258 -3.3258 -3.3258 -3.3258 -3.1291 -3.1291 -3.1291 -3.1291 -2.3974 -2.3974 -2.2774 -2.2774 -2.2774 -2.2774 -1.9870 -1.9870 1.9943 1.9943 2.1952 2.1952 2.1952 2.1952 2.2096 2.2096 8.2116 8.2116 8.2116 8.2116 8.2218 8.2218 8.7106 8.7106 8.7106 8.7106 8.8522 8.8522 8.8711 8.8711 8.8711 8.8711 13.3523 13.3523 15.2670 15.2670 15.2670 15.2670 15.2679 15.2679 17.5016 17.5016 17.5016 17.5016 k = 0.4904 0.5000 0.4904 ( 2800 PWs) bands (ev): -5.6931 -5.6931 -5.5421 -5.5421 -5.5198 -5.5190 -5.5182 -5.5167 -3.8582 -3.8577 -3.8574 -3.8571 -3.5744 -3.5700 -3.5667 -3.5622 -3.4903 -3.4903 -3.4054 -3.4053 -3.3524 -3.3524 -3.3272 -3.3262 -3.3254 -3.3244 -3.1305 -3.1295 -3.1289 -3.1280 -2.3979 -2.3979 -2.2807 -2.2800 -2.2781 -2.2739 -1.9874 -1.9874 1.9966 1.9966 2.1966 2.1971 2.1985 2.1986 2.2122 2.2123 8.2083 8.2085 8.2106 8.2109 8.2200 8.2201 8.7068 8.7085 8.7089 8.7105 8.8501 8.8502 8.8685 8.8688 8.8695 8.8697 13.3557 13.3557 15.2684 15.2690 15.2700 15.2705 15.2714 15.2716 17.4998 17.5002 17.5019 17.5028 k = 0.4808 0.5000 0.4808 ( 2752 PWs) bands (ev): -5.6930 -5.6930 -5.5420 -5.5419 -5.5209 -5.5199 -5.5182 -5.5146 -3.8585 -3.8573 -3.8567 -3.8563 -3.5803 -3.5718 -3.5653 -3.5560 -3.4902 -3.4902 -3.4052 -3.4052 -3.3524 -3.3524 -3.3283 -3.3264 -3.3249 -3.3228 -3.1319 -3.1300 -3.1287 -3.1270 -2.3995 -2.3995 -2.2859 -2.2838 -2.2818 -2.2703 -1.9886 -1.9883 2.0035 2.0035 2.2008 2.2018 2.2079 2.2080 2.2214 2.2218 8.1972 8.1978 8.2079 8.2085 8.2163 8.2167 8.6972 8.7009 8.7054 8.7085 8.8439 8.8446 8.8622 8.8622 8.8654 8.8655 13.3656 13.3656 15.2727 15.2738 15.2794 15.2799 15.2826 15.2835 17.4940 17.4951 17.5035 17.5051 k = 0.4712 0.5000 0.4712 ( 2740 PWs) bands (ev): -5.6930 -5.6928 -5.5420 -5.5418 -5.5218 -5.5212 -5.5187 -5.5122 -3.8588 -3.8570 -3.8560 -3.8555 -3.5865 -3.5740 -3.5643 -3.5500 -3.4904 -3.4903 -3.4053 -3.4053 -3.3527 -3.3526 -3.3296 -3.3267 -3.3245 -3.3214 -3.1338 -3.1309 -3.1289 -3.1264 -2.4027 -2.4026 -2.2950 -2.2880 -2.2865 -2.2667 -1.9905 -1.9896 2.0145 2.0145 2.2071 2.2085 2.2218 2.2224 2.2391 2.2402 8.1767 8.1780 8.2032 8.2039 8.2116 8.2121 8.6802 8.6864 8.6998 8.7044 8.8330 8.8350 8.8517 8.8522 8.8585 8.8590 13.3818 13.3819 15.2797 15.2814 15.2949 15.2954 15.3014 15.3031 17.4827 17.4849 17.5053 17.5070 k = 0.4615 0.5000 0.4615 ( 2732 PWs) bands (ev): -5.6930 -5.6926 -5.5423 -5.5419 -5.5231 -5.5218 -5.5194 -5.5095 -3.8592 -3.8564 -3.8551 -3.8547 -3.5927 -3.5764 -3.5635 -3.5442 -3.4907 -3.4904 -3.4054 -3.4053 -3.3531 -3.3529 -3.3309 -3.3270 -3.3241 -3.3199 -3.1359 -3.1319 -3.1292 -3.1261 -2.4078 -2.4077 -2.3070 -2.2961 -2.2886 -2.2628 -1.9932 -1.9912 2.0291 2.0291 2.2152 2.2169 2.2408 2.2416 2.2659 2.2676 8.1475 8.1495 8.1965 8.1971 8.2059 8.2063 8.6545 8.6635 8.6922 8.6983 8.8188 8.8222 8.8385 8.8396 8.8492 8.8509 13.4041 13.4042 15.2896 15.2919 15.3163 15.3168 15.3276 15.3298 17.4662 17.4693 17.5069 17.5080 k = 0.4519 0.5000 0.4519 ( 2728 PWs) bands (ev): -5.6931 -5.6924 -5.5429 -5.5423 -5.5249 -5.5215 -5.5203 -5.5064 -3.8595 -3.8557 -3.8541 -3.8538 -3.5989 -3.5790 -3.5630 -3.5385 -3.4912 -3.4905 -3.4055 -3.4054 -3.3537 -3.3532 -3.3322 -3.3273 -3.3237 -3.3185 -3.1382 -3.1331 -3.1298 -3.1260 -2.4156 -2.4154 -2.3214 -2.3054 -2.2899 -2.2587 -1.9965 -1.9929 2.0467 2.0467 2.2252 2.2271 2.2659 2.2668 2.3011 2.3033 8.1099 8.1126 8.1876 8.1879 8.1991 8.1992 8.6189 8.6312 8.6827 8.6902 8.8030 8.8074 8.8234 8.8249 8.8378 8.8406 13.4321 13.4322 15.3021 15.3050 15.3435 15.3441 15.3607 15.3633 17.4450 17.4490 17.5079 17.5083 k = 0.4423 0.5000 0.4423 ( 2728 PWs) bands (ev): -5.6934 -5.6922 -5.5439 -5.5432 -5.5267 -5.5212 -5.5206 -5.5028 -3.8598 -3.8549 -3.8532 -3.8525 -3.6051 -3.5818 -3.5629 -3.5331 -3.4918 -3.4907 -3.4057 -3.4055 -3.3544 -3.3537 -3.3334 -3.3276 -3.3234 -3.3172 -3.1407 -3.1346 -3.1306 -3.1263 -2.4267 -2.4266 -2.3376 -2.3152 -2.2899 -2.2543 -2.0002 -1.9943 2.0665 2.0667 2.2371 2.2393 2.2976 2.2987 2.3438 2.3465 8.0639 8.0675 8.1765 8.1765 8.1907 8.1910 8.5731 8.5886 8.6712 8.6802 8.7864 8.7920 8.8069 8.8089 8.8243 8.8284 13.4651 13.4654 15.3172 15.3206 15.3761 15.3769 15.4001 15.4031 17.4195 17.4243 17.5083 17.5085 k = 0.4327 0.5000 0.4327 ( 2720 PWs) bands (ev): -5.6939 -5.6921 -5.5456 -5.5449 -5.5282 -5.5220 -5.5189 -5.4988 -3.8600 -3.8538 -3.8523 -3.8509 -3.6112 -3.5848 -3.5629 -3.5277 -3.4926 -3.4908 -3.4060 -3.4056 -3.3553 -3.3541 -3.3346 -3.3279 -3.3231 -3.3158 -3.1434 -3.1362 -3.1316 -3.1269 -2.4418 -2.4414 -2.3551 -2.3251 -2.2885 -2.2494 -2.0039 -1.9953 2.0882 2.0884 2.2511 2.2535 2.3365 2.3377 2.3938 2.3969 8.0100 8.0145 8.1630 8.1633 8.1808 8.1816 8.5173 8.5360 8.6578 8.6683 8.7688 8.7760 8.7897 8.7924 8.8090 8.8142 13.5028 13.5032 15.3347 15.3387 15.4139 15.4148 15.4454 15.4486 17.3901 17.3956 17.5081 17.5088 k = 0.4231 0.5000 0.4231 ( 2724 PWs) bands (ev): -5.6948 -5.6922 -5.5480 -5.5476 -5.5291 -5.5226 -5.5165 -5.4944 -3.8602 -3.8527 -3.8514 -3.8491 -3.6173 -3.5880 -3.5634 -3.5227 -3.4937 -3.4910 -3.4062 -3.4058 -3.3563 -3.3546 -3.3358 -3.3281 -3.3228 -3.3146 -3.1464 -3.1380 -3.1327 -3.1277 -2.4612 -2.4597 -2.3734 -2.3351 -2.2854 -2.2438 -2.0072 -1.9957 2.1111 2.1114 2.2671 2.2698 2.3827 2.3840 2.4505 2.4541 7.9484 7.9538 8.1473 8.1478 8.1694 8.1708 8.4524 8.4741 8.6426 8.6544 8.7497 8.7587 8.7729 8.7763 8.7915 8.7977 13.5445 13.5451 15.3543 15.3588 15.4564 15.4576 15.4958 15.4992 17.3571 17.3633 17.5075 17.5088 k = 0.4135 0.5000 0.4135 ( 2724 PWs) bands (ev): -5.6961 -5.6925 -5.5514 -5.5511 -5.5293 -5.5229 -5.5135 -5.4895 -3.8603 -3.8515 -3.8504 -3.8470 -3.6234 -3.5913 -3.5641 -3.5179 -3.4950 -3.4911 -3.4066 -3.4059 -3.3574 -3.3551 -3.3368 -3.3283 -3.3225 -3.3133 -3.1495 -3.1399 -3.1340 -3.1289 -2.4845 -2.4812 -2.3927 -2.3456 -2.2807 -2.2374 -2.0099 -1.9952 2.1351 2.1355 2.2852 2.2882 2.4361 2.4375 2.5136 2.5176 7.8797 7.8861 8.1293 8.1302 8.1563 8.1584 8.3796 8.4041 8.6257 8.6388 8.7291 8.7396 8.7570 8.7608 8.7720 8.7792 13.5896 13.5904 15.3757 15.3808 15.5032 15.5046 15.5508 15.5542 17.3210 17.3279 17.5066 17.5084 k = 0.4038 0.5000 0.4038 ( 2724 PWs) bands (ev): -5.6979 -5.6930 -5.5561 -5.5550 -5.5288 -5.5228 -5.5098 -5.4842 -3.8604 -3.8500 -3.8493 -3.8447 -3.6294 -3.5947 -3.5651 -3.5134 -3.4966 -3.4910 -3.4069 -3.4060 -3.3587 -3.3556 -3.3378 -3.3283 -3.3222 -3.3121 -3.1527 -3.1420 -3.1355 -3.1303 -2.5113 -2.5054 -2.4129 -2.3573 -2.2743 -2.2301 -2.0115 -1.9937 2.1601 2.1606 2.3054 2.3087 2.4965 2.4980 2.5827 2.5872 7.8044 7.8119 8.1092 8.1104 8.1412 8.1443 8.3000 8.3273 8.6070 8.6214 8.7071 8.7190 8.7415 8.7456 8.7509 8.7587 13.6377 13.6386 15.3988 15.4045 15.5538 15.5555 15.6096 15.6129 17.2823 17.2897 17.5053 17.5077 k = 0.3942 0.5000 0.3942 ( 2722 PWs) bands (ev): -5.7002 -5.6939 -5.5616 -5.5596 -5.5276 -5.5223 -5.5056 -5.4784 -3.8604 -3.8485 -3.8482 -3.8421 -3.6353 -3.5983 -3.5663 -3.5095 -3.4985 -3.4907 -3.4073 -3.4060 -3.3600 -3.3562 -3.3387 -3.3283 -3.3220 -3.3110 -3.1561 -3.1442 -3.1372 -3.1321 -2.5407 -2.5316 -2.4344 -2.3705 -2.2664 -2.2218 -2.0117 -1.9912 2.1862 2.1869 2.3276 2.3312 2.5634 2.5652 2.6574 2.6623 7.7231 7.7316 8.0867 8.0882 8.1229 8.1274 8.2154 8.2456 8.5867 8.6023 8.6841 8.6973 8.7241 8.7299 8.7300 8.7365 13.6881 13.6893 15.4232 15.4294 15.6076 15.6096 15.6715 15.6747 17.2413 17.2492 17.5038 17.5068 k = 0.3846 0.5000 0.3846 ( 2710 PWs) bands (ev): -5.7032 -5.6953 -5.5678 -5.5649 -5.5258 -5.5214 -5.5009 -5.4723 -3.8603 -3.8469 -3.8469 -3.8394 -3.6411 -3.6019 -3.5678 -3.5061 -3.5008 -3.4901 -3.4076 -3.4060 -3.3613 -3.3567 -3.3394 -3.3282 -3.3217 -3.3098 -3.1595 -3.1464 -3.1389 -3.1341 -2.5721 -2.5592 -2.4572 -2.3857 -2.2571 -2.2123 -2.0104 -1.9874 2.2136 2.2143 2.3519 2.3558 2.6365 2.6385 2.7374 2.7427 7.6365 7.6459 8.0611 8.0635 8.0964 8.0988 8.1364 8.1654 8.5650 8.5818 8.6607 8.6751 8.7006 8.7100 8.7133 8.7168 13.7403 13.7417 15.4485 15.4553 15.6639 15.6663 15.7359 15.7388 17.1984 17.2069 17.5020 17.5055 k = 0.3750 0.5000 0.3750 ( 2702 PWs) bands (ev): -5.7068 -5.6973 -5.5747 -5.5708 -5.5232 -5.5200 -5.4957 -5.4659 -3.8602 -3.8456 -3.8451 -3.8363 -3.6469 -3.6057 -3.5696 -3.5036 -3.5035 -3.4889 -3.4079 -3.4059 -3.3628 -3.3573 -3.3400 -3.3279 -3.3215 -3.3088 -3.1630 -3.1488 -3.1409 -3.1364 -2.6048 -2.5877 -2.4813 -2.4029 -2.2464 -2.2017 -2.0073 -1.9825 2.2421 2.2430 2.3782 2.3824 2.7153 2.7175 2.8223 2.8280 7.5453 7.5555 8.0116 8.0277 8.0411 8.0458 8.1018 8.1114 8.5418 8.5598 8.6366 8.6522 8.6740 8.6840 8.6976 8.7006 13.7939 13.7955 15.4744 15.4817 15.7221 15.7250 15.8020 15.8046 17.1541 17.1630 17.5001 17.5043 k = 0.3654 0.5000 0.3654 ( 2710 PWs) bands (ev): -5.7112 -5.6998 -5.5822 -5.5773 -5.5201 -5.5181 -5.4902 -5.4592 -3.8601 -3.8443 -3.8433 -3.8331 -3.6526 -3.6096 -3.5717 -3.5066 -3.5021 -3.4872 -3.4083 -3.4058 -3.3642 -3.3580 -3.3406 -3.3275 -3.3214 -3.3078 -3.1667 -3.1512 -3.1430 -3.1391 -2.6384 -2.6167 -2.5066 -2.4221 -2.2346 -2.1901 -2.0026 -1.9763 2.2721 2.2731 2.4065 2.4110 2.7994 2.8018 2.9117 2.9177 7.4500 7.4611 7.9155 7.9420 8.0092 8.0115 8.0798 8.0825 8.5173 8.5364 8.6120 8.6283 8.6460 8.6557 8.6814 8.6843 13.8483 13.8501 15.5004 15.5083 15.7816 15.7850 15.8691 15.8714 17.1086 17.1180 17.4982 17.5031 k = 0.3558 0.5000 0.3558 ( 2706 PWs) bands (ev): -5.7162 -5.7031 -5.5902 -5.5845 -5.5163 -5.5156 -5.4842 -5.4522 -3.8598 -3.8429 -3.8414 -3.8296 -3.6581 -3.6136 -3.5740 -3.5103 -3.5015 -3.4850 -3.4086 -3.4056 -3.3657 -3.3587 -3.3409 -3.3270 -3.3213 -3.3069 -3.1703 -3.1537 -3.1454 -3.1420 -2.6724 -2.6459 -2.5331 -2.4432 -2.2215 -2.1773 -1.9962 -1.9690 2.3034 2.3046 2.4368 2.4416 2.8882 2.8909 3.0053 3.0116 7.3515 7.3634 7.8118 7.8417 7.9776 7.9801 8.0577 8.0577 8.4918 8.5119 8.5872 8.6030 8.6177 8.6258 8.6649 8.6677 13.9031 13.9052 15.5262 15.5345 15.8415 15.8454 15.9367 15.9385 17.0625 17.0724 17.4967 17.5022 k = 0.3462 0.5000 0.3462 ( 2706 PWs) bands (ev): -5.7218 -5.7070 -5.5988 -5.5922 -5.5126 -5.5119 -5.4780 -5.4450 -3.8596 -3.8414 -3.8394 -3.8259 -3.6635 -3.6176 -3.5765 -3.5144 -3.5014 -3.4826 -3.4088 -3.4053 -3.3671 -3.3595 -3.3410 -3.3263 -3.3212 -3.3060 -3.1739 -3.1562 -3.1481 -3.1450 -2.7065 -2.6748 -2.5604 -2.4660 -2.2073 -2.1635 -1.9881 -1.9605 2.3362 2.3376 2.4690 2.4742 2.9814 2.9844 3.1028 3.1093 7.2502 7.2628 7.7045 7.7365 7.9438 7.9467 8.0325 8.0340 8.4653 8.4865 8.5622 8.5749 8.5906 8.5945 8.6479 8.6507 13.9579 13.9603 15.5511 15.5600 15.9013 15.9057 16.0040 16.0054 17.0161 17.0263 17.4958 17.5019 k = 0.3365 0.5000 0.3365 ( 2710 PWs) bands (ev): -5.7281 -5.7117 -5.6079 -5.6004 -5.5091 -5.5070 -5.4714 -5.4376 -3.8592 -3.8398 -3.8373 -3.8221 -3.6689 -3.6217 -3.5793 -3.5192 -3.5019 -3.4802 -3.4090 -3.4050 -3.3686 -3.3604 -3.3410 -3.3254 -3.3211 -3.3052 -3.1775 -3.1587 -3.1515 -3.1480 -2.7401 -2.7034 -2.5884 -2.4901 -2.1922 -2.1488 -1.9786 -1.9510 2.3705 2.3720 2.5032 2.5086 3.0786 3.0820 3.2037 3.2104 7.1467 7.1599 7.5944 7.6280 7.9078 7.9110 8.0056 8.0085 8.4381 8.4604 8.5369 8.5436 8.5621 8.5654 8.6305 8.6332 14.0124 14.0150 15.5748 15.5842 15.9600 15.9650 16.0703 16.0714 16.9697 16.9803 17.4958 17.5026 k = 0.3269 0.5000 0.3269 ( 2710 PWs) bands (ev): -5.7350 -5.7171 -5.6175 -5.6091 -5.5050 -5.5017 -5.4645 -5.4301 -3.8588 -3.8381 -3.8352 -3.8180 -3.6741 -3.6257 -3.5823 -3.5244 -3.5027 -3.4779 -3.4091 -3.4045 -3.3700 -3.3613 -3.3408 -3.3243 -3.3210 -3.3044 -3.1809 -3.1612 -3.1555 -3.1509 -2.7732 -2.7312 -2.6169 -2.5154 -2.1759 -2.1332 -1.9678 -1.9404 2.4062 2.4079 2.5392 2.5449 3.1794 3.1832 3.3078 3.3147 7.0418 7.0555 7.4825 7.5173 7.8693 7.8728 7.9768 7.9810 8.4103 8.4336 8.5103 8.5108 8.5294 8.5412 8.6127 8.6153 14.0662 14.0690 15.5968 15.6067 16.0172 16.0226 16.1351 16.1357 16.9235 16.9345 17.4971 17.5046 k = 0.3173 0.5000 0.3173 ( 2710 PWs) bands (ev): -5.7425 -5.7232 -5.6275 -5.6183 -5.5003 -5.4958 -5.4574 -5.4225 -3.8584 -3.8363 -3.8329 -3.8138 -3.6792 -3.6298 -3.5854 -3.5301 -3.5037 -3.4759 -3.4090 -3.4039 -3.3713 -3.3623 -3.3405 -3.3230 -3.3211 -3.3038 -3.1844 -3.1637 -3.1603 -3.1537 -2.8052 -2.7582 -2.6457 -2.5416 -2.1588 -2.1166 -1.9557 -1.9289 2.4434 2.4453 2.5770 2.5831 3.2835 3.2877 3.4148 3.4217 6.9358 6.9500 7.3692 7.4051 7.8283 7.8322 7.9456 7.9511 8.3820 8.4063 8.4759 8.4828 8.4977 8.5173 8.5944 8.5971 14.1189 14.1218 15.6165 15.6269 16.0720 16.0780 16.1975 16.1978 16.8781 16.8894 17.4999 17.5081 k = 0.3077 0.5000 0.3077 ( 2706 PWs) bands (ev): -5.7504 -5.7300 -5.6380 -5.6280 -5.4952 -5.4897 -5.4501 -5.4149 -3.8578 -3.8345 -3.8306 -3.8094 -3.6842 -3.6339 -3.5887 -3.5364 -3.5051 -3.4743 -3.4088 -3.4033 -3.3725 -3.3633 -3.3400 -3.3214 -3.3211 -3.3031 -3.1876 -3.1662 -3.1656 -3.1565 -2.8360 -2.7842 -2.6746 -2.5683 -2.1407 -2.0993 -1.9424 -1.9165 2.4820 2.4840 2.6166 2.6230 3.3905 3.3952 3.5243 3.5312 6.8292 6.8438 7.2550 7.2917 7.7848 7.7890 7.9119 7.9188 8.3535 8.3788 8.4409 8.4513 8.4692 8.4939 8.5759 8.5785 14.1701 14.1733 15.6335 15.6443 16.1241 16.1305 16.2567 16.2567 16.8333 16.8449 17.5047 17.5135 k = 0.2981 0.5000 0.2981 ( 2706 PWs) bands (ev): -5.7588 -5.7374 -5.6488 -5.6382 -5.4897 -5.4832 -5.4426 -5.4072 -3.8572 -3.8325 -3.8283 -3.8050 -3.6892 -3.6380 -3.5922 -3.5431 -3.5066 -3.4730 -3.4085 -3.4025 -3.3736 -3.3644 -3.3394 -3.3211 -3.3196 -3.3026 -3.1907 -3.1715 -3.1687 -3.1593 -2.8654 -2.8090 -2.7033 -2.5956 -2.1217 -2.0812 -1.9281 -1.9033 2.5220 2.5242 2.6580 2.6647 3.5002 3.5052 3.6360 3.6428 6.7226 6.7376 7.1402 7.1777 7.7386 7.7433 7.8753 7.8836 8.3249 8.3512 8.4057 8.4173 8.4432 8.4708 8.5572 8.5597 14.2195 14.2229 15.6472 15.6585 16.1729 16.1797 16.3117 16.3119 16.7894 16.8013 17.5113 17.5207 k = 0.2885 0.5000 0.2885 ( 2702 PWs) bands (ev): -5.7676 -5.7454 -5.6601 -5.6487 -5.4838 -5.4765 -5.4349 -5.3996 -3.8565 -3.8304 -3.8259 -3.8004 -3.6940 -3.6420 -3.5958 -3.5501 -3.5084 -3.4721 -3.4080 -3.4017 -3.3746 -3.3655 -3.3388 -3.3212 -3.3176 -3.3021 -3.1936 -3.1782 -3.1712 -3.1623 -2.8931 -2.8327 -2.7317 -2.6230 -2.1019 -2.0624 -1.9129 -1.8893 2.5632 2.5656 2.7010 2.7080 3.6120 3.6176 3.7496 3.7562 6.6163 6.6317 7.0254 7.0635 7.6897 7.6949 7.8356 7.8455 8.2964 8.3237 8.3707 8.3825 8.4184 8.4479 8.5382 8.5407 14.2667 14.2703 15.6574 15.6690 16.2183 16.2253 16.3618 16.3622 16.7467 16.7588 17.5192 17.5293 k = 0.2788 0.5000 0.2788 ( 2710 PWs) bands (ev): -5.7767 -5.7540 -5.6716 -5.6597 -5.4776 -5.4697 -5.4271 -5.3920 -3.8558 -3.8283 -3.8236 -3.7959 -3.6987 -3.6460 -3.5995 -3.5575 -3.5105 -3.4717 -3.4074 -3.4007 -3.3755 -3.3667 -3.3381 -3.3214 -3.3153 -3.3016 -3.1963 -3.1855 -3.1736 -3.1653 -2.9189 -2.8552 -2.7597 -2.6506 -2.0814 -2.0429 -1.8969 -1.8747 2.6057 2.6083 2.7455 2.7529 3.7259 3.7319 3.8646 3.8711 6.5109 6.5265 6.9111 6.9496 7.6382 7.6438 7.7925 7.8041 8.2681 8.2963 8.3362 8.3478 8.3943 8.4253 8.5191 8.5216 14.3113 14.3152 15.6635 15.6755 16.2599 16.2672 16.4061 16.4066 16.7051 16.7174 17.5236 17.5352 k = 0.2692 0.5000 0.2692 ( 2704 PWs) bands (ev): -5.7861 -5.7630 -5.6835 -5.6710 -5.4710 -5.4627 -5.4193 -5.3845 -3.8549 -3.8261 -3.8211 -3.7914 -3.7033 -3.6499 -3.6033 -3.5651 -3.5128 -3.4716 -3.4066 -3.3997 -3.3763 -3.3678 -3.3372 -3.3215 -3.3128 -3.3012 -3.1988 -3.1935 -3.1759 -3.1685 -2.9426 -2.8764 -2.7869 -2.6780 -2.0601 -2.0229 -1.8801 -1.8593 2.6493 2.6521 2.7916 2.7993 3.8414 3.8479 3.9810 3.9871 6.4067 6.4226 6.7975 6.8365 7.5841 7.5902 7.7461 7.7594 8.2402 8.2694 8.3026 8.3137 8.3709 8.4033 8.4999 8.5025 14.3531 14.3572 15.6654 15.6777 16.2979 16.3054 16.4435 16.4441 16.6648 16.6771 17.5141 17.5267 k = 0.2596 0.5000 0.2596 ( 2708 PWs) bands (ev): -5.7958 -5.7724 -5.6956 -5.6826 -5.4643 -5.4557 -5.4114 -5.3771 -3.8540 -3.8237 -3.8187 -3.7869 -3.7078 -3.6537 -3.6072 -3.5728 -3.5153 -3.4721 -3.4057 -3.3987 -3.3769 -3.3690 -3.3364 -3.3217 -3.3101 -3.3009 -3.2021 -3.2011 -3.1782 -3.1717 -2.9643 -2.8964 -2.8134 -2.7052 -2.0381 -2.0023 -1.8626 -1.8434 2.6939 2.6969 2.8391 2.8470 3.9582 3.9652 4.0981 4.1038 6.3042 6.3203 6.6850 6.7244 7.5273 7.5339 7.6961 7.7111 8.2128 8.2428 8.2699 8.2804 8.3482 8.3819 8.4808 8.4833 14.3915 14.3959 15.6628 15.6754 16.3322 16.3399 16.4733 16.4740 16.6257 16.6380 17.5060 17.5198 k = 0.2500 0.5000 0.2500 ( 2716 PWs) bands (ev): -5.8056 -5.7821 -5.7079 -5.6946 -5.4574 -5.4486 -5.4034 -5.3699 -3.8530 -3.8213 -3.8163 -3.7827 -3.7122 -3.6574 -3.6112 -3.5804 -3.5182 -3.4731 -3.4046 -3.3977 -3.3775 -3.3702 -3.3355 -3.3220 -3.3073 -3.3006 -3.2114 -3.2031 -3.1805 -3.1751 -2.9838 -2.9151 -2.8390 -2.7320 -2.0156 -1.9813 -1.8445 -1.8270 2.7395 2.7427 2.8879 2.8961 4.0761 4.0836 4.2157 4.2210 6.2037 6.2200 6.5742 6.6137 7.4681 7.4750 7.6425 7.6592 8.1860 8.2169 8.2386 8.2483 8.3261 8.3610 8.4616 8.4642 14.4263 14.4310 15.6558 15.6686 16.3631 16.3709 16.4950 16.4957 16.5880 16.6001 17.5048 17.5198 k = 0.2404 0.5000 0.2404 ( 2716 PWs) bands (ev): -5.8156 -5.7922 -5.7204 -5.7067 -5.4503 -5.4416 -5.3955 -5.3629 -3.8520 -3.8187 -3.8138 -3.7786 -3.7163 -3.6610 -3.6153 -3.5880 -3.5214 -3.4745 -3.4034 -3.3966 -3.3778 -3.3713 -3.3347 -3.3224 -3.3042 -3.3002 -3.2211 -3.2049 -3.1827 -3.1785 -3.0011 -2.9327 -2.8636 -2.7585 -1.9925 -1.9598 -1.8259 -1.8101 2.7857 2.7891 2.9379 2.9464 4.1946 4.2027 4.3334 4.3381 6.1059 6.1222 6.4653 6.5050 7.4064 7.4138 7.5853 7.6038 8.1599 8.1915 8.2086 8.2175 8.3049 8.3409 8.4427 8.4452 14.4570 14.4621 15.6443 15.6574 16.3907 16.3988 16.5083 16.5091 16.5519 16.5636 17.5119 17.5279 k = 0.2308 0.5000 0.2308 ( 2726 PWs) bands (ev): -5.8257 -5.8024 -5.7330 -5.7191 -5.4432 -5.4347 -5.3876 -5.3560 -3.8508 -3.8161 -3.8113 -3.7748 -3.7203 -3.6645 -3.6193 -3.5953 -3.5250 -3.4765 -3.4020 -3.3957 -3.3781 -3.3724 -3.3338 -3.3228 -3.3011 -3.2998 -3.2312 -3.2066 -3.1848 -3.1820 -3.0164 -2.9491 -2.8871 -2.7845 -1.9688 -1.9379 -1.8068 -1.7928 2.8326 2.8362 2.9889 2.9976 4.3134 4.3221 4.4507 4.4549 6.0110 6.0275 6.3588 6.3986 7.3423 7.3502 7.5248 7.5448 8.1346 8.1668 8.1801 8.1881 8.2844 8.3215 8.4238 8.4264 14.4833 14.4887 15.6287 15.6419 16.4149 16.4234 16.5126 16.5135 16.5195 16.5286 17.5273 17.5441 k = 0.2212 0.5000 0.2212 ( 2718 PWs) bands (ev): -5.8357 -5.8128 -5.7456 -5.7316 -5.4361 -5.4278 -5.3797 -5.3493 -3.8496 -3.8134 -3.8088 -3.7715 -3.7238 -3.6678 -3.6234 -3.6023 -3.5288 -3.4789 -3.4006 -3.3948 -3.3782 -3.3734 -3.3328 -3.3233 -3.2994 -3.2979 -3.2412 -3.2080 -3.1869 -3.1855 -3.0298 -2.9644 -2.9092 -2.8097 -1.9448 -1.9158 -1.7873 -1.7751 2.8799 2.8837 3.0408 3.0498 4.4324 4.4416 4.5673 4.5708 5.9196 5.9363 6.2550 6.2949 7.2761 7.2843 7.4609 7.4824 8.1103 8.1429 8.1532 8.1602 8.2650 8.3031 8.4053 8.4079 14.5049 14.5107 15.6093 15.6226 16.4349 16.4448 16.4850 16.4946 16.5125 16.5141 17.5502 17.5677 k = 0.2115 0.5000 0.2115 ( 2718 PWs) bands (ev): -5.8457 -5.8233 -5.7582 -5.7442 -5.4289 -5.4211 -5.3719 -5.3429 -3.8483 -3.8106 -3.8064 -3.7688 -3.7269 -3.6710 -3.6276 -3.6089 -3.5330 -3.4819 -3.3991 -3.3941 -3.3781 -3.3743 -3.3319 -3.3238 -3.2988 -3.2947 -3.2511 -3.2092 -3.1891 -3.1889 -3.0415 -2.9786 -2.9301 -2.8344 -1.9205 -1.8934 -1.7676 -1.7572 2.9274 2.9314 3.0935 3.1026 4.5510 4.5607 4.6824 4.6853 5.8324 5.8492 6.1544 6.1943 7.2077 7.2163 7.3939 7.4167 8.0868 8.1196 8.1278 8.1337 8.2466 8.2855 8.3871 8.3897 14.5214 14.5276 15.5864 15.5998 16.4399 16.4555 16.4669 16.4705 16.5048 16.5067 17.5772 17.5937 k = 0.2019 0.5000 0.2019 ( 2726 PWs) bands (ev): -5.8557 -5.8338 -5.7708 -5.7568 -5.4219 -5.4146 -5.3643 -5.3368 -3.8469 -3.8077 -3.8039 -3.7669 -3.7293 -3.6740 -3.6317 -3.6151 -3.5375 -3.4854 -3.3976 -3.3937 -3.3780 -3.3750 -3.3309 -3.3245 -3.2982 -3.2919 -3.2605 -3.2103 -3.1926 -3.1908 -3.0516 -2.9919 -2.9496 -2.8584 -1.8960 -1.8709 -1.7476 -1.7390 2.9748 2.9790 3.1466 3.1559 4.6690 4.6792 4.7956 4.7978 5.7499 5.7669 6.0574 6.0972 7.1374 7.1464 7.3240 7.3481 8.0643 8.0970 8.1041 8.1086 8.2292 8.2690 8.3693 8.3719 14.5325 14.5392 15.5605 15.5740 16.4159 16.4289 16.4763 16.4819 16.4925 16.4947 17.5815 17.5903 k = 0.1923 0.5000 0.1923 ( 2722 PWs) bands (ev): -5.8655 -5.8442 -5.7833 -5.7694 -5.4150 -5.4083 -5.3568 -5.3308 -3.8455 -3.8048 -3.8014 -3.7660 -3.7309 -3.6768 -3.6358 -3.6207 -3.5423 -3.4894 -3.3960 -3.3936 -3.3777 -3.3754 -3.3299 -3.3251 -3.2974 -3.2897 -3.2687 -3.2112 -3.1962 -3.1927 -3.0604 -3.0042 -2.9678 -2.8815 -1.8713 -1.8484 -1.7275 -1.7208 3.0220 3.0263 3.2001 3.2095 4.7858 4.7966 4.9057 4.9073 5.6732 5.6906 5.9645 6.0042 7.0653 7.0746 7.2515 7.2767 8.0428 8.0751 8.0819 8.0850 8.2130 8.2536 8.3518 8.3545 14.5379 14.5452 15.5323 15.5458 16.3882 16.4000 16.4768 16.4793 16.4879 16.4944 17.5695 17.5770 k = 0.1827 0.5000 0.1827 ( 2722 PWs) bands (ev): -5.8752 -5.8546 -5.7956 -5.7819 -5.4082 -5.4022 -5.3494 -5.3251 -3.8440 -3.8019 -3.7990 -3.7660 -3.7315 -3.6795 -3.6399 -3.6258 -3.5474 -3.4940 -3.3944 -3.3939 -3.3774 -3.3754 -3.3288 -3.3259 -3.2965 -3.2899 -3.2741 -3.2120 -3.1996 -3.1945 -3.0681 -3.0157 -2.9845 -2.9039 -1.8466 -1.8259 -1.7073 -1.7024 3.0685 3.0730 3.2535 3.2630 4.9011 4.9124 5.0114 5.0124 5.6038 5.6217 5.8760 5.9155 6.9916 7.0012 7.1765 7.2027 8.0223 8.0540 8.0612 8.0627 8.1981 8.2394 8.3349 8.3376 14.5376 14.5454 15.5024 15.5158 16.3615 16.3724 16.4588 16.4616 16.4968 16.5037 17.5508 17.5577 k = 0.1731 0.5000 0.1731 ( 2722 PWs) bands (ev): -5.8846 -5.8648 -5.8077 -5.7943 -5.4016 -5.3963 -5.3423 -5.3197 -3.8424 -3.7990 -3.7966 -3.7670 -3.7313 -3.6820 -3.6439 -3.6303 -3.5528 -3.4992 -3.3945 -3.3929 -3.3770 -3.3751 -3.3277 -3.3267 -3.2954 -3.2939 -3.2749 -3.2127 -3.2030 -3.1963 -3.0747 -3.0263 -2.9999 -2.9253 -1.8220 -1.8036 -1.6872 -1.6841 3.1141 3.1188 3.3066 3.3162 5.0144 5.0259 5.1099 5.1105 5.5447 5.5632 5.7926 5.8319 6.9164 6.9263 7.0994 7.1265 8.0029 8.0339 8.0417 8.0418 8.1846 8.2263 8.3186 8.3213 14.5315 14.5397 15.4712 15.4846 16.3365 16.3466 16.4393 16.4423 16.5023 16.5095 17.5266 17.5331 k = 0.1635 0.5000 0.1635 ( 2736 PWs) bands (ev): -5.8938 -5.8749 -5.8195 -5.8064 -5.3953 -5.3907 -5.3355 -5.3146 -3.8408 -3.7962 -3.7943 -3.7686 -3.7304 -3.6843 -3.6480 -3.6343 -3.5584 -3.5050 -3.3954 -3.3916 -3.3766 -3.3747 -3.3276 -3.3266 -3.3000 -3.2942 -3.2732 -3.2133 -3.2062 -3.1981 -3.0806 -3.0362 -3.0139 -2.9459 -1.7976 -1.7815 -1.6672 -1.6658 3.1585 3.1632 3.3591 3.3687 5.1242 5.1355 5.1954 5.1958 5.5027 5.5220 5.7146 5.7537 6.8400 6.8500 7.0202 7.0481 7.9845 8.0148 8.0220 8.0233 8.1724 8.2146 8.3027 8.3055 14.5195 14.5282 15.4395 15.4527 16.3132 16.3225 16.4191 16.4223 16.5040 16.5114 17.4980 17.5043 k = 0.1538 0.5000 0.1538 ( 2736 PWs) bands (ev): -5.9027 -5.8847 -5.8310 -5.8183 -5.3892 -5.3854 -5.3288 -5.3097 -3.8391 -3.7936 -3.7920 -3.7705 -3.7291 -3.6864 -3.6519 -3.6376 -3.5641 -3.5112 -3.3964 -3.3902 -3.3761 -3.3740 -3.3284 -3.3254 -3.3061 -3.2926 -3.2705 -3.2139 -3.2093 -3.1998 -3.0857 -3.0453 -3.0267 -2.9655 -1.7736 -1.7598 -1.6477 -1.6474 3.2012 3.2060 3.4106 3.4200 5.2213 5.2275 5.2605 5.2678 5.4936 5.5122 5.6430 5.6817 6.7627 6.7728 6.9396 6.9681 7.9673 7.9968 8.0036 8.0061 8.1617 8.2042 8.2876 8.2905 14.5019 14.5110 15.4077 15.4207 16.2919 16.3005 16.3988 16.4022 16.5016 16.5092 17.4664 17.4726 k = 0.1442 0.5000 0.1442 ( 2736 PWs) bands (ev): -5.9113 -5.8942 -5.8420 -5.8298 -5.3834 -5.3803 -5.3225 -5.3051 -3.8374 -3.7913 -3.7898 -3.7723 -3.7276 -3.6882 -3.6558 -3.6405 -3.5699 -3.5181 -3.3975 -3.3890 -3.3757 -3.3732 -3.3292 -3.3242 -3.3117 -3.2909 -3.2676 -3.2145 -3.2121 -3.2016 -3.0902 -3.0537 -3.0382 -2.9840 -1.7501 -1.7385 -1.6299 -1.6281 3.2418 3.2466 3.4606 3.4699 5.2495 5.2536 5.3483 5.3615 5.5301 5.5440 5.5805 5.6167 6.6846 6.6948 6.8575 6.8866 7.9512 7.9799 7.9864 7.9899 8.1526 8.1951 8.2732 8.2761 14.4791 14.4886 15.3762 15.3890 16.2726 16.2805 16.3790 16.3824 16.4951 16.5029 17.4331 17.4391 k = 0.1346 0.5000 0.1346 ( 2738 PWs) bands (ev): -5.9194 -5.9033 -5.8526 -5.8410 -5.3779 -5.3755 -5.3165 -5.3008 -3.8356 -3.7897 -3.7875 -3.7736 -3.7259 -3.6897 -3.6596 -3.6428 -3.5758 -3.5254 -3.3986 -3.3878 -3.3754 -3.3724 -3.3300 -3.3231 -3.3163 -3.2890 -3.2647 -3.2152 -3.2147 -3.2034 -3.0941 -3.0615 -3.0486 -3.0015 -1.7272 -1.7178 -1.6124 -1.6092 3.2799 3.2848 3.5086 3.5177 5.2353 5.2422 5.4481 5.4613 5.5183 5.5554 5.6002 5.6136 6.6060 6.6163 6.7744 6.8040 7.9362 7.9640 7.9704 7.9748 8.1450 8.1873 8.2596 8.2625 14.4515 14.4613 15.3453 15.3579 16.2552 16.2625 16.3598 16.3632 16.4847 16.4925 17.3992 17.4052 k = 0.1250 0.5000 0.1250 ( 2734 PWs) bands (ev): -5.9271 -5.9121 -5.8627 -5.8517 -5.3728 -5.3710 -5.3107 -5.2967 -3.8338 -3.7890 -3.7854 -3.7739 -3.7242 -3.6908 -3.6633 -3.6446 -3.5816 -3.5332 -3.3995 -3.3868 -3.3753 -3.3717 -3.3307 -3.3233 -3.3188 -3.2869 -3.2619 -3.2170 -3.2158 -3.2052 -3.0976 -3.0686 -3.0579 -3.0178 -1.7052 -1.6978 -1.5954 -1.5908 3.3153 3.3201 3.5543 3.5630 5.2130 5.2215 5.4675 5.5061 5.5460 5.5604 5.6751 5.6883 6.5274 6.5377 6.6904 6.7204 7.9224 7.9493 7.9555 7.9607 8.1389 8.1808 8.2467 8.2497 14.4201 14.4300 15.3155 15.3278 16.2399 16.2465 16.3416 16.3450 16.4706 16.4783 17.3659 17.3718 k = 0.1154 0.5000 0.1154 ( 2734 PWs) bands (ev): -5.9344 -5.9204 -5.8722 -5.8618 -5.3680 -5.3668 -5.3054 -5.2929 -3.8319 -3.7895 -3.7833 -3.7732 -3.7225 -3.6915 -3.6670 -3.6459 -3.5874 -3.5415 -3.4002 -3.3858 -3.3753 -3.3712 -3.3313 -3.3257 -3.3182 -3.2847 -3.2591 -3.2191 -3.2166 -3.2072 -3.1006 -3.0752 -3.0662 -3.0330 -1.6841 -1.6786 -1.5789 -1.5733 3.3475 3.3522 3.5969 3.6054 5.1924 5.2019 5.4263 5.4647 5.6391 5.6535 5.7517 5.7645 6.4492 6.4593 6.6058 6.6361 7.9097 7.9356 7.9418 7.9476 8.1345 8.1756 8.2347 8.2377 14.3854 14.3954 15.2867 15.2986 16.2266 16.2326 16.3245 16.3278 16.4531 16.4608 17.3339 17.3398 k = 0.1058 0.5000 0.1058 ( 2732 PWs) bands (ev): -5.9411 -5.9282 -5.8811 -5.8714 -5.3636 -5.3630 -5.3004 -5.2895 -3.8300 -3.7908 -3.7812 -3.7718 -3.7208 -3.6916 -3.6705 -3.6469 -3.5930 -3.5500 -3.4008 -3.3850 -3.3755 -3.3709 -3.3318 -3.3282 -3.3165 -3.2824 -3.2565 -3.2210 -3.2175 -3.2092 -3.1033 -3.0811 -3.0737 -3.0468 -1.6642 -1.6604 -1.5630 -1.5565 3.3762 3.3808 3.6362 3.6442 5.1775 5.1875 5.3938 5.4319 5.7274 5.7416 5.8249 5.8375 6.3722 6.3820 6.5210 6.5515 7.8982 7.9229 7.9292 7.9354 8.1315 8.1715 8.2237 8.2267 14.3486 14.3584 15.2592 15.2707 16.2152 16.2207 16.3087 16.3118 16.4331 16.4404 17.3039 17.3096 k = 0.0962 0.5000 0.0962 ( 2732 PWs) bands (ev): -5.9473 -5.9356 -5.8894 -5.8804 -5.3596 -5.3594 -5.2958 -5.2863 -3.8281 -3.7924 -3.7793 -3.7702 -3.7192 -3.6912 -3.6740 -3.6475 -3.5984 -3.5589 -3.4011 -3.3844 -3.3758 -3.3708 -3.3322 -3.3301 -3.3145 -3.2801 -3.2540 -3.2226 -3.2186 -3.2114 -3.1056 -3.0865 -3.0804 -3.0593 -1.6455 -1.6432 -1.5479 -1.5408 3.4014 3.4057 3.6716 3.6791 5.1696 5.1800 5.3707 5.4086 5.8101 5.8240 5.8920 5.9040 6.2980 6.3071 6.4361 6.4668 7.8879 7.9113 7.9178 7.9243 8.1299 8.1684 8.2136 8.2166 14.3106 14.3202 15.2331 15.2441 16.2058 16.2107 16.2942 16.2971 16.4111 16.4181 17.2762 17.2817 k = 0.0865 0.5000 0.0865 ( 2732 PWs) bands (ev): -5.9530 -5.9423 -5.8969 -5.8888 -5.3561 -5.3560 -5.2915 -5.2834 -3.8263 -3.7943 -3.7774 -3.7685 -3.7177 -3.6901 -3.6774 -3.6477 -3.6036 -3.5680 -3.4012 -3.3839 -3.3763 -3.3709 -3.3325 -3.3315 -3.3122 -3.2778 -3.2516 -3.2240 -3.2201 -3.2136 -3.1076 -3.0914 -3.0863 -3.0705 -1.6282 -1.6271 -1.5336 -1.5261 3.4229 3.4270 3.7029 3.7098 5.1694 5.1800 5.3574 5.3951 5.8864 5.8999 5.9490 5.9595 6.2303 6.2377 6.3517 6.3824 7.8788 7.9007 7.9075 7.9141 8.1296 8.1660 8.2046 8.2074 14.2725 14.2816 15.2085 15.2189 16.1983 16.2026 16.2811 16.2838 16.3879 16.3945 17.2511 17.2562 k = 0.0769 0.5000 0.0769 ( 2732 PWs) bands (ev): -5.9581 -5.9486 -5.9038 -5.8964 -5.3532 -5.3528 -5.2877 -5.2808 -3.8243 -3.7961 -3.7756 -3.7669 -3.7163 -3.6882 -3.6808 -3.6477 -3.6086 -3.5771 -3.4010 -3.3836 -3.3769 -3.3713 -3.3327 -3.3323 -3.3096 -3.2757 -3.2494 -3.2253 -3.2219 -3.2157 -3.1093 -3.0958 -3.0915 -3.0801 -1.6125 -1.6124 -1.5202 -1.5127 3.4408 3.4446 3.7298 3.7361 5.1772 5.1879 5.3540 5.3915 5.9551 5.9680 5.9868 5.9928 6.1809 6.1835 6.2682 6.2986 7.8709 7.8911 7.8984 7.9049 8.1304 8.1642 8.1968 8.1993 14.2353 14.2438 15.1856 15.1953 16.1927 16.1965 16.2694 16.2719 16.3643 16.3703 17.2287 17.2335 k = 0.0673 0.5000 0.0673 ( 2732 PWs) bands (ev): -5.9625 -5.9542 -5.9098 -5.9033 -5.3505 -5.3499 -5.2843 -5.2785 -3.8225 -3.7979 -3.7739 -3.7656 -3.7148 -3.6856 -3.6840 -3.6473 -3.6132 -3.5864 -3.4006 -3.3837 -3.3774 -3.3718 -3.3328 -3.3327 -3.3068 -3.2739 -3.2473 -3.2264 -3.2242 -3.2176 -3.1107 -3.0997 -3.0962 -3.0883 -1.5991 -1.5984 -1.5080 -1.5007 3.4554 3.4588 3.7525 3.7580 5.1927 5.2036 5.3605 5.3979 5.9782 5.9787 6.0212 6.0318 6.1616 6.1703 6.1897 6.2165 7.8643 7.8826 7.8904 7.8966 8.1321 8.1626 8.1903 8.1923 14.1999 14.2077 15.1645 15.1734 16.1890 16.1923 16.2591 16.2613 16.3409 16.3462 17.2090 17.2133 k = 0.0577 0.5000 0.0577 ( 2738 PWs) bands (ev): -5.9664 -5.9592 -5.9150 -5.9094 -5.3482 -5.3475 -5.2813 -5.2765 -3.8206 -3.7997 -3.7723 -3.7647 -3.7134 -3.6871 -3.6822 -3.6466 -3.6177 -3.5956 -3.4000 -3.3842 -3.3777 -3.3724 -3.3329 -3.3328 -3.3036 -3.2725 -3.2454 -3.2273 -3.2271 -3.2193 -3.1119 -3.1032 -3.1003 -3.0952 -1.5872 -1.5861 -1.4969 -1.4901 3.4670 3.4700 3.7709 3.7757 5.2156 5.2265 5.3766 5.4138 5.9287 5.9339 6.0749 6.0849 6.1006 6.1321 6.1885 6.1962 7.8587 7.8749 7.8835 7.8893 8.1343 8.1608 8.1852 8.1864 14.1673 14.1743 15.1456 15.1535 16.1871 16.1899 16.2502 16.2522 16.3183 16.3230 17.1920 17.1958 k = 0.0481 0.5000 0.0481 ( 2734 PWs) bands (ev): -5.9695 -5.9636 -5.9194 -5.9147 -5.3462 -5.3455 -5.2787 -5.2748 -3.8187 -3.8015 -3.7708 -3.7640 -3.7119 -3.6900 -3.6780 -3.6457 -3.6218 -3.6047 -3.3991 -3.3850 -3.3778 -3.3730 -3.3329 -3.3327 -3.3002 -3.2717 -3.2437 -3.2300 -3.2281 -3.2208 -3.1128 -3.1061 -3.1038 -3.1006 -1.5770 -1.5756 -1.4872 -1.4810 3.4759 3.4784 3.7855 3.7896 5.2451 5.2561 5.4015 5.4389 5.8657 5.8719 6.0216 6.0527 6.1215 6.1302 6.2188 6.2272 7.8545 7.8684 7.8778 7.8830 8.1369 8.1588 8.1818 8.1818 14.1384 14.1444 15.1291 15.1360 16.1871 16.1893 16.2428 16.2445 16.2971 16.3010 17.1777 17.1810 k = 0.0385 0.5000 0.0385 ( 2732 PWs) bands (ev): -5.9721 -5.9673 -5.9230 -5.9192 -5.3445 -5.3439 -5.2765 -5.2735 -3.8169 -3.8032 -3.7693 -3.7637 -3.7103 -3.6929 -3.6731 -3.6445 -3.6257 -3.6136 -3.3981 -3.3862 -3.3777 -3.3737 -3.3328 -3.3326 -3.2965 -3.2716 -3.2421 -3.2327 -3.2285 -3.2222 -3.1134 -3.1086 -3.1067 -3.1048 -1.5684 -1.5670 -1.4789 -1.4737 3.4825 3.4846 3.7967 3.8000 5.2803 5.2914 5.4346 5.4722 5.8005 5.8061 5.9444 5.9749 6.1599 6.1670 6.2493 6.2570 7.8513 7.8627 7.8732 7.8776 8.1395 8.1563 8.1784 8.1796 14.1137 14.1187 15.1152 15.1209 16.1890 16.1906 16.2368 16.2381 16.2775 16.2807 17.1662 17.1688 k = 0.0288 0.5000 0.0288 ( 2742 PWs) bands (ev): -5.9740 -5.9704 -5.9257 -5.9228 -5.3432 -5.3427 -5.2747 -5.2725 -3.8152 -3.8049 -3.7681 -3.7636 -3.7086 -3.6956 -3.6676 -3.6430 -3.6295 -3.6221 -3.3969 -3.3877 -3.3774 -3.3744 -3.3327 -3.3326 -3.2926 -3.2725 -3.2409 -3.2350 -3.2287 -3.2236 -3.1138 -3.1106 -3.1092 -3.1079 -1.5616 -1.5604 -1.4721 -1.4680 3.4872 3.4888 3.8049 3.8073 5.3197 5.3306 5.4744 5.5126 5.7379 5.7415 5.8705 5.9000 6.1899 6.1954 6.2753 6.2816 7.8491 7.8579 7.8697 7.8730 8.1417 8.1536 8.1762 8.1780 14.0941 14.0979 15.1043 15.1087 16.1926 16.1937 16.2322 16.2332 16.2598 16.2624 17.1573 17.1593 k = 0.0192 0.5000 0.0192 ( 2738 PWs) bands (ev): -5.9751 -5.9727 -5.9275 -5.9256 -5.3422 -5.3419 -5.2734 -5.2719 -3.8134 -3.8066 -3.7669 -3.7639 -3.7068 -3.6981 -3.6614 -3.6413 -3.6338 -3.6293 -3.3955 -3.3892 -3.3771 -3.3750 -3.3325 -3.3325 -3.2886 -3.2744 -3.2399 -3.2367 -3.2286 -3.2249 -3.1138 -3.1120 -3.1110 -3.1102 -1.5566 -1.5557 -1.4670 -1.4642 3.4904 3.4915 3.8105 3.8121 5.3607 5.3709 5.5188 5.5579 5.6822 5.6826 5.8014 5.8290 6.2116 6.2154 6.2951 6.2995 7.8482 7.8541 7.8674 7.8697 8.1437 8.1512 8.1752 8.1770 14.0799 14.0824 15.0966 15.0995 16.1980 16.1986 16.2289 16.2296 16.2445 16.2464 17.1510 17.1524 k = 0.0096 0.5000 0.0096 ( 2730 PWs) bands (ev): -5.9756 -5.9744 -5.9283 -5.9274 -5.3416 -5.3414 -5.2724 -5.2717 -3.8117 -3.8083 -3.7658 -3.7643 -3.7048 -3.7004 -3.6547 -3.6403 -3.6392 -3.6338 -3.3940 -3.3908 -3.3766 -3.3756 -3.3324 -3.3324 -3.2845 -3.2772 -3.2392 -3.2378 -3.2280 -3.2261 -3.1135 -3.1128 -3.1122 -3.1117 -1.5534 -1.5530 -1.4636 -1.4621 3.4923 3.4929 3.8139 3.8147 5.3975 5.4048 5.5613 5.5984 5.6385 5.6457 5.7426 5.7648 6.2250 6.2269 6.3078 6.3100 7.8482 7.8512 7.8662 7.8674 8.1455 8.1491 8.1751 8.1762 14.0715 14.0728 15.0922 15.0937 16.2045 16.2047 16.2270 16.2273 16.2324 16.2335 17.1475 17.1481 k = 0.0000 0.5000-0.0000 ( 2730 PWs) bands (ev): -5.9753 -5.9753 -5.9283 -5.9283 -5.3413 -5.3413 -5.2718 -5.2718 -3.8100 -3.8100 -3.7650 -3.7650 -3.7027 -3.7027 -3.6476 -3.6476 -3.6367 -3.6367 -3.3924 -3.3924 -3.3761 -3.3761 -3.3324 -3.3324 -3.2807 -3.2807 -3.2386 -3.2386 -3.2272 -3.2272 -3.1128 -3.1128 -3.1128 -3.1128 -1.5522 -1.5522 -1.4620 -1.4620 3.4931 3.4931 3.8153 3.8153 5.4168 5.4168 5.5887 5.5887 5.6414 5.6414 5.7216 5.7216 6.2301 6.2301 6.3128 6.3128 7.8493 7.8493 7.8662 7.8662 8.1472 8.1472 8.1755 8.1755 14.0691 14.0691 15.0912 15.0912 16.2087 16.2087 16.2256 16.2256 16.2276 16.2276 17.1465 17.1465 k = 0.5000 0.5000-0.0000 ( 2704 PWs) bands (ev): -5.6781 -5.6781 -5.5649 -5.5649 -5.5296 -5.5296 -5.5007 -5.5007 -3.8098 -3.8098 -3.7993 -3.7993 -3.7150 -3.7150 -3.6483 -3.6483 -3.4373 -3.4373 -3.3871 -3.3871 -3.3761 -3.3761 -3.3545 -3.3545 -3.2727 -3.2727 -3.2526 -3.2526 -3.1763 -3.1763 -2.7605 -2.7605 -2.5400 -2.5400 -2.5250 -2.5250 -2.2288 -2.2288 3.8839 3.8839 4.1462 4.1462 4.1530 4.1530 4.1586 4.1586 5.9869 5.9869 6.0558 6.0558 6.1187 6.1187 6.1269 6.1269 8.3523 8.3523 8.3743 8.3743 8.6900 8.6900 8.7250 8.7250 15.5118 15.5118 15.5230 15.5230 16.8351 16.8351 16.8362 16.8362 17.4869 17.4869 17.5880 17.5880 k = 0.5000 0.5000 0.0135 ( 2704 PWs) bands (ev): -5.6781 -5.6781 -5.5648 -5.5648 -5.5297 -5.5297 -5.5007 -5.5007 -3.8100 -3.8100 -3.7995 -3.7995 -3.7148 -3.7148 -3.6478 -3.6478 -3.4375 -3.4375 -3.3871 -3.3871 -3.3762 -3.3762 -3.3545 -3.3545 -3.2730 -3.2730 -3.2522 -3.2522 -3.1762 -3.1762 -2.7598 -2.7598 -2.5402 -2.5402 -2.5242 -2.5242 -2.2283 -2.2283 3.8766 3.8766 4.1405 4.1405 4.1459 4.1459 4.1518 4.1518 5.9854 5.9854 6.0712 6.0712 6.1267 6.1267 6.1349 6.1349 8.3525 8.3525 8.3745 8.3745 8.6899 8.6899 8.7254 8.7254 15.4698 15.4698 15.5615 15.5615 16.8335 16.8335 16.8346 16.8346 17.4871 17.4871 17.5860 17.5860 k = 0.5000 0.5000 0.0270 ( 2704 PWs) bands (ev): -5.6782 -5.6782 -5.5646 -5.5646 -5.5297 -5.5297 -5.5007 -5.5007 -3.8104 -3.8104 -3.8001 -3.8001 -3.7144 -3.7144 -3.6463 -3.6463 -3.4381 -3.4381 -3.3871 -3.3871 -3.3762 -3.3762 -3.3543 -3.3543 -3.2739 -3.2739 -3.2509 -3.2509 -3.1758 -3.1758 -2.7578 -2.7578 -2.5407 -2.5407 -2.5221 -2.5221 -2.2270 -2.2270 3.8551 3.8551 4.1229 4.1229 4.1251 4.1251 4.1320 4.1320 5.9882 5.9882 6.1096 6.1096 6.1505 6.1505 6.1586 6.1586 8.3531 8.3531 8.3751 8.3751 8.6896 8.6896 8.7266 8.7266 15.4191 15.4191 15.6014 15.6014 16.8286 16.8286 16.8297 16.8297 17.4876 17.4876 17.5800 17.5800 k = 0.5000 0.5000 0.0405 ( 2712 PWs) bands (ev): -5.6784 -5.6784 -5.5643 -5.5643 -5.5298 -5.5298 -5.5008 -5.5008 -3.8112 -3.8112 -3.8011 -3.8011 -3.7136 -3.7136 -3.6439 -3.6439 -3.4390 -3.4390 -3.3871 -3.3871 -3.3763 -3.3763 -3.3541 -3.3541 -3.2752 -3.2752 -3.2489 -3.2489 -3.1752 -3.1752 -2.7545 -2.7545 -2.5411 -2.5411 -2.5188 -2.5188 -2.2249 -2.2249 3.8209 3.8209 4.0912 4.0912 4.0930 4.0930 4.1014 4.1014 6.0021 6.0021 6.1615 6.1615 6.1890 6.1890 6.1977 6.1977 8.3541 8.3541 8.3761 8.3761 8.6891 8.6891 8.7285 8.7285 15.3649 15.3649 15.6379 15.6379 16.8203 16.8203 16.8213 16.8213 17.4882 17.4882 17.5705 17.5705 k = 0.5000 0.5000 0.0541 ( 2720 PWs) bands (ev): -5.6786 -5.6786 -5.5639 -5.5639 -5.5300 -5.5300 -5.5009 -5.5009 -3.8123 -3.8123 -3.8024 -3.8024 -3.7125 -3.7125 -3.6406 -3.6406 -3.4403 -3.4403 -3.3871 -3.3871 -3.3763 -3.3763 -3.3538 -3.3538 -3.2768 -3.2768 -3.2464 -3.2464 -3.1744 -3.1744 -2.7499 -2.7499 -2.5412 -2.5412 -2.5147 -2.5147 -2.2219 -2.2219 3.7756 3.7756 4.0464 4.0464 4.0499 4.0499 4.0621 4.0621 6.0289 6.0289 6.2219 6.2219 6.2402 6.2402 6.2528 6.2528 8.3554 8.3554 8.3775 8.3775 8.6885 8.6885 8.7310 8.7310 15.3073 15.3073 15.6709 15.6709 16.8081 16.8081 16.8091 16.8091 17.4886 17.4886 17.5583 17.5583 k = 0.5000 0.5000 0.0676 ( 2712 PWs) bands (ev): -5.6788 -5.6788 -5.5633 -5.5633 -5.5301 -5.5301 -5.5010 -5.5010 -3.8135 -3.8135 -3.8039 -3.8039 -3.7109 -3.7109 -3.6366 -3.6366 -3.4418 -3.4418 -3.3873 -3.3873 -3.3762 -3.3762 -3.3534 -3.3534 -3.2785 -3.2785 -3.2434 -3.2434 -3.1733 -3.1733 -2.7441 -2.7441 -2.5408 -2.5408 -2.5098 -2.5098 -2.2180 -2.2180 3.7213 3.7213 3.9920 3.9920 3.9964 3.9964 4.0143 4.0143 6.0681 6.0681 6.2884 6.2884 6.3018 6.3018 6.3225 6.3225 8.3572 8.3572 8.3793 8.3793 8.6880 8.6880 8.7341 8.7341 15.2465 15.2465 15.7003 15.7003 16.7917 16.7917 16.7927 16.7927 17.4882 17.4882 17.5442 17.5442 k = 0.5000 0.5000 0.0811 ( 2712 PWs) bands (ev): -5.6791 -5.6791 -5.5627 -5.5627 -5.5303 -5.5303 -5.5012 -5.5012 -3.8151 -3.8151 -3.8057 -3.8057 -3.7091 -3.7091 -3.6319 -3.6319 -3.4437 -3.4437 -3.3877 -3.3877 -3.3760 -3.3760 -3.3529 -3.3529 -3.2804 -3.2804 -3.2401 -3.2401 -3.1720 -3.1720 -2.7369 -2.7369 -2.5399 -2.5399 -2.5043 -2.5043 -2.2134 -2.2134 3.6598 3.6598 3.9296 3.9296 3.9347 3.9347 3.9584 3.9584 6.1184 6.1184 6.3613 6.3613 6.3722 6.3722 6.4028 6.4028 8.3595 8.3595 8.3816 8.3816 8.6874 8.6874 8.7377 8.7377 15.1827 15.1827 15.7264 15.7264 16.7705 16.7705 16.7715 16.7715 17.4865 17.4865 17.5291 17.5291 k = 0.5000 0.5000 0.0946 ( 2724 PWs) bands (ev): -5.6795 -5.6795 -5.5619 -5.5619 -5.5305 -5.5305 -5.5014 -5.5014 -3.8169 -3.8169 -3.8076 -3.8076 -3.7069 -3.7069 -3.6268 -3.6268 -3.4457 -3.4457 -3.3883 -3.3883 -3.3756 -3.3756 -3.3524 -3.3524 -3.2823 -3.2823 -3.2366 -3.2366 -3.1705 -3.1705 -2.7287 -2.7287 -2.5385 -2.5385 -2.4983 -2.4983 -2.2080 -2.2080 3.5925 3.5925 3.8611 3.8611 3.8666 3.8666 3.8955 3.8955 6.1783 6.1783 6.4406 6.4406 6.4500 6.4500 6.4903 6.4903 8.3621 8.3621 8.3843 8.3843 8.6870 8.6870 8.7416 8.7416 15.1161 15.1161 15.7488 15.7488 16.7442 16.7442 16.7451 16.7451 17.4829 17.4829 17.5141 17.5141 k = 0.5000 0.5000 0.1081 ( 2720 PWs) bands (ev): -5.6798 -5.6798 -5.5610 -5.5610 -5.5308 -5.5308 -5.5015 -5.5015 -3.8188 -3.8188 -3.8097 -3.8097 -3.7043 -3.7043 -3.6211 -3.6211 -3.4479 -3.4479 -3.3891 -3.3891 -3.3751 -3.3751 -3.3518 -3.3518 -3.2842 -3.2842 -3.2327 -3.2327 -3.1688 -3.1688 -2.7192 -2.7192 -2.5365 -2.5365 -2.4917 -2.4917 -2.2018 -2.2018 3.5210 3.5210 3.7877 3.7877 3.7937 3.7937 3.8270 3.8270 6.2465 6.2465 6.5255 6.5255 6.5337 6.5337 6.5830 6.5830 8.3652 8.3652 8.3874 8.3874 8.6867 8.6867 8.7459 8.7459 15.0471 15.0471 15.7679 15.7679 16.7124 16.7124 16.7133 16.7133 17.4770 17.4770 17.5001 17.5001 k = 0.5000 0.5000 0.1216 ( 2720 PWs) bands (ev): -5.6802 -5.6802 -5.5600 -5.5600 -5.5311 -5.5311 -5.5018 -5.5018 -3.8209 -3.8209 -3.8118 -3.8118 -3.7014 -3.7014 -3.6151 -3.6151 -3.4503 -3.4503 -3.3900 -3.3900 -3.3744 -3.3744 -3.3512 -3.3512 -3.2861 -3.2861 -3.2286 -3.2286 -3.1670 -3.1670 -2.7086 -2.7086 -2.5338 -2.5338 -2.4845 -2.4845 -2.1949 -2.1949 3.4464 3.4464 3.7109 3.7109 3.7172 3.7172 3.7539 3.7539 6.3214 6.3214 6.6149 6.6149 6.6222 6.6222 6.6795 6.6795 8.3687 8.3687 8.3911 8.3911 8.6865 8.6865 8.7505 8.7505 14.9757 14.9757 15.7835 15.7835 16.6749 16.6749 16.6758 16.6758 17.4690 17.4690 17.4879 17.4879 k = 0.5000 0.5000 0.1351 ( 2724 PWs) bands (ev): -5.6807 -5.6807 -5.5589 -5.5589 -5.5314 -5.5314 -5.5020 -5.5020 -3.8231 -3.8231 -3.8141 -3.8141 -3.6982 -3.6982 -3.6089 -3.6089 -3.4528 -3.4528 -3.3911 -3.3911 -3.3736 -3.3736 -3.3505 -3.3505 -3.2880 -3.2880 -3.2244 -3.2244 -3.1650 -3.1650 -2.6970 -2.6970 -2.5306 -2.5306 -2.4770 -2.4770 -2.1874 -2.1874 3.3697 3.3697 3.6315 3.6315 3.6382 3.6382 3.6775 3.6775 6.4016 6.4016 6.7078 6.7078 6.7141 6.7141 6.7789 6.7789 8.3728 8.3728 8.3952 8.3952 8.6866 8.6866 8.7554 8.7554 14.9024 14.9024 15.7954 15.7954 16.6317 16.6317 16.6326 16.6326 17.4596 17.4596 17.4777 17.4777 k = 0.5000 0.5000 0.1486 ( 2716 PWs) bands (ev): -5.6812 -5.6812 -5.5578 -5.5578 -5.5317 -5.5317 -5.5022 -5.5022 -3.8254 -3.8254 -3.8162 -3.8162 -3.6947 -3.6947 -3.6025 -3.6025 -3.4554 -3.4554 -3.3923 -3.3923 -3.3728 -3.3728 -3.3498 -3.3498 -3.2899 -3.2899 -3.2200 -3.2200 -3.1629 -3.1629 -2.6844 -2.6844 -2.5267 -2.5267 -2.4689 -2.4689 -2.1792 -2.1792 3.2915 3.2915 3.5505 3.5505 3.5575 3.5575 3.5986 3.5986 6.4862 6.4862 6.8032 6.8032 6.8087 6.8087 6.8804 6.8804 8.3774 8.3774 8.3999 8.3999 8.6868 8.6868 8.7605 8.7605 14.8274 14.8274 15.8037 15.8037 16.5831 16.5831 16.5840 16.5840 17.4492 17.4492 17.4699 17.4699 k = 0.5000 0.5000 0.1622 ( 2708 PWs) bands (ev): -5.6817 -5.6817 -5.5565 -5.5565 -5.5321 -5.5321 -5.5025 -5.5025 -3.8277 -3.8277 -3.8184 -3.8184 -3.6909 -3.6909 -3.5960 -3.5960 -3.4580 -3.4580 -3.3935 -3.3935 -3.3719 -3.3719 -3.3490 -3.3490 -3.2917 -3.2917 -3.2154 -3.2154 -3.1607 -3.1607 -2.6708 -2.6708 -2.5223 -2.5223 -2.4605 -2.4605 -2.1705 -2.1705 3.2128 3.2128 3.4687 3.4687 3.4760 3.4760 3.5183 3.5183 6.5740 6.5740 6.9003 6.9003 6.9049 6.9049 6.9832 6.9832 8.3825 8.3825 8.4052 8.4052 8.6871 8.6871 8.7658 8.7658 14.7511 14.7511 15.8082 15.8082 16.5295 16.5295 16.5305 16.5305 17.4375 17.4375 17.4645 17.4645 k = 0.5000 0.5000 0.1757 ( 2708 PWs) bands (ev): -5.6823 -5.6823 -5.5552 -5.5552 -5.5325 -5.5325 -5.5028 -5.5028 -3.8301 -3.8301 -3.8206 -3.8206 -3.6870 -3.6870 -3.5895 -3.5895 -3.4607 -3.4607 -3.3947 -3.3947 -3.3709 -3.3709 -3.3482 -3.3482 -3.2936 -3.2936 -3.2107 -3.2107 -3.1584 -3.1584 -2.6565 -2.6565 -2.5171 -2.5171 -2.4517 -2.4517 -2.1613 -2.1613 3.1338 3.1338 3.3867 3.3867 3.3943 3.3943 3.4370 3.4370 6.6643 6.6643 6.9982 6.9982 7.0020 7.0020 7.0867 7.0867 8.3883 8.3883 8.4111 8.4111 8.6877 8.6877 8.7712 8.7712 14.6737 14.6737 15.8087 15.8087 16.4716 16.4716 16.4725 16.4725 17.4246 17.4246 17.4613 17.4613 k = 0.5000 0.5000 0.1892 ( 2708 PWs) bands (ev): -5.6829 -5.6829 -5.5538 -5.5538 -5.5329 -5.5329 -5.5031 -5.5031 -3.8325 -3.8325 -3.8228 -3.8228 -3.6828 -3.6828 -3.5831 -3.5831 -3.4635 -3.4635 -3.3960 -3.3960 -3.3699 -3.3699 -3.3474 -3.3474 -3.2954 -3.2954 -3.2060 -3.2060 -3.1561 -3.1561 -2.6414 -2.6414 -2.5114 -2.5114 -2.4425 -2.4425 -2.1517 -2.1517 3.0553 3.0553 3.3051 3.3051 3.3128 3.3128 3.3556 3.3556 6.7562 6.7562 7.0963 7.0963 7.0993 7.0993 7.1904 7.1904 8.3948 8.3948 8.4177 8.4177 8.6883 8.6883 8.7767 8.7767 14.5955 14.5955 15.8051 15.8051 16.4099 16.4099 16.4109 16.4109 17.4112 17.4112 17.4603 17.4603 k = 0.5000 0.5000 0.2027 ( 2712 PWs) bands (ev): -5.6835 -5.6835 -5.5524 -5.5524 -5.5333 -5.5333 -5.5034 -5.5034 -3.8348 -3.8348 -3.8250 -3.8250 -3.6784 -3.6784 -3.5769 -3.5769 -3.4663 -3.4663 -3.3973 -3.3973 -3.3690 -3.3690 -3.3466 -3.3466 -3.2972 -3.2972 -3.2012 -3.2012 -3.1538 -3.1538 -2.6256 -2.6256 -2.5051 -2.5051 -2.4330 -2.4330 -2.1417 -2.1417 2.9776 2.9776 3.2242 3.2242 3.2321 3.2321 3.2746 3.2746 6.8491 6.8491 7.1939 7.1939 7.1961 7.1961 7.2938 7.2938 8.4021 8.4021 8.4252 8.4252 8.6892 8.6892 8.7823 8.7823 14.5168 14.5168 15.7974 15.7974 16.3451 16.3451 16.3461 16.3461 17.3981 17.3981 17.4612 17.4612 k = 0.5000 0.5000 0.2162 ( 2704 PWs) bands (ev): -5.6841 -5.6841 -5.5509 -5.5509 -5.5338 -5.5338 -5.5038 -5.5038 -3.8371 -3.8371 -3.8271 -3.8271 -3.6738 -3.6738 -3.5708 -3.5708 -3.4690 -3.4690 -3.3985 -3.3985 -3.3680 -3.3680 -3.3457 -3.3457 -3.2989 -3.2989 -3.1964 -3.1964 -3.1515 -3.1515 -2.6094 -2.6094 -2.4981 -2.4981 -2.4232 -2.4232 -2.1314 -2.1314 2.9011 2.9011 3.1445 3.1445 3.1526 3.1526 3.1943 3.1943 6.9425 6.9425 7.2903 7.2903 7.2917 7.2917 7.3964 7.3964 8.4104 8.4104 8.4336 8.4336 8.6902 8.6902 8.7880 8.7880 14.4380 14.4380 15.7856 15.7856 16.2780 16.2780 16.2790 16.2790 17.3862 17.3862 17.4636 17.4636 k = 0.5000 0.5000 0.2297 ( 2712 PWs) bands (ev): -5.6847 -5.6847 -5.5494 -5.5494 -5.5342 -5.5342 -5.5042 -5.5042 -3.8393 -3.8393 -3.8292 -3.8292 -3.6691 -3.6691 -3.5651 -3.5651 -3.4718 -3.4718 -3.3996 -3.3996 -3.3670 -3.3670 -3.3449 -3.3449 -3.3006 -3.3006 -3.1917 -3.1917 -3.1492 -3.1492 -2.5927 -2.5927 -2.4904 -2.4904 -2.4133 -2.4133 -2.1210 -2.1210 2.8260 2.8260 3.0665 3.0665 3.0746 3.0746 3.1152 3.1152 7.0358 7.0358 7.3849 7.3849 7.3854 7.3854 7.4979 7.4979 8.4197 8.4197 8.4431 8.4431 8.6912 8.6912 8.7937 8.7937 14.3594 14.3594 15.7696 15.7696 16.2092 16.2092 16.2102 16.2102 17.3761 17.3761 17.4670 17.4670 k = 0.5000 0.5000 0.2432 ( 2712 PWs) bands (ev): -5.6854 -5.6854 -5.5478 -5.5478 -5.5346 -5.5346 -5.5045 -5.5045 -3.8414 -3.8414 -3.8313 -3.8313 -3.6642 -3.6642 -3.5597 -3.5597 -3.4745 -3.4745 -3.4007 -3.4007 -3.3660 -3.3660 -3.3440 -3.3440 -3.3022 -3.3022 -3.1869 -3.1869 -3.1469 -3.1469 -2.5758 -2.5758 -2.4822 -2.4822 -2.4031 -2.4031 -2.1104 -2.1104 2.7529 2.7529 2.9903 2.9903 2.9985 2.9985 3.0378 3.0378 7.1285 7.1285 7.4765 7.4765 7.4770 7.4770 7.5977 7.5977 8.4303 8.4303 8.4539 8.4539 8.6924 8.6924 8.7993 8.7993 14.2812 14.2812 15.7498 15.7498 16.1394 16.1394 16.1404 16.1404 17.3684 17.3684 17.4711 17.4711 k = 0.5000 0.5000 0.2568 ( 2704 PWs) bands (ev): -5.6860 -5.6860 -5.5463 -5.5463 -5.5350 -5.5350 -5.5049 -5.5049 -3.8433 -3.8433 -3.8333 -3.8333 -3.6592 -3.6592 -3.5546 -3.5546 -3.4771 -3.4771 -3.4017 -3.4017 -3.3649 -3.3649 -3.3431 -3.3431 -3.3038 -3.3038 -3.1822 -3.1822 -3.1447 -3.1447 -2.5588 -2.5588 -2.4732 -2.4732 -2.3929 -2.3929 -2.0998 -2.0998 2.6819 2.6819 2.9164 2.9164 2.9246 2.9246 2.9622 2.9622 7.2202 7.2202 7.5646 7.5646 7.5659 7.5659 7.6956 7.6956 8.4426 8.4426 8.4663 8.4663 8.6937 8.6937 8.8050 8.8050 14.2040 14.2040 15.7262 15.7262 16.0691 16.0691 16.0701 16.0701 17.3635 17.3635 17.4756 17.4756 k = 0.5000 0.5000 0.2703 ( 2704 PWs) bands (ev): -5.6866 -5.6866 -5.5448 -5.5448 -5.5354 -5.5354 -5.5054 -5.5054 -3.8452 -3.8452 -3.8353 -3.8353 -3.6542 -3.6542 -3.5501 -3.5501 -3.4796 -3.4796 -3.4025 -3.4025 -3.3639 -3.3639 -3.3422 -3.3422 -3.3053 -3.3053 -3.1776 -3.1776 -3.1425 -3.1425 -2.5420 -2.5420 -2.4635 -2.4635 -2.3825 -2.3825 -2.0892 -2.0892 2.6132 2.6132 2.8449 2.8449 2.8531 2.8531 2.8889 2.8889 7.3104 7.3104 7.6488 7.6488 7.6508 7.6508 7.7912 7.7912 8.4566 8.4566 8.4804 8.4804 8.6951 8.6951 8.8105 8.8105 14.1278 14.1278 15.6994 15.6994 15.9990 15.9990 15.9999 15.9999 17.3615 17.3615 17.4802 17.4802 k = 0.5000 0.5000 0.2838 ( 2696 PWs) bands (ev): -5.6872 -5.6872 -5.5433 -5.5433 -5.5357 -5.5357 -5.5058 -5.5058 -3.8470 -3.8470 -3.8372 -3.8372 -3.6490 -3.6490 -3.5460 -3.5460 -3.4820 -3.4820 -3.4033 -3.4033 -3.3628 -3.3628 -3.3412 -3.3412 -3.3068 -3.3068 -3.1731 -3.1731 -3.1404 -3.1404 -2.5255 -2.5255 -2.4531 -2.4531 -2.3722 -2.3722 -2.0788 -2.0788 2.5472 2.5472 2.7761 2.7761 2.7843 2.7843 2.8181 2.8181 7.3987 7.3987 7.7283 7.7283 7.7310 7.7310 7.8840 7.8840 8.4728 8.4728 8.4966 8.4966 8.6965 8.6965 8.8159 8.8159 14.0532 14.0532 15.6697 15.6697 15.9296 15.9296 15.9305 15.9305 17.3624 17.3624 17.4847 17.4847 k = 0.5000 0.5000 0.2973 ( 2704 PWs) bands (ev): -5.6878 -5.6878 -5.5419 -5.5419 -5.5359 -5.5359 -5.5063 -5.5063 -3.8486 -3.8486 -3.8392 -3.8392 -3.6438 -3.6438 -3.5427 -3.5427 -3.4842 -3.4842 -3.4040 -3.4040 -3.3619 -3.3619 -3.3403 -3.3403 -3.3082 -3.3082 -3.1688 -3.1688 -3.1385 -3.1385 -2.5097 -2.5097 -2.4417 -2.4417 -2.3620 -2.3620 -2.0686 -2.0686 2.4841 2.4841 2.7103 2.7103 2.7184 2.7184 2.7500 2.7500 7.4845 7.4845 7.8023 7.8023 7.8057 7.8057 7.9736 7.9736 8.4914 8.4914 8.5152 8.5152 8.6979 8.6979 8.8211 8.8211 13.9803 13.9803 15.6376 15.6376 15.8613 15.8613 15.8622 15.8622 17.3661 17.3661 17.4888 17.4888 k = 0.5000 0.5000 0.3108 ( 2712 PWs) bands (ev): -5.6885 -5.6885 -5.5409 -5.5409 -5.5359 -5.5359 -5.5069 -5.5069 -3.8501 -3.8501 -3.8410 -3.8410 -3.6386 -3.6386 -3.5399 -3.5399 -3.4862 -3.4862 -3.4045 -3.4045 -3.3609 -3.3609 -3.3394 -3.3394 -3.3096 -3.3096 -3.1647 -3.1647 -3.1367 -3.1367 -2.4949 -2.4949 -2.4296 -2.4296 -2.3520 -2.3520 -2.0587 -2.0587 2.4240 2.4240 2.6476 2.6476 2.6555 2.6555 2.6849 2.6849 7.5676 7.5676 7.8702 7.8702 7.8741 7.8741 8.0598 8.0598 8.5131 8.5131 8.5366 8.5366 8.6994 8.6994 8.8263 8.8263 13.9095 13.9095 15.6038 15.6038 15.7947 15.7947 15.7955 15.7955 17.3723 17.3723 17.4924 17.4924 k = 0.5000 0.5000 0.3243 ( 2712 PWs) bands (ev): -5.6890 -5.6890 -5.5402 -5.5402 -5.5354 -5.5354 -5.5074 -5.5074 -3.8515 -3.8515 -3.8428 -3.8428 -3.6333 -3.6333 -3.5380 -3.5380 -3.4878 -3.4878 -3.4049 -3.4049 -3.3599 -3.3599 -3.3384 -3.3384 -3.3110 -3.3110 -3.1607 -3.1607 -3.1350 -3.1350 -2.4811 -2.4811 -2.4165 -2.4165 -2.3421 -2.3421 -2.0493 -2.0493 2.3673 2.3673 2.5883 2.5883 2.5961 2.5961 2.6231 2.6231 7.6476 7.6476 7.9314 7.9314 7.9357 7.9357 8.1421 8.1421 8.5377 8.5377 8.5608 8.5608 8.7008 8.7008 8.8312 8.8312 13.8414 13.8414 15.5689 15.5689 15.7303 15.7303 15.7311 15.7311 17.3808 17.3808 17.4956 17.4956 k = 0.5000 0.5000 0.3378 ( 2720 PWs) bands (ev): -5.6896 -5.6896 -5.5400 -5.5400 -5.5345 -5.5345 -5.5080 -5.5080 -3.8528 -3.8528 -3.8445 -3.8445 -3.6281 -3.6281 -3.5368 -3.5368 -3.4892 -3.4892 -3.4053 -3.4053 -3.3589 -3.3589 -3.3375 -3.3375 -3.3123 -3.3123 -3.1568 -3.1568 -3.1334 -3.1334 -2.4684 -2.4684 -2.4027 -2.4027 -2.3326 -2.3326 -2.0403 -2.0403 2.3140 2.3140 2.5326 2.5326 2.5401 2.5401 2.5648 2.5648 7.7239 7.7239 7.9853 7.9853 7.9900 7.9900 8.2203 8.2203 8.5655 8.5655 8.5878 8.5878 8.7023 8.7023 8.8358 8.8358 13.7762 13.7762 15.5334 15.5334 15.6685 15.6685 15.6692 15.6692 17.3912 17.3912 17.4981 17.4981 k = 0.5000 0.5000 0.3514 ( 2720 PWs) bands (ev): -5.6901 -5.6901 -5.5400 -5.5400 -5.5332 -5.5332 -5.5086 -5.5086 -3.8539 -3.8539 -3.8461 -3.8461 -3.6228 -3.6228 -3.5364 -3.5364 -3.4901 -3.4901 -3.4055 -3.4055 -3.3580 -3.3580 -3.3365 -3.3365 -3.3135 -3.3135 -3.1532 -3.1532 -3.1320 -3.1320 -2.4570 -2.4570 -2.3884 -2.3884 -2.3235 -2.3235 -2.0319 -2.0319 2.2644 2.2644 2.4806 2.4806 2.4878 2.4878 2.5102 2.5102 7.7962 7.7962 8.0321 8.0321 8.0369 8.0369 8.2938 8.2938 8.5961 8.5961 8.6174 8.6174 8.7038 8.7038 8.8403 8.8403 13.7143 13.7143 15.4982 15.4982 15.6097 15.6097 15.6104 15.6104 17.4030 17.4030 17.5001 17.5001 k = 0.5000 0.5000 0.3649 ( 2720 PWs) bands (ev): -5.6906 -5.6906 -5.5402 -5.5402 -5.5318 -5.5318 -5.5092 -5.5092 -3.8549 -3.8549 -3.8476 -3.8476 -3.6175 -3.6175 -3.5368 -3.5368 -3.4908 -3.4908 -3.4056 -3.4056 -3.3571 -3.3571 -3.3355 -3.3355 -3.3147 -3.3147 -3.1498 -3.1498 -3.1307 -3.1307 -2.4467 -2.4467 -2.3740 -2.3740 -2.3149 -2.3149 -2.0241 -2.0241 2.2186 2.2186 2.4325 2.4325 2.4393 2.4393 2.4596 2.4596 7.8641 7.8641 8.0717 8.0717 8.0766 8.0766 8.3625 8.3625 8.6290 8.6290 8.6489 8.6489 8.7054 8.7054 8.8444 8.8444 13.6560 13.6560 15.4636 15.4636 15.5544 15.5544 15.5550 15.5550 17.4158 17.4158 17.5015 17.5015 k = 0.5000 0.5000 0.3784 ( 2724 PWs) bands (ev): -5.6911 -5.6911 -5.5405 -5.5405 -5.5304 -5.5304 -5.5099 -5.5099 -3.8557 -3.8557 -3.8491 -3.8491 -3.6122 -3.6122 -3.5380 -3.5380 -3.4911 -3.4911 -3.4057 -3.4057 -3.3562 -3.3562 -3.3346 -3.3346 -3.3159 -3.3159 -3.1467 -3.1467 -3.1296 -3.1296 -2.4374 -2.4374 -2.3596 -2.3596 -2.3069 -2.3069 -2.0170 -2.0170 2.1767 2.1767 2.3884 2.3884 2.3948 2.3948 2.4131 2.4131 7.9271 7.9271 8.1046 8.1046 8.1097 8.1097 8.4259 8.4259 8.6630 8.6630 8.6807 8.6807 8.7078 8.7078 8.8483 8.8483 13.6018 13.6018 15.4304 15.4304 15.5030 15.5030 15.5035 15.5035 17.4291 17.4291 17.5025 17.5025 k = 0.5000 0.5000 0.3919 ( 2716 PWs) bands (ev): -5.6915 -5.6915 -5.5407 -5.5407 -5.5289 -5.5289 -5.5106 -5.5106 -3.8564 -3.8564 -3.8504 -3.8504 -3.6070 -3.6070 -3.5398 -3.5398 -3.4911 -3.4911 -3.4057 -3.4057 -3.3554 -3.3554 -3.3335 -3.3335 -3.3170 -3.3170 -3.1437 -3.1437 -3.1287 -3.1287 -2.4291 -2.4291 -2.3458 -2.3458 -2.2996 -2.2996 -2.0106 -2.0106 2.1390 2.1390 2.3486 2.3486 2.3544 2.3544 2.3710 2.3710 7.9849 7.9849 8.1317 8.1317 8.1369 8.1369 8.4837 8.4837 8.6972 8.6972 8.7030 8.7030 8.7198 8.7198 8.8519 8.8519 13.5520 13.5520 15.3991 15.3991 15.4558 15.4558 15.4563 15.4563 17.4425 17.4425 17.5031 17.5031 k = 0.5000 0.5000 0.4054 ( 2712 PWs) bands (ev): -5.6918 -5.6918 -5.5410 -5.5410 -5.5275 -5.5275 -5.5114 -5.5114 -3.8569 -3.8569 -3.8516 -3.8516 -3.6018 -3.6018 -3.5421 -3.5421 -3.4910 -3.4910 -3.4056 -3.4056 -3.3547 -3.3547 -3.3325 -3.3325 -3.3181 -3.3181 -3.1410 -3.1410 -3.1280 -3.1280 -2.4218 -2.4218 -2.3326 -2.3326 -2.2930 -2.2930 -2.0050 -2.0050 2.1054 2.1054 2.3132 2.3132 2.3182 2.3182 2.3335 2.3335 8.0370 8.0370 8.1534 8.1534 8.1590 8.1590 8.5356 8.5356 8.7066 8.7066 8.7305 8.7305 8.7491 8.7491 8.8551 8.8551 13.5070 13.5070 15.3702 15.3702 15.4131 15.4131 15.4136 15.4136 17.4554 17.4554 17.5033 17.5033 k = 0.5000 0.5000 0.4189 ( 2728 PWs) bands (ev): -5.6922 -5.6922 -5.5412 -5.5412 -5.5261 -5.5261 -5.5123 -5.5123 -3.8574 -3.8574 -3.8528 -3.8528 -3.5967 -3.5967 -3.5449 -3.5449 -3.4909 -3.4909 -3.4056 -3.4056 -3.3541 -3.3541 -3.3316 -3.3316 -3.3193 -3.3193 -3.1386 -3.1386 -3.1275 -3.1275 -2.4154 -2.4154 -2.3205 -2.3205 -2.2874 -2.2874 -2.0002 -2.0002 2.0762 2.0762 2.2822 2.2822 2.2864 2.2864 2.3008 2.3008 8.0829 8.0829 8.1707 8.1707 8.1766 8.1766 8.5812 8.5812 8.7079 8.7079 8.7613 8.7613 8.7785 8.7785 8.8579 8.8579 13.4671 13.4671 15.3442 15.3442 15.3754 15.3754 15.3759 15.3759 17.4673 17.4673 17.5032 17.5032 k = 0.5000 0.5000 0.4324 ( 2728 PWs) bands (ev): -5.6924 -5.6924 -5.5414 -5.5414 -5.5247 -5.5247 -5.5131 -5.5131 -3.8577 -3.8577 -3.8539 -3.8539 -3.5917 -3.5917 -3.5481 -3.5481 -3.4907 -3.4907 -3.4055 -3.4055 -3.3535 -3.3535 -3.3306 -3.3306 -3.3204 -3.3204 -3.1363 -3.1363 -3.1272 -3.1272 -2.4099 -2.4099 -2.3096 -2.3096 -2.2827 -2.2827 -1.9961 -1.9961 2.0513 2.0513 2.2557 2.2557 2.2591 2.2591 2.2730 2.2730 8.1225 8.1225 8.1843 8.1843 8.1906 8.1906 8.6202 8.6202 8.7090 8.7090 8.7890 8.7890 8.8052 8.8052 8.8605 8.8605 13.4328 13.4328 15.3214 15.3214 15.3430 15.3430 15.3434 15.3434 17.4779 17.4779 17.5030 17.5030 k = 0.5000 0.5000 0.4459 ( 2728 PWs) bands (ev): -5.6927 -5.6927 -5.5416 -5.5416 -5.5233 -5.5233 -5.5141 -5.5141 -3.8579 -3.8579 -3.8548 -3.8548 -3.5867 -3.5867 -3.5516 -3.5516 -3.4904 -3.4904 -3.4054 -3.4054 -3.3530 -3.3530 -3.3296 -3.3296 -3.3214 -3.3214 -3.1344 -3.1344 -3.1271 -3.1271 -2.4054 -2.4054 -2.3000 -2.3000 -2.2790 -2.2790 -1.9928 -1.9928 2.0309 2.0309 2.2340 2.2340 2.2365 2.2365 2.2502 2.2502 8.1553 8.1553 8.1948 8.1948 8.2016 8.2016 8.6526 8.6526 8.7098 8.7098 8.8124 8.8124 8.8282 8.8282 8.8630 8.8630 13.4042 13.4042 15.3023 15.3023 15.3161 15.3161 15.3165 15.3165 17.4868 17.4868 17.5027 17.5027 k = 0.5000 0.5000 0.4595 ( 2736 PWs) bands (ev): -5.6929 -5.6929 -5.5418 -5.5418 -5.5220 -5.5220 -5.5151 -5.5151 -3.8580 -3.8580 -3.8556 -3.8556 -3.5819 -3.5819 -3.5554 -3.5554 -3.4903 -3.4903 -3.4053 -3.4053 -3.3526 -3.3526 -3.3286 -3.3286 -3.3225 -3.3225 -3.1327 -3.1327 -3.1272 -3.1272 -2.4019 -2.4019 -2.2920 -2.2920 -2.2766 -2.2766 -1.9902 -1.9902 2.0149 2.0149 2.2170 2.2170 2.2186 2.2186 2.2325 2.2325 8.1808 8.1808 8.2025 8.2025 8.2098 8.2098 8.6778 8.6778 8.7104 8.7104 8.8308 8.8308 8.8467 8.8467 8.8654 8.8654 13.3817 13.3817 15.2871 15.2871 15.2949 15.2949 15.2953 15.2953 17.4936 17.4936 17.5024 17.5024 k = 0.5000 0.5000 0.4730 ( 2760 PWs) bands (ev): -5.6930 -5.6930 -5.5419 -5.5419 -5.5207 -5.5207 -5.5161 -5.5161 -3.8580 -3.8580 -3.8564 -3.8564 -3.5773 -3.5773 -3.5595 -3.5595 -3.4902 -3.4902 -3.4053 -3.4053 -3.3524 -3.3524 -3.3277 -3.3277 -3.3236 -3.3236 -3.1313 -3.1313 -3.1277 -3.1277 -2.3994 -2.3994 -2.2855 -2.2855 -2.2754 -2.2754 -1.9884 -1.9884 2.0035 2.0035 2.2048 2.2048 2.2057 2.2057 2.2198 2.2198 8.1988 8.1988 8.2077 8.2077 8.2159 8.2159 8.6960 8.6960 8.7107 8.7107 8.8435 8.8435 8.8603 8.8603 8.8679 8.8679 13.3655 13.3655 15.2760 15.2760 15.2795 15.2795 15.2800 15.2800 17.4982 17.4982 17.5021 17.5021 k = 0.5000 0.5000 0.4865 ( 2800 PWs) bands (ev): -5.6931 -5.6931 -5.5421 -5.5421 -5.5196 -5.5196 -5.5173 -5.5173 -3.8580 -3.8580 -3.8572 -3.8572 -3.5728 -3.5728 -3.5639 -3.5639 -3.4903 -3.4903 -3.4053 -3.4053 -3.3524 -3.3524 -3.3268 -3.3268 -3.3248 -3.3248 -3.1301 -3.1301 -3.1283 -3.1283 -2.3979 -2.3979 -2.2807 -2.2807 -2.2757 -2.2757 -1.9874 -1.9874 1.9966 1.9966 2.1975 2.1975 2.1979 2.1979 2.2121 2.2121 8.2086 8.2086 8.2106 8.2106 8.2200 8.2200 8.7067 8.7067 8.7107 8.7107 8.8501 8.8501 8.8683 8.8683 8.8700 8.8700 13.3556 13.3556 15.2692 15.2692 15.2703 15.2703 15.2709 15.2709 17.5007 17.5007 17.5018 17.5018 k = 0.5000 0.5000 0.5000 ( 2800 PWs) bands (ev): -5.6932 -5.6932 -5.5421 -5.5421 -5.5184 -5.5184 -5.5184 -5.5184 -3.8576 -3.8576 -3.8576 -3.8576 -3.5682 -3.5682 -3.5682 -3.5682 -3.4903 -3.4903 -3.4053 -3.4053 -3.3523 -3.3523 -3.3258 -3.3258 -3.3258 -3.3258 -3.1291 -3.1291 -3.1291 -3.1291 -2.3974 -2.3974 -2.2774 -2.2774 -2.2774 -2.2774 -1.9870 -1.9870 1.9943 1.9943 2.1952 2.1952 2.1952 2.1952 2.2096 2.2096 8.2116 8.2116 8.2116 8.2116 8.2218 8.2218 8.7106 8.7106 8.7106 8.7106 8.8522 8.8522 8.8711 8.8711 8.8711 8.8711 13.3523 13.3523 15.2670 15.2670 15.2670 15.2670 15.2679 15.2679 17.5016 17.5016 17.5016 17.5016 Writing output data file Ga3BN4.save init_run : 2.50s CPU 11.77s WALL ( 1 calls) electrons : 991.76s CPU 999.46s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.61s CPU 1.45s WALL ( 1 calls) Called by electrons: c_bands : 991.70s CPU 998.97s WALL ( 1 calls) v_of_rho : 0.39s CPU 0.92s WALL ( 1 calls) v_h : 0.05s CPU 0.06s WALL ( 1 calls) v_xc : 0.32s CPU 0.56s WALL ( 1 calls) newd : 0.49s CPU 0.57s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.05s WALL ( 284 calls) cegterg : 948.57s CPU 953.47s WALL ( 853 calls) Called by sum_band: Called by *egterg: h_psi : 244.55s CPU 252.74s WALL ( 15417 calls) s_psi : 34.53s CPU 35.68s WALL ( 15417 calls) g_psi : 0.49s CPU 0.60s WALL ( 14280 calls) cdiaghg : 542.39s CPU 540.13s WALL ( 14564 calls) cegterg:over : 70.91s CPU 66.61s WALL ( 14280 calls) cegterg:upda : 12.38s CPU 15.65s WALL ( 14280 calls) cegterg:last : 10.16s CPU 10.68s WALL ( 1705 calls) Called by h_psi: h_psi:vloc : 171.06s CPU 178.45s WALL ( 15417 calls) h_psi:vnl : 73.27s CPU 73.60s WALL ( 15417 calls) add_vuspsi : 23.86s CPU 28.34s WALL ( 15417 calls) General routines calbec : 49.36s CPU 45.12s WALL ( 15417 calls) fft : 0.48s CPU 1.53s WALL ( 19 calls) ffts : 0.05s CPU 0.05s WALL ( 4 calls) fftw : 164.06s CPU 170.12s WALL ( 1417132 calls) interpolate : 0.10s CPU 0.12s WALL ( 4 calls) davcio : 0.02s CPU 1.31s WALL ( 568 calls) Parallel routines fft_scatter : 120.20s CPU 123.94s WALL ( 1417155 calls) PWSCF : 17m24.66s CPU 18m30.50s WALL This run was terminated on: 12:57:15 30Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=