Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:29:17 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./CaNiN.save/ file Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 32 18 5 1634 702 115 Max 33 19 6 1643 723 124 Sum 1177 673 197 58971 25641 4251 bravais-lattice index = 14 lattice parameter (alat) = 6.7669 a.u. unit-cell volume = 606.5605 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 50.00 number of Kohn-Sham states= 60 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 321.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.766920 celldm(2)= 1.000000 celldm(3)= 1.957497 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 1.957497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.510857 ) PseudoPot. # 1 for Ca read from file: /users/gautes/Pseudo/Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 60bd286d514994a6a955285ae841e6ef Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1169 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ni read from file: /users/gautes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ca 10.00 40.07800 Ca( 1.00) Ni 10.00 58.69340 Ni( 1.00) N 5.00 14.00670 N( 1.00) 8 Sym. Ops., with inversion, found (note: 8 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [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 inversion cryst. s( 5) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 6) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 6) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_2h (mmm) there are 10 classes and 2 irreducible representations the character table: E -E C2 C2' C2'' i -i s_v s_v' s_v'' -C2 -C2' -C2'' -s_v -s_v' -s_v' G_5+ 2.00 -2.00 0.00 0.00 0.00 2.00 -2.00 0.00 0.00 0.00 G_5- 2.00 -2.00 0.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] C2' -C2' 3 -3 180 deg rotation - cart. axis [0,1,0] C2'' -C2'' 4 -4 180 deg rotation - cart. axis [1,0,0] i 5 inversion -i -5 inversion E s_v -s_v 6 -6 inv. 180 deg rotation - cart. axis [0,0,1] s_v'-s_v' 7 -7 inv. 180 deg rotation - cart. axis [0,1,0] s_v''-s_v' 8 -8 inv. 180 deg rotation - cart. axis [1,0,0] Cartesian axes number of k points= 380 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026316 k( 2) = ( 0.0000000 0.0113636 -0.0000000), wk = 0.0026316 k( 3) = ( 0.0000000 0.0227273 -0.0000000), wk = 0.0026316 k( 4) = ( 0.0000000 0.0340909 -0.0000000), wk = 0.0026316 k( 5) = ( 0.0000000 0.0454546 -0.0000000), wk = 0.0026316 k( 6) = ( 0.0000000 0.0568182 -0.0000000), wk = 0.0026316 k( 7) = ( 0.0000000 0.0681818 -0.0000000), wk = 0.0026316 k( 8) = ( 0.0000000 0.0795455 -0.0000000), wk = 0.0026316 k( 9) = ( 0.0000000 0.0909091 -0.0000000), wk = 0.0026316 k( 10) = ( 0.0000000 0.1022727 -0.0000000), wk = 0.0026316 k( 11) = ( 0.0000000 0.1136364 -0.0000000), wk = 0.0026316 k( 12) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0026316 k( 13) = ( 0.0000000 0.1363636 -0.0000000), wk = 0.0026316 k( 14) = ( 0.0000000 0.1477273 -0.0000000), wk = 0.0026316 k( 15) = ( 0.0000000 0.1590909 -0.0000000), wk = 0.0026316 k( 16) = ( 0.0000000 0.1704546 -0.0000000), wk = 0.0026316 k( 17) = ( 0.0000000 0.1818182 -0.0000000), wk = 0.0026316 k( 18) = ( 0.0000000 0.1931818 -0.0000000), wk = 0.0026316 k( 19) = ( 0.0000000 0.2045454 -0.0000000), wk = 0.0026316 k( 20) = ( 0.0000000 0.2159091 -0.0000000), wk = 0.0026316 k( 21) = ( 0.0000000 0.2272727 -0.0000000), wk = 0.0026316 k( 22) = ( 0.0000000 0.2386364 -0.0000000), wk = 0.0026316 k( 23) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0026316 k( 24) = ( 0.0000000 0.2613636 -0.0000000), wk = 0.0026316 k( 25) = ( 0.0000000 0.2727273 -0.0000000), wk = 0.0026316 k( 26) = ( 0.0000000 0.2840909 -0.0000000), wk = 0.0026316 k( 27) = ( 0.0000000 0.2954545 -0.0000000), wk = 0.0026316 k( 28) = ( 0.0000000 0.3068182 -0.0000000), wk = 0.0026316 k( 29) = ( 0.0000000 0.3181818 -0.0000000), wk = 0.0026316 k( 30) = ( 0.0000000 0.3295455 -0.0000000), wk = 0.0026316 k( 31) = ( 0.0000000 0.3409091 -0.0000000), wk = 0.0026316 k( 32) = ( 0.0000000 0.3522727 -0.0000000), wk = 0.0026316 k( 33) = ( 0.0000000 0.3636364 -0.0000000), wk = 0.0026316 k( 34) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0026316 k( 35) = ( 0.0000000 0.3863636 -0.0000000), wk = 0.0026316 k( 36) = ( 0.0000000 0.3977273 -0.0000000), wk = 0.0026316 k( 37) = ( 0.0000000 0.4090909 -0.0000000), wk = 0.0026316 k( 38) = ( 0.0000000 0.4204545 -0.0000000), wk = 0.0026316 k( 39) = ( 0.0000000 0.4318182 -0.0000000), wk = 0.0026316 k( 40) = ( 0.0000000 0.4431818 -0.0000000), wk = 0.0026316 k( 41) = ( 0.0000000 0.4545455 -0.0000000), wk = 0.0026316 k( 42) = ( 0.0000000 0.4659091 -0.0000000), wk = 0.0026316 k( 43) = ( 0.0000000 0.4772727 -0.0000000), wk = 0.0026316 k( 44) = ( 0.0000000 0.4886364 -0.0000000), wk = 0.0026316 k( 45) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026316 k( 46) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026316 k( 47) = ( 0.0113636 0.5000000 -0.0000000), wk = 0.0026316 k( 48) = ( 0.0227273 0.5000000 -0.0000000), wk = 0.0026316 k( 49) = ( 0.0340909 0.5000000 -0.0000000), wk = 0.0026316 k( 50) = ( 0.0454546 0.5000000 -0.0000000), wk = 0.0026316 k( 51) = ( 0.0568182 0.5000000 -0.0000000), wk = 0.0026316 k( 52) = ( 0.0681818 0.5000000 -0.0000000), wk = 0.0026316 k( 53) = ( 0.0795455 0.5000000 -0.0000000), wk = 0.0026316 k( 54) = ( 0.0909091 0.5000000 -0.0000000), wk = 0.0026316 k( 55) = ( 0.1022727 0.5000000 -0.0000000), wk = 0.0026316 k( 56) = ( 0.1136364 0.5000000 -0.0000000), wk = 0.0026316 k( 57) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0026316 k( 58) = ( 0.1363636 0.5000000 -0.0000000), wk = 0.0026316 k( 59) = ( 0.1477273 0.5000000 -0.0000000), wk = 0.0026316 k( 60) = ( 0.1590909 0.5000000 -0.0000000), wk = 0.0026316 k( 61) = ( 0.1704546 0.5000000 -0.0000000), wk = 0.0026316 k( 62) = ( 0.1818182 0.5000000 -0.0000000), wk = 0.0026316 k( 63) = ( 0.1931818 0.5000000 -0.0000000), wk = 0.0026316 k( 64) = ( 0.2045454 0.5000000 -0.0000000), wk = 0.0026316 k( 65) = ( 0.2159091 0.5000000 -0.0000000), wk = 0.0026316 k( 66) = ( 0.2272727 0.5000000 -0.0000000), wk = 0.0026316 k( 67) = ( 0.2386364 0.5000000 -0.0000000), wk = 0.0026316 k( 68) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0026316 k( 69) = ( 0.2613636 0.5000000 -0.0000000), wk = 0.0026316 k( 70) = ( 0.2727273 0.5000000 -0.0000000), wk = 0.0026316 k( 71) = ( 0.2840909 0.5000000 -0.0000000), wk = 0.0026316 k( 72) = ( 0.2954545 0.5000000 -0.0000000), wk = 0.0026316 k( 73) = ( 0.3068182 0.5000000 -0.0000000), wk = 0.0026316 k( 74) = ( 0.3181818 0.5000000 -0.0000000), wk = 0.0026316 k( 75) = ( 0.3295455 0.5000000 -0.0000000), wk = 0.0026316 k( 76) = ( 0.3409091 0.5000000 -0.0000000), wk = 0.0026316 k( 77) = ( 0.3522727 0.5000000 -0.0000000), wk = 0.0026316 k( 78) = ( 0.3636364 0.5000000 -0.0000000), wk = 0.0026316 k( 79) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0026316 k( 80) = ( 0.3863636 0.5000000 -0.0000000), wk = 0.0026316 k( 81) = ( 0.3977273 0.5000000 -0.0000000), wk = 0.0026316 k( 82) = ( 0.4090909 0.5000000 -0.0000000), wk = 0.0026316 k( 83) = ( 0.4204545 0.5000000 -0.0000000), wk = 0.0026316 k( 84) = ( 0.4318182 0.5000000 -0.0000000), wk = 0.0026316 k( 85) = ( 0.4431818 0.5000000 -0.0000000), wk = 0.0026316 k( 86) = ( 0.4545455 0.5000000 -0.0000000), wk = 0.0026316 k( 87) = ( 0.4659091 0.5000000 -0.0000000), wk = 0.0026316 k( 88) = ( 0.4772727 0.5000000 -0.0000000), wk = 0.0026316 k( 89) = ( 0.4886364 0.5000000 -0.0000000), wk = 0.0026316 k( 90) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026316 k( 91) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026316 k( 92) = ( 0.4920635 0.4920635 -0.0000000), wk = 0.0026316 k( 93) = ( 0.4841270 0.4841270 -0.0000000), wk = 0.0026316 k( 94) = ( 0.4761905 0.4761905 -0.0000000), wk = 0.0026316 k( 95) = ( 0.4682540 0.4682540 -0.0000000), wk = 0.0026316 k( 96) = ( 0.4603175 0.4603175 -0.0000000), wk = 0.0026316 k( 97) = ( 0.4523810 0.4523809 -0.0000000), wk = 0.0026316 k( 98) = ( 0.4444444 0.4444444 -0.0000000), wk = 0.0026316 k( 99) = ( 0.4365079 0.4365079 -0.0000000), wk = 0.0026316 k( 100) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0026316 k( 101) = ( 0.4206349 0.4206349 -0.0000000), wk = 0.0026316 k( 102) = ( 0.4126984 0.4126984 -0.0000000), wk = 0.0026316 k( 103) = ( 0.4047619 0.4047619 -0.0000000), wk = 0.0026316 k( 104) = ( 0.3968254 0.3968254 -0.0000000), wk = 0.0026316 k( 105) = ( 0.3888889 0.3888889 -0.0000000), wk = 0.0026316 k( 106) = ( 0.3809524 0.3809524 -0.0000000), wk = 0.0026316 k( 107) = ( 0.3730159 0.3730159 -0.0000000), wk = 0.0026316 k( 108) = ( 0.3650794 0.3650794 -0.0000000), wk = 0.0026316 k( 109) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0026316 k( 110) = ( 0.3492063 0.3492063 -0.0000000), wk = 0.0026316 k( 111) = ( 0.3412698 0.3412698 -0.0000000), wk = 0.0026316 k( 112) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0026316 k( 113) = ( 0.3253968 0.3253968 -0.0000000), wk = 0.0026316 k( 114) = ( 0.3174603 0.3174603 -0.0000000), wk = 0.0026316 k( 115) = ( 0.3095238 0.3095238 -0.0000000), wk = 0.0026316 k( 116) = ( 0.3015873 0.3015873 -0.0000000), wk = 0.0026316 k( 117) = ( 0.2936508 0.2936508 -0.0000000), wk = 0.0026316 k( 118) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0026316 k( 119) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0026316 k( 120) = ( 0.2698413 0.2698413 -0.0000000), wk = 0.0026316 k( 121) = ( 0.2619048 0.2619048 -0.0000000), wk = 0.0026316 k( 122) = ( 0.2539683 0.2539683 -0.0000000), wk = 0.0026316 k( 123) = ( 0.2460317 0.2460317 -0.0000000), wk = 0.0026316 k( 124) = ( 0.2380952 0.2380952 -0.0000000), wk = 0.0026316 k( 125) = ( 0.2301587 0.2301587 -0.0000000), wk = 0.0026316 k( 126) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0026316 k( 127) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0026316 k( 128) = ( 0.2063492 0.2063492 -0.0000000), wk = 0.0026316 k( 129) = ( 0.1984127 0.1984127 -0.0000000), wk = 0.0026316 k( 130) = ( 0.1904762 0.1904762 -0.0000000), wk = 0.0026316 k( 131) = ( 0.1825397 0.1825397 -0.0000000), wk = 0.0026316 k( 132) = ( 0.1746032 0.1746032 -0.0000000), wk = 0.0026316 k( 133) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0026316 k( 134) = ( 0.1587302 0.1587302 -0.0000000), wk = 0.0026316 k( 135) = ( 0.1507937 0.1507936 -0.0000000), wk = 0.0026316 k( 136) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0026316 k( 137) = ( 0.1349206 0.1349206 -0.0000000), wk = 0.0026316 k( 138) = ( 0.1269841 0.1269841 -0.0000000), wk = 0.0026316 k( 139) = ( 0.1190476 0.1190476 -0.0000000), wk = 0.0026316 k( 140) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0026316 k( 141) = ( 0.1031746 0.1031746 -0.0000000), wk = 0.0026316 k( 142) = ( 0.0952381 0.0952381 -0.0000000), wk = 0.0026316 k( 143) = ( 0.0873016 0.0873016 -0.0000000), wk = 0.0026316 k( 144) = ( 0.0793651 0.0793651 -0.0000000), wk = 0.0026316 k( 145) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0026316 k( 146) = ( 0.0634921 0.0634921 -0.0000000), wk = 0.0026316 k( 147) = ( 0.0555556 0.0555556 -0.0000000), wk = 0.0026316 k( 148) = ( 0.0476191 0.0476190 -0.0000000), wk = 0.0026316 k( 149) = ( 0.0396825 0.0396825 -0.0000000), wk = 0.0026316 k( 150) = ( 0.0317460 0.0317460 -0.0000000), wk = 0.0026316 k( 151) = ( 0.0238095 0.0238095 -0.0000000), wk = 0.0026316 k( 152) = ( 0.0158730 0.0158730 -0.0000000), wk = 0.0026316 k( 153) = ( 0.0079365 0.0079365 -0.0000000), wk = 0.0026316 k( 154) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026316 k( 155) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026316 k( 156) = ( 0.0000000 0.0000000 0.0111056), wk = 0.0026316 k( 157) = ( 0.0000000 0.0000000 0.0222112), wk = 0.0026316 k( 158) = ( 0.0000000 0.0000000 0.0333167), wk = 0.0026316 k( 159) = ( 0.0000000 0.0000000 0.0444223), wk = 0.0026316 k( 160) = ( 0.0000000 0.0000000 0.0555279), wk = 0.0026316 k( 161) = ( 0.0000000 0.0000000 0.0666335), wk = 0.0026316 k( 162) = ( 0.0000000 0.0000000 0.0777390), wk = 0.0026316 k( 163) = ( 0.0000000 0.0000000 0.0888446), wk = 0.0026316 k( 164) = ( 0.0000000 0.0000000 0.0999502), wk = 0.0026316 k( 165) = ( 0.0000000 0.0000000 0.1110558), wk = 0.0026316 k( 166) = ( 0.0000000 0.0000000 0.1221613), wk = 0.0026316 k( 167) = ( 0.0000000 0.0000000 0.1332669), wk = 0.0026316 k( 168) = ( 0.0000000 0.0000000 0.1443725), wk = 0.0026316 k( 169) = ( 0.0000000 0.0000000 0.1554781), wk = 0.0026316 k( 170) = ( 0.0000000 0.0000000 0.1665837), wk = 0.0026316 k( 171) = ( 0.0000000 0.0000000 0.1776892), wk = 0.0026316 k( 172) = ( 0.0000000 0.0000000 0.1887948), wk = 0.0026316 k( 173) = ( 0.0000000 0.0000000 0.1999004), wk = 0.0026316 k( 174) = ( 0.0000000 0.0000000 0.2110060), wk = 0.0026316 k( 175) = ( 0.0000000 0.0000000 0.2221115), wk = 0.0026316 k( 176) = ( 0.0000000 0.0000000 0.2332171), wk = 0.0026316 k( 177) = ( 0.0000000 0.0000000 0.2443227), wk = 0.0026316 k( 178) = ( 0.0000000 0.0000000 0.2554283), wk = 0.0026316 k( 179) = ( 0.0000000 0.0000000 0.2554283), wk = 0.0026316 k( 180) = ( 0.0000000 0.0113636 0.2554283), wk = 0.0026316 k( 181) = ( 0.0000000 0.0227273 0.2554283), wk = 0.0026316 k( 182) = ( 0.0000000 0.0340909 0.2554283), wk = 0.0026316 k( 183) = ( 0.0000000 0.0454546 0.2554283), wk = 0.0026316 k( 184) = ( 0.0000000 0.0568182 0.2554283), wk = 0.0026316 k( 185) = ( 0.0000000 0.0681818 0.2554283), wk = 0.0026316 k( 186) = ( 0.0000000 0.0795455 0.2554283), wk = 0.0026316 k( 187) = ( 0.0000000 0.0909091 0.2554283), wk = 0.0026316 k( 188) = ( 0.0000000 0.1022727 0.2554283), wk = 0.0026316 k( 189) = ( 0.0000000 0.1136364 0.2554283), wk = 0.0026316 k( 190) = ( 0.0000000 0.1250000 0.2554283), wk = 0.0026316 k( 191) = ( 0.0000000 0.1363636 0.2554283), wk = 0.0026316 k( 192) = ( 0.0000000 0.1477273 0.2554283), wk = 0.0026316 k( 193) = ( 0.0000000 0.1590909 0.2554283), wk = 0.0026316 k( 194) = ( 0.0000000 0.1704546 0.2554283), wk = 0.0026316 k( 195) = ( 0.0000000 0.1818182 0.2554283), wk = 0.0026316 k( 196) = ( 0.0000000 0.1931818 0.2554283), wk = 0.0026316 k( 197) = ( 0.0000000 0.2045454 0.2554283), wk = 0.0026316 k( 198) = ( 0.0000000 0.2159091 0.2554283), wk = 0.0026316 k( 199) = ( 0.0000000 0.2272727 0.2554283), wk = 0.0026316 k( 200) = ( 0.0000000 0.2386364 0.2554283), wk = 0.0026316 k( 201) = ( 0.0000000 0.2500000 0.2554283), wk = 0.0026316 k( 202) = ( 0.0000000 0.2613636 0.2554283), wk = 0.0026316 k( 203) = ( 0.0000000 0.2727273 0.2554283), wk = 0.0026316 k( 204) = ( 0.0000000 0.2840909 0.2554283), wk = 0.0026316 k( 205) = ( 0.0000000 0.2954545 0.2554283), wk = 0.0026316 k( 206) = ( 0.0000000 0.3068182 0.2554283), wk = 0.0026316 k( 207) = ( 0.0000000 0.3181818 0.2554283), wk = 0.0026316 k( 208) = ( 0.0000000 0.3295455 0.2554283), wk = 0.0026316 k( 209) = ( 0.0000000 0.3409091 0.2554283), wk = 0.0026316 k( 210) = ( 0.0000000 0.3522727 0.2554283), wk = 0.0026316 k( 211) = ( 0.0000000 0.3636364 0.2554283), wk = 0.0026316 k( 212) = ( 0.0000000 0.3750000 0.2554283), wk = 0.0026316 k( 213) = ( 0.0000000 0.3863636 0.2554283), wk = 0.0026316 k( 214) = ( 0.0000000 0.3977273 0.2554283), wk = 0.0026316 k( 215) = ( 0.0000000 0.4090909 0.2554283), wk = 0.0026316 k( 216) = ( 0.0000000 0.4204545 0.2554283), wk = 0.0026316 k( 217) = ( 0.0000000 0.4318182 0.2554283), wk = 0.0026316 k( 218) = ( 0.0000000 0.4431818 0.2554283), wk = 0.0026316 k( 219) = ( 0.0000000 0.4545455 0.2554283), wk = 0.0026316 k( 220) = ( 0.0000000 0.4659091 0.2554283), wk = 0.0026316 k( 221) = ( 0.0000000 0.4772727 0.2554283), wk = 0.0026316 k( 222) = ( 0.0000000 0.4886364 0.2554283), wk = 0.0026316 k( 223) = ( 0.0000000 0.5000000 0.2554283), wk = 0.0026316 k( 224) = ( 0.0000000 0.5000000 0.2554283), wk = 0.0026316 k( 225) = ( 0.0113636 0.5000000 0.2554283), wk = 0.0026316 k( 226) = ( 0.0227273 0.5000000 0.2554283), wk = 0.0026316 k( 227) = ( 0.0340909 0.5000000 0.2554283), wk = 0.0026316 k( 228) = ( 0.0454546 0.5000000 0.2554283), wk = 0.0026316 k( 229) = ( 0.0568182 0.5000000 0.2554283), wk = 0.0026316 k( 230) = ( 0.0681818 0.5000000 0.2554283), wk = 0.0026316 k( 231) = ( 0.0795455 0.5000000 0.2554283), wk = 0.0026316 k( 232) = ( 0.0909091 0.5000000 0.2554283), wk = 0.0026316 k( 233) = ( 0.1022727 0.5000000 0.2554283), wk = 0.0026316 k( 234) = ( 0.1136364 0.5000000 0.2554283), wk = 0.0026316 k( 235) = ( 0.1250000 0.5000000 0.2554283), wk = 0.0026316 k( 236) = ( 0.1363636 0.5000000 0.2554283), wk = 0.0026316 k( 237) = ( 0.1477273 0.5000000 0.2554283), wk = 0.0026316 k( 238) = ( 0.1590909 0.5000000 0.2554283), wk = 0.0026316 k( 239) = ( 0.1704546 0.5000000 0.2554283), wk = 0.0026316 k( 240) = ( 0.1818182 0.5000000 0.2554283), wk = 0.0026316 k( 241) = ( 0.1931818 0.5000000 0.2554283), wk = 0.0026316 k( 242) = ( 0.2045454 0.5000000 0.2554283), wk = 0.0026316 k( 243) = ( 0.2159091 0.5000000 0.2554283), wk = 0.0026316 k( 244) = ( 0.2272727 0.5000000 0.2554283), wk = 0.0026316 k( 245) = ( 0.2386364 0.5000000 0.2554283), wk = 0.0026316 k( 246) = ( 0.2500000 0.5000000 0.2554283), wk = 0.0026316 k( 247) = ( 0.2613636 0.5000000 0.2554283), wk = 0.0026316 k( 248) = ( 0.2727273 0.5000000 0.2554283), wk = 0.0026316 k( 249) = ( 0.2840909 0.5000000 0.2554283), wk = 0.0026316 k( 250) = ( 0.2954545 0.5000000 0.2554283), wk = 0.0026316 k( 251) = ( 0.3068182 0.5000000 0.2554283), wk = 0.0026316 k( 252) = ( 0.3181818 0.5000000 0.2554283), wk = 0.0026316 k( 253) = ( 0.3295455 0.5000000 0.2554283), wk = 0.0026316 k( 254) = ( 0.3409091 0.5000000 0.2554283), wk = 0.0026316 k( 255) = ( 0.3522727 0.5000000 0.2554283), wk = 0.0026316 k( 256) = ( 0.3636364 0.5000000 0.2554283), wk = 0.0026316 k( 257) = ( 0.3750000 0.5000000 0.2554283), wk = 0.0026316 k( 258) = ( 0.3863636 0.5000000 0.2554283), wk = 0.0026316 k( 259) = ( 0.3977273 0.5000000 0.2554283), wk = 0.0026316 k( 260) = ( 0.4090909 0.5000000 0.2554283), wk = 0.0026316 k( 261) = ( 0.4204545 0.5000000 0.2554283), wk = 0.0026316 k( 262) = ( 0.4318182 0.5000000 0.2554283), wk = 0.0026316 k( 263) = ( 0.4431818 0.5000000 0.2554283), wk = 0.0026316 k( 264) = ( 0.4545455 0.5000000 0.2554283), wk = 0.0026316 k( 265) = ( 0.4659091 0.5000000 0.2554283), wk = 0.0026316 k( 266) = ( 0.4772727 0.5000000 0.2554283), wk = 0.0026316 k( 267) = ( 0.4886364 0.5000000 0.2554283), wk = 0.0026316 k( 268) = ( 0.5000000 0.5000000 0.2554283), wk = 0.0026316 k( 269) = ( 0.5000000 0.5000000 0.2554283), wk = 0.0026316 k( 270) = ( 0.4920635 0.4920635 0.2554283), wk = 0.0026316 k( 271) = ( 0.4841270 0.4841270 0.2554283), wk = 0.0026316 k( 272) = ( 0.4761905 0.4761905 0.2554283), wk = 0.0026316 k( 273) = ( 0.4682540 0.4682540 0.2554283), wk = 0.0026316 k( 274) = ( 0.4603175 0.4603175 0.2554283), wk = 0.0026316 k( 275) = ( 0.4523810 0.4523809 0.2554283), wk = 0.0026316 k( 276) = ( 0.4444444 0.4444444 0.2554283), wk = 0.0026316 k( 277) = ( 0.4365079 0.4365079 0.2554283), wk = 0.0026316 k( 278) = ( 0.4285714 0.4285714 0.2554283), wk = 0.0026316 k( 279) = ( 0.4206349 0.4206349 0.2554283), wk = 0.0026316 k( 280) = ( 0.4126984 0.4126984 0.2554283), wk = 0.0026316 k( 281) = ( 0.4047619 0.4047619 0.2554283), wk = 0.0026316 k( 282) = ( 0.3968254 0.3968254 0.2554283), wk = 0.0026316 k( 283) = ( 0.3888889 0.3888889 0.2554283), wk = 0.0026316 k( 284) = ( 0.3809524 0.3809524 0.2554283), wk = 0.0026316 k( 285) = ( 0.3730159 0.3730159 0.2554283), wk = 0.0026316 k( 286) = ( 0.3650794 0.3650794 0.2554283), wk = 0.0026316 k( 287) = ( 0.3571429 0.3571429 0.2554283), wk = 0.0026316 k( 288) = ( 0.3492063 0.3492063 0.2554283), wk = 0.0026316 k( 289) = ( 0.3412698 0.3412698 0.2554283), wk = 0.0026316 k( 290) = ( 0.3333333 0.3333333 0.2554283), wk = 0.0026316 k( 291) = ( 0.3253968 0.3253968 0.2554283), wk = 0.0026316 k( 292) = ( 0.3174603 0.3174603 0.2554283), wk = 0.0026316 k( 293) = ( 0.3095238 0.3095238 0.2554283), wk = 0.0026316 k( 294) = ( 0.3015873 0.3015873 0.2554283), wk = 0.0026316 k( 295) = ( 0.2936508 0.2936508 0.2554283), wk = 0.0026316 k( 296) = ( 0.2857143 0.2857143 0.2554283), wk = 0.0026316 k( 297) = ( 0.2777778 0.2777778 0.2554283), wk = 0.0026316 k( 298) = ( 0.2698413 0.2698413 0.2554283), wk = 0.0026316 k( 299) = ( 0.2619048 0.2619048 0.2554283), wk = 0.0026316 k( 300) = ( 0.2539683 0.2539683 0.2554283), wk = 0.0026316 k( 301) = ( 0.2460317 0.2460317 0.2554283), wk = 0.0026316 k( 302) = ( 0.2380952 0.2380952 0.2554283), wk = 0.0026316 k( 303) = ( 0.2301587 0.2301587 0.2554283), wk = 0.0026316 k( 304) = ( 0.2222222 0.2222222 0.2554283), wk = 0.0026316 k( 305) = ( 0.2142857 0.2142857 0.2554283), wk = 0.0026316 k( 306) = ( 0.2063492 0.2063492 0.2554283), wk = 0.0026316 k( 307) = ( 0.1984127 0.1984127 0.2554283), wk = 0.0026316 k( 308) = ( 0.1904762 0.1904762 0.2554283), wk = 0.0026316 k( 309) = ( 0.1825397 0.1825397 0.2554283), wk = 0.0026316 k( 310) = ( 0.1746032 0.1746032 0.2554283), wk = 0.0026316 k( 311) = ( 0.1666667 0.1666667 0.2554283), wk = 0.0026316 k( 312) = ( 0.1587302 0.1587302 0.2554283), wk = 0.0026316 k( 313) = ( 0.1507937 0.1507936 0.2554283), wk = 0.0026316 k( 314) = ( 0.1428571 0.1428571 0.2554283), wk = 0.0026316 k( 315) = ( 0.1349206 0.1349206 0.2554283), wk = 0.0026316 k( 316) = ( 0.1269841 0.1269841 0.2554283), wk = 0.0026316 k( 317) = ( 0.1190476 0.1190476 0.2554283), wk = 0.0026316 k( 318) = ( 0.1111111 0.1111111 0.2554283), wk = 0.0026316 k( 319) = ( 0.1031746 0.1031746 0.2554283), wk = 0.0026316 k( 320) = ( 0.0952381 0.0952381 0.2554283), wk = 0.0026316 k( 321) = ( 0.0873016 0.0873016 0.2554283), wk = 0.0026316 k( 322) = ( 0.0793651 0.0793651 0.2554283), wk = 0.0026316 k( 323) = ( 0.0714286 0.0714286 0.2554283), wk = 0.0026316 k( 324) = ( 0.0634921 0.0634921 0.2554283), wk = 0.0026316 k( 325) = ( 0.0555556 0.0555556 0.2554283), wk = 0.0026316 k( 326) = ( 0.0476191 0.0476190 0.2554283), wk = 0.0026316 k( 327) = ( 0.0396825 0.0396825 0.2554283), wk = 0.0026316 k( 328) = ( 0.0317460 0.0317460 0.2554283), wk = 0.0026316 k( 329) = ( 0.0238095 0.0238095 0.2554283), wk = 0.0026316 k( 330) = ( 0.0158730 0.0158730 0.2554283), wk = 0.0026316 k( 331) = ( 0.0079365 0.0079365 0.2554283), wk = 0.0026316 k( 332) = ( 0.0000000 0.0000000 0.2554283), wk = 0.0026316 k( 333) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026316 k( 334) = ( 0.0000000 0.5000000 0.0111056), wk = 0.0026316 k( 335) = ( 0.0000000 0.5000000 0.0222112), wk = 0.0026316 k( 336) = ( 0.0000000 0.5000000 0.0333167), wk = 0.0026316 k( 337) = ( 0.0000000 0.5000000 0.0444223), wk = 0.0026316 k( 338) = ( 0.0000000 0.5000000 0.0555279), wk = 0.0026316 k( 339) = ( 0.0000000 0.5000000 0.0666335), wk = 0.0026316 k( 340) = ( 0.0000000 0.5000000 0.0777390), wk = 0.0026316 k( 341) = ( 0.0000000 0.5000000 0.0888446), wk = 0.0026316 k( 342) = ( 0.0000000 0.5000000 0.0999502), wk = 0.0026316 k( 343) = ( 0.0000000 0.5000000 0.1110558), wk = 0.0026316 k( 344) = ( 0.0000000 0.5000000 0.1221613), wk = 0.0026316 k( 345) = ( 0.0000000 0.5000000 0.1332669), wk = 0.0026316 k( 346) = ( 0.0000000 0.5000000 0.1443725), wk = 0.0026316 k( 347) = ( 0.0000000 0.5000000 0.1554781), wk = 0.0026316 k( 348) = ( 0.0000000 0.5000000 0.1665837), wk = 0.0026316 k( 349) = ( 0.0000000 0.5000000 0.1776892), wk = 0.0026316 k( 350) = ( 0.0000000 0.5000000 0.1887948), wk = 0.0026316 k( 351) = ( 0.0000000 0.5000000 0.1999004), wk = 0.0026316 k( 352) = ( 0.0000000 0.5000000 0.2110060), wk = 0.0026316 k( 353) = ( 0.0000000 0.5000000 0.2221115), wk = 0.0026316 k( 354) = ( 0.0000000 0.5000000 0.2332171), wk = 0.0026316 k( 355) = ( 0.0000000 0.5000000 0.2443227), wk = 0.0026316 k( 356) = ( 0.0000000 0.5000000 0.2554283), wk = 0.0026316 k( 357) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026316 k( 358) = ( 0.5000000 0.5000000 0.0111056), wk = 0.0026316 k( 359) = ( 0.5000000 0.5000000 0.0222112), wk = 0.0026316 k( 360) = ( 0.5000000 0.5000000 0.0333167), wk = 0.0026316 k( 361) = ( 0.5000000 0.5000000 0.0444223), wk = 0.0026316 k( 362) = ( 0.5000000 0.5000000 0.0555279), wk = 0.0026316 k( 363) = ( 0.5000000 0.5000000 0.0666335), wk = 0.0026316 k( 364) = ( 0.5000000 0.5000000 0.0777390), wk = 0.0026316 k( 365) = ( 0.5000000 0.5000000 0.0888446), wk = 0.0026316 k( 366) = ( 0.5000000 0.5000000 0.0999502), wk = 0.0026316 k( 367) = ( 0.5000000 0.5000000 0.1110558), wk = 0.0026316 k( 368) = ( 0.5000000 0.5000000 0.1221613), wk = 0.0026316 k( 369) = ( 0.5000000 0.5000000 0.1332669), wk = 0.0026316 k( 370) = ( 0.5000000 0.5000000 0.1443725), wk = 0.0026316 k( 371) = ( 0.5000000 0.5000000 0.1554781), wk = 0.0026316 k( 372) = ( 0.5000000 0.5000000 0.1665837), wk = 0.0026316 k( 373) = ( 0.5000000 0.5000000 0.1776892), wk = 0.0026316 k( 374) = ( 0.5000000 0.5000000 0.1887948), wk = 0.0026316 k( 375) = ( 0.5000000 0.5000000 0.1999004), wk = 0.0026316 k( 376) = ( 0.5000000 0.5000000 0.2110060), wk = 0.0026316 k( 377) = ( 0.5000000 0.5000000 0.2221115), wk = 0.0026316 k( 378) = ( 0.5000000 0.5000000 0.2332171), wk = 0.0026316 k( 379) = ( 0.5000000 0.5000000 0.2443227), wk = 0.0026316 k( 380) = ( 0.5000000 0.5000000 0.2554283), wk = 0.0026316 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026316 k( 2) = ( 0.0000000 0.0113636 0.0000000), wk = 0.0026316 k( 3) = ( 0.0000000 0.0227273 -0.0000000), wk = 0.0026316 k( 4) = ( 0.0000000 0.0340909 0.0000000), wk = 0.0026316 k( 5) = ( 0.0000000 0.0454546 -0.0000000), wk = 0.0026316 k( 6) = ( 0.0000000 0.0568182 -0.0000000), wk = 0.0026316 k( 7) = ( 0.0000000 0.0681818 0.0000000), wk = 0.0026316 k( 8) = ( 0.0000000 0.0795455 0.0000000), wk = 0.0026316 k( 9) = ( 0.0000000 0.0909091 -0.0000000), wk = 0.0026316 k( 10) = ( 0.0000000 0.1022727 -0.0000000), wk = 0.0026316 k( 11) = ( 0.0000000 0.1136364 -0.0000000), wk = 0.0026316 k( 12) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0026316 k( 13) = ( 0.0000000 0.1363636 0.0000000), wk = 0.0026316 k( 14) = ( 0.0000000 0.1477273 -0.0000000), wk = 0.0026316 k( 15) = ( 0.0000000 0.1590909 -0.0000000), wk = 0.0026316 k( 16) = ( 0.0000000 0.1704546 -0.0000000), wk = 0.0026316 k( 17) = ( 0.0000000 0.1818182 -0.0000000), wk = 0.0026316 k( 18) = ( 0.0000000 0.1931818 -0.0000000), wk = 0.0026316 k( 19) = ( 0.0000000 0.2045454 -0.0000000), wk = 0.0026316 k( 20) = ( 0.0000000 0.2159091 -0.0000000), wk = 0.0026316 k( 21) = ( 0.0000000 0.2272727 -0.0000000), wk = 0.0026316 k( 22) = ( 0.0000000 0.2386364 -0.0000000), wk = 0.0026316 k( 23) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0026316 k( 24) = ( 0.0000000 0.2613636 -0.0000000), wk = 0.0026316 k( 25) = ( 0.0000000 0.2727273 -0.0000000), wk = 0.0026316 k( 26) = ( 0.0000000 0.2840909 0.0000000), wk = 0.0026316 k( 27) = ( 0.0000000 0.2954545 -0.0000000), wk = 0.0026316 k( 28) = ( 0.0000000 0.3068182 0.0000000), wk = 0.0026316 k( 29) = ( 0.0000000 0.3181818 -0.0000000), wk = 0.0026316 k( 30) = ( 0.0000000 0.3295455 0.0000000), wk = 0.0026316 k( 31) = ( 0.0000000 0.3409091 -0.0000000), wk = 0.0026316 k( 32) = ( 0.0000000 0.3522727 0.0000000), wk = 0.0026316 k( 33) = ( 0.0000000 0.3636364 -0.0000000), wk = 0.0026316 k( 34) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0026316 k( 35) = ( 0.0000000 0.3863636 -0.0000000), wk = 0.0026316 k( 36) = ( 0.0000000 0.3977273 -0.0000000), wk = 0.0026316 k( 37) = ( 0.0000000 0.4090909 -0.0000000), wk = 0.0026316 k( 38) = ( 0.0000000 0.4204545 -0.0000000), wk = 0.0026316 k( 39) = ( 0.0000000 0.4318182 -0.0000000), wk = 0.0026316 k( 40) = ( 0.0000000 0.4431818 -0.0000000), wk = 0.0026316 k( 41) = ( 0.0000000 0.4545455 -0.0000000), wk = 0.0026316 k( 42) = ( 0.0000000 0.4659091 -0.0000000), wk = 0.0026316 k( 43) = ( 0.0000000 0.4772727 -0.0000000), wk = 0.0026316 k( 44) = ( 0.0000000 0.4886364 -0.0000000), wk = 0.0026316 k( 45) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026316 k( 46) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026316 k( 47) = ( 0.0113636 0.5000000 -0.0000000), wk = 0.0026316 k( 48) = ( 0.0227273 0.5000000 -0.0000000), wk = 0.0026316 k( 49) = ( 0.0340909 0.5000000 -0.0000000), wk = 0.0026316 k( 50) = ( 0.0454546 0.5000000 -0.0000000), wk = 0.0026316 k( 51) = ( 0.0568182 0.5000000 -0.0000000), wk = 0.0026316 k( 52) = ( 0.0681818 0.5000000 -0.0000000), wk = 0.0026316 k( 53) = ( 0.0795455 0.5000000 0.0000000), wk = 0.0026316 k( 54) = ( 0.0909091 0.5000000 0.0000000), wk = 0.0026316 k( 55) = ( 0.1022727 0.5000000 -0.0000000), wk = 0.0026316 k( 56) = ( 0.1136364 0.5000000 0.0000000), wk = 0.0026316 k( 57) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0026316 k( 58) = ( 0.1363636 0.5000000 -0.0000000), wk = 0.0026316 k( 59) = ( 0.1477273 0.5000000 -0.0000000), wk = 0.0026316 k( 60) = ( 0.1590909 0.5000000 0.0000000), wk = 0.0026316 k( 61) = ( 0.1704546 0.5000000 0.0000000), wk = 0.0026316 k( 62) = ( 0.1818182 0.5000000 0.0000000), wk = 0.0026316 k( 63) = ( 0.1931818 0.5000000 0.0000000), wk = 0.0026316 k( 64) = ( 0.2045454 0.5000000 0.0000000), wk = 0.0026316 k( 65) = ( 0.2159091 0.5000000 -0.0000000), wk = 0.0026316 k( 66) = ( 0.2272727 0.5000000 0.0000000), wk = 0.0026316 k( 67) = ( 0.2386364 0.5000000 -0.0000000), wk = 0.0026316 k( 68) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0026316 k( 69) = ( 0.2613636 0.5000000 -0.0000000), wk = 0.0026316 k( 70) = ( 0.2727273 0.5000000 -0.0000000), wk = 0.0026316 k( 71) = ( 0.2840909 0.5000000 -0.0000000), wk = 0.0026316 k( 72) = ( 0.2954545 0.5000000 -0.0000000), wk = 0.0026316 k( 73) = ( 0.3068182 0.5000000 -0.0000000), wk = 0.0026316 k( 74) = ( 0.3181818 0.5000000 -0.0000000), wk = 0.0026316 k( 75) = ( 0.3295455 0.5000000 -0.0000000), wk = 0.0026316 k( 76) = ( 0.3409091 0.5000000 -0.0000000), wk = 0.0026316 k( 77) = ( 0.3522727 0.5000000 -0.0000000), wk = 0.0026316 k( 78) = ( 0.3636364 0.5000000 -0.0000000), wk = 0.0026316 k( 79) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0026316 k( 80) = ( 0.3863636 0.5000000 -0.0000000), wk = 0.0026316 k( 81) = ( 0.3977273 0.5000000 -0.0000000), wk = 0.0026316 k( 82) = ( 0.4090909 0.5000000 -0.0000000), wk = 0.0026316 k( 83) = ( 0.4204545 0.5000000 -0.0000000), wk = 0.0026316 k( 84) = ( 0.4318182 0.5000000 -0.0000000), wk = 0.0026316 k( 85) = ( 0.4431818 0.5000000 -0.0000000), wk = 0.0026316 k( 86) = ( 0.4545455 0.5000000 -0.0000000), wk = 0.0026316 k( 87) = ( 0.4659091 0.5000000 -0.0000000), wk = 0.0026316 k( 88) = ( 0.4772727 0.5000000 -0.0000000), wk = 0.0026316 k( 89) = ( 0.4886364 0.5000000 0.0000000), wk = 0.0026316 k( 90) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026316 k( 91) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026316 k( 92) = ( 0.4920635 0.4920635 0.0000000), wk = 0.0026316 k( 93) = ( 0.4841270 0.4841270 -0.0000000), wk = 0.0026316 k( 94) = ( 0.4761905 0.4761905 -0.0000000), wk = 0.0026316 k( 95) = ( 0.4682540 0.4682540 -0.0000000), wk = 0.0026316 k( 96) = ( 0.4603175 0.4603175 -0.0000000), wk = 0.0026316 k( 97) = ( 0.4523810 0.4523810 0.0000000), wk = 0.0026316 k( 98) = ( 0.4444444 0.4444444 -0.0000000), wk = 0.0026316 k( 99) = ( 0.4365079 0.4365079 -0.0000000), wk = 0.0026316 k( 100) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0026316 k( 101) = ( 0.4206349 0.4206349 -0.0000000), wk = 0.0026316 k( 102) = ( 0.4126984 0.4126984 -0.0000000), wk = 0.0026316 k( 103) = ( 0.4047619 0.4047619 -0.0000000), wk = 0.0026316 k( 104) = ( 0.3968254 0.3968254 -0.0000000), wk = 0.0026316 k( 105) = ( 0.3888889 0.3888889 -0.0000000), wk = 0.0026316 k( 106) = ( 0.3809524 0.3809524 -0.0000000), wk = 0.0026316 k( 107) = ( 0.3730159 0.3730159 -0.0000000), wk = 0.0026316 k( 108) = ( 0.3650794 0.3650794 -0.0000000), wk = 0.0026316 k( 109) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0026316 k( 110) = ( 0.3492063 0.3492063 -0.0000000), wk = 0.0026316 k( 111) = ( 0.3412698 0.3412698 -0.0000000), wk = 0.0026316 k( 112) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0026316 k( 113) = ( 0.3253968 0.3253968 -0.0000000), wk = 0.0026316 k( 114) = ( 0.3174603 0.3174603 -0.0000000), wk = 0.0026316 k( 115) = ( 0.3095238 0.3095238 -0.0000000), wk = 0.0026316 k( 116) = ( 0.3015873 0.3015873 -0.0000000), wk = 0.0026316 k( 117) = ( 0.2936508 0.2936508 -0.0000000), wk = 0.0026316 k( 118) = ( 0.2857143 0.2857143 0.0000000), wk = 0.0026316 k( 119) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0026316 k( 120) = ( 0.2698413 0.2698413 0.0000000), wk = 0.0026316 k( 121) = ( 0.2619048 0.2619048 0.0000000), wk = 0.0026316 k( 122) = ( 0.2539683 0.2539683 0.0000000), wk = 0.0026316 k( 123) = ( 0.2460317 0.2460317 -0.0000000), wk = 0.0026316 k( 124) = ( 0.2380952 0.2380952 -0.0000000), wk = 0.0026316 k( 125) = ( 0.2301587 0.2301587 -0.0000000), wk = 0.0026316 k( 126) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0026316 k( 127) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0026316 k( 128) = ( 0.2063492 0.2063492 -0.0000000), wk = 0.0026316 k( 129) = ( 0.1984127 0.1984127 -0.0000000), wk = 0.0026316 k( 130) = ( 0.1904762 0.1904762 -0.0000000), wk = 0.0026316 k( 131) = ( 0.1825397 0.1825397 0.0000000), wk = 0.0026316 k( 132) = ( 0.1746032 0.1746032 -0.0000000), wk = 0.0026316 k( 133) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0026316 k( 134) = ( 0.1587302 0.1587302 -0.0000000), wk = 0.0026316 k( 135) = ( 0.1507937 0.1507937 -0.0000000), wk = 0.0026316 k( 136) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0026316 k( 137) = ( 0.1349206 0.1349206 0.0000000), wk = 0.0026316 k( 138) = ( 0.1269841 0.1269841 0.0000000), wk = 0.0026316 k( 139) = ( 0.1190476 0.1190476 -0.0000000), wk = 0.0026316 k( 140) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0026316 k( 141) = ( 0.1031746 0.1031746 -0.0000000), wk = 0.0026316 k( 142) = ( 0.0952381 0.0952381 -0.0000000), wk = 0.0026316 k( 143) = ( 0.0873016 0.0873016 -0.0000000), wk = 0.0026316 k( 144) = ( 0.0793651 0.0793651 -0.0000000), wk = 0.0026316 k( 145) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0026316 k( 146) = ( 0.0634921 0.0634921 0.0000000), wk = 0.0026316 k( 147) = ( 0.0555556 0.0555556 -0.0000000), wk = 0.0026316 k( 148) = ( 0.0476191 0.0476191 -0.0000000), wk = 0.0026316 k( 149) = ( 0.0396825 0.0396825 -0.0000000), wk = 0.0026316 k( 150) = ( 0.0317460 0.0317460 0.0000000), wk = 0.0026316 k( 151) = ( 0.0238095 0.0238095 -0.0000000), wk = 0.0026316 k( 152) = ( 0.0158730 0.0158730 0.0000000), wk = 0.0026316 k( 153) = ( 0.0079365 0.0079365 0.0000000), wk = 0.0026316 k( 154) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026316 k( 155) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026316 k( 156) = ( 0.0000000 0.0000000 0.0217391), wk = 0.0026316 k( 157) = ( 0.0000000 0.0000000 0.0434783), wk = 0.0026316 k( 158) = ( 0.0000000 0.0000000 0.0652174), wk = 0.0026316 k( 159) = ( 0.0000000 0.0000000 0.0869565), wk = 0.0026316 k( 160) = ( 0.0000000 0.0000000 0.1086957), wk = 0.0026316 k( 161) = ( 0.0000000 0.0000000 0.1304348), wk = 0.0026316 k( 162) = ( 0.0000000 0.0000000 0.1521739), wk = 0.0026316 k( 163) = ( 0.0000000 0.0000000 0.1739130), wk = 0.0026316 k( 164) = ( 0.0000000 0.0000000 0.1956522), wk = 0.0026316 k( 165) = ( 0.0000000 0.0000000 0.2173913), wk = 0.0026316 k( 166) = ( 0.0000000 0.0000000 0.2391304), wk = 0.0026316 k( 167) = ( 0.0000000 0.0000000 0.2608696), wk = 0.0026316 k( 168) = ( 0.0000000 0.0000000 0.2826087), wk = 0.0026316 k( 169) = ( 0.0000000 0.0000000 0.3043478), wk = 0.0026316 k( 170) = ( 0.0000000 0.0000000 0.3260870), wk = 0.0026316 k( 171) = ( 0.0000000 0.0000000 0.3478261), wk = 0.0026316 k( 172) = ( 0.0000000 0.0000000 0.3695652), wk = 0.0026316 k( 173) = ( 0.0000000 0.0000000 0.3913044), wk = 0.0026316 k( 174) = ( 0.0000000 0.0000000 0.4130435), wk = 0.0026316 k( 175) = ( 0.0000000 0.0000000 0.4347826), wk = 0.0026316 k( 176) = ( 0.0000000 0.0000000 0.4565217), wk = 0.0026316 k( 177) = ( 0.0000000 0.0000000 0.4782609), wk = 0.0026316 k( 178) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026316 k( 179) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026316 k( 180) = ( 0.0000000 0.0113636 0.5000000), wk = 0.0026316 k( 181) = ( 0.0000000 0.0227273 0.5000000), wk = 0.0026316 k( 182) = ( 0.0000000 0.0340909 0.5000000), wk = 0.0026316 k( 183) = ( 0.0000000 0.0454546 0.5000000), wk = 0.0026316 k( 184) = ( 0.0000000 0.0568182 0.5000000), wk = 0.0026316 k( 185) = ( 0.0000000 0.0681818 0.5000000), wk = 0.0026316 k( 186) = ( 0.0000000 0.0795455 0.5000000), wk = 0.0026316 k( 187) = ( 0.0000000 0.0909091 0.5000000), wk = 0.0026316 k( 188) = ( 0.0000000 0.1022727 0.5000000), wk = 0.0026316 k( 189) = ( 0.0000000 0.1136364 0.5000000), wk = 0.0026316 k( 190) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0026316 k( 191) = ( 0.0000000 0.1363636 0.5000000), wk = 0.0026316 k( 192) = ( 0.0000000 0.1477273 0.5000000), wk = 0.0026316 k( 193) = ( 0.0000000 0.1590909 0.5000000), wk = 0.0026316 k( 194) = ( 0.0000000 0.1704546 0.5000000), wk = 0.0026316 k( 195) = ( 0.0000000 0.1818182 0.5000000), wk = 0.0026316 k( 196) = ( 0.0000000 0.1931818 0.5000000), wk = 0.0026316 k( 197) = ( 0.0000000 0.2045454 0.5000000), wk = 0.0026316 k( 198) = ( 0.0000000 0.2159091 0.5000000), wk = 0.0026316 k( 199) = ( 0.0000000 0.2272727 0.5000000), wk = 0.0026316 k( 200) = ( 0.0000000 0.2386364 0.5000000), wk = 0.0026316 k( 201) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0026316 k( 202) = ( 0.0000000 0.2613636 0.5000000), wk = 0.0026316 k( 203) = ( 0.0000000 0.2727273 0.5000000), wk = 0.0026316 k( 204) = ( 0.0000000 0.2840909 0.5000000), wk = 0.0026316 k( 205) = ( 0.0000000 0.2954545 0.5000000), wk = 0.0026316 k( 206) = ( 0.0000000 0.3068182 0.5000000), wk = 0.0026316 k( 207) = ( 0.0000000 0.3181818 0.5000000), wk = 0.0026316 k( 208) = ( 0.0000000 0.3295455 0.5000000), wk = 0.0026316 k( 209) = ( 0.0000000 0.3409091 0.5000000), wk = 0.0026316 k( 210) = ( 0.0000000 0.3522727 0.5000000), wk = 0.0026316 k( 211) = ( 0.0000000 0.3636364 0.5000000), wk = 0.0026316 k( 212) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0026316 k( 213) = ( 0.0000000 0.3863636 0.5000000), wk = 0.0026316 k( 214) = ( 0.0000000 0.3977273 0.5000000), wk = 0.0026316 k( 215) = ( 0.0000000 0.4090909 0.5000000), wk = 0.0026316 k( 216) = ( 0.0000000 0.4204545 0.5000000), wk = 0.0026316 k( 217) = ( 0.0000000 0.4318182 0.5000000), wk = 0.0026316 k( 218) = ( 0.0000000 0.4431818 0.5000000), wk = 0.0026316 k( 219) = ( 0.0000000 0.4545455 0.5000000), wk = 0.0026316 k( 220) = ( 0.0000000 0.4659091 0.5000000), wk = 0.0026316 k( 221) = ( 0.0000000 0.4772727 0.5000000), wk = 0.0026316 k( 222) = ( 0.0000000 0.4886364 0.5000000), wk = 0.0026316 k( 223) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026316 k( 224) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026316 k( 225) = ( 0.0113636 0.5000000 0.5000000), wk = 0.0026316 k( 226) = ( 0.0227273 0.5000000 0.5000000), wk = 0.0026316 k( 227) = ( 0.0340909 0.5000000 0.5000000), wk = 0.0026316 k( 228) = ( 0.0454546 0.5000000 0.5000000), wk = 0.0026316 k( 229) = ( 0.0568182 0.5000000 0.5000000), wk = 0.0026316 k( 230) = ( 0.0681818 0.5000000 0.5000000), wk = 0.0026316 k( 231) = ( 0.0795455 0.5000000 0.5000000), wk = 0.0026316 k( 232) = ( 0.0909091 0.5000000 0.5000000), wk = 0.0026316 k( 233) = ( 0.1022727 0.5000000 0.5000000), wk = 0.0026316 k( 234) = ( 0.1136364 0.5000000 0.5000000), wk = 0.0026316 k( 235) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0026316 k( 236) = ( 0.1363636 0.5000000 0.5000000), wk = 0.0026316 k( 237) = ( 0.1477273 0.5000000 0.5000000), wk = 0.0026316 k( 238) = ( 0.1590909 0.5000000 0.5000000), wk = 0.0026316 k( 239) = ( 0.1704546 0.5000000 0.5000000), wk = 0.0026316 k( 240) = ( 0.1818182 0.5000000 0.5000000), wk = 0.0026316 k( 241) = ( 0.1931818 0.5000000 0.5000000), wk = 0.0026316 k( 242) = ( 0.2045454 0.5000000 0.5000000), wk = 0.0026316 k( 243) = ( 0.2159091 0.5000000 0.5000000), wk = 0.0026316 k( 244) = ( 0.2272727 0.5000000 0.5000000), wk = 0.0026316 k( 245) = ( 0.2386364 0.5000000 0.5000000), wk = 0.0026316 k( 246) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0026316 k( 247) = ( 0.2613636 0.5000000 0.5000000), wk = 0.0026316 k( 248) = ( 0.2727273 0.5000000 0.5000000), wk = 0.0026316 k( 249) = ( 0.2840909 0.5000000 0.5000000), wk = 0.0026316 k( 250) = ( 0.2954545 0.5000000 0.5000000), wk = 0.0026316 k( 251) = ( 0.3068182 0.5000000 0.5000000), wk = 0.0026316 k( 252) = ( 0.3181818 0.5000000 0.5000000), wk = 0.0026316 k( 253) = ( 0.3295455 0.5000000 0.5000000), wk = 0.0026316 k( 254) = ( 0.3409091 0.5000000 0.5000000), wk = 0.0026316 k( 255) = ( 0.3522727 0.5000000 0.5000000), wk = 0.0026316 k( 256) = ( 0.3636364 0.5000000 0.5000000), wk = 0.0026316 k( 257) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0026316 k( 258) = ( 0.3863636 0.5000000 0.5000000), wk = 0.0026316 k( 259) = ( 0.3977273 0.5000000 0.5000000), wk = 0.0026316 k( 260) = ( 0.4090909 0.5000000 0.5000000), wk = 0.0026316 k( 261) = ( 0.4204545 0.5000000 0.5000000), wk = 0.0026316 k( 262) = ( 0.4318182 0.5000000 0.5000000), wk = 0.0026316 k( 263) = ( 0.4431818 0.5000000 0.5000000), wk = 0.0026316 k( 264) = ( 0.4545455 0.5000000 0.5000000), wk = 0.0026316 k( 265) = ( 0.4659091 0.5000000 0.5000000), wk = 0.0026316 k( 266) = ( 0.4772727 0.5000000 0.5000000), wk = 0.0026316 k( 267) = ( 0.4886364 0.5000000 0.5000000), wk = 0.0026316 k( 268) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026316 k( 269) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026316 k( 270) = ( 0.4920635 0.4920635 0.5000000), wk = 0.0026316 k( 271) = ( 0.4841270 0.4841270 0.5000000), wk = 0.0026316 k( 272) = ( 0.4761905 0.4761905 0.5000000), wk = 0.0026316 k( 273) = ( 0.4682540 0.4682540 0.5000000), wk = 0.0026316 k( 274) = ( 0.4603175 0.4603175 0.5000000), wk = 0.0026316 k( 275) = ( 0.4523810 0.4523810 0.5000000), wk = 0.0026316 k( 276) = ( 0.4444444 0.4444444 0.5000000), wk = 0.0026316 k( 277) = ( 0.4365079 0.4365079 0.5000000), wk = 0.0026316 k( 278) = ( 0.4285714 0.4285714 0.5000000), wk = 0.0026316 k( 279) = ( 0.4206349 0.4206349 0.5000000), wk = 0.0026316 k( 280) = ( 0.4126984 0.4126984 0.5000000), wk = 0.0026316 k( 281) = ( 0.4047619 0.4047619 0.5000000), wk = 0.0026316 k( 282) = ( 0.3968254 0.3968254 0.5000000), wk = 0.0026316 k( 283) = ( 0.3888889 0.3888889 0.5000000), wk = 0.0026316 k( 284) = ( 0.3809524 0.3809524 0.5000000), wk = 0.0026316 k( 285) = ( 0.3730159 0.3730159 0.5000000), wk = 0.0026316 k( 286) = ( 0.3650794 0.3650794 0.5000000), wk = 0.0026316 k( 287) = ( 0.3571429 0.3571429 0.5000000), wk = 0.0026316 k( 288) = ( 0.3492063 0.3492063 0.5000000), wk = 0.0026316 k( 289) = ( 0.3412698 0.3412698 0.5000000), wk = 0.0026316 k( 290) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0026316 k( 291) = ( 0.3253968 0.3253968 0.5000000), wk = 0.0026316 k( 292) = ( 0.3174603 0.3174603 0.5000000), wk = 0.0026316 k( 293) = ( 0.3095238 0.3095238 0.5000000), wk = 0.0026316 k( 294) = ( 0.3015873 0.3015873 0.5000000), wk = 0.0026316 k( 295) = ( 0.2936508 0.2936508 0.5000000), wk = 0.0026316 k( 296) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0026316 k( 297) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0026316 k( 298) = ( 0.2698413 0.2698413 0.5000000), wk = 0.0026316 k( 299) = ( 0.2619048 0.2619048 0.5000000), wk = 0.0026316 k( 300) = ( 0.2539683 0.2539683 0.5000000), wk = 0.0026316 k( 301) = ( 0.2460317 0.2460317 0.5000000), wk = 0.0026316 k( 302) = ( 0.2380952 0.2380952 0.5000000), wk = 0.0026316 k( 303) = ( 0.2301587 0.2301587 0.5000000), wk = 0.0026316 k( 304) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0026316 k( 305) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0026316 k( 306) = ( 0.2063492 0.2063492 0.5000000), wk = 0.0026316 k( 307) = ( 0.1984127 0.1984127 0.5000000), wk = 0.0026316 k( 308) = ( 0.1904762 0.1904762 0.5000000), wk = 0.0026316 k( 309) = ( 0.1825397 0.1825397 0.5000000), wk = 0.0026316 k( 310) = ( 0.1746032 0.1746032 0.5000000), wk = 0.0026316 k( 311) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0026316 k( 312) = ( 0.1587302 0.1587302 0.5000000), wk = 0.0026316 k( 313) = ( 0.1507937 0.1507937 0.5000000), wk = 0.0026316 k( 314) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0026316 k( 315) = ( 0.1349206 0.1349206 0.5000000), wk = 0.0026316 k( 316) = ( 0.1269841 0.1269841 0.5000000), wk = 0.0026316 k( 317) = ( 0.1190476 0.1190476 0.5000000), wk = 0.0026316 k( 318) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0026316 k( 319) = ( 0.1031746 0.1031746 0.5000000), wk = 0.0026316 k( 320) = ( 0.0952381 0.0952381 0.5000000), wk = 0.0026316 k( 321) = ( 0.0873016 0.0873016 0.5000000), wk = 0.0026316 k( 322) = ( 0.0793651 0.0793651 0.5000000), wk = 0.0026316 k( 323) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0026316 k( 324) = ( 0.0634921 0.0634921 0.5000000), wk = 0.0026316 k( 325) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0026316 k( 326) = ( 0.0476191 0.0476191 0.5000000), wk = 0.0026316 k( 327) = ( 0.0396825 0.0396825 0.5000000), wk = 0.0026316 k( 328) = ( 0.0317460 0.0317460 0.5000000), wk = 0.0026316 k( 329) = ( 0.0238095 0.0238095 0.5000000), wk = 0.0026316 k( 330) = ( 0.0158730 0.0158730 0.5000000), wk = 0.0026316 k( 331) = ( 0.0079365 0.0079365 0.5000000), wk = 0.0026316 k( 332) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026316 k( 333) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026316 k( 334) = ( 0.0000000 0.5000000 0.0217391), wk = 0.0026316 k( 335) = ( 0.0000000 0.5000000 0.0434783), wk = 0.0026316 k( 336) = ( 0.0000000 0.5000000 0.0652174), wk = 0.0026316 k( 337) = ( 0.0000000 0.5000000 0.0869565), wk = 0.0026316 k( 338) = ( 0.0000000 0.5000000 0.1086957), wk = 0.0026316 k( 339) = ( 0.0000000 0.5000000 0.1304348), wk = 0.0026316 k( 340) = ( 0.0000000 0.5000000 0.1521739), wk = 0.0026316 k( 341) = ( 0.0000000 0.5000000 0.1739130), wk = 0.0026316 k( 342) = ( 0.0000000 0.5000000 0.1956522), wk = 0.0026316 k( 343) = ( 0.0000000 0.5000000 0.2173913), wk = 0.0026316 k( 344) = ( 0.0000000 0.5000000 0.2391304), wk = 0.0026316 k( 345) = ( 0.0000000 0.5000000 0.2608696), wk = 0.0026316 k( 346) = ( 0.0000000 0.5000000 0.2826087), wk = 0.0026316 k( 347) = ( 0.0000000 0.5000000 0.3043478), wk = 0.0026316 k( 348) = ( 0.0000000 0.5000000 0.3260870), wk = 0.0026316 k( 349) = ( 0.0000000 0.5000000 0.3478261), wk = 0.0026316 k( 350) = ( 0.0000000 0.5000000 0.3695652), wk = 0.0026316 k( 351) = ( 0.0000000 0.5000000 0.3913044), wk = 0.0026316 k( 352) = ( 0.0000000 0.5000000 0.4130435), wk = 0.0026316 k( 353) = ( 0.0000000 0.5000000 0.4347826), wk = 0.0026316 k( 354) = ( 0.0000000 0.5000000 0.4565217), wk = 0.0026316 k( 355) = ( 0.0000000 0.5000000 0.4782609), wk = 0.0026316 k( 356) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026316 k( 357) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026316 k( 358) = ( 0.5000000 0.5000000 0.0217391), wk = 0.0026316 k( 359) = ( 0.5000000 0.5000000 0.0434783), wk = 0.0026316 k( 360) = ( 0.5000000 0.5000000 0.0652174), wk = 0.0026316 k( 361) = ( 0.5000000 0.5000000 0.0869565), wk = 0.0026316 k( 362) = ( 0.5000000 0.5000000 0.1086957), wk = 0.0026316 k( 363) = ( 0.5000000 0.5000000 0.1304348), wk = 0.0026316 k( 364) = ( 0.5000000 0.5000000 0.1521739), wk = 0.0026316 k( 365) = ( 0.5000000 0.5000000 0.1739130), wk = 0.0026316 k( 366) = ( 0.5000000 0.5000000 0.1956522), wk = 0.0026316 k( 367) = ( 0.5000000 0.5000000 0.2173913), wk = 0.0026316 k( 368) = ( 0.5000000 0.5000000 0.2391304), wk = 0.0026316 k( 369) = ( 0.5000000 0.5000000 0.2608696), wk = 0.0026316 k( 370) = ( 0.5000000 0.5000000 0.2826087), wk = 0.0026316 k( 371) = ( 0.5000000 0.5000000 0.3043478), wk = 0.0026316 k( 372) = ( 0.5000000 0.5000000 0.3260870), wk = 0.0026316 k( 373) = ( 0.5000000 0.5000000 0.3478261), wk = 0.0026316 k( 374) = ( 0.5000000 0.5000000 0.3695652), wk = 0.0026316 k( 375) = ( 0.5000000 0.5000000 0.3913044), wk = 0.0026316 k( 376) = ( 0.5000000 0.5000000 0.4130435), wk = 0.0026316 k( 377) = ( 0.5000000 0.5000000 0.4347826), wk = 0.0026316 k( 378) = ( 0.5000000 0.5000000 0.4565217), wk = 0.0026316 k( 379) = ( 0.5000000 0.5000000 0.4782609), wk = 0.0026316 k( 380) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026316 Dense grid: 58971 G-vectors FFT dimensions: ( 40, 40, 75) Smooth grid: 25641 G-vectors FFT dimensions: ( 30, 30, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.18 Mb ( 202, 60) NL pseudopotentials 0.25 Mb ( 101, 164) Each V/rho on FFT grid 0.07 Mb ( 4800) Each G-vector array 0.01 Mb ( 1636) G-vector shells 0.01 Mb ( 834) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.74 Mb ( 202, 240) Each subspace H/S matrix 0.05 Mb ( 60, 60) Each matrix 0.30 Mb ( 164, 2, 60) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./CaNiN.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.0 secs Computing kpt #: 2 total cpu time spent up to now is 4.5 secs Computing kpt #: 3 total cpu time spent up to now is 5.1 secs Computing kpt #: 4 total cpu time spent up to now is 5.6 secs Computing kpt #: 5 total cpu time spent up to now is 6.2 secs Computing kpt #: 6 total cpu time spent up to now is 6.7 secs Computing kpt #: 7 total cpu time spent up to now is 7.3 secs Computing kpt #: 8 total cpu time spent up to now is 7.8 secs Computing kpt #: 9 total cpu time spent up to now is 8.3 secs Computing kpt #: 10 total cpu time spent up to now is 8.9 secs Computing kpt #: 11 total cpu time spent up to now is 9.4 secs Computing kpt #: 12 total cpu time spent up to now is 10.0 secs Computing kpt #: 13 total cpu time spent up to now is 10.5 secs Computing kpt #: 14 total cpu time spent up to now is 11.1 secs Computing kpt #: 15 total cpu time spent up to now is 11.6 secs Computing kpt #: 16 total cpu time spent up to now is 12.2 secs Computing kpt #: 17 total cpu time spent up to now is 12.8 secs Computing kpt #: 18 total cpu time spent up to now is 13.4 secs Computing kpt #: 19 total cpu time spent up to now is 13.9 secs Computing kpt #: 20 total cpu time spent up to now is 14.5 secs Computing kpt #: 21 total cpu time spent up to now is 15.0 secs Computing kpt #: 22 total cpu time spent up to now is 15.6 secs Computing kpt #: 23 total cpu time spent up to now is 16.2 secs Computing kpt #: 24 total cpu time spent up to now is 16.8 secs Computing kpt #: 25 total cpu time spent up to now is 17.4 secs Computing kpt #: 26 total cpu time spent up to now is 18.2 secs Computing kpt #: 27 total cpu time spent up to now is 19.1 secs Computing kpt #: 28 total cpu time spent up to now is 19.7 secs Computing kpt #: 29 total cpu time spent up to now is 20.7 secs Computing kpt #: 30 total cpu time spent up to now is 21.3 secs Computing kpt #: 31 total cpu time spent up to now is 22.2 secs Computing kpt #: 32 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 23.8 secs Computing kpt #: 33 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 25.4 secs Computing kpt #: 34 total cpu time spent up to now is 26.6 secs Computing kpt #: 35 total cpu time spent up to now is 27.5 secs Computing kpt #: 36 total cpu time spent up to now is 28.3 secs Computing kpt #: 37 total cpu time spent up to now is 29.1 secs Computing kpt #: 38 total cpu time spent up to now is 30.7 secs Computing kpt #: 39 total cpu time spent up to now is 31.6 secs Computing kpt #: 40 total cpu time spent up to now is 32.4 secs Computing kpt #: 41 total cpu time spent up to now is 33.3 secs Computing kpt #: 42 total cpu time spent up to now is 34.4 secs Computing kpt #: 43 total cpu time spent up to now is 35.6 secs Computing kpt #: 44 total cpu time spent up to now is 36.7 secs Computing kpt #: 45 total cpu time spent up to now is 38.0 secs Computing kpt #: 46 total cpu time spent up to now is 39.2 secs Computing kpt #: 47 total cpu time spent up to now is 40.3 secs Computing kpt #: 48 total cpu time spent up to now is 41.1 secs Computing kpt #: 49 total cpu time spent up to now is 42.4 secs Computing kpt #: 50 total cpu time spent up to now is 43.5 secs Computing kpt #: 51 total cpu time spent up to now is 44.7 secs Computing kpt #: 52 total cpu time spent up to now is 46.2 secs Computing kpt #: 53 total cpu time spent up to now is 47.5 secs Computing kpt #: 54 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 49.1 secs Computing kpt #: 55 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 50.7 secs Computing kpt #: 56 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 52.3 secs Computing kpt #: 57 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 53.9 secs Computing kpt #: 58 total cpu time spent up to now is 55.0 secs Computing kpt #: 59 total cpu time spent up to now is 56.1 secs Computing kpt #: 60 total cpu time spent up to now is 57.1 secs Computing kpt #: 61 total cpu time spent up to now is 58.2 secs Computing kpt #: 62 total cpu time spent up to now is 59.3 secs Computing kpt #: 63 total cpu time spent up to now is 60.4 secs Computing kpt #: 64 total cpu time spent up to now is 61.4 secs Computing kpt #: 65 total cpu time spent up to now is 62.7 secs Computing kpt #: 66 total cpu time spent up to now is 64.0 secs Computing kpt #: 67 total cpu time spent up to now is 65.3 secs Computing kpt #: 68 total cpu time spent up to now is 66.7 secs Computing kpt #: 69 total cpu time spent up to now is 68.0 secs Computing kpt #: 70 total cpu time spent up to now is 69.2 secs Computing kpt #: 71 total cpu time spent up to now is 70.4 secs Computing kpt #: 72 total cpu time spent up to now is 71.8 secs Computing kpt #: 73 total cpu time spent up to now is 73.1 secs Computing kpt #: 74 total cpu time spent up to now is 74.6 secs Computing kpt #: 75 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 76.1 secs Computing kpt #: 76 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 77.7 secs Computing kpt #: 77 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 79.3 secs Computing kpt #: 78 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 80.8 secs Computing kpt #: 79 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 82.4 secs Computing kpt #: 80 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 83.9 secs Computing kpt #: 81 total cpu time spent up to now is 84.8 secs Computing kpt #: 82 total cpu time spent up to now is 85.9 secs Computing kpt #: 83 total cpu time spent up to now is 87.4 secs Computing kpt #: 84 total cpu time spent up to now is 88.3 secs Computing kpt #: 85 total cpu time spent up to now is 89.3 secs Computing kpt #: 86 total cpu time spent up to now is 90.2 secs Computing kpt #: 87 total cpu time spent up to now is 91.0 secs Computing kpt #: 88 total cpu time spent up to now is 91.8 secs Computing kpt #: 89 total cpu time spent up to now is 92.7 secs Computing kpt #: 90 total cpu time spent up to now is 93.6 secs Computing kpt #: 91 total cpu time spent up to now is 94.4 secs Computing kpt #: 92 total cpu time spent up to now is 95.3 secs Computing kpt #: 93 total cpu time spent up to now is 96.1 secs Computing kpt #: 94 total cpu time spent up to now is 96.9 secs Computing kpt #: 95 total cpu time spent up to now is 97.9 secs Computing kpt #: 96 total cpu time spent up to now is 98.9 secs Computing kpt #: 97 total cpu time spent up to now is 99.9 secs Computing kpt #: 98 total cpu time spent up to now is 101.2 secs Computing kpt #: 99 total cpu time spent up to now is 102.6 secs Computing kpt #: 100 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 104.1 secs Computing kpt #: 101 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 105.6 secs Computing kpt #: 102 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 107.2 secs Computing kpt #: 103 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 108.7 secs Computing kpt #: 104 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 110.3 secs Computing kpt #: 105 total cpu time spent up to now is 111.7 secs Computing kpt #: 106 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 113.3 secs Computing kpt #: 107 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 114.9 secs Computing kpt #: 108 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 116.4 secs Computing kpt #: 109 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 118.0 secs Computing kpt #: 110 total cpu time spent up to now is 119.6 secs Computing kpt #: 111 total cpu time spent up to now is 120.9 secs Computing kpt #: 112 total cpu time spent up to now is 121.7 secs Computing kpt #: 113 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 123.3 secs Computing kpt #: 114 total cpu time spent up to now is 124.2 secs Computing kpt #: 115 total cpu time spent up to now is 125.3 secs Computing kpt #: 116 total cpu time spent up to now is 126.0 secs Computing kpt #: 117 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 127.6 secs Computing kpt #: 118 total cpu time spent up to now is 128.2 secs Computing kpt #: 119 total cpu time spent up to now is 129.0 secs Computing kpt #: 120 total cpu time spent up to now is 129.6 secs Computing kpt #: 121 total cpu time spent up to now is 130.4 secs Computing kpt #: 122 total cpu time spent up to now is 131.2 secs Computing kpt #: 123 total cpu time spent up to now is 131.9 secs Computing kpt #: 124 total cpu time spent up to now is 132.6 secs Computing kpt #: 125 total cpu time spent up to now is 133.3 secs Computing kpt #: 126 total cpu time spent up to now is 134.0 secs Computing kpt #: 127 total cpu time spent up to now is 134.7 secs Computing kpt #: 128 total cpu time spent up to now is 135.4 secs Computing kpt #: 129 total cpu time spent up to now is 136.1 secs Computing kpt #: 130 total cpu time spent up to now is 136.8 secs Computing kpt #: 131 total cpu time spent up to now is 137.6 secs Computing kpt #: 132 total cpu time spent up to now is 138.3 secs Computing kpt #: 133 total cpu time spent up to now is 139.0 secs Computing kpt #: 134 total cpu time spent up to now is 139.5 secs Computing kpt #: 135 total cpu time spent up to now is 140.2 secs Computing kpt #: 136 total cpu time spent up to now is 140.7 secs Computing kpt #: 137 total cpu time spent up to now is 141.3 secs Computing kpt #: 138 total cpu time spent up to now is 141.9 secs Computing kpt #: 139 total cpu time spent up to now is 142.4 secs Computing kpt #: 140 total cpu time spent up to now is 143.0 secs Computing kpt #: 141 total cpu time spent up to now is 143.6 secs Computing kpt #: 142 total cpu time spent up to now is 144.1 secs Computing kpt #: 143 total cpu time spent up to now is 144.7 secs Computing kpt #: 144 total cpu time spent up to now is 145.3 secs Computing kpt #: 145 total cpu time spent up to now is 145.8 secs Computing kpt #: 146 total cpu time spent up to now is 146.4 secs Computing kpt #: 147 total cpu time spent up to now is 146.9 secs Computing kpt #: 148 total cpu time spent up to now is 147.4 secs Computing kpt #: 149 total cpu time spent up to now is 148.0 secs Computing kpt #: 150 total cpu time spent up to now is 148.5 secs Computing kpt #: 151 total cpu time spent up to now is 149.1 secs Computing kpt #: 152 total cpu time spent up to now is 149.6 secs Computing kpt #: 153 total cpu time spent up to now is 150.2 secs Computing kpt #: 154 total cpu time spent up to now is 150.7 secs Computing kpt #: 155 total cpu time spent up to now is 151.3 secs Computing kpt #: 156 total cpu time spent up to now is 151.8 secs Computing kpt #: 157 total cpu time spent up to now is 152.4 secs Computing kpt #: 158 total cpu time spent up to now is 153.0 secs Computing kpt #: 159 total cpu time spent up to now is 153.5 secs Computing kpt #: 160 total cpu time spent up to now is 154.1 secs Computing kpt #: 161 total cpu time spent up to now is 154.6 secs Computing kpt #: 162 total cpu time spent up to now is 155.2 secs Computing kpt #: 163 total cpu time spent up to now is 155.7 secs Computing kpt #: 164 total cpu time spent up to now is 156.3 secs Computing kpt #: 165 total cpu time spent up to now is 156.8 secs Computing kpt #: 166 total cpu time spent up to now is 157.4 secs Computing kpt #: 167 total cpu time spent up to now is 157.9 secs Computing kpt #: 168 total cpu time spent up to now is 158.5 secs Computing kpt #: 169 total cpu time spent up to now is 159.0 secs Computing kpt #: 170 total cpu time spent up to now is 159.5 secs Computing kpt #: 171 total cpu time spent up to now is 160.0 secs Computing kpt #: 172 total cpu time spent up to now is 160.6 secs Computing kpt #: 173 total cpu time spent up to now is 161.1 secs Computing kpt #: 174 total cpu time spent up to now is 161.6 secs Computing kpt #: 175 total cpu time spent up to now is 162.2 secs Computing kpt #: 176 total cpu time spent up to now is 162.7 secs Computing kpt #: 177 total cpu time spent up to now is 163.2 secs Computing kpt #: 178 total cpu time spent up to now is 163.7 secs Computing kpt #: 179 total cpu time spent up to now is 164.3 secs Computing kpt #: 180 total cpu time spent up to now is 164.8 secs Computing kpt #: 181 total cpu time spent up to now is 165.4 secs Computing kpt #: 182 total cpu time spent up to now is 165.9 secs Computing kpt #: 183 total cpu time spent up to now is 166.4 secs Computing kpt #: 184 total cpu time spent up to now is 166.9 secs Computing kpt #: 185 total cpu time spent up to now is 167.5 secs Computing kpt #: 186 total cpu time spent up to now is 168.0 secs Computing kpt #: 187 total cpu time spent up to now is 168.5 secs Computing kpt #: 188 total cpu time spent up to now is 169.0 secs Computing kpt #: 189 total cpu time spent up to now is 169.5 secs Computing kpt #: 190 total cpu time spent up to now is 170.0 secs Computing kpt #: 191 total cpu time spent up to now is 170.6 secs Computing kpt #: 192 total cpu time spent up to now is 171.1 secs Computing kpt #: 193 total cpu time spent up to now is 171.6 secs Computing kpt #: 194 total cpu time spent up to now is 172.2 secs Computing kpt #: 195 total cpu time spent up to now is 172.7 secs Computing kpt #: 196 total cpu time spent up to now is 173.3 secs Computing kpt #: 197 total cpu time spent up to now is 173.8 secs Computing kpt #: 198 total cpu time spent up to now is 174.4 secs Computing kpt #: 199 total cpu time spent up to now is 174.9 secs Computing kpt #: 200 total cpu time spent up to now is 175.6 secs Computing kpt #: 201 total cpu time spent up to now is 176.2 secs Computing kpt #: 202 total cpu time spent up to now is 176.8 secs Computing kpt #: 203 total cpu time spent up to now is 177.3 secs Computing kpt #: 204 total cpu time spent up to now is 177.9 secs Computing kpt #: 205 total cpu time spent up to now is 178.5 secs Computing kpt #: 206 total cpu time spent up to now is 179.1 secs Computing kpt #: 207 total cpu time spent up to now is 179.7 secs Computing kpt #: 208 total cpu time spent up to now is 180.4 secs Computing kpt #: 209 total cpu time spent up to now is 181.4 secs Computing kpt #: 210 total cpu time spent up to now is 182.2 secs Computing kpt #: 211 total cpu time spent up to now is 183.0 secs Computing kpt #: 212 total cpu time spent up to now is 183.7 secs Computing kpt #: 213 total cpu time spent up to now is 184.4 secs Computing kpt #: 214 total cpu time spent up to now is 185.3 secs Computing kpt #: 215 total cpu time spent up to now is 186.2 secs Computing kpt #: 216 total cpu time spent up to now is 187.0 secs Computing kpt #: 217 total cpu time spent up to now is 187.8 secs Computing kpt #: 218 total cpu time spent up to now is 188.6 secs Computing kpt #: 219 total cpu time spent up to now is 189.3 secs Computing kpt #: 220 total cpu time spent up to now is 190.1 secs Computing kpt #: 221 total cpu time spent up to now is 190.8 secs Computing kpt #: 222 total cpu time spent up to now is 191.6 secs Computing kpt #: 223 total cpu time spent up to now is 192.4 secs Computing kpt #: 224 total cpu time spent up to now is 193.2 secs Computing kpt #: 225 total cpu time spent up to now is 193.9 secs Computing kpt #: 226 total cpu time spent up to now is 194.7 secs Computing kpt #: 227 total cpu time spent up to now is 195.4 secs Computing kpt #: 228 total cpu time spent up to now is 196.1 secs Computing kpt #: 229 total cpu time spent up to now is 196.8 secs Computing kpt #: 230 total cpu time spent up to now is 197.5 secs Computing kpt #: 231 total cpu time spent up to now is 198.1 secs Computing kpt #: 232 total cpu time spent up to now is 198.7 secs Computing kpt #: 233 total cpu time spent up to now is 199.3 secs Computing kpt #: 234 total cpu time spent up to now is 200.0 secs Computing kpt #: 235 total cpu time spent up to now is 200.5 secs Computing kpt #: 236 total cpu time spent up to now is 201.2 secs Computing kpt #: 237 total cpu time spent up to now is 201.8 secs Computing kpt #: 238 total cpu time spent up to now is 202.4 secs Computing kpt #: 239 total cpu time spent up to now is 203.0 secs Computing kpt #: 240 total cpu time spent up to now is 203.6 secs Computing kpt #: 241 total cpu time spent up to now is 204.3 secs Computing kpt #: 242 total cpu time spent up to now is 204.9 secs Computing kpt #: 243 total cpu time spent up to now is 205.8 secs Computing kpt #: 244 total cpu time spent up to now is 206.7 secs Computing kpt #: 245 total cpu time spent up to now is 207.4 secs Computing kpt #: 246 total cpu time spent up to now is 208.1 secs Computing kpt #: 247 total cpu time spent up to now is 208.8 secs Computing kpt #: 248 total cpu time spent up to now is 209.4 secs Computing kpt #: 249 total cpu time spent up to now is 210.0 secs Computing kpt #: 250 total cpu time spent up to now is 210.5 secs Computing kpt #: 251 total cpu time spent up to now is 211.1 secs Computing kpt #: 252 total cpu time spent up to now is 211.6 secs Computing kpt #: 253 total cpu time spent up to now is 212.2 secs Computing kpt #: 254 total cpu time spent up to now is 212.7 secs Computing kpt #: 255 total cpu time spent up to now is 213.3 secs Computing kpt #: 256 total cpu time spent up to now is 213.8 secs Computing kpt #: 257 total cpu time spent up to now is 214.4 secs Computing kpt #: 258 total cpu time spent up to now is 214.9 secs Computing kpt #: 259 total cpu time spent up to now is 215.5 secs Computing kpt #: 260 total cpu time spent up to now is 216.0 secs Computing kpt #: 261 total cpu time spent up to now is 216.5 secs Computing kpt #: 262 total cpu time spent up to now is 217.1 secs Computing kpt #: 263 total cpu time spent up to now is 217.6 secs Computing kpt #: 264 total cpu time spent up to now is 218.2 secs Computing kpt #: 265 total cpu time spent up to now is 218.6 secs Computing kpt #: 266 total cpu time spent up to now is 219.1 secs Computing kpt #: 267 total cpu time spent up to now is 219.6 secs Computing kpt #: 268 total cpu time spent up to now is 220.0 secs Computing kpt #: 269 total cpu time spent up to now is 220.5 secs Computing kpt #: 270 total cpu time spent up to now is 221.0 secs Computing kpt #: 271 total cpu time spent up to now is 221.6 secs Computing kpt #: 272 total cpu time spent up to now is 222.0 secs Computing kpt #: 273 total cpu time spent up to now is 222.6 secs Computing kpt #: 274 total cpu time spent up to now is 223.1 secs Computing kpt #: 275 total cpu time spent up to now is 223.7 secs Computing kpt #: 276 total cpu time spent up to now is 224.2 secs Computing kpt #: 277 total cpu time spent up to now is 224.7 secs Computing kpt #: 278 total cpu time spent up to now is 225.3 secs Computing kpt #: 279 total cpu time spent up to now is 225.9 secs Computing kpt #: 280 total cpu time spent up to now is 226.4 secs Computing kpt #: 281 total cpu time spent up to now is 227.0 secs Computing kpt #: 282 total cpu time spent up to now is 227.6 secs Computing kpt #: 283 total cpu time spent up to now is 228.1 secs Computing kpt #: 284 total cpu time spent up to now is 228.7 secs Computing kpt #: 285 total cpu time spent up to now is 229.3 secs Computing kpt #: 286 total cpu time spent up to now is 229.9 secs Computing kpt #: 287 total cpu time spent up to now is 230.5 secs Computing kpt #: 288 total cpu time spent up to now is 231.1 secs Computing kpt #: 289 total cpu time spent up to now is 231.6 secs Computing kpt #: 290 total cpu time spent up to now is 232.2 secs Computing kpt #: 291 total cpu time spent up to now is 232.8 secs Computing kpt #: 292 total cpu time spent up to now is 233.4 secs Computing kpt #: 293 total cpu time spent up to now is 234.0 secs Computing kpt #: 294 total cpu time spent up to now is 234.6 secs Computing kpt #: 295 total cpu time spent up to now is 235.2 secs Computing kpt #: 296 total cpu time spent up to now is 235.7 secs Computing kpt #: 297 total cpu time spent up to now is 236.3 secs Computing kpt #: 298 total cpu time spent up to now is 236.8 secs Computing kpt #: 299 total cpu time spent up to now is 237.4 secs Computing kpt #: 300 total cpu time spent up to now is 237.9 secs Computing kpt #: 301 total cpu time spent up to now is 238.5 secs Computing kpt #: 302 total cpu time spent up to now is 239.0 secs Computing kpt #: 303 total cpu time spent up to now is 239.6 secs Computing kpt #: 304 total cpu time spent up to now is 240.1 secs Computing kpt #: 305 total cpu time spent up to now is 240.6 secs Computing kpt #: 306 total cpu time spent up to now is 241.2 secs Computing kpt #: 307 total cpu time spent up to now is 241.7 secs Computing kpt #: 308 total cpu time spent up to now is 242.2 secs Computing kpt #: 309 total cpu time spent up to now is 242.8 secs Computing kpt #: 310 total cpu time spent up to now is 243.3 secs Computing kpt #: 311 total cpu time spent up to now is 243.8 secs Computing kpt #: 312 total cpu time spent up to now is 244.4 secs Computing kpt #: 313 total cpu time spent up to now is 244.9 secs Computing kpt #: 314 total cpu time spent up to now is 245.4 secs Computing kpt #: 315 total cpu time spent up to now is 245.9 secs Computing kpt #: 316 total cpu time spent up to now is 246.5 secs Computing kpt #: 317 total cpu time spent up to now is 247.0 secs Computing kpt #: 318 total cpu time spent up to now is 247.5 secs Computing kpt #: 319 total cpu time spent up to now is 248.0 secs Computing kpt #: 320 total cpu time spent up to now is 248.5 secs Computing kpt #: 321 total cpu time spent up to now is 249.1 secs Computing kpt #: 322 total cpu time spent up to now is 249.6 secs Computing kpt #: 323 total cpu time spent up to now is 250.1 secs Computing kpt #: 324 total cpu time spent up to now is 250.6 secs Computing kpt #: 325 total cpu time spent up to now is 251.1 secs Computing kpt #: 326 total cpu time spent up to now is 251.6 secs Computing kpt #: 327 total cpu time spent up to now is 252.1 secs Computing kpt #: 328 total cpu time spent up to now is 252.7 secs Computing kpt #: 329 total cpu time spent up to now is 253.2 secs Computing kpt #: 330 total cpu time spent up to now is 253.7 secs Computing kpt #: 331 total cpu time spent up to now is 254.2 secs Computing kpt #: 332 total cpu time spent up to now is 254.8 secs Computing kpt #: 333 total cpu time spent up to now is 256.1 secs Computing kpt #: 334 total cpu time spent up to now is 257.1 secs Computing kpt #: 335 total cpu time spent up to now is 258.3 secs Computing kpt #: 336 total cpu time spent up to now is 259.1 secs Computing kpt #: 337 total cpu time spent up to now is 260.0 secs Computing kpt #: 338 total cpu time spent up to now is 261.1 secs Computing kpt #: 339 total cpu time spent up to now is 262.0 secs Computing kpt #: 340 total cpu time spent up to now is 263.0 secs Computing kpt #: 341 total cpu time spent up to now is 263.9 secs Computing kpt #: 342 total cpu time spent up to now is 264.8 secs Computing kpt #: 343 total cpu time spent up to now is 265.6 secs Computing kpt #: 344 total cpu time spent up to now is 266.5 secs Computing kpt #: 345 total cpu time spent up to now is 267.3 secs Computing kpt #: 346 total cpu time spent up to now is 268.1 secs Computing kpt #: 347 total cpu time spent up to now is 268.9 secs Computing kpt #: 348 total cpu time spent up to now is 269.8 secs Computing kpt #: 349 total cpu time spent up to now is 270.4 secs Computing kpt #: 350 total cpu time spent up to now is 271.0 secs Computing kpt #: 351 total cpu time spent up to now is 271.8 secs Computing kpt #: 352 total cpu time spent up to now is 272.6 secs Computing kpt #: 353 total cpu time spent up to now is 273.3 secs Computing kpt #: 354 total cpu time spent up to now is 274.1 secs Computing kpt #: 355 total cpu time spent up to now is 274.9 secs Computing kpt #: 356 total cpu time spent up to now is 275.6 secs Computing kpt #: 357 total cpu time spent up to now is 276.4 secs Computing kpt #: 358 total cpu time spent up to now is 277.2 secs Computing kpt #: 359 total cpu time spent up to now is 278.0 secs Computing kpt #: 360 total cpu time spent up to now is 278.8 secs Computing kpt #: 361 total cpu time spent up to now is 279.5 secs Computing kpt #: 362 total cpu time spent up to now is 280.1 secs Computing kpt #: 363 total cpu time spent up to now is 280.9 secs Computing kpt #: 364 total cpu time spent up to now is 281.5 secs Computing kpt #: 365 total cpu time spent up to now is 282.2 secs Computing kpt #: 366 total cpu time spent up to now is 282.8 secs Computing kpt #: 367 total cpu time spent up to now is 283.5 secs Computing kpt #: 368 total cpu time spent up to now is 284.1 secs Computing kpt #: 369 total cpu time spent up to now is 284.7 secs Computing kpt #: 370 total cpu time spent up to now is 285.3 secs Computing kpt #: 371 total cpu time spent up to now is 285.8 secs Computing kpt #: 372 total cpu time spent up to now is 286.4 secs Computing kpt #: 373 total cpu time spent up to now is 286.9 secs Computing kpt #: 374 total cpu time spent up to now is 287.4 secs Computing kpt #: 375 total cpu time spent up to now is 288.0 secs Computing kpt #: 376 total cpu time spent up to now is 288.5 secs Computing kpt #: 377 total cpu time spent up to now is 289.0 secs Computing kpt #: 378 total cpu time spent up to now is 289.5 secs Computing kpt #: 379 total cpu time spent up to now is 290.0 secs Computing kpt #: 380 total cpu time spent up to now is 290.4 secs ethr = 2.00E-08, avg # of iterations = 38.8 total cpu time spent up to now is 290.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3221 PWs) bands (ev): -30.7032 -30.7032 -30.6797 -30.6797 -12.1151 -12.1151 -11.9324 -11.9324 -11.7029 -11.7029 -11.5763 -11.5763 -11.5411 -11.5411 -11.5272 -11.5272 -5.4967 -5.4967 -5.0028 -5.0028 4.9641 4.9641 5.7855 5.7855 6.1611 6.1611 6.1695 6.1695 6.5764 6.5764 6.8099 6.8099 6.8255 6.8255 6.8757 6.8757 7.3180 7.3180 7.3431 7.3431 7.3455 7.3455 7.3879 7.3879 7.4841 7.4841 7.9559 7.9559 7.9571 7.9571 8.2622 8.2622 10.8485 10.8485 11.1668 11.1668 12.0713 12.0713 12.5757 12.5757 k = 0.0000 0.0114-0.0000 ( 3217 PWs) bands (ev): -30.7032 -30.7032 -30.6797 -30.6797 -12.1150 -12.1150 -11.9325 -11.9325 -11.7030 -11.7030 -11.5765 -11.5765 -11.5412 -11.5412 -11.5272 -11.5272 -5.4960 -5.4960 -5.0024 -5.0024 4.9643 4.9643 5.7853 5.7853 6.1563 6.1563 6.1674 6.1674 6.5729 6.5729 6.8038 6.8038 6.8186 6.8186 6.8789 6.8789 7.3209 7.3209 7.3457 7.3457 7.3489 7.3489 7.3914 7.3914 7.4877 7.4877 7.9559 7.9559 7.9568 7.9568 8.2631 8.2631 10.8518 10.8518 11.1694 11.1694 12.0714 12.0714 12.5773 12.5773 k = 0.0000 0.0227-0.0000 ( 3215 PWs) bands (ev): -30.7031 -30.7031 -30.6797 -30.6797 -12.1148 -12.1148 -11.9328 -11.9328 -11.7032 -11.7032 -11.5770 -11.5770 -11.5416 -11.5416 -11.5273 -11.5273 -5.4938 -5.4938 -5.0014 -5.0014 4.9652 4.9652 5.7844 5.7844 6.1379 6.1379 6.1653 6.1653 6.5625 6.5625 6.7822 6.7822 6.8056 6.8056 6.8863 6.8863 7.3252 7.3252 7.3517 7.3517 7.3623 7.3623 7.4017 7.4017 7.4998 7.4998 7.9558 7.9558 7.9564 7.9564 8.2656 8.2656 10.8614 10.8614 11.1773 11.1773 12.0716 12.0716 12.5819 12.5819 k = 0.0000 0.0341-0.0000 ( 3207 PWs) bands (ev): -30.7030 -30.7030 -30.6795 -30.6795 -12.1145 -12.1145 -11.9334 -11.9334 -11.7035 -11.7035 -11.5778 -11.5778 -11.5422 -11.5422 -11.5273 -11.5273 -5.4902 -5.4902 -4.9997 -4.9997 4.9665 4.9665 5.7829 5.7829 6.1059 6.1059 6.1635 6.1635 6.5461 6.5461 6.7472 6.7472 6.7909 6.7909 6.8953 6.8953 7.3272 7.3272 7.3586 7.3586 7.3864 7.3864 7.4162 7.4162 7.5239 7.5239 7.9543 7.9543 7.9567 7.9567 8.2696 8.2696 10.8762 10.8762 11.1913 11.1913 12.0718 12.0718 12.5895 12.5895 k = 0.0000 0.0455-0.0000 ( 3205 PWs) bands (ev): -30.7029 -30.7029 -30.6794 -30.6794 -12.1141 -12.1141 -11.9341 -11.9341 -11.7041 -11.7041 -11.5790 -11.5790 -11.5432 -11.5432 -11.5274 -11.5274 -5.4853 -5.4853 -4.9974 -4.9974 4.9683 4.9683 5.7807 5.7807 6.0614 6.0614 6.1611 6.1611 6.5248 6.5248 6.7044 6.7044 6.7743 6.7743 6.9050 6.9050 7.3277 7.3277 7.3652 7.3652 7.4155 7.4155 7.4333 7.4333 7.5619 7.5619 7.9522 7.9522 7.9574 7.9574 8.2748 8.2748 10.8943 10.8943 11.2128 11.2128 12.0721 12.0721 12.6001 12.6001 k = 0.0000 0.0568-0.0000 ( 3207 PWs) bands (ev): -30.7027 -30.7027 -30.6792 -30.6792 -12.1136 -12.1136 -11.9351 -11.9351 -11.7047 -11.7047 -11.5806 -11.5806 -11.5443 -11.5443 -11.5274 -11.5274 -5.4790 -5.4790 -4.9944 -4.9944 4.9705 4.9705 5.7778 5.7778 6.0055 6.0055 6.1578 6.1578 6.4998 6.4998 6.6575 6.6575 6.7561 6.7561 6.9154 6.9154 7.3273 7.3273 7.3711 7.3711 7.4364 7.4364 7.4633 7.4633 7.6120 7.6120 7.9497 7.9497 7.9583 7.9583 8.2808 8.2808 10.9136 10.9136 11.2432 11.2432 12.0722 12.0722 12.6137 12.6137 k = 0.0000 0.0682-0.0000 ( 3211 PWs) bands (ev): -30.7024 -30.7024 -30.6790 -30.6790 -12.1130 -12.1130 -11.9364 -11.9364 -11.7056 -11.7056 -11.5825 -11.5825 -11.5457 -11.5457 -11.5274 -11.5274 -5.4714 -5.4714 -4.9907 -4.9907 4.9729 4.9729 5.7739 5.7739 5.9390 5.9390 6.1532 6.1532 6.4721 6.4721 6.6089 6.6089 6.7371 6.7371 6.9262 6.9262 7.3265 7.3265 7.3759 7.3759 7.4502 7.4502 7.5051 7.5051 7.6707 7.6707 7.9466 7.9466 7.9596 7.9596 8.2874 8.2874 10.9321 10.9321 11.2837 11.2837 12.0722 12.0722 12.6301 12.6301 k = 0.0000 0.0795-0.0000 ( 3207 PWs) bands (ev): -30.7022 -30.7022 -30.6787 -30.6787 -12.1123 -12.1123 -11.9378 -11.9378 -11.7066 -11.7066 -11.5848 -11.5848 -11.5472 -11.5472 -11.5274 -11.5274 -5.4625 -5.4625 -4.9862 -4.9862 4.9756 4.9756 5.7687 5.7687 5.8636 5.8636 6.1468 6.1468 6.4429 6.4429 6.5605 6.5605 6.7179 6.7179 6.9375 6.9375 7.3254 7.3254 7.3793 7.3793 7.4637 7.4637 7.5519 7.5519 7.7349 7.7349 7.9431 7.9431 7.9616 7.9616 8.2944 8.2944 10.9484 10.9484 11.3352 11.3352 12.0718 12.0718 12.6494 12.6494 k = 0.0000 0.0909-0.0000 ( 3213 PWs) bands (ev): -30.7018 -30.7018 -30.6784 -30.6784 -12.1115 -12.1115 -11.9396 -11.9396 -11.7078 -11.7078 -11.5874 -11.5874 -11.5489 -11.5489 -11.5274 -11.5274 -5.4525 -5.4525 -4.9810 -4.9810 4.9783 4.9783 5.7557 5.7557 5.7865 5.7865 6.1381 6.1381 6.4129 6.4129 6.5138 6.5138 6.6990 6.6990 6.9493 6.9493 7.3240 7.3240 7.3814 7.3814 7.4783 7.4783 7.6019 7.6019 7.8021 7.8021 7.9393 7.9393 7.9650 7.9650 8.3014 8.3014 10.9618 10.9618 11.3970 11.3970 12.0710 12.0710 12.6715 12.6715 k = 0.0000 0.1023-0.0000 ( 3205 PWs) bands (ev): -30.7015 -30.7015 -30.6781 -30.6781 -12.1107 -12.1107 -11.9415 -11.9415 -11.7091 -11.7091 -11.5902 -11.5902 -11.5506 -11.5506 -11.5273 -11.5273 -5.4414 -5.4414 -4.9750 -4.9750 4.9810 4.9810 5.6811 5.6811 5.7627 5.7627 6.1261 6.1261 6.3829 6.3829 6.4703 6.4703 6.6809 6.6809 6.9613 6.9613 7.3223 7.3223 7.3823 7.3823 7.4943 7.4943 7.6543 7.6543 7.8684 7.8684 7.9355 7.9355 7.9726 7.9726 8.3083 8.3083 10.9725 10.9725 11.4684 11.4684 12.0697 12.0697 12.6962 12.6962 k = 0.0000 0.1136-0.0000 ( 3203 PWs) bands (ev): -30.7011 -30.7011 -30.6777 -30.6777 -12.1098 -12.1098 -11.9437 -11.9437 -11.7107 -11.7107 -11.5934 -11.5934 -11.5525 -11.5525 -11.5272 -11.5272 -5.4292 -5.4292 -4.9683 -4.9683 4.9833 4.9833 5.5836 5.5836 5.7544 5.7544 6.1100 6.1100 6.3536 6.3536 6.4312 6.4312 6.6639 6.6639 6.9737 6.9737 7.3205 7.3205 7.3823 7.3823 7.5114 7.5114 7.7079 7.7079 7.9219 7.9219 7.9321 7.9321 7.9956 7.9956 8.3150 8.3150 10.9808 10.9808 11.5480 11.5480 12.0676 12.0676 12.7236 12.7236 k = 0.0000 0.1250-0.0000 ( 3199 PWs) bands (ev): -30.7006 -30.7006 -30.6773 -30.6773 -12.1088 -12.1088 -11.9462 -11.9462 -11.7124 -11.7124 -11.5967 -11.5967 -11.5545 -11.5545 -11.5269 -11.5269 -5.4162 -5.4162 -4.9606 -4.9606 4.9853 4.9853 5.4796 5.4796 5.7461 5.7461 6.0889 6.0889 6.3255 6.3255 6.3975 6.3975 6.6480 6.6480 6.9863 6.9863 7.3184 7.3184 7.3814 7.3814 7.5295 7.5295 7.7611 7.7611 7.9290 7.9290 7.9470 7.9470 8.0505 8.0505 8.3213 8.3213 10.9872 10.9872 11.6344 11.6344 12.0646 12.0646 12.7534 12.7534 k = 0.0000 0.1364-0.0000 ( 3203 PWs) bands (ev): -30.7002 -30.7002 -30.6769 -30.6769 -12.1079 -12.1079 -11.9489 -11.9489 -11.7144 -11.7144 -11.6004 -11.6004 -11.5565 -11.5565 -11.5267 -11.5267 -5.4024 -5.4024 -4.9521 -4.9521 4.9867 4.9867 5.3710 5.3710 5.7371 5.7371 6.0624 6.0624 6.2992 6.2992 6.3699 6.3699 6.6335 6.6335 6.9992 6.9992 7.3161 7.3161 7.3799 7.3799 7.5483 7.5483 7.8104 7.8104 7.9286 7.9286 7.9594 7.9594 8.1219 8.1219 8.3271 8.3271 10.9922 10.9922 11.7264 11.7264 12.0607 12.0607 12.7856 12.7856 k = 0.0000 0.1477-0.0000 ( 3201 PWs) bands (ev): -30.6997 -30.6997 -30.6765 -30.6765 -12.1068 -12.1068 -11.9519 -11.9519 -11.7165 -11.7165 -11.6041 -11.6041 -11.5585 -11.5585 -11.5264 -11.5264 -5.3880 -5.3880 -4.9427 -4.9427 4.9873 4.9873 5.2587 5.2587 5.7273 5.7273 6.0307 6.0307 6.2750 6.2750 6.3482 6.3482 6.6204 6.6204 7.0122 7.0122 7.3136 7.3136 7.3779 7.3779 7.5676 7.5676 7.8482 7.8482 7.9323 7.9323 7.9765 7.9765 8.1981 8.1981 8.3328 8.3328 10.9960 10.9960 11.8229 11.8229 12.0557 12.0557 12.8200 12.8200 k = 0.0000 0.1591-0.0000 ( 3203 PWs) bands (ev): -30.6992 -30.6992 -30.6760 -30.6760 -12.1058 -12.1058 -11.9552 -11.9552 -11.7188 -11.7188 -11.6081 -11.6081 -11.5605 -11.5605 -11.5260 -11.5260 -5.3731 -5.3731 -4.9323 -4.9323 4.9867 4.9867 5.1441 5.1441 5.7165 5.7165 5.9946 5.9946 6.2528 6.2528 6.3320 6.3320 6.6088 6.6088 7.0254 7.0254 7.3109 7.3109 7.3755 7.3755 7.5873 7.5873 7.8669 7.8669 7.9385 7.9385 8.0097 8.0097 8.2762 8.2762 8.3382 8.3382 10.9990 10.9990 11.9229 11.9229 12.0496 12.0496 12.8566 12.8566 k = 0.0000 0.1705-0.0000 ( 3197 PWs) bands (ev): -30.6986 -30.6986 -30.6755 -30.6755 -12.1047 -12.1047 -11.9586 -11.9586 -11.7212 -11.7212 -11.6121 -11.6121 -11.5624 -11.5624 -11.5256 -11.5256 -5.3578 -5.3578 -4.9209 -4.9209 4.9817 4.9817 5.0308 5.0308 5.7049 5.7049 5.9554 5.9554 6.2329 6.2329 6.3204 6.3204 6.5987 6.5987 7.0388 7.0388 7.3081 7.3081 7.3728 7.3728 7.6072 7.6072 7.8716 7.8716 7.9432 7.9432 8.0586 8.0586 8.3436 8.3436 8.3554 8.3554 11.0013 11.0013 12.0250 12.0250 12.0427 12.0427 12.8953 12.8953 k = 0.0000 0.1818-0.0000 ( 3213 PWs) bands (ev): -30.6981 -30.6981 -30.6750 -30.6750 -12.1037 -12.1037 -11.9625 -11.9625 -11.7239 -11.7239 -11.6163 -11.6163 -11.5643 -11.5643 -11.5251 -11.5251 -5.3423 -5.3423 -4.9084 -4.9084 4.9032 4.9032 4.9884 4.9884 5.6925 5.6925 5.9142 5.9142 6.2151 6.2151 6.3123 6.3123 6.5900 6.5900 7.0522 7.0522 7.3050 7.3050 7.3698 7.3698 7.6270 7.6270 7.8701 7.8701 7.9462 7.9462 8.1150 8.1150 8.3495 8.3495 8.4349 8.4349 11.0028 11.0028 12.0331 12.0331 12.1302 12.1302 12.9360 12.9360 k = 0.0000 0.1932-0.0000 ( 3217 PWs) bands (ev): -30.6975 -30.6975 -30.6744 -30.6744 -12.1027 -12.1027 -11.9666 -11.9666 -11.7266 -11.7266 -11.6205 -11.6205 -11.5661 -11.5661 -11.5246 -11.5246 -5.3267 -5.3267 -4.8948 -4.8948 4.7853 4.7853 4.9836 4.9836 5.6792 5.6792 5.8719 5.8719 6.1997 6.1997 6.3070 6.3070 6.5827 6.5827 7.0656 7.0656 7.3018 7.3018 7.3667 7.3667 7.6465 7.6465 7.8666 7.8666 7.9483 7.9483 8.1739 8.1739 8.3568 8.3568 8.5147 8.5147 11.0041 11.0041 12.0229 12.0229 12.2357 12.2357 12.9786 12.9786 k = 0.0000 0.2045-0.0000 ( 3217 PWs) bands (ev): -30.6969 -30.6969 -30.6739 -30.6739 -12.1017 -12.1017 -11.9709 -11.9709 -11.7295 -11.7295 -11.6246 -11.6246 -11.5678 -11.5678 -11.5240 -11.5240 -5.3113 -5.3113 -4.8801 -4.8801 4.6659 4.6659 4.9789 4.9789 5.6653 5.6653 5.8293 5.8293 6.1866 6.1866 6.3036 6.3036 6.5767 6.5767 7.0792 7.0792 7.2986 7.2986 7.3634 7.3634 7.6655 7.6655 7.8623 7.8623 7.9500 7.9500 8.2310 8.2310 8.3677 8.3677 8.5945 8.5945 11.0050 11.0050 12.0113 12.0113 12.3416 12.3416 13.0230 13.0230 k = 0.0000 0.2159-0.0000 ( 3217 PWs) bands (ev): -30.6963 -30.6963 -30.6733 -30.6733 -12.1008 -12.1008 -11.9754 -11.9754 -11.7325 -11.7325 -11.6288 -11.6288 -11.5694 -11.5694 -11.5234 -11.5234 -5.2960 -5.2960 -4.8642 -4.8642 4.5465 4.5465 4.9733 4.9733 5.6509 5.6509 5.7869 5.7869 6.1759 6.1759 6.3018 6.3018 6.5718 6.5718 7.0926 7.0926 7.2954 7.2954 7.3601 7.3601 7.6837 7.6837 7.8583 7.8583 7.9515 7.9515 8.2797 8.2797 8.3883 8.3883 8.6741 8.6741 11.0057 11.0057 11.9982 11.9982 12.4471 12.4471 13.0695 13.0695 k = 0.0000 0.2273-0.0000 ( 3203 PWs) bands (ev): -30.6957 -30.6957 -30.6727 -30.6727 -12.0999 -12.0999 -11.9801 -11.9801 -11.7355 -11.7355 -11.6328 -11.6328 -11.5708 -11.5708 -11.5227 -11.5227 -5.2811 -5.2811 -4.8471 -4.8471 4.4279 4.4279 4.9666 4.9666 5.6359 5.6359 5.7451 5.7451 6.1675 6.1675 6.3011 6.3011 6.5680 6.5680 7.1059 7.1059 7.2923 7.2923 7.3567 7.3567 7.7007 7.7007 7.8552 7.8552 7.9529 7.9529 8.3109 8.3109 8.4273 8.4273 8.7532 8.7532 11.0061 11.0061 11.9835 11.9835 12.5517 12.5517 13.1179 13.1179 k = 0.0000 0.2386-0.0000 ( 3203 PWs) bands (ev): -30.6950 -30.6950 -30.6722 -30.6722 -12.0991 -12.0991 -11.9850 -11.9850 -11.7386 -11.7386 -11.6367 -11.6367 -11.5721 -11.5721 -11.5221 -11.5221 -5.2668 -5.2668 -4.8290 -4.8290 4.3103 4.3103 4.9589 4.9589 5.6204 5.6204 5.7043 5.7043 6.1613 6.1613 6.3013 6.3013 6.5652 6.5652 7.1189 7.1189 7.2892 7.2892 7.3534 7.3534 7.7157 7.7157 7.8537 7.8537 7.9542 7.9542 8.3262 8.3262 8.4825 8.4825 8.8317 8.8317 11.0062 11.0062 11.9672 11.9672 12.6544 12.6544 13.1685 13.1685 k = 0.0000 0.2500-0.0000 ( 3207 PWs) bands (ev): -30.6944 -30.6944 -30.6716 -30.6716 -12.0984 -12.0984 -11.9902 -11.9902 -11.7418 -11.7418 -11.6406 -11.6406 -11.5732 -11.5732 -11.5214 -11.5214 -5.2529 -5.2529 -4.8097 -4.8097 4.1945 4.1945 4.9501 4.9501 5.6045 5.6045 5.6649 5.6649 6.1571 6.1571 6.3022 6.3022 6.5631 6.5631 7.1315 7.1315 7.2863 7.2863 7.3500 7.3500 7.7279 7.7279 7.8545 7.8545 7.9556 7.9556 8.3340 8.3340 8.5458 8.5458 8.9094 8.9094 11.0062 11.0062 11.9493 11.9493 12.7541 12.7541 13.2215 13.2215 k = 0.0000 0.2614-0.0000 ( 3203 PWs) bands (ev): -30.6938 -30.6938 -30.6710 -30.6710 -12.0977 -12.0977 -11.9955 -11.9955 -11.7449 -11.7449 -11.6443 -11.6443 -11.5743 -11.5743 -11.5206 -11.5206 -5.2398 -5.2398 -4.7894 -4.7894 4.0807 4.0807 4.9405 4.9405 5.5877 5.5877 5.6275 5.6275 6.1549 6.1549 6.3036 6.3036 6.5617 6.5617 7.1434 7.1434 7.2838 7.2838 7.3467 7.3467 7.7368 7.7368 7.8585 7.8585 7.9573 7.9573 8.3386 8.3386 8.6127 8.6127 8.9862 8.9862 11.0060 11.0060 11.9297 11.9297 12.8500 12.8500 13.2772 13.2772 k = 0.0000 0.2727-0.0000 ( 3203 PWs) bands (ev): -30.6932 -30.6932 -30.6704 -30.6704 -12.0972 -12.0972 -12.0009 -12.0009 -11.7480 -11.7480 -11.6479 -11.6479 -11.5751 -11.5751 -11.5199 -11.5199 -5.2273 -5.2273 -4.7682 -4.7682 3.9693 3.9693 4.9302 4.9302 5.5684 5.5684 5.5940 5.5940 6.1544 6.1544 6.3054 6.3054 6.5609 6.5609 7.1545 7.1545 7.2819 7.2819 7.3435 7.3435 7.7419 7.7419 7.8658 7.8658 7.9591 7.9591 8.3415 8.3415 8.6813 8.6813 9.0617 9.0617 11.0057 11.0057 11.9083 11.9083 12.9410 12.9410 13.3361 13.3361 k = 0.0000 0.2841-0.0000 ( 3203 PWs) bands (ev): -30.6925 -30.6925 -30.6699 -30.6699 -12.0967 -12.0967 -12.0065 -12.0065 -11.7510 -11.7510 -11.6513 -11.6513 -11.5759 -11.5759 -11.5192 -11.5192 -5.2157 -5.2157 -4.7462 -4.7462 3.8606 3.8606 4.9192 4.9192 5.5424 5.5424 5.5688 5.5688 6.1554 6.1554 6.3075 6.3075 6.5605 6.5605 7.1646 7.1646 7.2807 7.2807 7.3405 7.3405 7.7437 7.7437 7.8760 7.8760 7.9613 7.9613 8.3436 8.3436 8.7510 8.7510 9.1359 9.1359 11.0053 11.0053 11.8851 11.8851 13.0261 13.0261 13.3983 13.3983 k = 0.0000 0.2955-0.0000 ( 3189 PWs) bands (ev): -30.6919 -30.6919 -30.6693 -30.6693 -12.0962 -12.0962 -12.0120 -12.0120 -11.7539 -11.7539 -11.6546 -11.6546 -11.5765 -11.5765 -11.5184 -11.5184 -5.2047 -5.2047 -4.7236 -4.7236 3.7552 3.7552 4.9078 4.9078 5.5114 5.5114 5.5506 5.5506 6.1576 6.1576 6.3098 6.3098 6.5605 6.5605 7.1733 7.1733 7.2805 7.2805 7.3378 7.3378 7.7429 7.7429 7.8882 7.8882 7.9641 7.9641 8.3453 8.3453 8.8213 8.8213 9.2084 9.2084 11.0047 11.0047 11.8602 11.8602 13.1045 13.1045 13.4637 13.4638 k = 0.0000 0.3068-0.0000 ( 3184 PWs) bands (ev): -30.6913 -30.6913 -30.6687 -30.6687 -12.0959 -12.0959 -12.0176 -12.0176 -11.7567 -11.7567 -11.6576 -11.6576 -11.5770 -11.5770 -11.5177 -11.5177 -5.1946 -5.1946 -4.7006 -4.7006 3.6532 3.6532 4.8960 4.8960 5.4799 5.4799 5.5348 5.5348 6.1610 6.1610 6.3123 6.3123 6.5607 6.5607 7.1803 7.1803 7.2814 7.2814 7.3353 7.3353 7.7403 7.7403 7.9010 7.9010 7.9679 7.9679 8.3465 8.3465 8.8919 8.8919 9.2792 9.2792 11.0041 11.0041 11.8334 11.8334 13.1760 13.1760 13.5318 13.5318 k = 0.0000 0.3182-0.0000 ( 3184 PWs) bands (ev): -30.6907 -30.6907 -30.6682 -30.6682 -12.0957 -12.0957 -12.0232 -12.0232 -11.7594 -11.7594 -11.6605 -11.6605 -11.5775 -11.5775 -11.5170 -11.5170 -5.1852 -5.1852 -4.6772 -4.6772 3.5550 3.5550 4.8841 4.8841 5.4493 5.4493 5.5202 5.5202 6.1652 6.1652 6.3150 6.3150 6.5610 6.5610 7.1855 7.1855 7.2834 7.2834 7.3331 7.3331 7.7365 7.7365 7.9134 7.9134 7.9731 7.9731 8.3474 8.3474 8.9625 8.9625 9.3480 9.3480 11.0034 11.0034 11.8047 11.8047 13.2406 13.2406 13.6012 13.6013 k = 0.0000 0.3295-0.0000 ( 3184 PWs) bands (ev): -30.6902 -30.6902 -30.6677 -30.6677 -12.0956 -12.0956 -12.0287 -12.0287 -11.7621 -11.7621 -11.6631 -11.6631 -11.5779 -11.5779 -11.5163 -11.5163 -5.1766 -5.1766 -4.6538 -4.6538 3.4610 3.4610 4.8722 4.8722 5.4201 5.4201 5.5064 5.5064 6.1700 6.1700 6.3177 6.3177 6.5615 6.5615 7.1889 7.1889 7.2865 7.2865 7.3316 7.3316 7.7320 7.7320 7.9241 7.9241 7.9804 7.9804 8.3481 8.3481 9.0328 9.0328 9.4144 9.4144 11.0026 11.0026 11.7743 11.7743 13.2991 13.2991 13.6493 13.6493 k = 0.0000 0.3409-0.0000 ( 3184 PWs) bands (ev): -30.6896 -30.6896 -30.6672 -30.6672 -12.0955 -12.0955 -12.0342 -12.0342 -11.7645 -11.7645 -11.6656 -11.6656 -11.5781 -11.5781 -11.5156 -11.5156 -5.1687 -5.1687 -4.6306 -4.6306 3.3713 3.3713 4.8603 4.8603 5.3926 5.3926 5.4933 5.4933 6.1753 6.1753 6.3204 6.3204 6.5619 6.5619 7.1907 7.1907 7.2900 7.2900 7.3310 7.3310 7.7272 7.7272 7.9325 7.9325 7.9902 7.9902 8.3487 8.3487 9.1026 9.1026 9.4784 9.4784 11.0018 11.0018 11.7422 11.7422 13.3522 13.3522 13.6825 13.6826 k = 0.0000 0.3523-0.0000 ( 3184 PWs) bands (ev): -30.6891 -30.6891 -30.6667 -30.6667 -12.0955 -12.0955 -12.0395 -12.0395 -11.7668 -11.7668 -11.6679 -11.6679 -11.5783 -11.5783 -11.5150 -11.5150 -5.1614 -5.1614 -4.6077 -4.6077 3.2863 3.2863 4.8488 4.8488 5.3667 5.3667 5.4810 5.4810 6.1809 6.1809 6.3231 6.3231 6.5624 6.5624 7.1911 7.1911 7.2935 7.2935 7.3315 7.3315 7.7222 7.7222 7.9385 7.9385 8.0021 8.0021 8.3493 8.3493 9.1716 9.1716 9.5397 9.5397 11.0010 11.0010 11.7086 11.7086 13.4006 13.4006 13.7150 13.7150 k = 0.0000 0.3636-0.0000 ( 3180 PWs) bands (ev): -30.6886 -30.6886 -30.6662 -30.6662 -12.0955 -12.0955 -12.0447 -12.0447 -11.7690 -11.7690 -11.6699 -11.6699 -11.5785 -11.5785 -11.5143 -11.5143 -5.1549 -5.1549 -4.5854 -4.5854 3.2063 3.2063 4.8377 4.8377 5.3427 5.3427 5.4694 5.4694 6.1867 6.1867 6.3257 6.3257 6.5629 6.5629 7.1906 7.1906 7.2962 7.2962 7.3336 7.3336 7.7174 7.7174 7.9429 7.9429 8.0153 8.0153 8.3498 8.3498 9.2396 9.2396 9.5979 9.5979 11.0001 11.0001 11.6736 11.6736 13.4449 13.4449 13.7464 13.7464 k = 0.0000 0.3750-0.0000 ( 3184 PWs) bands (ev): -30.6881 -30.6881 -30.6658 -30.6658 -12.0955 -12.0955 -12.0497 -12.0497 -11.7709 -11.7709 -11.6718 -11.6718 -11.5786 -11.5786 -11.5138 -11.5138 -5.1490 -5.1490 -4.5639 -4.5639 3.1315 3.1315 4.8271 4.8271 5.3204 5.3204 5.4586 5.4586 6.1925 6.1925 6.3283 6.3283 6.5633 6.5633 7.1892 7.1892 7.2977 7.2977 7.3371 7.3371 7.7126 7.7126 7.9459 7.9459 8.0291 8.0291 8.3502 8.3502 9.3060 9.3060 9.6529 9.6529 10.9992 10.9992 11.6375 11.6375 13.4855 13.4855 13.7764 13.7765 k = 0.0000 0.3864-0.0000 ( 3188 PWs) bands (ev): -30.6877 -30.6877 -30.6654 -30.6654 -12.0956 -12.0956 -12.0544 -12.0544 -11.7727 -11.7727 -11.6735 -11.6735 -11.5787 -11.5787 -11.5132 -11.5132 -5.1437 -5.1437 -4.5435 -4.5435 3.0623 3.0623 4.8170 4.8170 5.3000 5.3000 5.4487 5.4487 6.1981 6.1981 6.3307 6.3307 6.5636 6.5636 7.1874 7.1874 7.2983 7.2983 7.3417 7.3417 7.7080 7.7080 7.9481 7.9481 8.0428 8.0428 8.3507 8.3507 9.3705 9.3705 9.7043 9.7043 10.9984 10.9984 11.6008 11.6008 13.5228 13.5228 13.7657 13.7657 k = 0.0000 0.3977-0.0000 ( 3192 PWs) bands (ev): -30.6873 -30.6873 -30.6651 -30.6651 -12.0956 -12.0956 -12.0590 -12.0590 -11.7743 -11.7743 -11.6751 -11.6751 -11.5787 -11.5787 -11.5128 -11.5128 -5.1390 -5.1390 -4.5242 -4.5242 2.9988 2.9988 4.8076 4.8076 5.2815 5.2815 5.4397 5.4397 6.2034 6.2034 6.3330 6.3330 6.5639 6.5639 7.1854 7.1854 7.2981 7.2981 7.3470 7.3470 7.7038 7.7038 7.9498 7.9498 8.0560 8.0560 8.3511 8.3511 9.4324 9.4324 9.7520 9.7520 10.9975 10.9975 11.5639 11.5639 13.5570 13.5570 13.7321 13.7321 k = 0.0000 0.4091-0.0000 ( 3188 PWs) bands (ev): -30.6870 -30.6870 -30.6647 -30.6647 -12.0955 -12.0955 -12.0632 -12.0632 -11.7757 -11.7757 -11.6764 -11.6764 -11.5787 -11.5787 -11.5123 -11.5123 -5.1348 -5.1348 -4.5064 -4.5064 2.9414 2.9414 4.7991 4.7991 5.2649 5.2649 5.4315 5.4315 6.2085 6.2085 6.3352 6.3352 6.5641 6.5641 7.1834 7.1834 7.2976 7.2976 7.3525 7.3525 7.6999 7.6999 7.9512 7.9512 8.0684 8.0684 8.3516 8.3516 9.4913 9.4913 9.7956 9.7956 10.9967 10.9967 11.5274 11.5274 13.5881 13.5881 13.7013 13.7013 k = 0.0000 0.4205-0.0000 ( 3188 PWs) bands (ev): -30.6866 -30.6866 -30.6644 -30.6644 -12.0954 -12.0954 -12.0671 -12.0671 -11.7769 -11.7769 -11.6776 -11.6776 -11.5786 -11.5786 -11.5119 -11.5119 -5.1312 -5.1312 -4.4902 -4.4902 2.8901 2.8901 4.7913 4.7913 5.2503 5.2503 5.4243 5.4243 6.2131 6.2131 6.3371 6.3371 6.5642 6.5642 7.1814 7.1814 7.2969 7.2969 7.3579 7.3579 7.6964 7.6964 7.9524 7.9524 8.0798 8.0798 8.3521 8.3521 9.5464 9.5464 9.8348 9.8348 10.9960 10.9960 11.4920 11.4920 13.6163 13.6163 13.6735 13.6735 k = 0.0000 0.4318-0.0000 ( 3184 PWs) bands (ev): -30.6863 -30.6863 -30.6642 -30.6642 -12.0952 -12.0952 -12.0707 -12.0707 -11.7780 -11.7780 -11.6786 -11.6786 -11.5786 -11.5786 -11.5115 -11.5115 -5.1281 -5.1281 -4.4758 -4.4758 2.8453 2.8453 4.7845 4.7845 5.2375 5.2375 5.4180 5.4180 6.2172 6.2172 6.3389 6.3389 6.5644 6.5644 7.1794 7.1794 7.2960 7.2960 7.3629 7.3629 7.6934 7.6934 7.9533 7.9533 8.0900 8.0900 8.3525 8.3525 9.5968 9.5968 9.8695 9.8695 10.9954 10.9954 11.4585 11.4585 13.6411 13.6411 13.6494 13.6494 k = 0.0000 0.4432-0.0000 ( 3188 PWs) bands (ev): -30.6861 -30.6861 -30.6640 -30.6640 -12.0949 -12.0949 -12.0739 -12.0739 -11.7789 -11.7789 -11.6794 -11.6794 -11.5786 -11.5786 -11.5112 -11.5112 -5.1255 -5.1255 -4.4633 -4.4633 2.8070 2.8070 4.7786 4.7786 5.2267 5.2267 5.4126 5.4126 6.2208 6.2208 6.3404 6.3404 6.5644 6.5644 7.1777 7.1777 7.2952 7.2952 7.3673 7.3673 7.6907 7.6907 7.9540 7.9540 8.0989 8.0989 8.3529 8.3529 9.6416 9.6416 9.8994 9.8994 10.9948 10.9948 11.4278 11.4278 13.6276 13.6276 13.6641 13.6641 k = 0.0000 0.4545-0.0000 ( 3196 PWs) bands (ev): -30.6859 -30.6859 -30.6638 -30.6638 -12.0946 -12.0946 -12.0767 -12.0767 -11.7797 -11.7797 -11.6801 -11.6801 -11.5786 -11.5786 -11.5109 -11.5109 -5.1234 -5.1234 -4.4529 -4.4529 2.7755 2.7755 4.7737 4.7737 5.2178 5.2178 5.4082 5.4082 6.2238 6.2238 6.3416 6.3416 6.5644 6.5644 7.1762 7.1762 7.2945 7.2945 7.3710 7.3710 7.6885 7.6885 7.9545 7.9545 8.1062 8.1062 8.3532 8.3532 9.6801 9.6801 9.9242 9.9242 10.9943 10.9943 11.4007 11.4007 13.6100 13.6100 13.6830 13.6830 k = 0.0000 0.4659-0.0000 ( 3204 PWs) bands (ev): -30.6858 -30.6858 -30.6636 -30.6636 -12.0942 -12.0942 -12.0791 -12.0791 -11.7803 -11.7803 -11.6807 -11.6807 -11.5786 -11.5786 -11.5107 -11.5107 -5.1218 -5.1218 -4.4447 -4.4447 2.7508 2.7508 4.7699 4.7699 5.2109 5.2109 5.4047 5.4047 6.2261 6.2261 6.3426 6.3426 6.5644 6.5644 7.1749 7.1749 7.2939 7.2939 7.3740 7.3740 7.6868 7.6868 7.9549 7.9549 8.1120 8.1120 8.3535 8.3535 9.7112 9.7112 9.9438 9.9438 10.9939 10.9939 11.3784 11.3784 13.5961 13.5961 13.6985 13.6985 k = 0.0000 0.4773-0.0000 ( 3204 PWs) bands (ev): -30.6856 -30.6856 -30.6635 -30.6635 -12.0937 -12.0937 -12.0810 -12.0810 -11.7807 -11.7807 -11.6811 -11.6811 -11.5785 -11.5785 -11.5106 -11.5106 -5.1206 -5.1206 -4.4388 -4.4388 2.7331 2.7331 4.7672 4.7672 5.2060 5.2060 5.4023 5.4023 6.2278 6.2278 6.3433 6.3433 6.5644 6.5644 7.1741 7.1741 7.2934 7.2934 7.3761 7.3761 7.6855 7.6855 7.9552 7.9552 8.1162 8.1162 8.3537 8.3537 9.7342 9.7342 9.9579 9.9579 10.9936 10.9936 11.3617 11.3617 13.5862 13.5862 13.7101 13.7101 k = 0.0000 0.4886-0.0000 ( 3198 PWs) bands (ev): -30.6856 -30.6856 -30.6635 -30.6635 -12.0933 -12.0933 -12.0822 -12.0822 -11.7809 -11.7809 -11.6813 -11.6813 -11.5785 -11.5785 -11.5105 -11.5105 -5.1199 -5.1199 -4.4352 -4.4352 2.7225 2.7225 4.7655 4.7655 5.2030 5.2030 5.4008 5.4008 6.2289 6.2289 6.3438 6.3438 6.5644 6.5644 7.1735 7.1735 7.2932 7.2932 7.3774 7.3774 7.6848 7.6848 7.9554 7.9554 8.1188 8.1188 8.3539 8.3539 9.7483 9.7483 9.9665 9.9665 10.9934 10.9934 11.3514 11.3514 13.5801 13.5801 13.7174 13.7174 k = 0.0000 0.5000-0.0000 ( 3206 PWs) bands (ev): -30.6856 -30.6856 -30.6635 -30.6635 -12.0932 -12.0932 -12.0826 -12.0826 -11.7810 -11.7810 -11.6814 -11.6814 -11.5785 -11.5785 -11.5105 -11.5105 -5.1197 -5.1197 -4.4340 -4.4340 2.7189 2.7189 4.7650 4.7650 5.2020 5.2020 5.4003 5.4003 6.2292 6.2292 6.3439 6.3439 6.5644 6.5644 7.1733 7.1733 7.2930 7.2930 7.3779 7.3779 7.6846 7.6846 7.9553 7.9553 8.1196 8.1196 8.3539 8.3539 9.7530 9.7530 9.9693 9.9693 10.9934 10.9934 11.3479 11.3479 13.5781 13.5781 13.7199 13.7199 k = 0.0000 0.5000-0.0000 ( 3206 PWs) bands (ev): -30.6856 -30.6856 -30.6635 -30.6635 -12.0932 -12.0932 -12.0826 -12.0826 -11.7810 -11.7810 -11.6814 -11.6814 -11.5785 -11.5785 -11.5105 -11.5105 -5.1197 -5.1197 -4.4340 -4.4340 2.7189 2.7189 4.7650 4.7650 5.2020 5.2020 5.4003 5.4003 6.2292 6.2292 6.3439 6.3439 6.5644 6.5644 7.1733 7.1733 7.2930 7.2930 7.3779 7.3779 7.6846 7.6846 7.9553 7.9553 8.1196 8.1196 8.3539 8.3539 9.7530 9.7530 9.9693 9.9693 10.9934 10.9934 11.3479 11.3479 13.5781 13.5781 13.7199 13.7199 k = 0.0114 0.5000-0.0000 ( 3202 PWs) bands (ev): -30.6855 -30.6855 -30.6634 -30.6634 -12.0932 -12.0932 -12.0826 -12.0826 -11.7809 -11.7809 -11.6816 -11.6816 -11.5787 -11.5787 -11.5106 -11.5106 -5.1188 -5.1188 -4.4338 -4.4338 2.7191 2.7191 4.7654 4.7654 5.1997 5.1997 5.4002 5.4002 6.2252 6.2252 6.3359 6.3359 6.5651 6.5651 7.1764 7.1764 7.2969 7.2969 7.3790 7.3790 7.6847 7.6847 7.9555 7.9555 8.1220 8.1220 8.3544 8.3544 9.7532 9.7532 9.9689 9.9689 10.9942 10.9942 11.3465 11.3465 13.5711 13.5711 13.7219 13.7219 k = 0.0227 0.5000-0.0000 ( 3206 PWs) bands (ev): -30.6855 -30.6855 -30.6634 -30.6634 -12.0932 -12.0932 -12.0825 -12.0825 -11.7808 -11.7808 -11.6820 -11.6820 -11.5795 -11.5795 -11.5108 -11.5108 -5.1163 -5.1163 -4.4333 -4.4333 2.7196 2.7196 4.7666 4.7666 5.1926 5.1926 5.3998 5.3998 6.2133 6.2133 6.3123 6.3123 6.5672 6.5672 7.1853 7.1853 7.3081 7.3081 7.3826 7.3826 7.6850 7.6850 7.9556 7.9556 8.1289 8.1289 8.3559 8.3559 9.7539 9.7539 9.9676 9.9676 10.9968 10.9968 11.3425 11.3425 13.5515 13.5515 13.7279 13.7279 k = 0.0341 0.5000-0.0000 ( 3202 PWs) bands (ev): -30.6854 -30.6854 -30.6633 -30.6633 -12.0933 -12.0933 -12.0823 -12.0823 -11.7805 -11.7805 -11.6827 -11.6827 -11.5807 -11.5807 -11.5111 -11.5111 -5.1120 -5.1120 -4.4324 -4.4324 2.7205 2.7205 4.7687 4.7687 5.1813 5.1813 5.3989 5.3989 6.1940 6.1940 6.2741 6.2741 6.5708 6.5708 7.1998 7.1998 7.3258 7.3258 7.3891 7.3891 7.6855 7.6855 7.9559 7.9559 8.1399 8.1399 8.3584 8.3584 9.7551 9.7551 9.9656 9.9656 11.0011 11.0011 11.3358 11.3358 13.5218 13.5218 13.7379 13.7379 k = 0.0455 0.5000-0.0000 ( 3206 PWs) bands (ev): -30.6852 -30.6852 -30.6631 -30.6631 -12.0934 -12.0934 -12.0821 -12.0821 -11.7802 -11.7802 -11.6838 -11.6838 -11.5823 -11.5823 -11.5116 -11.5116 -5.1061 -5.1061 -4.4312 -4.4312 2.7216 2.7216 4.7716 4.7716 5.1659 5.1659 5.3973 5.3973 6.1676 6.1676 6.2233 6.2233 6.5756 6.5756 7.2193 7.2193 7.3472 7.3472 7.3998 7.3998 7.6862 7.6862 7.9560 7.9560 8.1543 8.1543 8.3622 8.3622 9.7567 9.7567 9.9627 9.9627 11.0070 11.0070 11.3264 11.3264 13.4844 13.4844 13.7518 13.7518 k = 0.0568 0.5000-0.0000 ( 3202 PWs) bands (ev): -30.6850 -30.6850 -30.6630 -30.6630 -12.0935 -12.0935 -12.0818 -12.0818 -11.7798 -11.7798 -11.6852 -11.6852 -11.5844 -11.5844 -11.5121 -11.5121 -5.0984 -5.0984 -4.4297 -4.4297 2.7232 2.7232 4.7752 4.7752 5.1471 5.1471 5.3947 5.3947 6.1322 6.1322 6.1643 6.1643 6.5818 6.5818 7.2434 7.2434 7.3675 7.3675 7.4186 7.4186 7.6872 7.6872 7.9563 7.9563 8.1710 8.1710 8.3676 8.3676 9.7587 9.7587 9.9591 9.9591 11.0142 11.0142 11.3145 11.3145 13.4410 13.4410 13.7694 13.7694 k = 0.0682 0.5000-0.0000 ( 3214 PWs) bands (ev): -30.6848 -30.6848 -30.6627 -30.6627 -12.0936 -12.0936 -12.0815 -12.0815 -11.7793 -11.7793 -11.6869 -11.6869 -11.5869 -11.5869 -11.5129 -11.5129 -5.0892 -5.0892 -4.4278 -4.4278 2.7250 2.7250 4.7796 4.7796 5.1252 5.1252 5.3911 5.3911 6.0738 6.0738 6.1136 6.1136 6.5891 6.5891 7.2713 7.2713 7.3825 7.3825 7.4484 7.4484 7.6884 7.6884 7.9565 7.9565 8.1888 8.1888 8.3750 8.3750 9.7611 9.7611 9.9549 9.9549 11.0227 11.0227 11.2999 11.2999 13.3921 13.3921 13.7907 13.7907 k = 0.0795 0.5000-0.0000 ( 3202 PWs) bands (ev): -30.6845 -30.6845 -30.6625 -30.6625 -12.0937 -12.0937 -12.0812 -12.0812 -11.7787 -11.7787 -11.6888 -11.6888 -11.5898 -11.5898 -11.5136 -11.5136 -5.0783 -5.0783 -4.4256 -4.4256 2.7272 2.7272 4.7847 4.7847 5.1008 5.1008 5.3862 5.3862 5.9938 5.9938 6.0724 6.0724 6.5977 6.5977 7.3028 7.3028 7.3940 7.3940 7.4866 7.4866 7.6901 7.6901 7.9573 7.9573 8.2066 8.2066 8.3847 8.3847 9.7640 9.7640 9.9501 9.9501 11.0322 11.0322 11.2827 11.2827 13.3383 13.3383 13.8154 13.8154 k = 0.0909 0.5000-0.0000 ( 3194 PWs) bands (ev): -30.6842 -30.6842 -30.6622 -30.6622 -12.0938 -12.0938 -12.0808 -12.0808 -11.7780 -11.7780 -11.6910 -11.6910 -11.5930 -11.5930 -11.5144 -11.5144 -5.0658 -5.0658 -4.4232 -4.4232 2.7296 2.7296 4.7905 4.7905 5.0741 5.0741 5.3801 5.3801 5.9037 5.9037 6.0312 6.0312 6.6073 6.6073 7.3367 7.3367 7.4047 7.4047 7.5291 7.5291 7.6926 7.6926 7.9589 7.9589 8.2232 8.2232 8.3972 8.3972 9.7672 9.7672 9.9448 9.9448 11.0423 11.0423 11.2631 11.2631 13.2793 13.2793 13.8432 13.8434 k = 0.1023 0.5000-0.0000 ( 3190 PWs) bands (ev): -30.6839 -30.6839 -30.6618 -30.6618 -12.0940 -12.0940 -12.0804 -12.0804 -11.7773 -11.7773 -11.6936 -11.6936 -11.5966 -11.5966 -11.5153 -11.5153 -5.0517 -5.0517 -4.4204 -4.4204 2.7324 2.7324 4.7968 4.7968 5.0456 5.0456 5.3727 5.3727 5.8067 5.8067 5.9887 5.9887 6.6180 6.6180 7.3705 7.3705 7.4180 7.4180 7.5730 7.5730 7.6965 7.6965 7.9617 7.9617 8.2377 8.2377 8.4124 8.4124 9.7706 9.7706 9.9392 9.9392 11.0528 11.0528 11.2411 11.2411 13.2154 13.2154 13.8738 13.8747 k = 0.1136 0.5000-0.0000 ( 3190 PWs) bands (ev): -30.6835 -30.6835 -30.6615 -30.6615 -12.0941 -12.0941 -12.0801 -12.0801 -11.7765 -11.7765 -11.6965 -11.6965 -11.6006 -11.6006 -11.5162 -11.5162 -5.0362 -5.0362 -4.4174 -4.4174 2.7353 2.7353 4.8037 4.8037 5.0156 5.0156 5.3640 5.3640 5.7041 5.7041 5.9452 5.9452 6.6295 6.6295 7.3972 7.3972 7.4411 7.4411 7.6146 7.6146 7.7036 7.7036 7.9668 7.9668 8.2499 8.2499 8.4304 8.4304 9.7744 9.7744 9.9332 9.9332 11.0633 11.0633 11.2168 11.2168 13.1465 13.1465 13.8863 13.8864 k = 0.1250 0.5000-0.0000 ( 3194 PWs) bands (ev): -30.6831 -30.6831 -30.6611 -30.6611 -12.0944 -12.0944 -12.0797 -12.0797 -11.7756 -11.7756 -11.6996 -11.6996 -11.6049 -11.6049 -11.5171 -11.5171 -5.0192 -5.0192 -4.4142 -4.4142 2.7386 2.7386 4.8110 4.8110 4.9844 4.9844 5.3539 5.3539 5.5972 5.5972 5.9011 5.9011 6.6418 6.6418 7.4132 7.4132 7.4776 7.4776 7.6483 7.6483 7.7175 7.7175 7.9756 7.9756 8.2597 8.2597 8.4506 8.4506 9.7783 9.7783 9.9271 9.9271 11.0735 11.0735 11.1903 11.1903 13.0727 13.0727 13.8809 13.8810 k = 0.1364 0.5000-0.0000 ( 3202 PWs) bands (ev): -30.6827 -30.6827 -30.6607 -30.6607 -12.0946 -12.0946 -12.0794 -12.0794 -11.7748 -11.7748 -11.7031 -11.7031 -11.6094 -11.6094 -11.5181 -11.5181 -5.0007 -5.0007 -4.4107 -4.4107 2.7420 2.7420 4.8186 4.8186 4.9523 4.9523 5.3424 5.3424 5.4871 5.4871 5.8565 5.8565 6.6548 6.6548 7.4247 7.4247 7.5207 7.5207 7.6695 7.6695 7.7410 7.7410 7.9899 7.9899 8.2674 8.2674 8.4723 8.4723 9.7824 9.7824 9.9208 9.9208 11.0828 11.0828 11.1617 11.1617 12.9940 12.9940 13.8774 13.8774 k = 0.1477 0.5000-0.0000 ( 3200 PWs) bands (ev): -30.6822 -30.6822 -30.6602 -30.6602 -12.0949 -12.0949 -12.0791 -12.0791 -11.7739 -11.7739 -11.7067 -11.7067 -11.6142 -11.6142 -11.5190 -11.5190 -4.9809 -4.9809 -4.4071 -4.4071 2.7456 2.7456 4.8264 4.8264 4.9198 4.9198 5.3271 5.3271 5.3770 5.3770 5.8120 5.8120 6.6683 6.6683 7.4355 7.4355 7.5655 7.5655 7.6831 7.6831 7.7679 7.7679 8.0125 8.0125 8.2737 8.2737 8.4948 8.4948 9.7866 9.7866 9.9146 9.9146 11.0907 11.0907 11.1315 11.1315 12.9107 12.9107 13.8760 13.8760 k = 0.1591 0.5000-0.0000 ( 3202 PWs) bands (ev): -30.6817 -30.6817 -30.6598 -30.6598 -12.0951 -12.0951 -12.0788 -12.0788 -11.7730 -11.7730 -11.7105 -11.7105 -11.6192 -11.6192 -11.5198 -11.5198 -4.9599 -4.9599 -4.4032 -4.4032 2.7494 2.7494 4.8335 4.8335 4.8879 4.8879 5.2529 5.2529 5.3226 5.3226 5.7676 5.7676 6.6820 6.6820 7.4467 7.4467 7.6075 7.6075 7.6981 7.6981 7.7907 7.7907 8.0446 8.0446 8.2786 8.2786 8.5176 8.5176 9.7908 9.7908 9.9086 9.9086 11.0925 11.0925 11.1038 11.1038 12.8230 12.8230 13.8771 13.8771 k = 0.1705 0.5000-0.0000 ( 3202 PWs) bands (ev): -30.6812 -30.6812 -30.6593 -30.6593 -12.0955 -12.0955 -12.0786 -12.0786 -11.7721 -11.7721 -11.7144 -11.7144 -11.6244 -11.6244 -11.5206 -11.5206 -4.9376 -4.9376 -4.3992 -4.3992 2.7534 2.7534 4.8345 4.8345 4.8619 4.8619 5.1379 5.1379 5.3070 5.3070 5.7237 5.7237 6.6960 6.6960 7.4588 7.4588 7.6387 7.6387 7.7242 7.7242 7.8067 7.8067 8.0862 8.0862 8.2828 8.2828 8.5405 8.5405 9.7949 9.7949 9.9028 9.9028 11.0630 11.0630 11.1036 11.1036 12.7312 12.7312 13.8809 13.8809 k = 0.1818 0.5000-0.0000 ( 3202 PWs) bands (ev): -30.6807 -30.6807 -30.6588 -30.6588 -12.0958 -12.0958 -12.0785 -12.0785 -11.7714 -11.7714 -11.7184 -11.7184 -11.6298 -11.6298 -11.5213 -11.5213 -4.9142 -4.9142 -4.3951 -4.3951 2.7574 2.7574 4.8120 4.8120 4.8594 4.8594 5.0205 5.0205 5.2922 5.2922 5.6804 5.6804 6.7099 6.7099 7.4721 7.4721 7.6553 7.6553 7.7655 7.7655 7.8172 7.8172 8.1353 8.1353 8.2864 8.2864 8.5629 8.5629 9.7988 9.7988 9.8974 9.8974 11.0275 11.0275 11.1053 11.1053 12.6355 12.6355 13.8877 13.8877 k = 0.1932 0.5000-0.0000 ( 3200 PWs) bands (ev): -30.6801 -30.6801 -30.6582 -30.6582 -12.0962 -12.0962 -12.0784 -12.0784 -11.7707 -11.7707 -11.7224 -11.7224 -11.6352 -11.6352 -11.5219 -11.5219 -4.8897 -4.8897 -4.3909 -4.3909 2.7615 2.7615 4.7796 4.7796 4.8667 4.8667 4.9030 4.9030 5.2770 5.2770 5.6378 5.6378 6.7237 6.7237 7.4870 7.4870 7.6635 7.6635 7.8090 7.8090 7.8309 7.8309 8.1894 8.1894 8.2899 8.2899 8.5849 8.5849 9.8023 9.8023 9.8925 9.8925 10.9904 10.9904 11.1044 11.1044 12.5363 12.5363 13.8976 13.8976 k = 0.2045 0.5000-0.0000 ( 3196 PWs) bands (ev): -30.6795 -30.6795 -30.6577 -30.6577 -12.0967 -12.0967 -12.0784 -12.0784 -11.7702 -11.7702 -11.7263 -11.7263 -11.6407 -11.6407 -11.5224 -11.5224 -4.8643 -4.8643 -4.3866 -4.3866 2.7657 2.7657 4.7431 4.7431 4.7884 4.7884 4.8753 4.8753 5.2615 5.2615 5.5962 5.5962 6.7370 6.7370 7.5036 7.5036 7.6682 7.6682 7.8197 7.8197 7.8791 7.8791 8.2454 8.2454 8.2949 8.2949 8.6064 8.6064 9.8054 9.8054 9.8884 9.8884 10.9519 10.9519 11.1002 11.1002 12.4340 12.4340 13.9107 13.9107 k = 0.2159 0.5000-0.0000 ( 3192 PWs) bands (ev): -30.6790 -30.6790 -30.6571 -30.6571 -12.0972 -12.0972 -12.0785 -12.0785 -11.7700 -11.7700 -11.7300 -11.7300 -11.6463 -11.6463 -11.5228 -11.5228 -4.8380 -4.8380 -4.3822 -4.3822 2.7699 2.7699 4.6610 4.6610 4.7201 4.7201 4.8844 4.8844 5.2458 5.2458 5.5555 5.5555 6.7498 6.7498 7.5221 7.5221 7.6715 7.6715 7.8209 7.8209 7.9378 7.9378 8.2848 8.2848 8.3186 8.3186 8.6273 8.6273 9.8078 9.8078 9.8851 9.8851 10.9122 10.9122 11.0923 11.0923 12.3288 12.3288 13.9272 13.9272 k = 0.2273 0.5000-0.0000 ( 3192 PWs) bands (ev): -30.6784 -30.6784 -30.6566 -30.6566 -12.0978 -12.0978 -12.0787 -12.0787 -11.7703 -11.7703 -11.7334 -11.7334 -11.6518 -11.6518 -11.5232 -11.5232 -4.8109 -4.8109 -4.3778 -4.3778 2.7741 2.7741 4.5466 4.5466 4.6853 4.6853 4.8935 4.8935 5.2297 5.2297 5.5159 5.5159 6.7619 6.7619 7.5423 7.5423 7.6740 7.6740 7.8202 7.8202 7.9989 7.9989 8.2925 8.2925 8.3755 8.3755 8.6476 8.6476 9.8095 9.8095 9.8827 9.8827 10.8715 10.8715 11.0805 11.0805 12.2213 12.2213 13.9471 13.9471 k = 0.2386 0.5000-0.0000 ( 3188 PWs) bands (ev): -30.6778 -30.6778 -30.6560 -30.6560 -12.0984 -12.0984 -12.0790 -12.0790 -11.7710 -11.7710 -11.7362 -11.7362 -11.6574 -11.6574 -11.5235 -11.5235 -4.7832 -4.7832 -4.3734 -4.3734 2.7782 2.7782 4.4318 4.4318 4.6529 4.6529 4.9026 4.9026 5.2135 5.2135 5.4775 5.4775 6.7732 6.7732 7.5644 7.5644 7.6762 7.6762 7.8189 7.8189 8.0612 8.0612 8.2963 8.2963 8.4374 8.4374 8.6675 8.6675 9.8103 9.8103 9.8815 9.8815 10.8300 10.8300 11.0646 11.0646 12.1117 12.1117 13.9704 13.9704 k = 0.2500 0.5000-0.0000 ( 3190 PWs) bands (ev): -30.6772 -30.6772 -30.6554 -30.6554 -12.0991 -12.0991 -12.0795 -12.0795 -11.7723 -11.7723 -11.7384 -11.7384 -11.6629 -11.6629 -11.5237 -11.5237 -4.7550 -4.7550 -4.3690 -4.3690 2.7822 2.7822 4.3185 4.3185 4.6216 4.6216 4.9116 4.9116 5.1973 5.1973 5.4403 5.4403 6.7835 6.7835 7.5880 7.5880 7.6782 7.6782 7.8177 7.8177 8.1239 8.1239 8.3002 8.3002 8.5001 8.5001 8.6872 8.6872 9.8103 9.8103 9.8813 9.8813 10.7877 10.7877 11.0444 11.0444 12.0003 12.0003 13.9972 13.9972 k = 0.2614 0.5000-0.0000 ( 3190 PWs) bands (ev): -30.6766 -30.6766 -30.6548 -30.6548 -12.0998 -12.0998 -12.0800 -12.0800 -11.7743 -11.7743 -11.7399 -11.7399 -11.6684 -11.6684 -11.5238 -11.5238 -4.7264 -4.7264 -4.3647 -4.3647 2.7861 2.7861 4.2073 4.2073 4.5912 4.5912 4.9204 4.9204 5.1811 5.1811 5.4044 5.4044 6.7928 6.7928 7.6126 7.6126 7.6804 7.6804 7.8172 7.8172 8.1851 8.1851 8.3065 8.3065 8.5627 8.5627 8.7070 8.7070 9.8095 9.8095 9.8821 9.8821 10.7449 10.7449 11.0199 11.0199 11.8876 11.8876 14.0274 14.0274 k = 0.2727 0.5000-0.0000 ( 3194 PWs) bands (ev): -30.6760 -30.6760 -30.6543 -30.6543 -12.1006 -12.1006 -12.0807 -12.0807 -11.7769 -11.7769 -11.7408 -11.7408 -11.6737 -11.6737 -11.5239 -11.5239 -4.6976 -4.6976 -4.3604 -4.3604 2.7898 2.7898 4.0986 4.0986 4.5618 4.5618 4.9290 4.9290 5.1650 5.1650 5.3699 5.3699 6.8010 6.8010 7.6372 7.6372 7.6829 7.6829 7.8185 7.8185 8.2387 8.2387 8.3210 8.3210 8.6241 8.6241 8.7279 8.7279 9.8080 9.8080 9.8837 9.8837 10.7015 10.7015 10.9910 10.9910 11.7738 11.7738 14.0611 14.0611 k = 0.2841 0.5000-0.0000 ( 3194 PWs) bands (ev): -30.6754 -30.6754 -30.6537 -30.6537 -12.1015 -12.1015 -12.0814 -12.0814 -11.7799 -11.7799 -11.7411 -11.7411 -11.6790 -11.6790 -11.5238 -11.5238 -4.6686 -4.6686 -4.3562 -4.3562 2.7932 2.7932 3.9927 3.9927 4.5334 4.5334 4.9373 4.9373 5.1492 5.1492 5.3368 5.3368 6.8082 6.8082 7.6593 7.6593 7.6869 7.6869 7.8229 7.8229 8.2708 8.2708 8.3578 8.3578 8.6818 8.6818 8.7522 8.7522 9.8061 9.8061 9.8858 9.8858 10.6579 10.6579 10.9578 10.9578 11.6594 11.6594 14.0980 14.0980 k = 0.2955 0.5000-0.0000 ( 3188 PWs) bands (ev): -30.6748 -30.6748 -30.6531 -30.6531 -12.1024 -12.1024 -12.0823 -12.0823 -11.7831 -11.7831 -11.7410 -11.7410 -11.6840 -11.6840 -11.5238 -11.5238 -4.6397 -4.6397 -4.3521 -4.3521 2.7965 2.7965 3.8902 3.8902 4.5061 4.5061 4.9453 4.9453 5.1337 5.1337 5.3052 5.3052 6.8144 6.8144 7.6742 7.6742 7.6952 7.6952 7.8324 7.8324 8.2830 8.2830 8.4150 8.4150 8.7290 8.7290 8.7866 8.7866 9.8041 9.8041 9.8885 9.8885 10.6139 10.6139 10.9206 10.9206 11.5445 11.5445 14.1380 14.1380 k = 0.3068 0.5000-0.0000 ( 3196 PWs) bands (ev): -30.6743 -30.6743 -30.6526 -30.6526 -12.1034 -12.1034 -12.0833 -12.0833 -11.7866 -11.7866 -11.7405 -11.7405 -11.6889 -11.6889 -11.5237 -11.5237 -4.6109 -4.6109 -4.3481 -4.3481 2.7993 2.7993 3.7914 3.7914 4.4798 4.4798 4.9529 4.9529 5.1186 5.1186 5.2751 5.2751 6.8195 6.8195 7.6804 7.6804 7.7069 7.7069 7.8490 7.8490 8.2882 8.2882 8.4794 8.4794 8.7608 8.7608 8.8363 8.8363 9.8019 9.8019 9.8913 9.8913 10.5698 10.5698 10.8794 10.8794 11.4296 11.4296 14.1811 14.1811 k = 0.3182 0.5000-0.0000 ( 3196 PWs) bands (ev): -30.6737 -30.6737 -30.6521 -30.6521 -12.1043 -12.1043 -12.0843 -12.0843 -11.7901 -11.7901 -11.7399 -11.7399 -11.6937 -11.6937 -11.5235 -11.5235 -4.5825 -4.5825 -4.3443 -4.3443 2.8017 2.8017 3.6965 3.6965 4.4549 4.4549 4.9601 4.9601 5.1040 5.1040 5.2465 5.2465 6.8238 6.8238 7.6835 7.6835 7.7159 7.7159 7.8733 7.8733 8.2913 8.2913 8.5461 8.5461 8.7851 8.7851 8.8935 8.8935 9.7996 9.7996 9.8943 9.8943 10.5256 10.5256 10.8346 10.8346 11.3148 11.3148 14.2269 14.2269 k = 0.3295 0.5000-0.0000 ( 3196 PWs) bands (ev): -30.6732 -30.6732 -30.6516 -30.6516 -12.1054 -12.1054 -12.0854 -12.0854 -11.7935 -11.7935 -11.7391 -11.7391 -11.6982 -11.6982 -11.5233 -11.5233 -4.5547 -4.5547 -4.3406 -4.3406 2.8035 2.8035 3.6061 3.6061 4.4314 4.4314 4.9669 4.9669 5.0900 5.0900 5.2195 5.2195 6.8272 6.8272 7.6857 7.6857 7.7208 7.7208 7.9041 7.9041 8.2935 8.2935 8.6136 8.6136 8.8079 8.8079 8.9526 8.9526 9.7976 9.7976 9.8973 9.8973 10.4813 10.4813 10.7864 10.7864 11.2006 11.2006 14.2752 14.2752 k = 0.3409 0.5000-0.0000 ( 3198 PWs) bands (ev): -30.6726 -30.6726 -30.6511 -30.6511 -12.1064 -12.1064 -12.0866 -12.0866 -11.7969 -11.7969 -11.7382 -11.7382 -11.7024 -11.7024 -11.5231 -11.5231 -4.5275 -4.5275 -4.3370 -4.3370 2.8047 2.8047 3.5205 3.5205 4.4090 4.4090 4.9733 4.9733 5.0766 5.0766 5.1942 5.1942 6.8299 6.8299 7.6876 7.6876 7.7224 7.7224 7.9395 7.9395 8.2953 8.2953 8.6805 8.6805 8.8317 8.8317 9.0119 9.0119 9.7957 9.7957 9.9003 9.9003 10.4370 10.4370 10.7351 10.7351 11.0872 11.0872 14.3258 14.3259 k = 0.3523 0.5000-0.0000 ( 3194 PWs) bands (ev): -30.6721 -30.6721 -30.6506 -30.6506 -12.1075 -12.1075 -12.0878 -12.0878 -11.8000 -11.8000 -11.7373 -11.7373 -11.7064 -11.7064 -11.5229 -11.5229 -4.5012 -4.5012 -4.3337 -4.3337 2.8052 2.8052 3.4401 3.4401 4.3881 4.3881 4.9792 4.9792 5.0639 5.0639 5.1705 5.1705 6.8319 6.8319 7.6893 7.6893 7.7221 7.7221 7.9778 7.9778 8.2968 8.2968 8.7455 8.7455 8.8587 8.8587 9.0707 9.0707 9.7940 9.7940 9.9032 9.9032 10.3929 10.3929 10.6811 10.6811 10.9749 10.9749 14.3783 14.3783 k = 0.3636 0.5000-0.0000 ( 3206 PWs) bands (ev): -30.6717 -30.6717 -30.6502 -30.6502 -12.1086 -12.1086 -12.0891 -12.0891 -11.8030 -11.8030 -11.7364 -11.7364 -11.7102 -11.7102 -11.5226 -11.5226 -4.4759 -4.4759 -4.3305 -4.3305 2.8047 2.8047 3.3653 3.3653 4.3685 4.3685 4.9846 4.9846 5.0519 5.0519 5.1484 5.1484 6.8334 6.8334 7.6908 7.6908 7.7205 7.7205 8.0173 8.0173 8.2983 8.2983 8.8052 8.8052 8.8924 8.8924 9.1286 9.1286 9.7927 9.7927 9.9059 9.9059 10.3488 10.3488 10.6246 10.6246 10.8641 10.8641 14.4322 14.4322 k = 0.3750 0.5000-0.0000 ( 3210 PWs) bands (ev): -30.6713 -30.6713 -30.6497 -30.6497 -12.1097 -12.1097 -12.0904 -12.0904 -11.8059 -11.8059 -11.7355 -11.7355 -11.7136 -11.7136 -11.5224 -11.5224 -4.4518 -4.4518 -4.3276 -4.3276 2.8030 2.8030 3.2966 3.2966 4.3503 4.3503 4.9894 4.9894 5.0409 5.0409 5.1281 5.1281 6.8343 6.8343 7.6922 7.6922 7.7183 7.7183 8.0571 8.0571 8.2999 8.2999 8.8548 8.8548 8.9378 8.9378 9.1856 9.1856 9.7917 9.7917 9.9085 9.9085 10.3049 10.3049 10.5661 10.5661 10.7551 10.7551 14.4871 14.4885 k = 0.3864 0.5000-0.0000 ( 3206 PWs) bands (ev): -30.6708 -30.6708 -30.6494 -30.6494 -12.1107 -12.1107 -12.0916 -12.0916 -11.8084 -11.8084 -11.7346 -11.7346 -11.7168 -11.7168 -11.5221 -11.5221 -4.4292 -4.4292 -4.3248 -4.3248 2.8001 2.8001 3.2344 3.2344 4.3337 4.3337 4.9936 4.9936 5.0309 5.0309 5.1095 5.1095 6.8350 6.8350 7.6936 7.6936 7.7159 7.7159 8.0961 8.0961 8.3017 8.3017 8.8946 8.8946 8.9951 8.9951 9.2414 9.2414 9.7913 9.7913 9.9109 9.9109 10.2612 10.2612 10.5058 10.5058 10.6484 10.6484 14.5752 14.5879 k = 0.3977 0.5000-0.0000 ( 3206 PWs) bands (ev): -30.6705 -30.6705 -30.6490 -30.6490 -12.1117 -12.1117 -12.0927 -12.0927 -11.8107 -11.8107 -11.7338 -11.7338 -11.7196 -11.7196 -11.5219 -11.5219 -4.4081 -4.4081 -4.3223 -4.3223 2.7956 2.7956 3.1792 3.1792 4.3186 4.3186 4.9967 4.9967 5.0224 5.0224 5.0926 5.0926 6.8353 6.8353 7.6949 7.6949 7.7133 7.7133 8.1331 8.1331 8.3039 8.3039 8.9301 8.9301 9.0586 9.0586 9.2960 9.2960 9.7914 9.7914 9.9131 9.9131 10.2177 10.2177 10.4441 10.4441 10.5444 10.5444 14.5929 14.5929 k = 0.4091 0.5000-0.0000 ( 3198 PWs) bands (ev): -30.6701 -30.6701 -30.6487 -30.6487 -12.1126 -12.1126 -12.0938 -12.0938 -11.8128 -11.8128 -11.7330 -11.7330 -11.7221 -11.7221 -11.5216 -11.5216 -4.3887 -4.3887 -4.3200 -4.3200 2.7893 2.7893 3.1314 3.1314 4.3050 4.3050 4.9981 4.9981 5.0161 5.0161 5.0775 5.0775 6.8355 6.8355 7.6961 7.6961 7.7107 7.7107 8.1672 8.1672 8.3067 8.3067 8.9652 8.9652 9.1242 9.1242 9.3491 9.3491 9.7922 9.7922 9.9151 9.9151 10.1746 10.1746 10.3814 10.3814 10.4436 10.4436 14.5968 14.5968 k = 0.4205 0.5000-0.0000 ( 3196 PWs) bands (ev): -30.6698 -30.6698 -30.6484 -30.6484 -12.1135 -12.1135 -12.0948 -12.0948 -11.8146 -11.8146 -11.7324 -11.7324 -11.7243 -11.7243 -11.5214 -11.5214 -4.3713 -4.3713 -4.3179 -4.3179 2.7813 2.7813 3.0912 3.0912 4.2930 4.2930 4.9962 4.9962 5.0135 5.0135 5.0642 5.0642 6.8354 6.8354 7.6972 7.6972 7.7083 7.7083 8.1973 8.1973 8.3105 8.3105 9.0016 9.0016 9.1899 9.1899 9.4006 9.4006 9.7939 9.7939 9.9168 9.9168 10.1320 10.1320 10.3181 10.3181 10.3469 10.3469 14.6003 14.6003 k = 0.4318 0.5000-0.0000 ( 3196 PWs) bands (ev): -30.6696 -30.6696 -30.6481 -30.6481 -12.1143 -12.1143 -12.0957 -12.0957 -11.8162 -11.8162 -11.7320 -11.7320 -11.7261 -11.7261 -11.5212 -11.5212 -4.3559 -4.3559 -4.3160 -4.3160 2.7718 2.7718 3.0586 3.0586 4.2825 4.2825 4.9919 4.9919 5.0138 5.0138 5.0526 5.0526 6.8352 6.8352 7.6981 7.6981 7.7061 7.7061 8.2224 8.2224 8.3157 8.3157 9.0395 9.0395 9.2544 9.2544 9.4502 9.4502 9.7970 9.7970 9.9184 9.9184 10.0900 10.0900 10.2543 10.2543 10.2554 10.2554 14.6034 14.6034 k = 0.4432 0.5000-0.0000 ( 3196 PWs) bands (ev): -30.6693 -30.6693 -30.6479 -30.6479 -12.1150 -12.1150 -12.0965 -12.0965 -11.8175 -11.8175 -11.7318 -11.7318 -11.7274 -11.7274 -11.5210 -11.5210 -4.3428 -4.3428 -4.3142 -4.3142 2.7613 2.7613 3.0331 3.0331 4.2736 4.2736 4.9871 4.9871 5.0151 5.0151 5.0428 5.0428 6.8350 6.8350 7.6989 7.6989 7.7042 7.7042 8.2415 8.2415 8.3227 8.3227 9.0785 9.0785 9.3164 9.3164 9.4974 9.4974 9.8020 9.8020 9.9196 9.9196 10.0491 10.0491 10.1694 10.1694 10.1916 10.1916 14.6060 14.6060 k = 0.4545 0.5000-0.0000 ( 3208 PWs) bands (ev): -30.6691 -30.6691 -30.6477 -30.6477 -12.1156 -12.1156 -12.0973 -12.0973 -11.8186 -11.8186 -11.7320 -11.7320 -11.7282 -11.7282 -11.5209 -11.5209 -4.3321 -4.3321 -4.3125 -4.3125 2.7507 2.7507 3.0139 3.0139 4.2663 4.2663 4.9827 4.9827 5.0164 5.0164 5.0348 5.0348 6.8347 6.8347 7.6996 7.6996 7.7026 7.7026 8.2548 8.2548 8.3310 8.3310 9.1171 9.1171 9.3742 9.3742 9.5415 9.5415 9.8097 9.8097 9.9206 9.9206 10.0099 10.0099 10.0918 10.0918 10.1298 10.1298 14.6082 14.6082 k = 0.4659 0.5000-0.0000 ( 3200 PWs) bands (ev): -30.6690 -30.6690 -30.6476 -30.6476 -12.1161 -12.1161 -12.0978 -12.0978 -11.8194 -11.8194 -11.7325 -11.7325 -11.7285 -11.7285 -11.5207 -11.5207 -4.3242 -4.3242 -4.3108 -4.3108 2.7411 2.7411 3.0004 3.0004 4.2606 4.2606 4.9792 4.9792 5.0176 5.0176 5.0287 5.0287 6.8344 6.8344 7.7001 7.7001 7.7014 7.7014 8.2633 8.2633 8.3395 8.3395 9.1532 9.1532 9.4256 9.4256 9.5812 9.5812 9.8214 9.8214 9.9214 9.9214 9.9739 9.9739 10.0247 10.0247 10.0704 10.0704 14.6100 14.6100 k = 0.4773 0.5000-0.0000 ( 3196 PWs) bands (ev): -30.6689 -30.6689 -30.6474 -30.6474 -12.1164 -12.1164 -12.0982 -12.0982 -11.8200 -11.8200 -11.7329 -11.7329 -11.7284 -11.7284 -11.5207 -11.5207 -4.3193 -4.3193 -4.3087 -4.3087 2.7335 2.7335 2.9913 2.9913 4.2565 4.2565 4.9767 4.9767 5.0183 5.0183 5.0246 5.0246 6.8343 6.8343 7.7002 7.7002 7.7008 7.7008 8.2682 8.2682 8.3467 8.3467 9.1834 9.1834 9.4672 9.4672 9.6144 9.6144 9.8381 9.8381 9.9218 9.9218 9.9437 9.9437 9.9718 9.9718 10.0151 10.0151 14.6112 14.6112 k = 0.4886 0.5000-0.0000 ( 3200 PWs) bands (ev): -30.6688 -30.6688 -30.6474 -30.6474 -12.1167 -12.1167 -12.0984 -12.0984 -11.8204 -11.8204 -11.7332 -11.7332 -11.7284 -11.7284 -11.5206 -11.5206 -4.3168 -4.3168 -4.3069 -4.3069 2.7286 2.7286 2.9862 2.9862 4.2541 4.2541 4.9752 4.9752 5.0183 5.0183 5.0223 5.0223 6.8341 6.8341 7.6997 7.6997 7.7008 7.7008 8.2708 8.2708 8.3514 8.3514 9.2040 9.2040 9.4949 9.4949 9.6374 9.6374 9.8584 9.8584 9.9208 9.9208 9.9257 9.9257 9.9375 9.9375 9.9670 9.9670 14.6120 14.6120 k = 0.5000 0.5000-0.0000 ( 3204 PWs) bands (ev): -30.6688 -30.6688 -30.6474 -30.6474 -12.1167 -12.1167 -12.0985 -12.0985 -11.8205 -11.8205 -11.7333 -11.7333 -11.7284 -11.7284 -11.5206 -11.5206 -4.3162 -4.3162 -4.3062 -4.3062 2.7269 2.7269 2.9846 2.9846 4.2533 4.2533 4.9746 4.9746 5.0182 5.0182 5.0218 5.0218 6.8341 6.8341 7.6995 7.6995 7.7009 7.7009 8.2716 8.2716 8.3530 8.3530 9.2114 9.2114 9.5047 9.5047 9.6458 9.6458 9.8700 9.8700 9.9207 9.9207 9.9227 9.9227 9.9292 9.9292 9.9377 9.9377 14.6122 14.6122 k = 0.5000 0.5000-0.0000 ( 3204 PWs) bands (ev): -30.6688 -30.6688 -30.6474 -30.6474 -12.1167 -12.1167 -12.0985 -12.0985 -11.8205 -11.8205 -11.7333 -11.7333 -11.7284 -11.7284 -11.5206 -11.5206 -4.3162 -4.3162 -4.3062 -4.3062 2.7269 2.7269 2.9846 2.9846 4.2533 4.2533 4.9746 4.9746 5.0182 5.0182 5.0218 5.0218 6.8341 6.8341 7.6995 7.6995 7.7009 7.7009 8.2716 8.2716 8.3530 8.3530 9.2114 9.2114 9.5047 9.5047 9.6458 9.6458 9.8700 9.8700 9.9207 9.9207 9.9227 9.9227 9.9292 9.9292 9.9377 9.9377 14.6122 14.6122 k = 0.4921 0.4921-0.0000 ( 3202 PWs) bands (ev): -30.6688 -30.6688 -30.6474 -30.6474 -12.1167 -12.1167 -12.0984 -12.0984 -11.8204 -11.8204 -11.7332 -11.7332 -11.7284 -11.7284 -11.5206 -11.5206 -4.3169 -4.3169 -4.3069 -4.3069 2.7286 2.7286 2.9862 2.9862 4.2541 4.2541 4.9751 4.9751 5.0185 5.0185 5.0221 5.0221 6.8341 6.8341 7.6996 7.6996 7.7009 7.7009 8.2708 8.2708 8.3514 8.3514 9.2041 9.2041 9.4952 9.4952 9.6376 9.6376 9.8588 9.8588 9.9176 9.9176 9.9258 9.9258 9.9406 9.9406 9.9658 9.9658 14.6120 14.6120 k = 0.4841 0.4841-0.0000 ( 3198 PWs) bands (ev): -30.6689 -30.6689 -30.6474 -30.6474 -12.1164 -12.1164 -12.0982 -12.0982 -11.8200 -11.8200 -11.7329 -11.7329 -11.7285 -11.7285 -11.5207 -11.5207 -4.3189 -4.3189 -4.3089 -4.3089 2.7336 2.7336 2.9909 2.9909 4.2565 4.2565 4.9767 4.9767 5.0194 5.0194 5.0233 5.0233 6.8343 6.8343 7.6996 7.6996 7.7013 7.7013 8.2686 8.2686 8.3466 8.3466 9.1834 9.1834 9.4699 9.4699 9.6152 9.6152 9.8383 9.8383 9.9117 9.9117 9.9480 9.9480 9.9741 9.9741 10.0145 10.0145 14.6112 14.6112 k = 0.4762 0.4762-0.0000 ( 3206 PWs) bands (ev): -30.6690 -30.6690 -30.6476 -30.6476 -12.1161 -12.1161 -12.0978 -12.0978 -11.8194 -11.8194 -11.7324 -11.7324 -11.7286 -11.7286 -11.5208 -11.5208 -4.3224 -4.3224 -4.3123 -4.3123 2.7419 2.7419 2.9989 2.9989 4.2604 4.2604 4.9792 4.9792 5.0205 5.0205 5.0256 5.0256 6.8344 6.8344 7.6993 7.6993 7.7021 7.7021 8.2647 8.2647 8.3385 8.3385 9.1516 9.1516 9.4344 9.4344 9.5835 9.5835 9.8186 9.8186 9.9042 9.9042 9.9829 9.9829 10.0216 10.0216 10.0743 10.0743 14.6099 14.6099 k = 0.4683 0.4683-0.0000 ( 3198 PWs) bands (ev): -30.6691 -30.6691 -30.6477 -30.6477 -12.1156 -12.1156 -12.0972 -12.0972 -11.8186 -11.8186 -11.7315 -11.7315 -11.7287 -11.7287 -11.5209 -11.5209 -4.3274 -4.3274 -4.3168 -4.3168 2.7535 2.7535 3.0100 3.0100 4.2660 4.2660 4.9828 4.9828 5.0218 5.0218 5.0291 5.0291 6.8346 6.8346 7.6989 7.6989 7.7033 7.7033 8.2593 8.2593 8.3273 8.3273 9.1116 9.1116 9.3938 9.3938 9.5465 9.5465 9.8009 9.8009 9.8942 9.8942 10.0250 10.0250 10.0793 10.0793 10.1423 10.1423 14.6081 14.6081 k = 0.4603 0.4603-0.0000 ( 3202 PWs) bands (ev): -30.6693 -30.6693 -30.6479 -30.6479 -12.1150 -12.1150 -12.0966 -12.0966 -11.8176 -11.8176 -11.7306 -11.7306 -11.7288 -11.7288 -11.5210 -11.5210 -4.3340 -4.3340 -4.3225 -4.3225 2.7684 2.7684 3.0242 3.0242 4.2731 4.2731 4.9873 4.9873 5.0232 5.0232 5.0338 5.0338 6.8349 6.8349 7.6983 7.6983 7.7049 7.7049 8.2520 8.2520 8.3131 8.3131 9.0663 9.0663 9.3514 9.3514 9.5062 9.5062 9.7844 9.7844 9.8815 9.8815 10.0714 10.0714 10.1442 10.1442 10.2168 10.2168 14.6056 14.6056 k = 0.4524 0.4524-0.0000 ( 3202 PWs) bands (ev): -30.6695 -30.6695 -30.6481 -30.6481 -12.1143 -12.1143 -12.0957 -12.0957 -11.8163 -11.8163 -11.7293 -11.7293 -11.7289 -11.7289 -11.5212 -11.5212 -4.3421 -4.3421 -4.3292 -4.3292 2.7866 2.7866 3.0416 3.0416 4.2818 4.2818 4.9927 4.9927 5.0249 5.0249 5.0396 5.0396 6.8350 6.8350 7.6975 7.6975 7.7068 7.7068 8.2427 8.2427 8.2960 8.2960 9.0181 9.0181 9.3090 9.3090 9.4641 9.4641 9.7682 9.7682 9.8662 9.8662 10.1210 10.1210 10.2145 10.2145 10.2963 10.2963 14.6023 14.6023 k = 0.4444 0.4444-0.0000 ( 3202 PWs) bands (ev): -30.6698 -30.6698 -30.6483 -30.6483 -12.1135 -12.1135 -12.0947 -12.0947 -11.8149 -11.8149 -11.7290 -11.7290 -11.7279 -11.7279 -11.5214 -11.5214 -4.3519 -4.3519 -4.3368 -4.3368 2.8080 2.8080 3.0620 3.0620 4.2920 4.2920 4.9991 4.9991 5.0269 5.0269 5.0466 5.0466 6.8351 6.8351 7.6967 7.6967 7.7092 7.7092 8.2312 8.2312 8.2763 8.2763 8.9689 8.9689 9.2677 9.2677 9.4208 9.4208 9.7517 9.7517 9.8483 9.8483 10.1728 10.1728 10.2887 10.2887 10.3797 10.3797 14.5981 14.5981 k = 0.4365 0.4365-0.0000 ( 3208 PWs) bands (ev): -30.6701 -30.6701 -30.6486 -30.6486 -12.1126 -12.1126 -12.0935 -12.0935 -11.8132 -11.8132 -11.7292 -11.7292 -11.7263 -11.7263 -11.5216 -11.5216 -4.3632 -4.3632 -4.3454 -4.3454 2.8326 2.8326 3.0854 3.0854 4.3038 4.3038 5.0062 5.0062 5.0294 5.0294 5.0547 5.0547 6.8350 6.8350 7.6957 7.6957 7.7118 7.7118 8.2173 8.2173 8.2541 8.2541 8.9200 8.9200 9.2280 9.2280 9.3766 9.3766 9.7345 9.7345 9.8278 9.8278 10.2266 10.2266 10.3660 10.3660 10.4662 10.4662 14.5927 14.5927 k = 0.4286 0.4286-0.0000 ( 3216 PWs) bands (ev): -30.6705 -30.6705 -30.6490 -30.6490 -12.1116 -12.1116 -12.0921 -12.0921 -11.8114 -11.8114 -11.7293 -11.7293 -11.7244 -11.7244 -11.5219 -11.5219 -4.3760 -4.3760 -4.3548 -4.3548 2.8603 2.8603 3.1118 3.1118 4.3171 4.3171 5.0137 5.0137 5.0327 5.0327 5.0638 5.0638 6.8347 6.8347 7.6947 7.6947 7.7146 7.7146 8.2008 8.2008 8.2297 8.2297 8.8727 8.8727 9.1901 9.1901 9.3318 9.3318 9.7161 9.7161 9.8049 9.8049 10.2822 10.2822 10.4458 10.4458 10.5550 10.5550 14.5858 14.5858 k = 0.4206 0.4206-0.0000 ( 3220 PWs) bands (ev): -30.6709 -30.6709 -30.6493 -30.6493 -12.1105 -12.1105 -12.0906 -12.0906 -11.8093 -11.8093 -11.7294 -11.7294 -11.7224 -11.7224 -11.5223 -11.5223 -4.3904 -4.3904 -4.3651 -4.3651 2.8911 2.8911 3.1412 3.1412 4.3320 4.3320 5.0209 5.0209 5.0375 5.0375 5.0740 5.0740 6.8340 6.8340 7.6937 7.6937 7.7177 7.7177 8.1814 8.1814 8.2036 8.2036 8.8279 8.8279 9.1542 9.1542 9.2864 9.2864 9.6965 9.6965 9.7795 9.7795 10.3394 10.3394 10.5277 10.5277 10.6456 10.6456 14.5768 14.5771 k = 0.4127 0.4127-0.0000 ( 3212 PWs) bands (ev): -30.6713 -30.6713 -30.6498 -30.6498 -12.1093 -12.1093 -12.0889 -12.0889 -11.8069 -11.8069 -11.7295 -11.7295 -11.7201 -11.7201 -11.5226 -11.5226 -4.4061 -4.4061 -4.3762 -4.3762 2.9250 2.9250 3.1734 3.1734 4.3484 4.3484 5.0267 5.0267 5.0449 5.0449 5.0854 5.0854 6.8331 6.8331 7.6927 7.6927 7.7211 7.7211 8.1589 8.1589 8.1762 8.1762 8.7861 8.7861 9.1203 9.1203 9.2406 9.2406 9.6755 9.6755 9.7519 9.7519 10.3981 10.3981 10.6111 10.6111 10.7374 10.7374 14.5515 14.5644 k = 0.4048 0.4048-0.0000 ( 3208 PWs) bands (ev): -30.6717 -30.6717 -30.6502 -30.6502 -12.1081 -12.1081 -12.0870 -12.0870 -11.8044 -11.8044 -11.7296 -11.7296 -11.7177 -11.7177 -11.5229 -11.5229 -4.4231 -4.4231 -4.3881 -4.3881 2.9619 2.9619 3.2085 3.2085 4.3663 4.3663 5.0311 5.0311 5.0550 5.0550 5.0977 5.0977 6.8316 6.8316 7.6917 7.6917 7.7245 7.7245 8.1333 8.1333 8.1477 8.1477 8.7479 8.7479 9.0882 9.0882 9.1943 9.1943 9.6529 9.6529 9.7220 9.7220 10.4581 10.4581 10.6958 10.6958 10.8301 10.8301 14.4624 14.5383 k = 0.3968 0.3968-0.0000 ( 3204 PWs) bands (ev): -30.6722 -30.6722 -30.6507 -30.6507 -12.1068 -12.1068 -12.0849 -12.0849 -11.8017 -11.8017 -11.7296 -11.7296 -11.7150 -11.7150 -11.5233 -11.5233 -4.4414 -4.4414 -4.4008 -4.4008 3.0017 3.0017 3.2463 3.2463 4.3857 4.3857 5.0347 5.0347 5.0670 5.0670 5.1111 5.1111 6.8296 6.8296 7.6907 7.6907 7.7281 7.7281 8.1048 8.1048 8.1185 8.1185 8.7133 8.7133 9.0574 9.0574 9.1479 9.1479 9.6288 9.6288 9.6901 9.6901 10.5195 10.5195 10.7814 10.7814 10.9230 10.9230 14.4036 14.4174 k = 0.3889 0.3889-0.0000 ( 3212 PWs) bands (ev): -30.6727 -30.6727 -30.6512 -30.6512 -12.1056 -12.1056 -12.0827 -12.0827 -11.7989 -11.7989 -11.7296 -11.7296 -11.7122 -11.7122 -11.5237 -11.5237 -4.4609 -4.4609 -4.4141 -4.4141 3.0444 3.0444 3.2867 3.2867 4.4064 4.4064 5.0378 5.0378 5.0805 5.0805 5.1255 5.1255 6.8269 6.8269 7.6897 7.6897 7.7315 7.7315 8.0739 8.0739 8.0885 8.0885 8.6824 8.6824 9.0277 9.0277 9.1012 9.1012 9.6030 9.6030 9.6562 9.6562 10.5820 10.5820 10.8678 10.8678 11.0158 11.0158 14.3451 14.3451 k = 0.3810 0.3810-0.0000 ( 3212 PWs) bands (ev): -30.6733 -30.6733 -30.6517 -30.6517 -12.1043 -12.1043 -12.0802 -12.0802 -11.7959 -11.7959 -11.7295 -11.7295 -11.7092 -11.7092 -11.5241 -11.5241 -4.4815 -4.4815 -4.4282 -4.4282 3.0899 3.0899 3.3298 3.3298 4.4285 4.4285 5.0408 5.0408 5.0954 5.0954 5.1409 5.1409 6.8235 6.8235 7.6887 7.6887 7.7348 7.7348 8.0410 8.0410 8.0583 8.0583 8.6552 8.6552 8.9984 8.9984 9.0551 9.0551 9.5756 9.5756 9.6206 9.6206 10.6457 10.6457 10.9545 10.9545 11.1081 11.1081 14.2873 14.2880 k = 0.3730 0.3730-0.0000 ( 3204 PWs) bands (ev): -30.6739 -30.6739 -30.6523 -30.6523 -12.1030 -12.1030 -12.0776 -12.0776 -11.7928 -11.7928 -11.7293 -11.7293 -11.7060 -11.7060 -11.5244 -11.5244 -4.5032 -4.5032 -4.4428 -4.4428 3.1381 3.1381 3.3754 3.3754 4.4521 4.4521 5.0437 5.0437 5.1114 5.1114 5.1574 5.1574 6.8193 6.8193 7.6878 7.6878 7.7377 7.7377 8.0065 8.0065 8.0284 8.0284 8.6313 8.6313 8.9680 8.9680 9.0106 9.0106 9.5463 9.5463 9.5834 9.5834 10.7103 10.7103 11.0414 11.0414 11.1994 11.1994 14.2297 14.2298 k = 0.3651 0.3651-0.0000 ( 3200 PWs) bands (ev): -30.6745 -30.6745 -30.6528 -30.6528 -12.1017 -12.1017 -12.0748 -12.0748 -11.7895 -11.7895 -11.7290 -11.7290 -11.7026 -11.7026 -11.5248 -11.5248 -4.5259 -4.5259 -4.4580 -4.4580 3.1890 3.1890 3.4234 3.4234 4.4771 4.4771 5.0466 5.0466 5.1287 5.1287 5.1749 5.1749 6.8141 6.8141 7.6868 7.6868 7.7400 7.7400 7.9709 7.9709 7.9992 7.9992 8.6103 8.6103 8.9333 8.9333 8.9710 8.9710 9.5150 9.5150 9.5450 9.5450 10.7758 10.7758 11.1281 11.1281 11.2892 11.2892 14.1725 14.1725 k = 0.3571 0.3571-0.0000 ( 3194 PWs) bands (ev): -30.6751 -30.6751 -30.6534 -30.6534 -12.1005 -12.1005 -12.0719 -12.0719 -11.7862 -11.7862 -11.7286 -11.7286 -11.6990 -11.6990 -11.5253 -11.5253 -4.5496 -4.5496 -4.4736 -4.4736 3.2424 3.2424 3.4738 3.4738 4.5035 4.5035 5.0494 5.0494 5.1470 5.1470 5.1934 5.1934 6.8080 6.8080 7.6857 7.6857 7.7411 7.7411 7.9348 7.9348 7.9715 7.9715 8.5919 8.5919 8.8918 8.8918 8.9384 8.9384 9.4810 9.4810 9.5061 9.5061 10.8420 10.8420 11.2144 11.2144 11.3772 11.3772 14.1159 14.1160 k = 0.3492 0.3492-0.0000 ( 3190 PWs) bands (ev): -30.6758 -30.6758 -30.6541 -30.6541 -12.0993 -12.0993 -12.0688 -12.0688 -11.7828 -11.7828 -11.7280 -11.7280 -11.6953 -11.6953 -11.5257 -11.5257 -4.5741 -4.5741 -4.4897 -4.4897 3.2984 3.2984 3.5264 3.5264 4.5311 4.5311 5.0521 5.0521 5.1664 5.1664 5.2128 5.2128 6.8008 6.8008 7.6842 7.6842 7.7403 7.7403 7.8993 7.8993 7.9456 7.9456 8.5757 8.5757 8.8457 8.8457 8.9106 8.9106 9.4438 9.4438 9.4675 9.4675 10.9087 10.9087 11.3000 11.3000 11.4626 11.4626 14.0601 14.0601 k = 0.3413 0.3413-0.0000 ( 3186 PWs) bands (ev): -30.6765 -30.6765 -30.6547 -30.6547 -12.0981 -12.0981 -12.0655 -12.0655 -11.7793 -11.7793 -11.7272 -11.7272 -11.6915 -11.6915 -11.5261 -11.5261 -4.5994 -4.5994 -4.5062 -4.5062 3.3568 3.3568 3.5813 3.5813 4.5600 4.5600 5.0547 5.0547 5.1869 5.1869 5.2332 5.2332 6.7925 6.7925 7.6821 7.6821 7.7364 7.7364 7.8659 7.8659 7.9222 7.9222 8.5612 8.5612 8.7978 8.7978 8.8848 8.8848 9.4030 9.4030 9.4296 9.4296 10.9756 10.9756 11.3844 11.3844 11.5450 11.5450 14.0054 14.0054 k = 0.3333 0.3333-0.0000 ( 3186 PWs) bands (ev): -30.6772 -30.6772 -30.6554 -30.6554 -12.0970 -12.0970 -12.0621 -12.0621 -11.7759 -11.7759 -11.7262 -11.7262 -11.6875 -11.6875 -11.5266 -11.5266 -4.6254 -4.6254 -4.5230 -4.5230 3.4174 3.4174 3.6382 3.6382 4.5902 4.5902 5.0573 5.0573 5.2085 5.2085 5.2547 5.2547 6.7831 6.7831 7.6786 7.6786 7.7279 7.7279 7.8366 7.8366 7.9020 7.9020 8.5478 8.5478 8.7492 8.7492 8.8599 8.8599 9.3594 9.3594 9.3917 9.3917 11.0427 11.0427 11.4674 11.4674 11.6240 11.6240 13.9519 13.9519 k = 0.3254 0.3254-0.0000 ( 3186 PWs) bands (ev): -30.6780 -30.6780 -30.6561 -30.6561 -12.0960 -12.0960 -12.0586 -12.0586 -11.7725 -11.7725 -11.7250 -11.7250 -11.6835 -11.6835 -11.5269 -11.5269 -4.6521 -4.6521 -4.5401 -4.5401 3.4803 3.4803 3.6972 3.6972 4.6216 4.6216 5.0596 5.0596 5.2311 5.2311 5.2770 5.2770 6.7725 6.7725 7.6721 7.6721 7.7142 7.7142 7.8132 7.8132 7.8857 7.8857 8.5352 8.5352 8.7007 8.7007 8.8353 8.8353 9.3136 9.3136 9.3533 9.3533 11.1097 11.1097 11.5484 11.5484 11.6988 11.6988 13.8996 13.8996 k = 0.3175 0.3175-0.0000 ( 3194 PWs) bands (ev): -30.6788 -30.6788 -30.6569 -30.6569 -12.0951 -12.0951 -12.0549 -12.0549 -11.7692 -11.7692 -11.7234 -11.7234 -11.6793 -11.6793 -11.5274 -11.5274 -4.6793 -4.6793 -4.5574 -4.5574 3.5454 3.5454 3.7580 3.7580 4.6542 4.6542 5.0618 5.0618 5.2548 5.2548 5.3003 5.3003 6.7606 6.7606 7.6584 7.6584 7.6991 7.6991 7.7957 7.7957 7.8739 7.8739 8.5223 8.5223 8.6530 8.6530 8.8107 8.8107 9.2662 9.2662 9.3140 9.3140 11.1763 11.1763 11.6269 11.6269 11.7691 11.7691 13.8487 13.8487 k = 0.3095 0.3095-0.0000 ( 3192 PWs) bands (ev): -30.6795 -30.6795 -30.6576 -30.6576 -12.0942 -12.0942 -12.0511 -12.0511 -11.7659 -11.7659 -11.7216 -11.7216 -11.6750 -11.6750 -11.5278 -11.5278 -4.7071 -4.7071 -4.5748 -4.5748 3.6125 3.6125 3.8207 3.8207 4.6880 4.6880 5.0637 5.0637 5.2796 5.2796 5.3245 5.3245 6.7478 6.7478 7.6347 7.6347 7.6875 7.6875 7.7827 7.7827 7.8666 7.8666 8.5077 8.5077 8.6079 8.6079 8.7859 8.7859 9.2176 9.2176 9.2738 9.2738 11.2422 11.2422 11.7025 11.7025 11.8341 11.8341 13.7993 13.7993 k = 0.3016 0.3016-0.0000 ( 3190 PWs) bands (ev): -30.6803 -30.6803 -30.6584 -30.6584 -12.0935 -12.0935 -12.0472 -12.0472 -11.7629 -11.7629 -11.7193 -11.7193 -11.6706 -11.6706 -11.5282 -11.5282 -4.7353 -4.7353 -4.5923 -4.5923 3.6815 3.6815 3.8851 3.8851 4.7229 4.7229 5.0655 5.0655 5.3055 5.3055 5.3498 5.3498 6.7338 6.7338 7.6042 7.6042 7.6780 7.6780 7.7727 7.7727 7.8631 7.8631 8.4878 8.4878 8.5687 8.5687 8.7608 8.7608 9.1679 9.1679 9.2324 9.2324 11.3071 11.3071 11.7744 11.7744 11.8934 11.8934 13.7516 13.7516 k = 0.2937 0.2937-0.0000 ( 3196 PWs) bands (ev): -30.6812 -30.6812 -30.6591 -30.6591 -12.0928 -12.0928 -12.0433 -12.0433 -11.7600 -11.7600 -11.7167 -11.7167 -11.6661 -11.6661 -11.5286 -11.5286 -4.7638 -4.7638 -4.6099 -4.6099 3.7524 3.7524 3.9511 3.9511 4.7588 4.7588 5.0670 5.0670 5.3324 5.3324 5.3759 5.3759 6.7189 6.7189 7.5707 7.5707 7.6684 7.6684 7.7655 7.7655 7.8623 7.8623 8.4579 8.4579 8.5403 8.5403 8.7352 8.7352 9.1172 9.1172 9.1899 9.1899 11.3708 11.3708 11.8418 11.8418 11.9466 11.9466 13.7055 13.7055 k = 0.2857 0.2857-0.0000 ( 3188 PWs) bands (ev): -30.6820 -30.6820 -30.6599 -30.6599 -12.0922 -12.0922 -12.0392 -12.0392 -11.7573 -11.7573 -11.7136 -11.7136 -11.6615 -11.6615 -11.5289 -11.5289 -4.7927 -4.7927 -4.6275 -4.6275 3.8251 3.8251 4.0187 4.0187 4.7958 4.7958 5.0682 5.0682 5.3605 5.3605 5.4029 5.4029 6.7030 6.7030 7.5364 7.5364 7.6577 7.6577 7.7609 7.7609 7.8635 7.8635 8.4181 8.4181 8.5224 8.5224 8.7091 8.7091 9.0658 9.0658 9.1464 9.1464 11.4329 11.4329 11.9039 11.9039 11.9931 11.9931 13.6612 13.6612 k = 0.2778 0.2778-0.0000 ( 3198 PWs) bands (ev): -30.6828 -30.6828 -30.6607 -30.6607 -12.0918 -12.0918 -12.0350 -12.0350 -11.7548 -11.7548 -11.7102 -11.7102 -11.6570 -11.6570 -11.5292 -11.5292 -4.8218 -4.8218 -4.6450 -4.6450 3.8994 3.8994 4.0877 4.0877 4.8337 4.8337 5.0692 5.0692 5.3896 5.3896 5.4309 5.4309 6.6863 6.6863 7.5019 7.5019 7.6458 7.6458 7.7586 7.7586 7.8660 7.8660 8.3731 8.3731 8.5102 8.5102 8.6823 8.6823 9.0136 9.0136 9.1016 9.1016 11.4930 11.4930 11.9596 11.9596 12.0327 12.0327 13.6187 13.6188 k = 0.2698 0.2698-0.0000 ( 3194 PWs) bands (ev): -30.6837 -30.6837 -30.6615 -30.6615 -12.0915 -12.0915 -12.0308 -12.0308 -11.7525 -11.7525 -11.7064 -11.7064 -11.6523 -11.6523 -11.5295 -11.5295 -4.8510 -4.8510 -4.6624 -4.6624 3.9752 3.9752 4.1580 4.1580 4.8725 4.8725 5.0698 5.0698 5.4197 5.4197 5.4597 5.4597 6.6690 6.6690 7.4677 7.4677 7.6333 7.6333 7.7581 7.7581 7.8693 7.8693 8.3262 8.3262 8.5007 8.5007 8.6548 8.6548 8.9609 8.9609 9.0558 9.0558 11.5509 11.5509 12.0081 12.0081 12.0652 12.0652 13.5783 13.5783 k = 0.2619 0.2619-0.0000 ( 3196 PWs) bands (ev): -30.6845 -30.6845 -30.6623 -30.6623 -12.0913 -12.0913 -12.0266 -12.0266 -11.7503 -11.7503 -11.7022 -11.7022 -11.6475 -11.6475 -11.5299 -11.5299 -4.8803 -4.8803 -4.6797 -4.6797 4.0525 4.0525 4.2295 4.2295 4.9122 4.9122 5.0701 5.0701 5.4509 5.4509 5.4894 5.4894 6.6510 6.6510 7.4343 7.4343 7.6203 7.6203 7.7590 7.7590 7.8729 7.8729 8.2788 8.2788 8.4925 8.4925 8.6266 8.6266 8.9078 8.9078 9.0091 9.0091 11.6062 11.6062 12.0481 12.0481 12.0903 12.0903 13.5398 13.5398 k = 0.2540 0.2540-0.0000 ( 3196 PWs) bands (ev): -30.6854 -30.6854 -30.6631 -30.6631 -12.0912 -12.0912 -12.0223 -12.0223 -11.7483 -11.7483 -11.6978 -11.6978 -11.6428 -11.6428 -11.5301 -11.5301 -4.9096 -4.9096 -4.6969 -4.6969 4.1310 4.1310 4.3021 4.3021 4.9527 4.9527 5.0701 5.0701 5.4831 5.4831 5.5200 5.5200 6.6327 6.6327 7.4017 7.4017 7.6074 7.6074 7.7610 7.7610 7.8769 7.8769 8.2315 8.2315 8.4849 8.4849 8.5975 8.5975 8.8544 8.8544 8.9613 8.9613 11.6586 11.6586 12.0788 12.0788 12.1081 12.1081 13.5033 13.5033 k = 0.2460 0.2460-0.0000 ( 3192 PWs) bands (ev): -30.6862 -30.6862 -30.6639 -30.6639 -12.0912 -12.0912 -12.0179 -12.0179 -11.7464 -11.7464 -11.6931 -11.6931 -11.6380 -11.6380 -11.5303 -11.5303 -4.9388 -4.9388 -4.7138 -4.7138 4.2107 4.2107 4.3757 4.3757 4.9939 4.9939 5.0697 5.0697 5.5164 5.5164 5.5516 5.5516 6.6141 6.6141 7.3701 7.3701 7.5945 7.5945 7.7638 7.7638 7.8809 7.8809 8.1850 8.1850 8.4773 8.4773 8.5676 8.5676 8.8007 8.8007 8.9127 8.9127 11.7079 11.7079 12.0995 12.0995 12.1188 12.1188 13.4689 13.4689 k = 0.2381 0.2381-0.0000 ( 3196 PWs) bands (ev): -30.6871 -30.6871 -30.6647 -30.6647 -12.0913 -12.0913 -12.0136 -12.0136 -11.7445 -11.7445 -11.6882 -11.6882 -11.6332 -11.6332 -11.5305 -11.5305 -4.9679 -4.9679 -4.7304 -4.7304 4.2914 4.2914 4.4501 4.4501 5.0355 5.0355 5.0691 5.0691 5.5505 5.5505 5.5841 5.5841 6.5954 6.5954 7.3394 7.3394 7.5818 7.5818 7.7670 7.7670 7.8847 7.8847 8.1395 8.1395 8.4695 8.4695 8.5370 8.5370 8.7471 8.7471 8.8631 8.8631 11.7538 11.7538 12.1096 12.1096 12.1224 12.1224 13.4365 13.4365 k = 0.2302 0.2302-0.0000 ( 3194 PWs) bands (ev): -30.6880 -30.6880 -30.6655 -30.6655 -12.0916 -12.0916 -12.0092 -12.0092 -11.7426 -11.7426 -11.6831 -11.6831 -11.6284 -11.6284 -11.5307 -11.5307 -4.9968 -4.9968 -4.7468 -4.7468 4.3730 4.3730 4.5253 4.5253 5.0665 5.0665 5.0795 5.0795 5.5855 5.5855 5.6175 5.6175 6.5768 6.5768 7.3099 7.3099 7.5695 7.5695 7.7706 7.7706 7.8880 7.8880 8.0955 8.0955 8.4606 8.4606 8.5060 8.5060 8.6938 8.6938 8.8128 8.8128 11.7963 11.7963 12.1093 12.1093 12.1193 12.1193 13.4063 13.4063 k = 0.2222 0.2222-0.0000 ( 3206 PWs) bands (ev): -30.6888 -30.6888 -30.6663 -30.6663 -12.0920 -12.0920 -12.0050 -12.0050 -11.7409 -11.7409 -11.6780 -11.6780 -11.6237 -11.6237 -11.5308 -11.5308 -5.0255 -5.0255 -4.7629 -4.7629 4.4554 4.4554 4.6010 4.6010 5.0658 5.0658 5.1215 5.1215 5.6215 5.6215 5.6518 5.6518 6.5585 6.5585 7.2813 7.2813 7.5574 7.5574 7.7740 7.7740 7.8904 7.8904 8.0535 8.0535 8.4483 8.4483 8.4765 8.4765 8.6411 8.6411 8.7616 8.7616 11.8351 11.8351 12.0987 12.0987 12.1096 12.1096 13.3783 13.3783 k = 0.2143 0.2143-0.0000 ( 3198 PWs) bands (ev): -30.6896 -30.6896 -30.6671 -30.6671 -12.0925 -12.0925 -12.0006 -12.0006 -11.7391 -11.7391 -11.6727 -11.6727 -11.6190 -11.6190 -11.5308 -11.5308 -5.0538 -5.0538 -4.7785 -4.7785 4.5384 4.5384 4.6772 4.6772 5.0639 5.0639 5.1647 5.1647 5.6582 5.6582 5.6873 5.6873 6.5406 6.5406 7.2540 7.2540 7.5459 7.5459 7.7771 7.7771 7.8914 7.8914 8.0149 8.0149 8.4261 8.4261 8.4541 8.4541 8.5901 8.5901 8.7098 8.7098 11.8703 11.8703 12.0787 12.0787 12.0941 12.0941 13.3524 13.3524 k = 0.2063 0.2063-0.0000 ( 3190 PWs) bands (ev): -30.6905 -30.6905 -30.6679 -30.6679 -12.0931 -12.0931 -11.9964 -11.9964 -11.7372 -11.7372 -11.6673 -11.6673 -11.6142 -11.6142 -11.5309 -11.5309 -5.0817 -5.0817 -4.7938 -4.7938 4.6218 4.6218 4.7537 4.7537 5.0618 5.0618 5.2081 5.2081 5.6956 5.6956 5.7238 5.7238 6.5234 6.5234 7.2278 7.2278 7.5345 7.5345 7.7791 7.7791 7.8893 7.8893 7.9817 7.9817 8.3941 8.3941 8.4369 8.4369 8.5427 8.5427 8.6574 8.6574 11.9018 11.9018 12.0503 12.0503 12.0731 12.0731 13.3286 13.3286 k = 0.1984 0.1984-0.0000 ( 3188 PWs) bands (ev): -30.6913 -30.6913 -30.6686 -30.6686 -12.0938 -12.0938 -11.9922 -11.9922 -11.7354 -11.7354 -11.6620 -11.6620 -11.6095 -11.6095 -11.5309 -11.5309 -5.1092 -5.1092 -4.8088 -4.8088 4.7054 4.7054 4.8302 4.8302 5.0593 5.0593 5.2517 5.2517 5.7335 5.7335 5.7616 5.7616 6.5071 6.5071 7.2027 7.2027 7.5235 7.5235 7.7786 7.7786 7.8820 7.8820 7.9575 7.9575 8.3582 8.3582 8.4149 8.4149 8.5027 8.5027 8.6043 8.6043 11.9295 11.9295 12.0146 12.0146 12.0471 12.0471 13.3070 13.3070 k = 0.1905 0.1905-0.0000 ( 3186 PWs) bands (ev): -30.6921 -30.6921 -30.6694 -30.6694 -12.0946 -12.0946 -11.9880 -11.9880 -11.7336 -11.7336 -11.6566 -11.6566 -11.6050 -11.6050 -11.5309 -11.5309 -5.1361 -5.1361 -4.8232 -4.8232 4.7891 4.7891 4.9065 4.9065 5.0568 5.0568 5.2952 5.2952 5.7719 5.7719 5.8006 5.8006 6.4918 6.4918 7.1788 7.1788 7.5129 7.5129 7.7733 7.7733 7.8696 7.8696 7.9442 7.9442 8.3200 8.3200 8.3818 8.3818 8.4748 8.4748 8.5507 8.5507 11.9503 11.9503 11.9759 11.9759 12.0165 12.0165 13.2875 13.2875 k = 0.1825 0.1825-0.0000 ( 3190 PWs) bands (ev): -30.6929 -30.6929 -30.6702 -30.6702 -12.0955 -12.0955 -11.9840 -11.9840 -11.7317 -11.7317 -11.6512 -11.6512 -11.6005 -11.6005 -11.5308 -11.5308 -5.1625 -5.1625 -4.8373 -4.8373 4.8724 4.8724 4.9817 4.9817 5.0551 5.0551 5.3384 5.3384 5.8105 5.8105 5.8410 5.8410 6.4778 6.4778 7.1558 7.1558 7.5024 7.5024 7.7605 7.7605 7.8579 7.8579 7.9390 7.9390 8.2797 8.2797 8.3395 8.3395 8.4570 8.4570 8.4967 8.4967 11.9207 11.9207 11.9785 11.9785 11.9825 11.9825 13.2700 13.2700 k = 0.1746 0.1746-0.0000 ( 3190 PWs) bands (ev): -30.6937 -30.6937 -30.6709 -30.6709 -12.0964 -12.0964 -11.9800 -11.9800 -11.7299 -11.7299 -11.6459 -11.6459 -11.5961 -11.5961 -11.5307 -11.5307 -5.1882 -5.1882 -4.8508 -4.8508 4.9547 4.9547 5.0399 5.0399 5.0704 5.0704 5.3811 5.3811 5.8495 5.8495 5.8829 5.8829 6.4655 6.4655 7.1340 7.1340 7.4924 7.4924 7.7394 7.7394 7.8517 7.8517 7.9377 7.9377 8.2374 8.2374 8.2930 8.2930 8.4410 8.4410 8.4458 8.4458 11.8691 11.8691 11.9438 11.9438 11.9968 11.9968 13.2545 13.2545 k = 0.1667 0.1667-0.0000 ( 3190 PWs) bands (ev): -30.6945 -30.6945 -30.6716 -30.6716 -12.0975 -12.0975 -11.9761 -11.9761 -11.7281 -11.7281 -11.6406 -11.6406 -11.5917 -11.5917 -11.5306 -11.5306 -5.2133 -5.2133 -4.8638 -4.8638 5.0264 5.0264 5.0542 5.0542 5.1388 5.1388 5.4232 5.4232 5.8886 5.8886 5.9260 5.9260 6.4550 6.4550 7.1133 7.1133 7.4826 7.4826 7.7129 7.7129 7.8502 7.8502 7.9381 7.9381 8.1927 8.1927 8.2457 8.2457 8.3874 8.3874 8.4343 8.4343 11.8133 11.8133 11.9027 11.9027 12.0124 12.0124 13.2301 13.2301 k = 0.1587 0.1587-0.0000 ( 3197 PWs) bands (ev): -30.6952 -30.6952 -30.6723 -30.6723 -12.0985 -12.0985 -11.9724 -11.9724 -11.7262 -11.7262 -11.6355 -11.6355 -11.5875 -11.5875 -11.5305 -11.5305 -5.2376 -5.2376 -4.8764 -4.8764 5.0352 5.0352 5.1240 5.1240 5.2129 5.2129 5.4642 5.4642 5.9280 5.9280 5.9705 5.9705 6.4467 6.4467 7.0937 7.0937 7.4731 7.4731 7.6839 7.6839 7.8515 7.8515 7.9390 7.9390 8.1458 8.1458 8.1989 8.1989 8.3326 8.3326 8.4247 8.4247 11.7544 11.7544 11.8591 11.8591 12.0257 12.0257 13.1721 13.1721 k = 0.1508 0.1508-0.0000 ( 3203 PWs) bands (ev): -30.6960 -30.6960 -30.6729 -30.6729 -12.0996 -12.0996 -11.9688 -11.9688 -11.7244 -11.7244 -11.6305 -11.6305 -11.5834 -11.5834 -11.5304 -11.5304 -5.2610 -5.2610 -4.8884 -4.8884 5.0320 5.0320 5.2038 5.2038 5.2867 5.2867 5.5040 5.5040 5.9677 5.9677 6.0160 6.0160 6.4410 6.4410 7.0750 7.0750 7.4639 7.4639 7.6542 7.6542 7.8539 7.8539 7.9402 7.9402 8.0971 8.0971 8.1532 8.1532 8.2777 8.2777 8.4155 8.4155 11.6933 11.6933 11.8135 11.8135 12.0367 12.0367 13.1154 13.1154 k = 0.1429 0.1429-0.0000 ( 3205 PWs) bands (ev): -30.6966 -30.6966 -30.6736 -30.6736 -12.1008 -12.1008 -11.9653 -11.9653 -11.7226 -11.7226 -11.6255 -11.6255 -11.5795 -11.5795 -11.5302 -11.5302 -5.2837 -5.2837 -4.8998 -4.8998 5.0277 5.0277 5.2830 5.2830 5.3596 5.3596 5.5423 5.5423 6.0075 6.0075 6.0628 6.0628 6.4382 6.4382 7.0574 7.0574 7.4551 7.4551 7.6248 7.6248 7.8561 7.8561 7.9413 7.9413 8.0472 8.0472 8.1088 8.1088 8.2228 8.2228 8.4063 8.4063 11.6308 11.6308 11.7663 11.7663 12.0459 12.0459 13.0611 13.0611 k = 0.1349 0.1349-0.0000 ( 3213 PWs) bands (ev): -30.6973 -30.6973 -30.6742 -30.6742 -12.1020 -12.1020 -11.9619 -11.9619 -11.7208 -11.7208 -11.6207 -11.6207 -11.5757 -11.5757 -11.5300 -11.5300 -5.3054 -5.3054 -4.9108 -4.9108 5.0230 5.0230 5.3605 5.3605 5.4311 5.4311 5.5787 5.5787 6.0476 6.0476 6.1105 6.1105 6.4385 6.4385 7.0407 7.0407 7.4465 7.4465 7.5964 7.5964 7.8573 7.8573 7.9417 7.9417 7.9971 7.9971 8.0659 8.0659 8.1682 8.1682 8.3971 8.3971 11.5674 11.5674 11.7181 11.7181 12.0533 12.0533 13.0092 13.0092 k = 0.1270 0.1270-0.0000 ( 3213 PWs) bands (ev): -30.6980 -30.6980 -30.6748 -30.6748 -12.1032 -12.1032 -11.9587 -11.9587 -11.7190 -11.7190 -11.6161 -11.6161 -11.5720 -11.5720 -11.5298 -11.5298 -5.3261 -5.3261 -4.9211 -4.9211 5.0181 5.0181 5.4359 5.4359 5.5011 5.5011 5.6132 5.6132 6.0878 6.0878 6.1591 6.1591 6.4425 6.4425 7.0250 7.0250 7.4383 7.4383 7.5691 7.5691 7.8557 7.8557 7.9364 7.9364 7.9524 7.9524 8.0252 8.0252 8.1143 8.1143 8.3876 8.3876 11.5036 11.5036 11.6694 11.6694 12.0592 12.0592 12.9600 12.9600 k = 0.1190 0.1190-0.0000 ( 3205 PWs) bands (ev): -30.6986 -30.6986 -30.6754 -30.6754 -12.1044 -12.1044 -11.9556 -11.9556 -11.7173 -11.7173 -11.6116 -11.6116 -11.5685 -11.5685 -11.5295 -11.5295 -5.3459 -5.3459 -4.9308 -4.9308 5.0131 5.0131 5.5084 5.5084 5.5693 5.5693 5.6459 5.6459 6.1281 6.1281 6.2085 6.2085 6.4503 6.4503 7.0103 7.0103 7.4304 7.4304 7.5432 7.5432 7.8478 7.8478 7.8947 7.8947 7.9447 7.9447 7.9890 7.9890 8.0618 8.0618 8.3780 8.3780 11.4401 11.4401 11.6206 11.6206 12.0638 12.0638 12.9137 12.9137 k = 0.1111 0.1111-0.0000 ( 3199 PWs) bands (ev): -30.6991 -30.6991 -30.6759 -30.6759 -12.1055 -12.1055 -11.9527 -11.9527 -11.7156 -11.7156 -11.6074 -11.6074 -11.5651 -11.5651 -11.5293 -11.5293 -5.3645 -5.3645 -4.9400 -4.9400 5.0080 5.0080 5.5765 5.5765 5.6355 5.6355 5.6775 5.6775 6.1684 6.1684 6.2585 6.2585 6.4622 6.4622 6.9965 6.9965 7.4228 7.4228 7.5188 7.5188 7.8256 7.8256 7.8521 7.8521 7.9411 7.9411 7.9603 7.9603 8.0133 8.0133 8.3682 8.3682 11.3773 11.3773 11.5721 11.5721 12.0673 12.0673 12.8701 12.8701 k = 0.1032 0.1032-0.0000 ( 3199 PWs) bands (ev): -30.6997 -30.6997 -30.6764 -30.6764 -12.1066 -12.1066 -11.9500 -11.9500 -11.7140 -11.7140 -11.6033 -11.6033 -11.5620 -11.5620 -11.5290 -11.5290 -5.3821 -5.3821 -4.9485 -4.9485 5.0030 5.0030 5.6367 5.6367 5.6993 5.6993 5.7111 5.7111 6.2086 6.2086 6.3090 6.3090 6.4782 6.4782 6.9835 6.9835 7.4155 7.4155 7.4958 7.4958 7.7839 7.7839 7.8176 7.8176 7.9222 7.9222 7.9457 7.9457 7.9776 7.9776 8.3581 8.3581 11.3157 11.3157 11.5246 11.5246 12.0698 12.0698 12.8295 12.8295 k = 0.0952 0.0952-0.0000 ( 3203 PWs) bands (ev): -30.7002 -30.7002 -30.6769 -30.6769 -12.1077 -12.1077 -11.9475 -11.9475 -11.7125 -11.7125 -11.5996 -11.5996 -11.5590 -11.5590 -11.5288 -11.5288 -5.3986 -5.3986 -4.9565 -4.9565 4.9981 4.9981 5.6823 5.6823 5.7528 5.7528 5.7605 5.7605 6.2484 6.2484 6.3596 6.3596 6.4983 6.4983 6.9713 6.9713 7.4086 7.4086 7.4743 7.4743 7.7364 7.7364 7.7803 7.7803 7.8818 7.8818 7.9408 7.9408 7.9632 7.9632 8.3480 8.3480 11.2558 11.2558 11.4783 11.4783 12.0716 12.0716 12.7919 12.7919 k = 0.0873 0.0873-0.0000 ( 3203 PWs) bands (ev): -30.7007 -30.7007 -30.6773 -30.6773 -12.1087 -12.1087 -11.9451 -11.9451 -11.7110 -11.7110 -11.5960 -11.5960 -11.5563 -11.5563 -11.5286 -11.5286 -5.4139 -5.4139 -4.9638 -4.9638 4.9933 4.9933 5.7119 5.7119 5.8040 5.8040 5.8188 5.8188 6.2878 6.2878 6.4103 6.4103 6.5222 6.5222 6.9600 6.9600 7.4020 7.4020 7.4544 7.4544 7.6885 7.6885 7.7390 7.7390 7.8340 7.8340 7.9393 7.9393 7.9590 7.9590 8.3377 8.3377 11.1983 11.1983 11.4338 11.4338 12.0727 12.0727 12.7573 12.7573 k = 0.0794 0.0794-0.0000 ( 3207 PWs) bands (ev): -30.7011 -30.7011 -30.6777 -30.6777 -12.1097 -12.1097 -11.9430 -11.9430 -11.7097 -11.7097 -11.5927 -11.5927 -11.5537 -11.5537 -11.5284 -11.5284 -5.4280 -5.4280 -4.9705 -4.9705 4.9887 4.9887 5.7318 5.7318 5.8581 5.8581 5.8739 5.8739 6.3266 6.3266 6.4607 6.4607 6.5496 6.5496 6.9495 6.9495 7.3956 7.3956 7.4360 7.4360 7.6414 7.6414 7.6954 7.6954 7.7852 7.7852 7.9400 7.9400 7.9576 7.9576 8.3275 8.3275 11.1434 11.1434 11.3915 11.3915 12.0733 12.0733 12.7257 12.7257 k = 0.0714 0.0714-0.0000 ( 3211 PWs) bands (ev): -30.7015 -30.7015 -30.6781 -30.6781 -12.1107 -12.1107 -11.9410 -11.9410 -11.7084 -11.7084 -11.5897 -11.5897 -11.5514 -11.5514 -11.5282 -11.5282 -5.4408 -5.4408 -4.9766 -4.9766 4.9844 4.9844 5.7464 5.7464 5.9105 5.9105 5.9255 5.9255 6.3644 6.3644 6.5105 6.5105 6.5799 6.5799 6.9396 6.9396 7.3896 7.3896 7.4190 7.4190 7.5957 7.5957 7.6509 7.6509 7.7371 7.7371 7.9418 7.9418 7.9571 7.9571 8.3174 8.3174 11.0919 11.0919 11.3518 11.3518 12.0736 12.0736 12.6971 12.6971 k = 0.0635 0.0635-0.0000 ( 3209 PWs) bands (ev): -30.7019 -30.7019 -30.6784 -30.6784 -12.1115 -12.1115 -11.9392 -11.9392 -11.7073 -11.7073 -11.5869 -11.5869 -11.5493 -11.5493 -11.5280 -11.5280 -5.4524 -5.4524 -4.9821 -4.9821 4.9804 4.9804 5.7574 5.7574 5.9596 5.9596 5.9733 5.9733 6.4010 6.4010 6.5591 6.5591 6.6124 6.6124 6.9306 6.9306 7.3837 7.3837 7.4035 7.4035 7.5517 7.5517 7.6067 7.6067 7.6908 7.6908 7.9441 7.9441 7.9568 7.9568 8.3076 8.3076 11.0441 11.0441 11.3153 11.3153 12.0736 12.0736 12.6715 12.6715 k = 0.0556 0.0556-0.0000 ( 3209 PWs) bands (ev): -30.7022 -30.7022 -30.6787 -30.6787 -12.1123 -12.1123 -11.9376 -11.9376 -11.7063 -11.7063 -11.5845 -11.5845 -11.5474 -11.5474 -11.5278 -11.5278 -5.4627 -5.4627 -4.9869 -4.9869 4.9768 4.9768 5.7658 5.7658 6.0044 6.0044 6.0167 6.0167 6.4359 6.4359 6.6062 6.6062 6.6463 6.6463 6.9221 6.9221 7.3779 7.3779 7.3892 7.3892 7.5101 7.5101 7.5635 7.5635 7.6470 7.6470 7.9466 7.9466 7.9567 7.9567 8.2982 8.2982 11.0005 11.0005 11.2820 11.2820 12.0733 12.0733 12.6490 12.6490 k = 0.0476 0.0476-0.0000 ( 3213 PWs) bands (ev): -30.7025 -30.7025 -30.6790 -30.6790 -12.1130 -12.1130 -11.9362 -11.9362 -11.7054 -11.7054 -11.5823 -11.5823 -11.5458 -11.5458 -11.5277 -11.5277 -5.4716 -5.4716 -4.9911 -4.9911 4.9735 4.9735 5.7722 5.7722 6.0443 6.0443 6.0556 6.0556 6.4685 6.4685 6.6512 6.6512 6.6806 6.6806 6.9142 6.9142 7.3718 7.3718 7.3765 7.3765 7.4712 7.4712 7.5222 7.5222 7.6065 7.6065 7.9489 7.9489 7.9566 7.9566 8.2896 8.2896 10.9617 10.9617 11.2524 11.2524 12.0730 12.0730 12.6295 12.6295 k = 0.0397 0.0397-0.0000 ( 3215 PWs) bands (ev): -30.7027 -30.7027 -30.6792 -30.6792 -12.1136 -12.1136 -11.9351 -11.9351 -11.7046 -11.7046 -11.5805 -11.5805 -11.5444 -11.5444 -11.5275 -11.5275 -5.4792 -5.4792 -4.9947 -4.9947 4.9707 4.9707 5.7770 5.7770 6.0790 6.0790 6.0893 6.0893 6.4984 6.4984 6.6932 6.6932 6.7143 6.7143 6.9067 6.9067 7.3623 7.3623 7.3680 7.3680 7.4357 7.4357 7.4840 7.4840 7.5705 7.5705 7.9511 7.9511 7.9566 7.9566 8.2817 8.2817 10.9281 10.9281 11.2268 11.2268 12.0726 12.0726 12.6131 12.6131 k = 0.0317 0.0317-0.0000 ( 3213 PWs) bands (ev): -30.7029 -30.7029 -30.6794 -30.6794 -12.1142 -12.1142 -11.9341 -11.9341 -11.7040 -11.7040 -11.5789 -11.5789 -11.5432 -11.5432 -11.5274 -11.5274 -5.4855 -5.4855 -4.9976 -4.9976 4.9683 4.9683 5.7804 5.7804 6.1080 6.1080 6.1176 6.1176 6.5246 6.5246 6.7312 6.7312 6.7462 6.7462 6.8996 6.8996 7.3507 7.3507 7.3622 7.3622 7.4045 7.4045 7.4502 7.4502 7.5398 7.5398 7.9529 7.9529 7.9566 7.9566 8.2750 8.2750 10.8999 10.8999 11.2056 11.2056 12.0722 12.0722 12.5996 12.5996 k = 0.0238 0.0238-0.0000 ( 3201 PWs) bands (ev): -30.7030 -30.7030 -30.6795 -30.6795 -12.1145 -12.1145 -11.9333 -11.9333 -11.7035 -11.7035 -11.5777 -11.5777 -11.5422 -11.5422 -11.5273 -11.5273 -5.4904 -5.4904 -4.9998 -4.9998 4.9665 4.9665 5.7828 5.7828 6.1310 6.1310 6.1401 6.1401 6.5463 6.5463 6.7638 6.7638 6.7752 6.7752 6.8926 6.8926 7.3394 7.3394 7.3565 7.3565 7.3788 7.3788 7.4226 7.4226 7.5155 7.5155 7.9544 7.9544 7.9567 7.9567 8.2696 8.2696 10.8777 10.8777 11.1888 11.1888 12.0719 12.0719 12.5892 12.5892 k = 0.0159 0.0159-0.0000 ( 3203 PWs) bands (ev): -30.7031 -30.7031 -30.6797 -30.6797 -12.1148 -12.1148 -11.9328 -11.9328 -11.7031 -11.7031 -11.5769 -11.5769 -11.5416 -11.5416 -11.5272 -11.5272 -5.4939 -5.4939 -5.0014 -5.0014 4.9651 4.9651 5.7844 5.7844 6.1476 6.1476 6.1563 6.1563 6.5627 6.5627 6.7889 6.7889 6.7999 6.7999 6.8854 6.8854 7.3290 7.3290 7.3507 7.3507 7.3599 7.3599 7.4028 7.4028 7.4980 7.4980 7.9554 7.9554 7.9568 7.9568 8.2656 8.2656 10.8616 10.8616 11.1766 11.1766 12.0716 12.0716 12.5818 12.5818 k = 0.0079 0.0079-0.0000 ( 3217 PWs) bands (ev): -30.7032 -30.7032 -30.6797 -30.6797 -12.1150 -12.1150 -11.9325 -11.9325 -11.7030 -11.7030 -11.5765 -11.5765 -11.5412 -11.5412 -11.5272 -11.5272 -5.4960 -5.4960 -5.0024 -5.0024 4.9643 4.9643 5.7853 5.7853 6.1577 6.1577 6.1662 6.1662 6.5729 6.5729 6.8046 6.8046 6.8182 6.8182 6.8788 6.8788 7.3211 7.3211 7.3455 7.3455 7.3488 7.3488 7.3914 7.3914 7.4876 7.4876 7.9558 7.9558 7.9570 7.9570 8.2631 8.2631 10.8518 10.8518 11.1693 11.1693 12.0714 12.0714 12.5773 12.5773 k = 0.0000 0.0000 0.0000 ( 3221 PWs) bands (ev): -30.7032 -30.7032 -30.6797 -30.6797 -12.1151 -12.1151 -11.9324 -11.9324 -11.7029 -11.7029 -11.5763 -11.5763 -11.5411 -11.5411 -11.5272 -11.5272 -5.4967 -5.4967 -5.0028 -5.0028 4.9641 4.9641 5.7855 5.7855 6.1611 6.1611 6.1695 6.1695 6.5764 6.5764 6.8099 6.8099 6.8255 6.8255 6.8757 6.8757 7.3180 7.3180 7.3431 7.3431 7.3455 7.3455 7.3879 7.3879 7.4841 7.4841 7.9559 7.9559 7.9571 7.9571 8.2622 8.2622 10.8485 10.8485 11.1668 11.1668 12.0713 12.0713 12.5757 12.5757 k = 0.0000 0.0000 0.0000 ( 3221 PWs) bands (ev): -30.7032 -30.7032 -30.6797 -30.6797 -12.1151 -12.1151 -11.9324 -11.9324 -11.7029 -11.7029 -11.5763 -11.5763 -11.5411 -11.5411 -11.5272 -11.5272 -5.4967 -5.4967 -5.0028 -5.0028 4.9641 4.9641 5.7855 5.7855 6.1611 6.1611 6.1695 6.1695 6.5764 6.5764 6.8099 6.8099 6.8255 6.8255 6.8757 6.8757 7.3180 7.3180 7.3431 7.3431 7.3455 7.3455 7.3879 7.3879 7.4841 7.4841 7.9559 7.9559 7.9571 7.9571 8.2622 8.2622 10.8485 10.8485 11.1668 11.1668 12.0713 12.0713 12.5757 12.5757 k = 0.0000 0.0000 0.0111 ( 3221 PWs) bands (ev): -30.7032 -30.7032 -30.6798 -30.6798 -12.1147 -12.1147 -11.9325 -11.9325 -11.7028 -11.7028 -11.5763 -11.5763 -11.5412 -11.5412 -11.5276 -11.5276 -5.4961 -5.4961 -5.0033 -5.0033 4.9643 4.9643 5.7821 5.7821 6.1613 6.1613 6.1697 6.1697 6.5803 6.5803 6.8097 6.8097 6.8252 6.8252 6.8764 6.8764 7.3181 7.3181 7.3432 7.3432 7.3458 7.3458 7.3880 7.3880 7.4841 7.4841 7.9558 7.9558 7.9571 7.9571 8.2613 8.2613 10.8491 10.8491 11.1678 11.1678 12.0685 12.0685 12.5735 12.5735 k = 0.0000 0.0000 0.0222 ( 3217 PWs) bands (ev): -30.7031 -30.7031 -30.6799 -30.6799 -12.1137 -12.1137 -11.9328 -11.9328 -11.7026 -11.7026 -11.5761 -11.5761 -11.5413 -11.5413 -11.5286 -11.5286 -5.4943 -5.4943 -5.0049 -5.0049 4.9650 4.9650 5.7720 5.7720 6.1620 6.1620 6.1703 6.1703 6.5916 6.5916 6.8089 6.8089 6.8243 6.8243 6.8786 6.8786 7.3184 7.3184 7.3433 7.3433 7.3466 7.3466 7.3883 7.3883 7.4843 7.4843 7.9557 7.9557 7.9569 7.9569 8.2589 8.2589 10.8511 10.8511 11.1708 11.1708 12.0599 12.0599 12.5669 12.5669 k = 0.0000 0.0000 0.0333 ( 3213 PWs) bands (ev): -30.7030 -30.7030 -30.6800 -30.6800 -12.1121 -12.1121 -11.9332 -11.9332 -11.7022 -11.7022 -11.5759 -11.5759 -11.5415 -11.5415 -11.5304 -11.5304 -5.4913 -5.4913 -5.0077 -5.0077 4.9661 4.9661 5.7559 5.7559 6.1631 6.1631 6.1714 6.1714 6.6097 6.6097 6.8077 6.8077 6.8229 6.8229 6.8822 6.8822 7.3188 7.3188 7.3435 7.3435 7.3478 7.3478 7.3888 7.3888 7.4846 7.4846 7.9555 7.9555 7.9567 7.9567 8.2546 8.2546 10.8544 10.8544 11.1759 11.1759 12.0457 12.0457 12.5559 12.5559 k = 0.0000 0.0000 0.0444 ( 3217 PWs) bands (ev): -30.7028 -30.7028 -30.6802 -30.6802 -12.1099 -12.1099 -11.9339 -11.9339 -11.7018 -11.7018 -11.5757 -11.5757 -11.5418 -11.5418 -11.5329 -11.5329 -5.4871 -5.4871 -5.0115 -5.0115 4.9678 4.9678 5.7347 5.7347 6.1647 6.1647 6.1729 6.1729 6.6336 6.6336 6.8060 6.8060 6.8209 6.8209 6.8871 6.8871 7.3194 7.3194 7.3437 7.3437 7.3495 7.3495 7.3894 7.3894 7.4849 7.4849 7.9551 7.9551 7.9564 7.9564 8.2485 8.2485 10.8590 10.8590 11.1829 11.1829 12.0262 12.0262 12.5405 12.5405 k = 0.0000 0.0000 0.0555 ( 3217 PWs) bands (ev): -30.7026 -30.7026 -30.6804 -30.6804 -12.1071 -12.1071 -11.9347 -11.9347 -11.7011 -11.7011 -11.5753 -11.5753 -11.5422 -11.5422 -11.5360 -11.5360 -5.4818 -5.4818 -5.0164 -5.0164 4.9700 4.9700 5.7093 5.7093 6.1667 6.1667 6.1748 6.1748 6.6622 6.6622 6.8039 6.8039 6.8184 6.8184 6.8934 6.8934 7.3201 7.3201 7.3440 7.3440 7.3518 7.3518 7.3903 7.3903 7.4855 7.4855 7.9544 7.9544 7.9562 7.9562 8.2408 8.2408 10.8650 10.8650 11.1921 11.1921 12.0019 12.0019 12.5207 12.5207 k = 0.0000 0.0000 0.0666 ( 3233 PWs) bands (ev): -30.7023 -30.7023 -30.6807 -30.6807 -12.1039 -12.1039 -11.9358 -11.9358 -11.7004 -11.7004 -11.5748 -11.5748 -11.5430 -11.5430 -11.5395 -11.5395 -5.4753 -5.4753 -5.0224 -5.0224 4.9727 4.9727 5.6806 5.6806 6.1690 6.1690 6.1770 6.1770 6.6942 6.6942 6.8015 6.8015 6.8153 6.8153 6.9008 6.9008 7.3209 7.3209 7.3443 7.3443 7.3546 7.3546 7.3912 7.3912 7.4862 7.4862 7.9535 7.9535 7.9561 7.9561 8.2311 8.2311 10.8724 10.8724 11.2032 11.2032 11.9730 11.9730 12.4967 12.4967 k = 0.0000 0.0000 0.0777 ( 3233 PWs) bands (ev): -30.7019 -30.7019 -30.6811 -30.6811 -12.1000 -12.1000 -11.9370 -11.9370 -11.6994 -11.6994 -11.5743 -11.5743 -11.5450 -11.5450 -11.5424 -11.5424 -5.4677 -5.4677 -5.0293 -5.0293 4.9761 4.9761 5.6497 5.6497 6.1717 6.1717 6.1796 6.1796 6.7284 6.7284 6.7992 6.7992 6.8119 6.8119 6.9094 6.9094 7.3219 7.3219 7.3447 7.3447 7.3582 7.3582 7.3924 7.3924 7.4872 7.4872 7.9523 7.9523 7.9560 7.9560 8.2199 8.2199 10.8811 10.8811 11.2165 11.2165 11.9402 11.9402 12.4687 12.4687 k = 0.0000 0.0000 0.0888 ( 3209 PWs) bands (ev): -30.7015 -30.7015 -30.6815 -30.6815 -12.0954 -12.0954 -11.9385 -11.9385 -11.6982 -11.6982 -11.5737 -11.5737 -11.5494 -11.5494 -11.5433 -11.5433 -5.4591 -5.4591 -5.0373 -5.0373 4.9802 4.9802 5.6171 5.6171 6.1748 6.1748 6.1824 6.1824 6.7628 6.7628 6.7980 6.7980 6.8081 6.8081 6.9189 6.9189 7.3231 7.3231 7.3452 7.3452 7.3626 7.3626 7.3938 7.3938 7.4889 7.4889 7.9511 7.9511 7.9561 7.9561 8.2072 8.2072 10.8915 10.8915 11.2319 11.2319 11.9040 11.9040 12.4369 12.4369 k = 0.0000 0.0000 0.1000 ( 3205 PWs) bands (ev): -30.7011 -30.7011 -30.6819 -30.6819 -12.0904 -12.0904 -11.9402 -11.9402 -11.6968 -11.6968 -11.5730 -11.5730 -11.5547 -11.5547 -11.5440 -11.5440 -5.4495 -5.4495 -5.0462 -5.0462 4.9850 4.9850 5.5834 5.5834 6.1780 6.1780 6.1855 6.1855 6.7841 6.7841 6.8039 6.8039 6.8102 6.8102 6.9291 6.9291 7.3243 7.3243 7.3457 7.3457 7.3677 7.3677 7.3953 7.3953 7.4911 7.4911 7.9495 7.9495 7.9561 7.9561 8.1928 8.1928 10.9031 10.9031 11.2493 11.2493 11.8649 11.8649 12.4014 12.4014 k = 0.0000 0.0000 0.1111 ( 3213 PWs) bands (ev): -30.7006 -30.7006 -30.6824 -30.6824 -12.0850 -12.0850 -11.9423 -11.9423 -11.6952 -11.6952 -11.5723 -11.5723 -11.5606 -11.5606 -11.5448 -11.5448 -5.4389 -5.4389 -5.0561 -5.0561 4.9907 4.9907 5.5491 5.5491 6.1815 6.1815 6.1887 6.1887 6.7844 6.7844 6.7995 6.7995 6.8429 6.8429 6.9400 6.9400 7.3256 7.3256 7.3460 7.3460 7.3735 7.3735 7.3969 7.3969 7.4940 7.4940 7.9476 7.9476 7.9562 7.9562 8.1766 8.1766 10.9163 10.9163 11.2688 11.2688 11.8233 11.8233 12.3626 12.3626 k = 0.0000 0.0000 0.1222 ( 3205 PWs) bands (ev): -30.7001 -30.7001 -30.6829 -30.6829 -12.0792 -12.0792 -11.9445 -11.9445 -11.6934 -11.6934 -11.5715 -11.5715 -11.5667 -11.5667 -11.5456 -11.5456 -5.4275 -5.4275 -5.0668 -5.0668 4.9972 4.9972 5.5148 5.5148 6.1852 6.1852 6.1921 6.1921 6.7814 6.7814 6.7950 6.7950 6.8777 6.8777 6.9515 6.9515 7.3270 7.3270 7.3464 7.3464 7.3801 7.3801 7.3986 7.3986 7.4983 7.4983 7.9454 7.9454 7.9563 7.9563 8.1589 8.1589 10.9311 10.9311 11.2904 11.2904 11.7800 11.7800 12.3209 12.3209 k = 0.0000 0.0000 0.1333 ( 3209 PWs) bands (ev): -30.6995 -30.6995 -30.6835 -30.6835 -12.0731 -12.0731 -11.9470 -11.9470 -11.6914 -11.6914 -11.5733 -11.5733 -11.5706 -11.5706 -11.5465 -11.5465 -5.4152 -5.4152 -5.0783 -5.0783 5.0046 5.0046 5.4805 5.4805 6.1890 6.1890 6.1956 6.1956 6.7778 6.7778 6.7903 6.7903 6.9112 6.9112 6.9632 6.9632 7.3284 7.3284 7.3467 7.3467 7.3872 7.3872 7.4004 7.4004 7.5042 7.5042 7.9428 7.9428 7.9565 7.9565 8.1398 8.1398 10.9474 10.9474 11.3140 11.3140 11.7354 11.7354 12.2766 12.2766 k = 0.0000 0.0000 0.1444 ( 3201 PWs) bands (ev): -30.6989 -30.6989 -30.6841 -30.6841 -12.0666 -12.0666 -11.9498 -11.9498 -11.6891 -11.6891 -11.5801 -11.5801 -11.5696 -11.5696 -11.5474 -11.5474 -5.4021 -5.4021 -5.0907 -5.0907 5.0131 5.0131 5.4468 5.4468 6.1928 6.1928 6.1990 6.1990 6.7741 6.7741 6.7855 6.7855 6.9422 6.9422 6.9751 6.9751 7.3300 7.3300 7.3470 7.3470 7.3945 7.3945 7.4025 7.4025 7.5126 7.5126 7.9395 7.9395 7.9568 7.9568 8.1194 8.1194 10.9654 10.9654 11.3396 11.3396 11.6902 11.6902 12.2302 12.2302 k = 0.0000 0.0000 0.1555 ( 3200 PWs) bands (ev): -30.6983 -30.6983 -30.6847 -30.6847 -12.0599 -12.0599 -11.9530 -11.9530 -11.6866 -11.6866 -11.5871 -11.5871 -11.5687 -11.5687 -11.5484 -11.5484 -5.3883 -5.3883 -5.1038 -5.1038 5.0226 5.0226 5.4136 5.4136 6.1966 6.1966 6.2023 6.2023 6.7704 6.7704 6.7808 6.7808 6.9702 6.9702 6.9869 6.9869 7.3315 7.3315 7.3472 7.3472 7.4015 7.4015 7.4045 7.4045 7.5241 7.5241 7.9354 7.9354 7.9572 7.9572 8.0981 8.0981 10.9850 10.9850 11.3667 11.3667 11.6451 11.6451 12.1821 12.1821 k = 0.0000 0.0000 0.1666 ( 3192 PWs) bands (ev): -30.6976 -30.6976 -30.6854 -30.6854 -12.0529 -12.0529 -11.9565 -11.9565 -11.6836 -11.6836 -11.5943 -11.5943 -11.5677 -11.5677 -11.5493 -11.5493 -5.3738 -5.3738 -5.1175 -5.1175 5.0332 5.0332 5.3813 5.3813 6.2002 6.2002 6.2056 6.2056 6.7668 6.7668 6.7763 6.7763 6.9946 6.9946 6.9986 6.9986 7.3330 7.3330 7.3473 7.3473 7.4063 7.4063 7.4081 7.4081 7.5394 7.5394 7.9302 7.9302 7.9578 7.9578 8.0763 8.0763 11.0064 11.0064 11.3948 11.3948 11.6012 11.6012 12.1327 12.1327 k = 0.0000 0.0000 0.1777 ( 3208 PWs) bands (ev): -30.6969 -30.6969 -30.6861 -30.6861 -12.0458 -12.0458 -11.9604 -11.9604 -11.6805 -11.6805 -11.6016 -11.6016 -11.5667 -11.5667 -11.5504 -11.5504 -5.3588 -5.3588 -5.1319 -5.1319 5.0450 5.0450 5.3499 5.3499 6.2037 6.2037 6.2085 6.2085 6.7635 6.7635 6.7719 6.7719 7.0097 7.0097 7.0152 7.0152 7.3344 7.3344 7.3472 7.3472 7.4082 7.4082 7.4130 7.4130 7.5586 7.5586 7.9228 7.9228 7.9583 7.9583 8.0546 8.0546 11.0295 11.0295 11.4217 11.4217 11.5609 11.5609 12.0822 12.0822 k = 0.0000 0.0000 0.1888 ( 3212 PWs) bands (ev): -30.6962 -30.6962 -30.6868 -30.6868 -12.0387 -12.0387 -11.9647 -11.9647 -11.6770 -11.6770 -11.6088 -11.6088 -11.5656 -11.5656 -11.5515 -11.5515 -5.3433 -5.3433 -5.1468 -5.1468 5.0581 5.0581 5.3196 5.3196 6.2070 6.2070 6.2112 6.2112 6.7605 6.7605 6.7679 6.7679 7.0204 7.0204 7.0318 7.0318 7.3359 7.3359 7.3470 7.3470 7.4102 7.4102 7.4168 7.4168 7.5819 7.5819 7.9129 7.9129 7.9591 7.9591 8.0340 8.0340 11.0544 11.0544 11.4390 11.4390 11.5329 11.5329 12.0312 12.0312 k = 0.0000 0.0000 0.1999 ( 3228 PWs) bands (ev): -30.6955 -30.6955 -30.6876 -30.6876 -12.0315 -12.0315 -11.9693 -11.9693 -11.6732 -11.6732 -11.6160 -11.6160 -11.5645 -11.5645 -11.5527 -11.5527 -5.3274 -5.3274 -5.1622 -5.1622 5.0724 5.0724 5.2904 5.2904 6.2099 6.2099 6.2136 6.2136 6.7579 6.7579 6.7642 6.7642 7.0304 7.0304 7.0447 7.0447 7.3372 7.3372 7.3467 7.3467 7.4121 7.4121 7.4193 7.4193 7.6084 7.6084 7.8992 7.8992 7.9600 7.9600 8.0157 8.0157 11.0810 11.0810 11.4280 11.4280 11.5362 11.5362 11.9800 11.9800 k = 0.0000 0.0000 0.2110 ( 3228 PWs) bands (ev): -30.6947 -30.6947 -30.6883 -30.6883 -12.0244 -12.0244 -11.9742 -11.9742 -11.6689 -11.6689 -11.6229 -11.6229 -11.5633 -11.5633 -11.5538 -11.5538 -5.3111 -5.3111 -5.1781 -5.1781 5.0880 5.0880 5.2625 5.2625 6.2125 6.2125 6.2155 6.2155 6.7559 6.7559 6.7609 6.7609 7.0394 7.0394 7.0540 7.0540 7.3386 7.3386 7.3463 7.3463 7.4140 7.4140 7.4209 7.4209 7.6379 7.6379 7.8808 7.8808 7.9613 7.9613 8.0008 8.0008 11.1097 11.1097 11.3953 11.3953 11.5643 11.5643 11.9289 11.9289 k = 0.0000 0.0000 0.2221 ( 3228 PWs) bands (ev): -30.6939 -30.6939 -30.6891 -30.6891 -12.0173 -12.0173 -11.9794 -11.9794 -11.6644 -11.6644 -11.6297 -11.6297 -11.5622 -11.5622 -11.5550 -11.5550 -5.2946 -5.2946 -5.1943 -5.1943 5.1050 5.1050 5.2359 5.2359 6.2146 6.2146 6.2170 6.2170 6.7543 6.7543 6.7582 6.7582 7.0472 7.0472 7.0601 7.0601 7.3399 7.3399 7.3458 7.3458 7.4158 7.4158 7.4216 7.4216 7.6695 7.6695 7.8577 7.8577 7.9629 7.9629 7.9896 7.9896 11.1401 11.1401 11.3570 11.3570 11.6012 11.6012 11.8782 11.8782 k = 0.0000 0.0000 0.2332 ( 3220 PWs) bands (ev): -30.6931 -30.6931 -30.6899 -30.6899 -12.0104 -12.0104 -11.9850 -11.9850 -11.6594 -11.6594 -11.6362 -11.6362 -11.5610 -11.5610 -11.5562 -11.5562 -5.2779 -5.2779 -5.2107 -5.2107 5.1233 5.1233 5.2106 5.2106 6.2162 6.2162 6.2180 6.2180 6.7534 6.7534 6.7560 6.7560 7.0539 7.0539 7.0634 7.0634 7.3412 7.3412 7.3452 7.3452 7.4174 7.4174 7.4217 7.4217 7.7024 7.7024 7.8306 7.8306 7.9650 7.9650 7.9814 7.9814 11.1724 11.1724 11.3178 11.3178 11.6424 11.6424 11.8284 11.8284 k = 0.0000 0.0000 0.2443 ( 3220 PWs) bands (ev): -30.6923 -30.6923 -30.6907 -30.6907 -12.0037 -12.0037 -11.9909 -11.9909 -11.6541 -11.6541 -11.6425 -11.6425 -11.5598 -11.5598 -11.5574 -11.5574 -5.2610 -5.2610 -5.2274 -5.2274 5.1431 5.1431 5.1867 5.1867 6.2173 6.2173 6.2186 6.2186 6.7530 6.7530 6.7545 6.7545 7.0591 7.0591 7.0641 7.0641 7.3422 7.3422 7.3445 7.3445 7.4188 7.4188 7.4213 7.4213 7.7356 7.7356 7.8006 7.8006 7.9676 7.9676 7.9754 7.9754 11.2064 11.2064 11.2794 11.2794 11.6862 11.6862 11.7795 11.7795 k = 0.0000 0.0000 0.2554 ( 3220 PWs) bands (ev): -30.6915 -30.6915 -30.6915 -30.6915 -11.9972 -11.9972 -11.9971 -11.9971 -11.6485 -11.6485 -11.6485 -11.6485 -11.5586 -11.5586 -11.5586 -11.5586 -5.2447 -5.2447 -5.2437 -5.2437 5.1641 5.1641 5.1643 5.1643 6.2177 6.2177 6.2187 6.2187 6.7530 6.7530 6.7539 6.7539 7.0622 7.0622 7.0629 7.0629 7.3428 7.3428 7.3440 7.3440 7.4196 7.4196 7.4208 7.4208 7.7682 7.7682 7.7690 7.7690 7.9704 7.9704 7.9715 7.9715 11.2420 11.2420 11.2423 11.2423 11.7318 11.7318 11.7322 11.7322 k = 0.0000 0.0000 0.2554 ( 3220 PWs) bands (ev): -30.6915 -30.6915 -30.6915 -30.6915 -11.9972 -11.9972 -11.9971 -11.9971 -11.6485 -11.6485 -11.6485 -11.6485 -11.5586 -11.5586 -11.5586 -11.5586 -5.2447 -5.2447 -5.2437 -5.2437 5.1641 5.1641 5.1643 5.1643 6.2177 6.2177 6.2187 6.2187 6.7530 6.7530 6.7539 6.7539 7.0622 7.0622 7.0629 7.0629 7.3428 7.3428 7.3440 7.3440 7.4196 7.4196 7.4208 7.4208 7.7682 7.7682 7.7690 7.7690 7.9704 7.9704 7.9715 7.9715 11.2420 11.2420 11.2423 11.2423 11.7318 11.7318 11.7322 11.7322 k = 0.0000 0.0114 0.2554 ( 3216 PWs) bands (ev): -30.6915 -30.6915 -30.6915 -30.6915 -11.9981 -11.9981 -11.9962 -11.9962 -11.6496 -11.6496 -11.6474 -11.6474 -11.5588 -11.5588 -11.5587 -11.5587 -5.2439 -5.2439 -5.2434 -5.2434 5.1633 5.1633 5.1655 5.1655 6.2103 6.2103 6.2189 6.2189 6.7440 6.7440 6.7501 6.7501 7.0607 7.0607 7.0664 7.0664 7.3425 7.3425 7.3471 7.3471 7.4211 7.4211 7.4274 7.4274 7.7649 7.7649 7.7753 7.7753 7.9692 7.9692 7.9729 7.9729 11.2430 11.2430 11.2457 11.2457 11.7330 11.7330 11.7350 11.7350 k = 0.0000 0.0227 0.2554 ( 3212 PWs) bands (ev): -30.6914 -30.6914 -30.6914 -30.6914 -11.9992 -11.9992 -11.9953 -11.9953 -11.6509 -11.6509 -11.6464 -11.6464 -11.5592 -11.5592 -11.5590 -11.5590 -5.2430 -5.2430 -5.2411 -5.2411 5.1609 5.1609 5.1690 5.1690 6.1883 6.1883 6.2193 6.2193 6.7195 6.7195 6.7382 6.7382 7.0605 7.0605 7.0713 7.0713 7.3425 7.3425 7.3536 7.3536 7.4245 7.4245 7.4487 7.4487 7.7636 7.7636 7.7852 7.7852 7.9678 7.9678 7.9750 7.9750 11.2455 11.2455 11.2563 11.2563 11.7351 11.7351 11.7443 11.7443 k = 0.0000 0.0341 0.2554 ( 3216 PWs) bands (ev): -30.6913 -30.6913 -30.6913 -30.6913 -12.0003 -12.0003 -11.9945 -11.9945 -11.6523 -11.6523 -11.6455 -11.6455 -11.5599 -11.5599 -11.5597 -11.5597 -5.2421 -5.2421 -5.2368 -5.2368 5.1571 5.1571 5.1748 5.1748 6.1523 6.1523 6.2199 6.2199 6.6826 6.6826 6.7195 6.7195 7.0614 7.0614 7.0763 7.0763 7.3424 7.3424 7.3607 7.3607 7.4304 7.4304 7.4840 7.4840 7.7642 7.7642 7.7985 7.7985 7.9667 7.9667 7.9772 7.9772 11.2496 11.2496 11.2733 11.2733 11.7386 11.7386 11.7602 11.7602 k = 0.0000 0.0455 0.2554 ( 3218 PWs) bands (ev): -30.6912 -30.6912 -30.6912 -30.6912 -12.0015 -12.0015 -11.9938 -11.9938 -11.6539 -11.6539 -11.6447 -11.6447 -11.5609 -11.5609 -11.5606 -11.5606 -5.2409 -5.2409 -5.2308 -5.2308 5.1517 5.1517 5.1830 5.1830 6.1034 6.1034 6.2208 6.2208 6.6373 6.6373 6.6952 6.6952 7.0626 7.0626 7.0808 7.0808 7.3424 7.3424 7.3668 7.3668 7.4392 7.4392 7.5311 7.5311 7.7660 7.7660 7.8152 7.8152 7.9664 7.9664 7.9797 7.9797 11.2553 11.2553 11.2958 11.2958 11.7436 11.7436 11.7831 11.7831 k = 0.0000 0.0568 0.2554 ( 3218 PWs) bands (ev): -30.6910 -30.6910 -30.6910 -30.6910 -12.0027 -12.0027 -11.9931 -11.9931 -11.6556 -11.6556 -11.6440 -11.6440 -11.5621 -11.5621 -11.5617 -11.5617 -5.2393 -5.2393 -5.2230 -5.2230 5.1447 5.1447 5.1933 5.1933 6.0426 6.0426 6.2220 6.2220 6.5863 6.5863 6.6665 6.6665 7.0636 7.0636 7.0844 7.0844 7.3421 7.3421 7.3716 7.3716 7.4510 7.4510 7.5867 7.5867 7.7688 7.7688 7.8344 7.8344 7.9675 7.9675 7.9828 7.9828 11.2625 11.2625 11.3224 11.3224 11.7499 11.7499 11.8136 11.8136 k = 0.0000 0.0682 0.2554 ( 3220 PWs) bands (ev): -30.6908 -30.6908 -30.6907 -30.6907 -12.0040 -12.0040 -11.9925 -11.9925 -11.6574 -11.6574 -11.6433 -11.6433 -11.5636 -11.5636 -11.5630 -11.5630 -5.2375 -5.2375 -5.2136 -5.2136 5.1364 5.1364 5.2059 5.2059 5.9711 5.9711 6.2234 6.2234 6.5319 6.5319 6.6345 6.6345 7.0639 7.0639 7.0872 7.0872 7.3417 7.3417 7.3751 7.3751 7.4654 7.4654 7.6483 7.6483 7.7721 7.7721 7.8548 7.8548 7.9708 7.9708 7.9870 7.9870 11.2712 11.2712 11.3518 11.3518 11.7576 11.7576 11.8522 11.8522 k = 0.0000 0.0795 0.2554 ( 3216 PWs) bands (ev): -30.6905 -30.6905 -30.6905 -30.6905 -12.0054 -12.0054 -11.9920 -11.9920 -11.6595 -11.6595 -11.6428 -11.6428 -11.5653 -11.5653 -11.5644 -11.5644 -5.2352 -5.2352 -5.2025 -5.2025 5.1266 5.1266 5.2206 5.2206 5.8904 5.8904 6.2251 6.2251 6.4756 6.4756 6.6000 6.6000 7.0634 7.0634 7.0895 7.0895 7.3411 7.3411 7.3775 7.3775 7.4820 7.4820 7.7127 7.7127 7.7769 7.7769 7.8737 7.8737 7.9772 7.9772 7.9941 7.9941 11.2814 11.2814 11.3829 11.3829 11.7666 11.7666 11.8994 11.8994 k = 0.0000 0.0909 0.2554 ( 3206 PWs) bands (ev): -30.6902 -30.6902 -30.6901 -30.6901 -12.0068 -12.0068 -11.9915 -11.9915 -11.6617 -11.6617 -11.6423 -11.6423 -11.5671 -11.5671 -11.5658 -11.5658 -5.2327 -5.2327 -5.1898 -5.1898 5.1155 5.1155 5.2375 5.2375 5.8014 5.8014 6.2270 6.2270 6.4180 6.4180 6.5637 6.5637 7.0618 7.0618 7.0915 7.0915 7.3402 7.3402 7.3790 7.3790 7.5002 7.5002 7.7641 7.7641 7.7969 7.7969 7.8883 7.8883 7.9846 7.9846 8.0093 8.0093 11.2929 11.2929 11.4144 11.4144 11.7769 11.7769 11.9551 11.9551 k = 0.0000 0.1023 0.2554 ( 3206 PWs) bands (ev): -30.6898 -30.6898 -30.6898 -30.6898 -12.0083 -12.0083 -11.9912 -11.9912 -11.6641 -11.6641 -11.6421 -11.6421 -11.5692 -11.5692 -11.5674 -11.5674 -5.2299 -5.2299 -5.1755 -5.1755 5.1030 5.1030 5.2563 5.2563 5.7055 5.7055 6.2292 6.2292 6.3601 6.3601 6.5260 6.5260 7.0590 7.0590 7.0936 7.0936 7.3389 7.3389 7.3798 7.3798 7.5195 7.5195 7.7742 7.7742 7.8586 7.8586 7.8972 7.8972 7.9917 7.9917 8.0359 8.0359 11.3056 11.3056 11.4457 11.4457 11.7883 11.7883 12.0191 12.0191 k = 0.0000 0.1136 0.2554 ( 3210 PWs) bands (ev): -30.6895 -30.6895 -30.6894 -30.6894 -12.0100 -12.0100 -11.9910 -11.9910 -11.6667 -11.6667 -11.6419 -11.6419 -11.5714 -11.5714 -11.5689 -11.5689 -5.2269 -5.2269 -5.1597 -5.1597 5.0892 5.0892 5.2771 5.2771 5.6036 5.6036 6.2315 6.2315 6.3023 6.3023 6.4875 6.4875 7.0549 7.0549 7.0961 7.0961 7.3374 7.3374 7.3800 7.3800 7.5395 7.5395 7.7768 7.7768 7.9010 7.9010 7.9238 7.9238 8.0027 8.0027 8.0721 8.0721 11.3196 11.3196 11.4765 11.4765 11.8008 11.8008 12.0907 12.0907 k = 0.0000 0.1250 0.2554 ( 3206 PWs) bands (ev): -30.6891 -30.6891 -30.6890 -30.6890 -12.0117 -12.0117 -11.9909 -11.9909 -11.6696 -11.6696 -11.6419 -11.6419 -11.5736 -11.5736 -11.5704 -11.5704 -5.2235 -5.2235 -5.1424 -5.1424 5.0743 5.0743 5.2998 5.2998 5.4968 5.4968 6.2340 6.2340 6.2449 6.2449 6.4485 6.4485 7.0496 7.0496 7.0992 7.0992 7.3356 7.3356 7.3798 7.3798 7.5599 7.5599 7.7782 7.7782 7.9024 7.9024 7.9677 7.9677 8.0351 8.0351 8.1156 8.1156 11.3345 11.3345 11.5067 11.5067 11.8144 11.8144 12.1693 12.1693 k = 0.0000 0.1364 0.2554 ( 3204 PWs) bands (ev): -30.6886 -30.6886 -30.6885 -30.6885 -12.0135 -12.0135 -11.9910 -11.9910 -11.6726 -11.6726 -11.6421 -11.6421 -11.5758 -11.5758 -11.5718 -11.5718 -5.2200 -5.2200 -5.1237 -5.1237 5.0582 5.0582 5.3241 5.3241 5.3860 5.3860 6.1881 6.1881 6.2368 6.2368 6.4092 6.4092 7.0430 7.0430 7.1031 7.1031 7.3335 7.3335 7.3794 7.3794 7.5804 7.5804 7.7789 7.7789 7.9021 7.9021 7.9827 7.9827 8.0955 8.0955 8.1658 8.1658 11.3505 11.3505 11.5363 11.5363 11.8288 11.8288 12.2536 12.2536 k = 0.0000 0.1477 0.2554 ( 3208 PWs) bands (ev): -30.6882 -30.6882 -30.6881 -30.6881 -12.0154 -12.0154 -11.9912 -11.9912 -11.6759 -11.6759 -11.6426 -11.6426 -11.5780 -11.5780 -11.5732 -11.5732 -5.2163 -5.2163 -5.1035 -5.1035 5.0411 5.0411 5.2719 5.2719 5.3502 5.3502 6.1323 6.1323 6.2397 6.2397 6.3699 6.3699 7.0353 7.0353 7.1079 7.1079 7.3311 7.3311 7.3786 7.3786 7.6007 7.6007 7.7791 7.7791 7.9009 7.9009 7.9888 7.9888 8.1612 8.1612 8.2235 8.2235 11.3672 11.3672 11.5656 11.5656 11.8440 11.8440 12.3427 12.3427 k = 0.0000 0.1591 0.2554 ( 3208 PWs) bands (ev): -30.6877 -30.6877 -30.6876 -30.6876 -12.0174 -12.0174 -11.9916 -11.9916 -11.6794 -11.6794 -11.6433 -11.6433 -11.5801 -11.5801 -11.5744 -11.5744 -5.2123 -5.2123 -5.0821 -5.0821 5.0225 5.0225 5.1559 5.1559 5.3778 5.3778 6.0775 6.0775 6.2426 6.2426 6.3309 6.3309 7.0266 7.0266 7.1134 7.1134 7.3285 7.3285 7.3778 7.3778 7.6206 7.6206 7.7792 7.7792 7.8993 7.8993 7.9927 7.9927 8.2238 8.2238 8.2896 8.2896 11.3847 11.3847 11.5947 11.5947 11.8598 11.8598 12.4356 12.4356 k = 0.0000 0.1705 0.2554 ( 3200 PWs) bands (ev): -30.6871 -30.6871 -30.6870 -30.6870 -12.0195 -12.0195 -11.9921 -11.9921 -11.6829 -11.6829 -11.6442 -11.6442 -11.5819 -11.5819 -11.5755 -11.5755 -5.2083 -5.2083 -5.0595 -5.0595 4.9991 4.9991 5.0422 5.0422 5.4067 5.4067 6.0240 6.0240 6.2453 6.2453 6.2925 6.2925 7.0170 7.0170 7.1199 7.1199 7.3258 7.3258 7.3769 7.3769 7.6397 7.6397 7.7796 7.7796 7.8976 7.8976 7.9957 7.9957 8.2831 8.2831 8.3621 8.3621 11.4028 11.4028 11.6238 11.6238 11.8759 11.8759 12.5314 12.5314 k = 0.0000 0.1818 0.2554 ( 3200 PWs) bands (ev): -30.6866 -30.6866 -30.6865 -30.6865 -12.0218 -12.0218 -11.9929 -11.9929 -11.6867 -11.6867 -11.6455 -11.6455 -11.5836 -11.5836 -11.5764 -11.5764 -5.2041 -5.2041 -5.0357 -5.0357 4.9122 4.9122 4.9901 4.9901 5.4369 5.4369 5.9717 5.9717 6.2436 6.2436 6.2591 6.2591 7.0066 7.0066 7.1271 7.1271 7.3229 7.3229 7.3761 7.3761 7.6574 7.6574 7.7807 7.7807 7.8958 7.8958 7.9981 7.9981 8.3408 8.3408 8.4383 8.4383 11.4214 11.4214 11.6531 11.6531 11.8923 11.8923 12.6294 12.6294 k = 0.0000 0.1932 0.2554 ( 3186 PWs) bands (ev): -30.6860 -30.6860 -30.6859 -30.6859 -12.0241 -12.0241 -11.9938 -11.9938 -11.6904 -11.6904 -11.6470 -11.6470 -11.5851 -11.5851 -11.5772 -11.5772 -5.1997 -5.1997 -5.0108 -5.0108 4.7936 4.7936 4.9686 4.9686 5.4683 5.4683 5.9208 5.9208 6.2132 6.2132 6.2552 6.2552 6.9955 6.9955 7.1349 7.1349 7.3199 7.3199 7.3753 7.3753 7.6732 7.6732 7.7832 7.7832 7.8942 7.8942 8.0004 8.0004 8.3984 8.3984 8.5163 8.5163 11.4404 11.4404 11.6827 11.6827 11.9086 11.9086 12.7287 12.7287 k = 0.0000 0.2045 0.2554 ( 3186 PWs) bands (ev): -30.6855 -30.6855 -30.6853 -30.6853 -12.0266 -12.0266 -11.9949 -11.9949 -11.6943 -11.6943 -11.6489 -11.6489 -11.5863 -11.5863 -11.5779 -11.5779 -5.1953 -5.1953 -4.9849 -4.9849 4.6736 4.6736 4.9480 4.9480 5.5006 5.5006 5.8713 5.8713 6.1765 6.1765 6.2582 6.2582 6.9838 6.9838 7.1432 7.1432 7.3168 7.3168 7.3747 7.3747 7.6861 7.6861 7.7877 7.7877 7.8929 7.8929 8.0023 8.0023 8.4559 8.4559 8.5950 8.5950 11.4595 11.4595 11.7126 11.7126 11.9246 11.9246 12.8289 12.8289 k = 0.0000 0.2159 0.2554 ( 3194 PWs) bands (ev): -30.6849 -30.6849 -30.6847 -30.6847 -12.0293 -12.0293 -11.9963 -11.9963 -11.6982 -11.6982 -11.6510 -11.6510 -11.5872 -11.5872 -11.5785 -11.5785 -5.1908 -5.1908 -4.9582 -4.9582 4.5536 4.5536 4.9273 4.9273 5.5336 5.5336 5.8234 5.8234 6.1401 6.1401 6.2618 6.2618 6.9716 6.9716 7.1518 7.1518 7.3138 7.3138 7.3744 7.3744 7.6954 7.6954 7.7948 7.7948 7.8919 7.8919 8.0040 8.0040 8.5138 8.5138 8.6739 8.6739 11.4787 11.4787 11.7429 11.7429 11.9400 11.9400 12.9293 12.9293 k = 0.0000 0.2273 0.2554 ( 3192 PWs) bands (ev): -30.6843 -30.6843 -30.6841 -30.6841 -12.0320 -12.0320 -11.9978 -11.9978 -11.7021 -11.7021 -11.6534 -11.6534 -11.5878 -11.5878 -11.5789 -11.5789 -5.1863 -5.1863 -4.9307 -4.9307 4.4344 4.4344 4.9066 4.9066 5.5673 5.5673 5.7772 5.7772 6.1044 6.1044 6.2656 6.2656 6.9591 6.9591 7.1604 7.1604 7.3110 7.3110 7.3744 7.3744 7.7011 7.7011 7.8047 7.8047 7.8918 7.8918 8.0056 8.0056 8.5721 8.5721 8.7528 8.7528 11.4977 11.4977 11.7735 11.7735 11.9546 11.9546 13.0297 13.0297 k = 0.0000 0.2386 0.2554 ( 3196 PWs) bands (ev): -30.6837 -30.6837 -30.6835 -30.6835 -12.0348 -12.0348 -11.9996 -11.9996 -11.7059 -11.7059 -11.6559 -11.6559 -11.5883 -11.5883 -11.5792 -11.5792 -5.1818 -5.1818 -4.9026 -4.9026 4.3165 4.3165 4.8858 4.8858 5.6011 5.6011 5.7328 5.7328 6.0695 6.0695 6.2695 6.2695 6.9462 6.9462 7.1687 7.1687 7.3085 7.3085 7.3749 7.3749 7.7035 7.7035 7.8163 7.8163 7.8928 7.8928 8.0071 8.0071 8.6306 8.6306 8.8311 8.8311 11.5165 11.5165 11.8045 11.8045 11.9683 11.9683 13.1297 13.1297 k = 0.0000 0.2500 0.2554 ( 3196 PWs) bands (ev): -30.6831 -30.6831 -30.6829 -30.6829 -12.0378 -12.0378 -12.0015 -12.0015 -11.7095 -11.7095 -11.6586 -11.6586 -11.5884 -11.5884 -11.5794 -11.5794 -5.1773 -5.1773 -4.8739 -4.8739 4.2002 4.2002 4.8651 4.8651 5.6342 5.6342 5.6912 5.6912 6.0356 6.0356 6.2735 6.2735 6.9333 6.9333 7.1765 7.1765 7.3065 7.3065 7.3760 7.3760 7.7034 7.7034 7.8281 7.8281 7.8956 7.8956 8.0086 8.0086 8.6892 8.6892 8.9088 8.9088 11.5346 11.5346 11.8359 11.8359 11.9806 11.9806 13.2288 13.2288 k = 0.0000 0.2614 0.2554 ( 3194 PWs) bands (ev): -30.6825 -30.6825 -30.6823 -30.6823 -12.0408 -12.0408 -12.0036 -12.0036 -11.7131 -11.7131 -11.6615 -11.6615 -11.5884 -11.5884 -11.5795 -11.5795 -5.1728 -5.1728 -4.8448 -4.8448 4.0861 4.0861 4.8446 4.8446 5.6420 5.6420 5.6767 5.6767 6.0028 6.0028 6.2775 6.2775 6.9202 6.9202 7.1835 7.1835 7.3051 7.3051 7.3779 7.3779 7.7015 7.7015 7.8387 7.8387 7.9013 7.9013 8.0099 8.0099 8.7478 8.7478 8.9856 8.9856 11.5519 11.5519 11.8675 11.8675 11.9917 11.9917 13.3271 13.3271 k = 0.0000 0.2727 0.2554 ( 3188 PWs) bands (ev): -30.6819 -30.6819 -30.6817 -30.6817 -12.0440 -12.0440 -12.0059 -12.0059 -11.7165 -11.7165 -11.6643 -11.6643 -11.5882 -11.5882 -11.5795 -11.5795 -5.1684 -5.1684 -4.8155 -4.8155 3.9744 3.9744 4.8244 4.8244 5.6059 5.6059 5.7078 5.7078 5.9711 5.9711 6.2815 6.2815 6.9073 6.9073 7.1892 7.1892 7.3042 7.3042 7.3806 7.3806 7.6983 7.6983 7.8467 7.8467 7.9104 7.9104 8.0113 8.0113 8.8064 8.8064 9.0612 9.0612 11.5680 11.5680 11.8994 11.8994 12.0015 12.0015 13.4242 13.4242 k = 0.0000 0.2841 0.2554 ( 3188 PWs) bands (ev): -30.6813 -30.6813 -30.6811 -30.6811 -12.0472 -12.0472 -12.0084 -12.0084 -11.7197 -11.7197 -11.6672 -11.6672 -11.5878 -11.5878 -11.5794 -11.5794 -5.1641 -5.1641 -4.7861 -4.7861 3.8655 3.8655 4.8045 4.8045 5.5686 5.5686 5.7415 5.7415 5.9406 5.9406 6.2856 6.2856 6.8946 6.8946 7.1935 7.1935 7.3039 7.3039 7.3845 7.3845 7.6943 7.6943 7.8519 7.8519 7.9229 7.9229 8.0126 8.0126 8.8648 8.8648 9.1355 9.1355 11.5825 11.5825 11.9313 11.9313 12.0099 12.0099 13.5201 13.5201 k = 0.0000 0.2955 0.2554 ( 3192 PWs) bands (ev): -30.6808 -30.6808 -30.6805 -30.6805 -12.0504 -12.0504 -12.0110 -12.0110 -11.7227 -11.7227 -11.6701 -11.6701 -11.5874 -11.5874 -11.5793 -11.5793 -5.1599 -5.1599 -4.7567 -4.7567 3.7598 3.7598 4.7850 4.7850 5.5327 5.5327 5.7751 5.7751 5.9114 5.9114 6.2896 6.2896 6.8822 6.8822 7.1964 7.1964 7.3041 7.3041 7.3894 7.3894 7.6896 7.6896 7.8549 7.8549 7.9377 7.9377 8.0140 8.0140 8.9228 8.9228 9.2082 9.2082 11.5950 11.5950 11.9632 11.9632 12.0172 12.0172 13.6145 13.6145 k = 0.0000 0.3068 0.2554 ( 3190 PWs) bands (ev): -30.6802 -30.6802 -30.6799 -30.6799 -12.0537 -12.0537 -12.0137 -12.0137 -11.7255 -11.7255 -11.6729 -11.6729 -11.5868 -11.5868 -11.5791 -11.5791 -5.1557 -5.1557 -4.7274 -4.7274 3.6576 3.6576 4.7662 4.7662 5.4985 5.4985 5.8078 5.8078 5.8839 5.8839 6.2936 6.2936 6.8702 6.8702 7.1978 7.1978 7.3045 7.3045 7.3955 7.3955 7.6844 7.6844 7.8566 7.8566 7.9539 7.9539 8.0154 8.0154 8.9804 8.9804 9.2791 9.2791 11.6049 11.6049 11.9949 11.9949 12.0238 12.0238 13.7073 13.7073 k = 0.0000 0.3182 0.2554 ( 3194 PWs) bands (ev): -30.6796 -30.6796 -30.6793 -30.6793 -12.0570 -12.0570 -12.0165 -12.0165 -11.7281 -11.7281 -11.6757 -11.6757 -11.5862 -11.5862 -11.5788 -11.5788 -5.1518 -5.1518 -4.6986 -4.6986 3.5592 3.5592 4.7479 4.7479 5.4661 5.4661 5.8368 5.8368 5.8608 5.8608 6.2974 6.2974 6.8587 6.8587 7.1980 7.1980 7.3051 7.3051 7.4026 7.4026 7.6789 7.6789 7.8576 7.8576 7.9705 7.9705 8.0170 8.0170 9.0373 9.0373 9.3480 9.3480 11.6117 11.6117 12.0263 12.0263 12.0300 12.0300 13.7985 13.7985 k = 0.0000 0.3295 0.2554 ( 3190 PWs) bands (ev): -30.6791 -30.6791 -30.6788 -30.6788 -12.0603 -12.0603 -12.0194 -12.0194 -11.7305 -11.7305 -11.6783 -11.6783 -11.5855 -11.5855 -11.5785 -11.5785 -5.1479 -5.1479 -4.6702 -4.6702 3.4649 3.4649 4.7304 4.7304 5.4356 5.4356 5.8285 5.8285 5.8751 5.8751 6.3013 6.3013 6.8478 6.8478 7.1972 7.1972 7.3056 7.3056 7.4107 7.4107 7.6732 7.6732 7.8582 7.8582 7.9869 7.9869 8.0192 8.0192 9.0933 9.0933 9.4146 9.4146 11.6149 11.6149 12.0363 12.0363 12.0574 12.0574 13.8289 13.8289 k = 0.0000 0.3409 0.2554 ( 3192 PWs) bands (ev): -30.6786 -30.6786 -30.6783 -30.6783 -12.0636 -12.0636 -12.0223 -12.0223 -11.7326 -11.7326 -11.6808 -11.6808 -11.5848 -11.5848 -11.5782 -11.5782 -5.1443 -5.1443 -4.6426 -4.6426 3.3750 3.3750 4.7137 4.7137 5.4069 5.4069 5.8057 5.8057 5.9043 5.9043 6.3049 6.3049 6.8376 6.8376 7.1955 7.1955 7.3060 7.3060 7.4195 7.4195 7.6673 7.6673 7.8586 7.8586 8.0015 8.0015 8.0229 8.0229 9.1484 9.1484 9.4787 9.4787 11.6141 11.6141 12.0432 12.0432 12.0878 12.0878 13.7815 13.7815 k = 0.0000 0.3523 0.2554 ( 3200 PWs) bands (ev): -30.6781 -30.6781 -30.6778 -30.6778 -12.0668 -12.0668 -12.0252 -12.0252 -11.7346 -11.7346 -11.6832 -11.6832 -11.5841 -11.5841 -11.5779 -11.5779 -5.1408 -5.1408 -4.6159 -4.6159 3.2898 3.2898 4.6978 4.6978 5.3800 5.3800 5.7835 5.7835 5.9329 5.9329 6.3085 6.3085 6.8282 6.8282 7.1933 7.1933 7.3061 7.3061 7.4286 7.4286 7.6614 7.6614 7.8588 7.8588 8.0112 8.0112 8.0310 8.0310 9.2022 9.2022 9.5400 9.5400 11.6091 11.6091 12.0510 12.0510 12.1173 12.1173 13.7361 13.7361 k = 0.0000 0.3636 0.2554 ( 3204 PWs) bands (ev): -30.6776 -30.6776 -30.6773 -30.6773 -12.0699 -12.0699 -12.0280 -12.0280 -11.7363 -11.7363 -11.6854 -11.6854 -11.5834 -11.5834 -11.5776 -11.5776 -5.1376 -5.1376 -4.5901 -4.5901 3.2097 3.2097 4.6829 4.6829 5.3552 5.3552 5.7628 5.7628 5.9601 5.9601 6.3119 6.3119 6.8195 6.8195 7.1907 7.1907 7.3061 7.3061 7.4380 7.4380 7.6555 7.6555 7.8590 7.8590 8.0156 8.0156 8.0439 8.0439 9.2545 9.2545 9.5984 9.5984 11.5999 11.5999 12.0599 12.0599 12.1459 12.1459 13.6930 13.6930 k = 0.0000 0.3750 0.2554 ( 3204 PWs) bands (ev): -30.6772 -30.6772 -30.6768 -30.6768 -12.0729 -12.0729 -12.0307 -12.0307 -11.7378 -11.7378 -11.6875 -11.6875 -11.5828 -11.5828 -11.5772 -11.5772 -5.1345 -5.1345 -4.5657 -4.5657 3.1348 3.1348 4.6689 4.6689 5.3322 5.3322 5.7435 5.7435 5.9856 5.9856 6.3151 6.3151 6.8118 6.8118 7.1880 7.1880 7.3060 7.3060 7.4472 7.4472 7.6499 7.6499 7.8592 7.8592 8.0178 8.0178 8.0584 8.0584 9.3051 9.3051 9.6534 9.6534 11.5869 11.5869 12.0700 12.0700 12.1733 12.1733 13.6523 13.6523 k = 0.0000 0.3864 0.2554 ( 3208 PWs) bands (ev): -30.6768 -30.6768 -30.6764 -30.6764 -12.0757 -12.0757 -12.0334 -12.0334 -11.7391 -11.7391 -11.6894 -11.6894 -11.5821 -11.5821 -11.5769 -11.5769 -5.1317 -5.1317 -4.5426 -4.5426 3.0655 3.0655 4.6560 4.6560 5.3112 5.3112 5.7257 5.7257 6.0093 6.0093 6.3181 6.3181 6.8050 6.8050 7.1851 7.1851 7.3057 7.3057 7.4561 7.4561 7.6443 7.6443 7.8594 7.8594 8.0194 8.0194 8.0726 8.0726 9.3535 9.3535 9.7049 9.7049 11.5705 11.5705 12.0810 12.0810 12.1993 12.1993 13.6142 13.6142 k = 0.0000 0.3977 0.2554 ( 3208 PWs) bands (ev): -30.6764 -30.6764 -30.6760 -30.6760 -12.0784 -12.0784 -12.0358 -12.0358 -11.7403 -11.7403 -11.6911 -11.6911 -11.5815 -11.5815 -11.5766 -11.5766 -5.1291 -5.1291 -4.5211 -4.5211 3.0019 3.0019 4.6442 4.6442 5.2922 5.2922 5.7095 5.7095 6.0310 6.0310 6.3208 6.3208 6.7990 6.7990 7.1823 7.1823 7.3054 7.3054 7.4646 7.4646 7.6391 7.6391 7.8595 7.8595 8.0206 8.0206 8.0862 8.0862 9.3995 9.3995 9.7526 9.7526 11.5516 11.5516 12.0927 12.0927 12.2237 12.2237 13.5790 13.5790 k = 0.0000 0.4091 0.2554 ( 3202 PWs) bands (ev): -30.6761 -30.6761 -30.6757 -30.6757 -12.0808 -12.0808 -12.0381 -12.0381 -11.7413 -11.7413 -11.6926 -11.6926 -11.5809 -11.5809 -11.5762 -11.5762 -5.1267 -5.1267 -4.5014 -4.5014 2.9444 2.9444 4.6335 4.6335 5.2752 5.2752 5.6950 5.6950 6.0505 6.0505 6.3234 6.3234 6.7939 6.7939 7.1796 7.1796 7.3050 7.3050 7.4725 7.4725 7.6342 7.6342 7.8598 7.8598 8.0217 8.0217 8.0988 8.0988 9.4427 9.4427 9.7961 9.7961 11.5310 11.5310 12.1047 12.1047 12.2462 12.2462 13.5468 13.5468 k = 0.0000 0.4205 0.2554 ( 3198 PWs) bands (ev): -30.6758 -30.6758 -30.6754 -30.6754 -12.0830 -12.0830 -12.0402 -12.0402 -11.7421 -11.7421 -11.6939 -11.6939 -11.5803 -11.5803 -11.5760 -11.5760 -5.1246 -5.1246 -4.4835 -4.4835 2.8931 2.8931 4.6240 4.6240 5.2601 5.2601 5.6821 5.6821 6.0680 6.0680 6.3257 6.3257 6.7896 6.7896 7.1770 7.1770 7.3046 7.3046 7.4796 7.4796 7.6298 7.6298 7.8599 7.8599 8.0226 8.0226 8.1104 8.1104 9.4824 9.4824 9.8354 9.8354 11.5096 11.5096 12.1166 12.1166 12.2667 12.2667 13.5178 13.5178 k = 0.0000 0.4318 0.2554 ( 3190 PWs) bands (ev): -30.6755 -30.6755 -30.6751 -30.6751 -12.0850 -12.0850 -12.0420 -12.0420 -11.7428 -11.7428 -11.6951 -11.6951 -11.5799 -11.5799 -11.5757 -11.5757 -5.1228 -5.1228 -4.4677 -4.4677 2.8483 2.8483 4.6157 4.6157 5.2471 5.2471 5.6709 5.6709 6.0831 6.0831 6.3277 6.3277 6.7862 6.7862 7.1748 7.1748 7.3042 7.3042 7.4859 7.4859 7.6259 7.6259 7.8601 7.8601 8.0233 8.0233 8.1207 8.1207 9.5185 9.5185 9.8700 9.8700 11.4885 11.4885 12.1279 12.1279 12.2850 12.2850 13.4923 13.4923 k = 0.0000 0.4432 0.2554 ( 3190 PWs) bands (ev): -30.6753 -30.6753 -30.6748 -30.6748 -12.0867 -12.0867 -12.0436 -12.0436 -11.7433 -11.7433 -11.6960 -11.6960 -11.5794 -11.5794 -11.5755 -11.5755 -5.1213 -5.1213 -4.4541 -4.4541 2.8100 2.8100 4.6086 4.6086 5.2360 5.2360 5.6614 5.6614 6.0960 6.0960 6.3294 6.3294 6.7835 6.7835 7.1728 7.1728 7.3038 7.3038 7.4912 7.4912 7.6225 7.6225 7.8602 7.8602 8.0240 8.0240 8.1295 8.1295 9.5501 9.5501 9.8997 9.8997 11.4685 11.4685 12.1383 12.1383 12.3008 12.3008 13.4703 13.4703 k = 0.0000 0.4545 0.2554 ( 3188 PWs) bands (ev): -30.6751 -30.6751 -30.6747 -30.6747 -12.0881 -12.0881 -12.0450 -12.0450 -11.7438 -11.7438 -11.6968 -11.6968 -11.5791 -11.5791 -11.5753 -11.5753 -5.1200 -5.1200 -4.4428 -4.4428 2.7784 2.7784 4.6027 4.6027 5.2270 5.2270 5.6536 5.6536 6.1065 6.1065 6.3309 6.3309 6.7813 6.7813 7.1711 7.1711 7.3034 7.3034 7.4956 7.4956 7.6197 7.6197 7.8604 7.8604 8.0245 8.0245 8.1369 8.1369 9.5769 9.5769 9.9244 9.9244 11.4507 11.4507 12.1473 12.1473 12.3140 12.3140 13.4520 13.4520 k = 0.0000 0.4659 0.2554 ( 3194 PWs) bands (ev): -30.6749 -30.6749 -30.6745 -30.6745 -12.0893 -12.0893 -12.0460 -12.0460 -11.7442 -11.7442 -11.6975 -11.6975 -11.5788 -11.5788 -11.5751 -11.5751 -5.1190 -5.1190 -4.4339 -4.4339 2.7537 2.7537 4.5982 4.5982 5.2199 5.2199 5.6475 5.6475 6.1147 6.1147 6.3320 6.3320 6.7798 6.7798 7.1697 7.1697 7.3031 7.3031 7.4990 7.4990 7.6174 7.6174 7.8605 7.8605 8.0249 8.0249 8.1427 8.1427 9.5983 9.5983 9.9437 9.9437 11.4359 11.4359 12.1546 12.1546 12.3244 12.3244 13.4377 13.4377 k = 0.0000 0.4773 0.2554 ( 3194 PWs) bands (ev): -30.6748 -30.6748 -30.6744 -30.6744 -12.0901 -12.0901 -12.0468 -12.0468 -11.7444 -11.7444 -11.6980 -11.6980 -11.5786 -11.5786 -11.5750 -11.5750 -5.1183 -5.1183 -4.4275 -4.4275 2.7360 2.7360 4.5949 4.5949 5.2149 5.2149 5.6432 5.6432 6.1205 6.1205 6.3328 6.3328 6.7787 6.7787 7.1687 7.1687 7.3029 7.3029 7.5015 7.5015 7.6158 7.6158 7.8605 7.8605 8.0252 8.0252 8.1469 8.1469 9.6139 9.6139 9.9577 9.9577 11.4248 11.4248 12.1601 12.1601 12.3320 12.3320 13.4273 13.4273 k = 0.0000 0.4886 0.2554 ( 3202 PWs) bands (ev): -30.6748 -30.6748 -30.6743 -30.6743 -12.0906 -12.0906 -12.0473 -12.0473 -11.7446 -11.7446 -11.6982 -11.6982 -11.5786 -11.5786 -11.5750 -11.5750 -5.1178 -5.1178 -4.4236 -4.4236 2.7253 2.7253 4.5929 4.5929 5.2118 5.2118 5.6405 5.6405 6.1240 6.1240 6.3333 6.3333 6.7781 6.7781 7.1681 7.1681 7.3027 7.3027 7.5029 7.5029 7.6148 7.6148 7.8606 7.8606 8.0254 8.0254 8.1495 8.1495 9.6235 9.6235 9.9661 9.9661 11.4179 11.4179 12.1634 12.1634 12.3365 12.3365 13.4211 13.4211 k = 0.0000 0.5000 0.2554 ( 3204 PWs) bands (ev): -30.6747 -30.6747 -30.6743 -30.6743 -12.0908 -12.0908 -12.0475 -12.0475 -11.7446 -11.7446 -11.6983 -11.6983 -11.5785 -11.5785 -11.5749 -11.5749 -5.1177 -5.1177 -4.4223 -4.4223 2.7218 2.7218 4.5923 4.5923 5.2108 5.2108 5.6396 5.6396 6.1252 6.1252 6.3335 6.3335 6.7779 6.7779 7.1679 7.1679 7.3027 7.3027 7.5034 7.5034 7.6145 7.6145 7.8606 7.8606 8.0254 8.0254 8.1503 8.1503 9.6266 9.6266 9.9689 9.9689 11.4156 11.4156 12.1645 12.1645 12.3381 12.3381 13.4190 13.4190 k = 0.0000 0.5000 0.2554 ( 3204 PWs) bands (ev): -30.6747 -30.6747 -30.6743 -30.6743 -12.0908 -12.0908 -12.0475 -12.0475 -11.7446 -11.7446 -11.6983 -11.6983 -11.5785 -11.5785 -11.5749 -11.5749 -5.1177 -5.1177 -4.4223 -4.4223 2.7218 2.7218 4.5923 4.5923 5.2108 5.2108 5.6396 5.6396 6.1252 6.1252 6.3335 6.3335 6.7779 6.7779 7.1679 7.1679 7.3027 7.3027 7.5034 7.5034 7.6145 7.6145 7.8606 7.8606 8.0254 8.0254 8.1503 8.1503 9.6266 9.6266 9.9689 9.9689 11.4156 11.4156 12.1645 12.1645 12.3381 12.3381 13.4190 13.4190 k = 0.0114 0.5000 0.2554 ( 3200 PWs) bands (ev): -30.6747 -30.6747 -30.6743 -30.6743 -12.0907 -12.0907 -12.0475 -12.0475 -11.7446 -11.7446 -11.6983 -11.6983 -11.5790 -11.5790 -11.5748 -11.5748 -5.1168 -5.1168 -4.4222 -4.4222 2.7219 2.7219 4.5927 4.5927 5.2100 5.2100 5.6377 5.6377 6.1225 6.1225 6.3256 6.3256 6.7775 6.7775 7.1710 7.1710 7.3061 7.3061 7.5047 7.5047 7.6149 7.6149 7.8610 7.8610 8.0256 8.0256 8.1520 8.1520 9.6272 9.6272 9.9684 9.9684 11.4177 11.4177 12.1609 12.1609 12.3402 12.3402 13.4124 13.4124 k = 0.0227 0.5000 0.2554 ( 3200 PWs) bands (ev): -30.6747 -30.6747 -30.6742 -30.6742 -12.0907 -12.0907 -12.0475 -12.0475 -11.7445 -11.7445 -11.6983 -11.6983 -11.5803 -11.5803 -11.5747 -11.5747 -5.1143 -5.1143 -4.4217 -4.4217 2.7225 2.7225 4.5940 4.5940 5.2074 5.2074 5.6320 5.6320 6.1143 6.1143 6.3025 6.3025 6.7765 6.7765 7.1800 7.1800 7.3160 7.3160 7.5084 7.5084 7.6160 7.6160 7.8622 7.8622 8.0260 8.0260 8.1569 8.1569 9.6288 9.6288 9.9670 9.9670 11.4239 11.4239 12.1502 12.1502 12.3465 12.3465 13.3930 13.3930 k = 0.0341 0.5000 0.2554 ( 3196 PWs) bands (ev): -30.6745 -30.6745 -30.6741 -30.6741 -12.0907 -12.0907 -12.0476 -12.0476 -11.7444 -11.7444 -11.6983 -11.6983 -11.5822 -11.5822 -11.5748 -11.5748 -5.1100 -5.1100 -4.4209 -4.4209 2.7234 2.7234 4.5961 4.5961 5.2032 5.2032 5.6227 5.6227 6.1009 6.1009 6.2648 6.2648 6.7754 6.7754 7.1946 7.1946 7.3315 7.3315 7.5143 7.5143 7.6179 7.6179 7.8642 7.8642 8.0271 8.0271 8.1648 8.1648 9.6314 9.6314 9.9646 9.9646 11.4342 11.4342 12.1327 12.1327 12.3571 12.3571 13.3614 13.3614 k = 0.0455 0.5000 0.2554 ( 3192 PWs) bands (ev): -30.6744 -30.6744 -30.6740 -30.6740 -12.0906 -12.0906 -12.0477 -12.0477 -11.7441 -11.7441 -11.6982 -11.6982 -11.5846 -11.5846 -11.5753 -11.5753 -5.1041 -5.1041 -4.4198 -4.4198 2.7247 2.7247 4.5990 4.5990 5.1973 5.1973 5.6099 5.6099 6.0825 6.0825 6.2140 6.2140 6.7749 6.7749 7.2143 7.2143 7.3516 7.3516 7.5219 7.5219 7.6205 7.6205 7.8669 7.8669 8.0294 8.0294 8.1751 8.1751 9.6351 9.6351 9.9612 9.9612 11.4483 11.4483 12.1089 12.1089 12.3719 12.3719 13.3186 13.3186 k = 0.0568 0.5000 0.2554 ( 3192 PWs) bands (ev): -30.6742 -30.6742 -30.6738 -30.6738 -12.0905 -12.0905 -12.0479 -12.0479 -11.7439 -11.7439 -11.6982 -11.6982 -11.5874 -11.5874 -11.5760 -11.5760 -5.0965 -5.0965 -4.4184 -4.4184 2.7263 2.7263 4.6027 4.6027 5.1898 5.1898 5.5940 5.5940 6.0591 6.0591 6.1517 6.1517 6.7757 6.7757 7.2387 7.2387 7.3746 7.3746 7.5307 7.5307 7.6237 7.6237 7.8702 7.8702 8.0336 8.0336 8.1873 8.1873 9.6398 9.6398 9.9570 9.9570 11.4660 11.4660 12.0793 12.0793 12.3909 12.3909 13.2657 13.2657 k = 0.0682 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6740 -30.6740 -30.6736 -30.6736 -12.0904 -12.0904 -12.0481 -12.0481 -11.7436 -11.7436 -11.6981 -11.6981 -11.5906 -11.5906 -11.5771 -11.5771 -5.0872 -5.0872 -4.4167 -4.4167 2.7282 2.7282 4.6071 4.6071 5.1808 5.1808 5.5752 5.5752 6.0300 6.0300 6.0807 6.0807 6.7782 6.7782 7.2673 7.2673 7.3989 7.3989 7.5406 7.5406 7.6276 7.6276 7.8738 7.8738 8.0404 8.0404 8.2010 8.2010 9.6454 9.6454 9.9519 9.9519 11.4870 11.4870 12.0447 12.0447 12.4140 12.4140 13.2041 13.2041 k = 0.0795 0.5000 0.2554 ( 3184 PWs) bands (ev): -30.6737 -30.6737 -30.6733 -30.6733 -12.0903 -12.0903 -12.0484 -12.0484 -11.7433 -11.7433 -11.6981 -11.6981 -11.5941 -11.5941 -11.5786 -11.5786 -5.0763 -5.0763 -4.4147 -4.4147 2.7306 2.7306 4.6122 4.6122 5.1703 5.1703 5.5540 5.5540 5.9826 5.9826 6.0155 6.0155 6.7829 6.7829 7.2996 7.2996 7.4227 7.4227 7.5515 7.5515 7.6320 7.6320 7.8776 7.8776 8.0509 8.0509 8.2155 8.2155 9.6519 9.6519 9.9462 9.9462 11.5109 11.5109 12.0056 12.0056 12.4413 12.4413 13.1349 13.1349 k = 0.0909 0.5000 0.2554 ( 3180 PWs) bands (ev): -30.6734 -30.6734 -30.6730 -30.6730 -12.0902 -12.0902 -12.0487 -12.0487 -11.7429 -11.7429 -11.6981 -11.6981 -11.5979 -11.5979 -11.5804 -11.5804 -5.0638 -5.0638 -4.4125 -4.4125 2.7332 2.7332 4.6179 4.6179 5.1583 5.1583 5.5306 5.5306 5.8995 5.8995 5.9754 5.9754 6.7900 6.7900 7.3352 7.3352 7.4445 7.4445 7.5632 7.5632 7.6372 7.6372 7.8810 7.8810 8.0661 8.0661 8.2305 8.2305 9.6594 9.6594 9.9396 9.9396 11.5375 11.5375 11.9627 11.9627 12.4726 12.4726 13.0592 13.0592 k = 0.1023 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6731 -30.6731 -30.6727 -30.6727 -12.0901 -12.0901 -12.0491 -12.0491 -11.7426 -11.7426 -11.6982 -11.6982 -11.6019 -11.6019 -11.5824 -11.5824 -5.0498 -5.0498 -4.4100 -4.4100 2.7361 2.7361 4.6241 4.6241 5.1450 5.1450 5.5054 5.5054 5.8043 5.8043 5.9385 5.9385 6.7995 6.7995 7.3736 7.3736 7.4631 7.4631 7.5757 7.5757 7.6430 7.6430 7.8837 7.8837 8.0868 8.0868 8.2454 8.2454 9.6675 9.6675 9.9325 9.9325 11.5662 11.5662 11.9168 11.9168 12.5080 12.5080 12.9781 12.9781 k = 0.1136 0.5000 0.2554 ( 3184 PWs) bands (ev): -30.6727 -30.6727 -30.6723 -30.6723 -12.0900 -12.0900 -12.0495 -12.0495 -11.7423 -11.7423 -11.6983 -11.6983 -11.6062 -11.6062 -11.5846 -11.5846 -5.0343 -5.0343 -4.4073 -4.4073 2.7392 2.7392 4.6308 4.6308 5.1305 5.1305 5.4786 5.4786 5.7029 5.7029 5.9006 5.9006 6.8116 6.8116 7.4140 7.4140 7.4785 7.4785 7.5883 7.5883 7.6498 7.6498 7.8855 7.8855 8.1137 8.1137 8.2602 8.2602 9.6763 9.6763 9.9248 9.9248 11.5968 11.5968 11.8684 11.8684 12.5474 12.5474 12.8925 12.8925 k = 0.1250 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6723 -30.6723 -30.6719 -30.6719 -12.0900 -12.0900 -12.0500 -12.0500 -11.7420 -11.7420 -11.6986 -11.6986 -11.6106 -11.6106 -11.5871 -11.5871 -5.0172 -5.0172 -4.4043 -4.4043 2.7427 2.7427 4.6378 4.6378 5.1148 5.1148 5.4504 5.4504 5.5971 5.5971 5.8616 5.8616 6.8260 6.8260 7.4545 7.4545 7.4922 7.4922 7.6003 7.6003 7.6580 7.6580 7.8862 7.8862 8.1470 8.1470 8.2744 8.2744 9.6857 9.6857 9.9167 9.9167 11.6290 11.6290 11.8180 11.8180 12.5907 12.5907 12.8030 12.8030 k = 0.1364 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6719 -30.6719 -30.6715 -30.6715 -12.0899 -12.0899 -12.0506 -12.0506 -11.7418 -11.7418 -11.6989 -11.6989 -11.6151 -11.6151 -11.5898 -11.5898 -4.9988 -4.9988 -4.4011 -4.4011 2.7464 2.7464 4.6451 4.6451 5.0981 5.0981 5.4198 5.4198 5.4891 5.4891 5.8217 5.8217 6.8427 6.8427 7.4847 7.4847 7.5139 7.5139 7.6111 7.6111 7.6682 7.6682 7.8859 7.8859 8.1865 8.1865 8.2880 8.2880 9.6955 9.6955 9.9082 9.9082 11.6622 11.6622 11.7660 11.7660 12.6379 12.6379 12.7104 12.7104 k = 0.1477 0.5000 0.2554 ( 3192 PWs) bands (ev): -30.6714 -30.6714 -30.6711 -30.6711 -12.0899 -12.0899 -12.0513 -12.0513 -11.7416 -11.7416 -11.6995 -11.6995 -11.6196 -11.6196 -11.5926 -11.5926 -4.9791 -4.9791 -4.3978 -4.3978 2.7503 2.7503 4.6526 4.6526 5.0805 5.0805 5.3628 5.3628 5.4040 5.4040 5.7812 5.7812 6.8615 6.8615 7.4959 7.4959 7.5512 7.5512 7.6207 7.6207 7.6815 7.6815 7.8846 7.8846 8.2317 8.2317 8.3007 8.3007 9.7058 9.7058 9.8994 9.8994 11.6963 11.6963 11.7130 11.7130 12.6152 12.6152 12.6888 12.6888 k = 0.1591 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6709 -30.6709 -30.6706 -30.6706 -12.0899 -12.0899 -12.0520 -12.0520 -11.7415 -11.7415 -11.7002 -11.7002 -11.6240 -11.6240 -11.5954 -11.5954 -4.9580 -4.9580 -4.3943 -4.3943 2.7544 2.7544 4.6601 4.6601 5.0620 5.0620 5.2534 5.2534 5.3690 5.3690 5.7405 5.7405 6.8825 6.8825 7.5007 7.5007 7.5882 7.5882 7.6300 7.6300 7.7006 7.7006 7.8827 7.8827 8.2816 8.2816 8.3129 8.3129 9.7162 9.7162 9.8905 9.8905 11.6589 11.6589 11.7313 11.7313 12.5178 12.5178 12.7435 12.7435 k = 0.1705 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6704 -30.6704 -30.6701 -30.6701 -12.0899 -12.0899 -12.0528 -12.0528 -11.7416 -11.7416 -11.7012 -11.7012 -11.6283 -11.6283 -11.5983 -11.5983 -4.9357 -4.9357 -4.3907 -4.3907 2.7587 2.7587 4.6675 4.6675 5.0428 5.0428 5.1373 5.1373 5.3391 5.3391 5.6998 5.6998 6.9053 6.9053 7.5031 7.5031 7.6146 7.6146 7.6413 7.6413 7.7298 7.7298 7.8803 7.8803 8.3216 8.3216 8.3384 8.3384 9.7268 9.7268 9.8817 9.8817 11.6045 11.6045 11.7664 11.7664 12.4186 12.4186 12.8017 12.8017 k = 0.1818 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6699 -30.6699 -30.6696 -30.6696 -12.0900 -12.0900 -12.0538 -12.0538 -11.7417 -11.7417 -11.7025 -11.7025 -11.6324 -11.6324 -11.6013 -11.6013 -4.9123 -4.9123 -4.3869 -4.3869 2.7631 2.7631 4.6747 4.6747 5.0189 5.0189 5.0236 5.0236 5.3101 5.3101 5.6592 5.6592 6.9298 6.9298 7.5038 7.5038 7.6280 7.6280 7.6546 7.6546 7.7706 7.7706 7.8777 7.8777 8.3326 8.3326 8.3954 8.3954 9.7371 9.7371 9.8730 9.8730 11.5496 11.5496 11.8018 11.8018 12.3180 12.3180 12.8634 12.8634 k = 0.1932 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6693 -30.6693 -30.6690 -30.6690 -12.0901 -12.0901 -12.0548 -12.0548 -11.7420 -11.7420 -11.7041 -11.7041 -11.6361 -11.6361 -11.6041 -11.6041 -4.8879 -4.8879 -4.3830 -4.3830 2.7677 2.7677 4.6815 4.6815 4.9012 4.9012 5.0027 5.0027 5.2818 5.2818 5.6191 5.6191 6.9558 6.9558 7.5033 7.5033 7.6353 7.6353 7.6660 7.6660 7.8196 7.8196 7.8756 7.8756 8.3418 8.3418 8.4564 8.4564 9.7471 9.7471 9.8647 9.8647 11.4946 11.4946 11.8371 11.8371 12.2163 12.2163 12.9285 12.9285 k = 0.2045 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6688 -30.6688 -30.6685 -30.6685 -12.0903 -12.0903 -12.0559 -12.0559 -11.7425 -11.7425 -11.7061 -11.7061 -11.6394 -11.6394 -11.6069 -11.6069 -4.8624 -4.8624 -4.3791 -4.3791 2.7724 2.7724 4.6871 4.6871 4.7835 4.7835 4.9820 4.9820 5.2544 5.2544 5.5795 5.5795 6.9832 6.9832 7.5019 7.5019 7.6407 7.6407 7.6750 7.6750 7.8632 7.8632 7.8842 7.8842 8.3501 8.3501 8.5197 8.5197 9.7562 9.7562 9.8571 9.8571 11.4395 11.4395 11.8722 11.8722 12.1137 12.1137 12.9967 12.9967 k = 0.2159 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6682 -30.6682 -30.6679 -30.6679 -12.0906 -12.0906 -12.0572 -12.0572 -11.7431 -11.7431 -11.7085 -11.7085 -11.6423 -11.6423 -11.6096 -11.6096 -4.8362 -4.8362 -4.3751 -4.3751 2.7771 2.7771 4.6590 4.6590 4.6994 4.6994 4.9610 4.9610 5.2280 5.2280 5.5407 5.5407 7.0117 7.0117 7.4996 7.4996 7.6453 7.6453 7.6823 7.6823 7.8664 7.8664 7.9366 7.9366 8.3577 8.3577 8.5848 8.5848 9.7641 9.7641 9.8508 9.8508 11.3845 11.3845 11.9070 11.9070 12.0106 12.0106 13.0679 13.0679 k = 0.2273 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6676 -30.6676 -30.6674 -30.6674 -12.0908 -12.0908 -12.0585 -12.0585 -11.7439 -11.7439 -11.7114 -11.7114 -11.6446 -11.6446 -11.6122 -11.6122 -4.8091 -4.8091 -4.3711 -4.3711 2.7819 2.7819 4.5451 4.5451 4.7012 4.7012 4.9400 4.9400 5.2027 5.2027 5.5027 5.5027 7.0411 7.0411 7.4965 7.4965 7.6495 7.6495 7.6887 7.6887 7.8647 7.8647 7.9968 7.9968 8.3648 8.3648 8.6513 8.6513 9.7699 9.7699 9.8464 9.8464 11.3295 11.3295 11.9061 11.9061 11.9422 11.9422 13.1420 13.1420 k = 0.2386 0.5000 0.2554 ( 3196 PWs) bands (ev): -30.6670 -30.6670 -30.6668 -30.6668 -12.0912 -12.0912 -12.0600 -12.0600 -11.7449 -11.7449 -11.7146 -11.7146 -11.6465 -11.6465 -11.6146 -11.6146 -4.7815 -4.7815 -4.3671 -4.3671 2.7868 2.7868 4.4293 4.4293 4.7052 4.7052 4.9188 4.9188 5.1787 5.1787 5.4657 5.4657 7.0711 7.0711 7.4929 7.4929 7.6535 7.6535 7.6944 7.6944 7.8632 7.8632 8.0589 8.0589 8.3715 8.3715 8.7188 8.7188 9.7730 9.7730 9.8445 9.8445 11.2746 11.2746 11.8027 11.8027 11.9756 11.9756 13.2187 13.2187 k = 0.2500 0.5000 0.2554 ( 3184 PWs) bands (ev): -30.6664 -30.6664 -30.6662 -30.6662 -12.0916 -12.0916 -12.0615 -12.0615 -11.7461 -11.7461 -11.7181 -11.7181 -11.6479 -11.6479 -11.6168 -11.6168 -4.7533 -4.7533 -4.3630 -4.3630 2.7917 2.7917 4.3151 4.3151 4.7085 4.7085 4.8978 4.8978 5.1564 5.1564 5.4299 5.4299 7.1015 7.1015 7.4889 7.4889 7.6574 7.6574 7.6999 7.6999 7.8628 7.8628 8.1220 8.1220 8.3785 8.3785 8.7869 8.7869 9.7730 9.7730 9.8455 9.8455 11.2198 11.2198 11.6989 11.6989 12.0089 12.0089 13.2979 13.2979 k = 0.2614 0.5000 0.2554 ( 3196 PWs) bands (ev): -30.6658 -30.6658 -30.6656 -30.6656 -12.0921 -12.0921 -12.0632 -12.0632 -11.7475 -11.7475 -11.7220 -11.7220 -11.6488 -11.6488 -11.6188 -11.6188 -4.7247 -4.7247 -4.3591 -4.3591 2.7965 2.7965 4.2027 4.2027 4.7108 4.7108 4.8769 4.8769 5.1356 5.1356 5.3951 5.3951 7.1317 7.1317 7.4843 7.4843 7.6612 7.6612 7.7050 7.7050 7.8636 7.8636 8.1850 8.1850 8.3864 8.3864 8.8553 8.8553 9.7701 9.7701 9.8490 9.8490 11.1649 11.1649 11.5951 11.5951 12.0415 12.0415 13.3791 13.3791 k = 0.2727 0.5000 0.2554 ( 3192 PWs) bands (ev): -30.6652 -30.6652 -30.6651 -30.6651 -12.0926 -12.0926 -12.0649 -12.0649 -11.7490 -11.7490 -11.7259 -11.7259 -11.6494 -11.6494 -11.6206 -11.6206 -4.6958 -4.6958 -4.3551 -4.3551 2.8013 2.8013 4.0929 4.0929 4.7119 4.7119 4.8563 4.8563 5.1166 5.1166 5.3616 5.3616 7.1615 7.1615 7.4795 7.4795 7.6649 7.6649 7.7098 7.7098 7.8666 7.8666 8.2460 8.2460 8.3974 8.3974 8.9237 8.9237 9.7653 9.7653 9.8543 9.8543 11.1101 11.1101 11.4918 11.4918 12.0734 12.0734 13.4534 13.4534 k = 0.2841 0.5000 0.2554 ( 3184 PWs) bands (ev): -30.6646 -30.6646 -30.6645 -30.6645 -12.0931 -12.0931 -12.0668 -12.0668 -11.7506 -11.7506 -11.7300 -11.7300 -11.6496 -11.6496 -11.6222 -11.6222 -4.6669 -4.6669 -4.3513 -4.3513 2.8061 2.8061 3.9857 3.9857 4.7118 4.7118 4.8361 4.8361 5.0996 5.0996 5.3294 5.3294 7.1905 7.1905 7.4744 7.4744 7.6685 7.6685 7.7142 7.7142 7.8721 7.8721 8.2996 8.2996 8.4165 8.4165 8.9917 8.9917 9.7595 9.7595 9.8604 9.8604 11.0551 11.0551 11.3891 11.3891 12.1045 12.1045 13.3746 13.3746 k = 0.2955 0.5000 0.2554 ( 3180 PWs) bands (ev): -30.6641 -30.6641 -30.6639 -30.6639 -12.0938 -12.0938 -12.0687 -12.0687 -11.7524 -11.7524 -11.7341 -11.7341 -11.6495 -11.6495 -11.6237 -11.6237 -4.6379 -4.6379 -4.3475 -4.3475 2.8107 2.8107 3.8816 3.8816 4.7103 4.7103 4.8164 4.8164 5.0845 5.0845 5.2986 5.2986 7.2182 7.2182 7.4692 7.4692 7.6720 7.6720 7.7180 7.7180 7.8808 7.8808 8.3365 8.3365 8.4529 8.4529 9.0593 9.0593 9.7529 9.7529 9.8668 9.8668 10.9999 10.9999 11.2872 11.2872 12.1346 12.1346 13.2966 13.2966 k = 0.3068 0.5000 0.2554 ( 3192 PWs) bands (ev): -30.6635 -30.6635 -30.6634 -30.6634 -12.0945 -12.0945 -12.0707 -12.0707 -11.7543 -11.7543 -11.7383 -11.7383 -11.6492 -11.6492 -11.6249 -11.6249 -4.6092 -4.6092 -4.3438 -4.3438 2.8152 2.8152 3.7810 3.7810 4.7076 4.7076 4.7972 4.7972 5.0713 5.0713 5.2691 5.2691 7.2442 7.2442 7.4637 7.4637 7.6752 7.6752 7.7209 7.7209 7.8934 7.8934 8.3556 8.3556 8.5078 8.5078 9.1260 9.1260 9.7460 9.7460 9.8730 9.8730 10.9444 10.9444 11.1863 11.1863 12.1638 12.1638 13.2200 13.2200 k = 0.3182 0.5000 0.2554 ( 3184 PWs) bands (ev): -30.6630 -30.6630 -30.6628 -30.6628 -12.0952 -12.0952 -12.0728 -12.0728 -11.7563 -11.7563 -11.7423 -11.7423 -11.6487 -11.6487 -11.6260 -11.6260 -4.5808 -4.5808 -4.3403 -4.3403 2.8196 2.8196 3.6840 3.6840 4.7037 4.7037 4.7787 4.7787 5.0600 5.0600 5.2412 5.2412 7.2683 7.2683 7.4583 7.4583 7.6784 7.6784 7.7230 7.7230 7.9103 7.9103 8.3653 8.3653 8.5727 8.5727 9.1916 9.1916 9.7391 9.7391 9.8789 9.8789 10.8886 10.8886 11.0867 11.0867 12.1919 12.1919 13.1451 13.1451 k = 0.3295 0.5000 0.2554 ( 3184 PWs) bands (ev): -30.6624 -30.6624 -30.6623 -30.6623 -12.0959 -12.0959 -12.0749 -12.0749 -11.7583 -11.7583 -11.7461 -11.7461 -11.6480 -11.6480 -11.6270 -11.6270 -4.5529 -4.5529 -4.3369 -4.3369 2.8238 2.8238 3.5912 3.5912 4.6987 4.6987 4.7609 4.7609 5.0506 5.0506 5.2147 5.2147 7.2901 7.2901 7.4529 7.4529 7.6813 7.6813 7.7239 7.7239 7.9316 7.9316 8.3709 8.3709 8.6422 8.6422 9.2556 9.2556 9.7324 9.7324 9.8844 9.8844 10.8322 10.8322 10.9888 10.9888 12.2189 12.2189 13.0721 13.0721 k = 0.3409 0.5000 0.2554 ( 3180 PWs) bands (ev): -30.6619 -30.6619 -30.6618 -30.6618 -12.0966 -12.0966 -12.0770 -12.0770 -11.7602 -11.7602 -11.7499 -11.7499 -11.6473 -11.6473 -11.6278 -11.6278 -4.5257 -4.5257 -4.3336 -4.3336 2.8279 2.8279 3.5027 3.5027 4.6928 4.6928 4.7440 4.7440 5.0428 5.0428 5.1898 5.1898 7.3096 7.3096 7.4475 7.4475 7.6840 7.6840 7.7240 7.7240 7.9574 7.9574 8.3745 8.3745 8.7142 8.7142 9.3180 9.3180 9.7259 9.7259 9.8892 9.8892 10.7753 10.7753 10.8929 10.8929 12.2447 12.2447 13.0013 13.0013 k = 0.3523 0.5000 0.2554 ( 3180 PWs) bands (ev): -30.6614 -30.6614 -30.6613 -30.6613 -12.0974 -12.0974 -12.0792 -12.0792 -11.7622 -11.7622 -11.7534 -11.7534 -11.6464 -11.6464 -11.6285 -11.6285 -4.4994 -4.4994 -4.3305 -4.3305 2.8317 2.8317 3.4188 3.4188 4.6863 4.6863 4.7279 4.7279 5.0364 5.0364 5.1665 5.1665 7.3266 7.3266 7.4423 7.4423 7.6865 7.6865 7.7233 7.7233 7.9872 7.9872 8.3771 8.3771 8.7875 8.7875 9.3781 9.3781 9.7196 9.7196 9.8933 9.8933 10.7177 10.7177 10.7993 10.7993 12.2692 12.2692 12.9331 12.9331 k = 0.3636 0.5000 0.2554 ( 3176 PWs) bands (ev): -30.6610 -30.6610 -30.6609 -30.6609 -12.0981 -12.0981 -12.0814 -12.0814 -11.7641 -11.7641 -11.7567 -11.7567 -11.6454 -11.6454 -11.6291 -11.6291 -4.4741 -4.4741 -4.3276 -4.3276 2.8354 2.8354 3.3398 3.3398 4.6792 4.6792 4.7127 4.7127 5.0314 5.0314 5.1449 5.1449 7.3414 7.3414 7.4373 7.4373 7.6888 7.6888 7.7221 7.7221 8.0207 8.0207 8.3790 8.3790 8.8619 8.8619 9.4358 9.4358 9.7138 9.7138 9.8967 9.8967 10.6593 10.6593 10.7088 10.7088 12.2923 12.2923 12.8677 12.8677 k = 0.3750 0.5000 0.2554 ( 3180 PWs) bands (ev): -30.6605 -30.6605 -30.6605 -30.6605 -12.0988 -12.0988 -12.0835 -12.0835 -11.7660 -11.7660 -11.7597 -11.7597 -11.6445 -11.6445 -11.6296 -11.6296 -4.4500 -4.4500 -4.3249 -4.3249 2.8388 2.8388 3.2660 3.2660 4.6719 4.6719 4.6985 4.6985 5.0275 5.0275 5.1248 5.1248 7.3538 7.3538 7.4324 7.4324 7.6909 7.6909 7.7204 7.7204 8.0570 8.0570 8.3803 8.3803 8.9369 8.9369 9.4904 9.4904 9.7082 9.7082 9.8993 9.8993 10.5990 10.5990 10.6227 10.6227 12.3140 12.3140 12.8055 12.8055 k = 0.3864 0.5000 0.2554 ( 3180 PWs) bands (ev): -30.6601 -30.6601 -30.6601 -30.6601 -12.0994 -12.0994 -12.0856 -12.0856 -11.7677 -11.7677 -11.7625 -11.7625 -11.6435 -11.6435 -11.6301 -11.6301 -4.4273 -4.4273 -4.3224 -4.3224 2.8419 2.8419 3.1977 3.1977 4.6645 4.6645 4.6854 4.6854 5.0245 5.0245 5.1064 5.1064 7.3644 7.3644 7.4279 7.4279 7.6929 7.6929 7.7185 7.7185 8.0956 8.0956 8.3814 8.3814 9.0122 9.0122 9.5416 9.5416 9.7032 9.7032 9.9009 9.9009 10.5307 10.5307 10.5481 10.5481 12.3342 12.3342 12.7468 12.7468 k = 0.3977 0.5000 0.2554 ( 3184 PWs) bands (ev): -30.6598 -30.6598 -30.6597 -30.6597 -12.1001 -12.1001 -12.0876 -12.0876 -11.7694 -11.7694 -11.7651 -11.7651 -11.6425 -11.6425 -11.6305 -11.6305 -4.4062 -4.4062 -4.3201 -4.3201 2.8448 2.8448 3.1350 3.1350 4.6573 4.6573 4.6733 4.6733 5.0222 5.0222 5.0897 5.0897 7.3731 7.3731 7.4236 7.4236 7.6946 7.6946 7.7165 7.7165 8.1355 8.1355 8.3822 8.3822 9.0876 9.0876 9.5887 9.5887 9.6986 9.6986 9.9015 9.9015 10.4544 10.4544 10.4859 10.4859 12.3527 12.3527 12.6919 12.6919 k = 0.4091 0.5000 0.2554 ( 3180 PWs) bands (ev): -30.6594 -30.6594 -30.6594 -30.6594 -12.1006 -12.1006 -12.0895 -12.0895 -11.7708 -11.7708 -11.7674 -11.7674 -11.6415 -11.6415 -11.6309 -11.6309 -4.3868 -4.3868 -4.3180 -4.3180 2.8475 2.8475 3.0784 3.0784 4.6504 4.6504 4.6625 4.6625 5.0205 5.0205 5.0747 5.0747 7.3803 7.3803 7.4197 7.4197 7.6961 7.6961 7.7144 7.7144 8.1760 8.1760 8.3829 8.3829 9.1630 9.1630 9.6311 9.6311 9.6946 9.6946 9.9008 9.9008 10.3814 10.3814 10.4259 10.4259 12.3695 12.3695 12.6414 12.6414 k = 0.4205 0.5000 0.2554 ( 3176 PWs) bands (ev): -30.6591 -30.6591 -30.6591 -30.6591 -12.1010 -12.1010 -12.0913 -12.0913 -11.7721 -11.7721 -11.7694 -11.7694 -11.6405 -11.6405 -11.6313 -11.6313 -4.3692 -4.3692 -4.3162 -4.3162 2.8499 2.8499 3.0277 3.0277 4.6440 4.6440 4.6528 4.6528 5.0193 5.0193 5.0615 5.0615 7.3862 7.3862 7.4161 7.4161 7.6975 7.6975 7.7125 7.7125 8.2159 8.2159 8.3834 8.3834 9.2380 9.2380 9.6677 9.6677 9.6916 9.6916 9.8985 9.8985 10.3144 10.3144 10.3669 10.3669 12.3846 12.3846 12.5955 12.5955 k = 0.4318 0.5000 0.2554 ( 3184 PWs) bands (ev): -30.6588 -30.6588 -30.6588 -30.6588 -12.1013 -12.1013 -12.0931 -12.0931 -11.7733 -11.7733 -11.7712 -11.7712 -11.6396 -11.6396 -11.6318 -11.6318 -4.3537 -4.3537 -4.3146 -4.3146 2.8519 2.8519 2.9834 2.9834 4.6383 4.6383 4.6443 4.6443 5.0183 5.0183 5.0500 5.0500 7.3909 7.3909 7.4130 7.4130 7.6987 7.6987 7.7106 7.7106 8.2541 8.2541 8.3837 8.3837 9.3122 9.3122 9.6856 9.6856 9.7019 9.7019 9.8938 9.8938 10.2550 10.2550 10.3094 10.3094 12.3978 12.3978 12.5546 12.5546 k = 0.4432 0.5000 0.2554 ( 3184 PWs) bands (ev): -30.6586 -30.6586 -30.6586 -30.6586 -12.1015 -12.1015 -12.0947 -12.0947 -11.7743 -11.7743 -11.7726 -11.7726 -11.6387 -11.6387 -11.6322 -11.6322 -4.3403 -4.3403 -4.3132 -4.3132 2.8537 2.8537 2.9456 2.9456 4.6332 4.6332 4.6371 4.6371 5.0177 5.0177 5.0402 5.0402 7.3946 7.3946 7.4102 7.4102 7.6997 7.6997 7.7089 7.7089 8.2896 8.2896 8.3840 8.3840 9.3853 9.3853 9.6841 9.6841 9.7255 9.7255 9.8859 9.8859 10.2043 10.2043 10.2546 10.2546 12.4092 12.4092 12.5191 12.5191 k = 0.4545 0.5000 0.2554 ( 3188 PWs) bands (ev): -30.6584 -30.6584 -30.6584 -30.6584 -12.1015 -12.1015 -12.0961 -12.0961 -11.7752 -11.7752 -11.7739 -11.7739 -11.6378 -11.6378 -11.6327 -11.6327 -4.3292 -4.3292 -4.3121 -4.3121 2.8551 2.8551 2.9145 2.9145 4.6289 4.6289 4.6312 4.6312 5.0173 5.0173 5.0322 5.0322 7.3975 7.3975 7.4080 7.4080 7.7006 7.7006 7.7074 7.7074 8.3210 8.3210 8.3842 8.3842 9.4566 9.4566 9.6821 9.6821 9.7431 9.7431 9.8734 9.8734 10.1635 10.1635 10.2045 10.2045 12.4185 12.4185 12.4895 12.4895 k = 0.4659 0.5000 0.2554 ( 3184 PWs) bands (ev): -30.6583 -30.6583 -30.6583 -30.6583 -12.1014 -12.1014 -12.0973 -12.0973 -11.7758 -11.7758 -11.7748 -11.7748 -11.6370 -11.6370 -11.6332 -11.6332 -4.3205 -4.3205 -4.3112 -4.3112 2.8562 2.8562 2.8902 2.8902 4.6255 4.6255 4.6266 4.6266 5.0170 5.0170 5.0259 5.0259 7.3996 7.3996 7.4062 7.4062 7.7014 7.7014 7.7062 7.7062 8.3472 8.3472 8.3844 8.3844 9.5254 9.5254 9.6806 9.6806 9.7545 9.7545 9.8543 9.8543 10.1330 10.1330 10.1618 10.1618 12.4258 12.4258 12.4661 12.4661 k = 0.4773 0.5000 0.2554 ( 3172 PWs) bands (ev): -30.6582 -30.6582 -30.6582 -30.6582 -12.1011 -12.1011 -12.0984 -12.0984 -11.7761 -11.7761 -11.7755 -11.7755 -11.6362 -11.6362 -11.6337 -11.6337 -4.3142 -4.3142 -4.3105 -4.3105 2.8571 2.8571 2.8727 2.8727 4.6229 4.6229 4.6236 4.6236 5.0169 5.0169 5.0215 5.0215 7.4012 7.4012 7.4049 7.4049 7.7021 7.7021 7.7052 7.7052 8.3669 8.3669 8.3845 8.3845 9.5896 9.5896 9.6796 9.6796 9.7606 9.7606 9.8273 9.8273 10.1126 10.1126 10.1294 10.1294 12.4312 12.4312 12.4492 12.4492 k = 0.4886 0.5000 0.2554 ( 3172 PWs) bands (ev): -30.6581 -30.6581 -30.6581 -30.6581 -12.1007 -12.1007 -12.0993 -12.0993 -11.7763 -11.7763 -11.7760 -11.7760 -11.6355 -11.6355 -11.6343 -11.6343 -4.3104 -4.3104 -4.3101 -4.3101 2.8575 2.8575 2.8623 2.8623 4.6211 4.6211 4.6219 4.6219 5.0168 5.0168 5.0188 5.0188 7.4022 7.4022 7.4039 7.4039 7.7027 7.7027 7.7044 7.7044 8.3792 8.3792 8.3846 8.3846 9.6446 9.6446 9.6788 9.6788 9.7638 9.7638 9.7947 9.7947 10.1017 10.1017 10.1088 10.1088 12.4343 12.4343 12.4389 12.4389 k = 0.5000 0.5000 0.2554 ( 3176 PWs) bands (ev): -30.6581 -30.6581 -30.6581 -30.6581 -12.1001 -12.1001 -12.1001 -12.1001 -11.7763 -11.7763 -11.7763 -11.7763 -11.6349 -11.6349 -11.6349 -11.6349 -4.3101 -4.3101 -4.3091 -4.3091 2.8577 2.8577 2.8588 2.8588 4.6204 4.6204 4.6214 4.6214 5.0168 5.0168 5.0178 5.0178 7.4026 7.4026 7.4034 7.4034 7.7029 7.7029 7.7040 7.7040 8.3834 8.3834 8.3846 8.3846 9.6745 9.6745 9.6756 9.6756 9.7697 9.7697 9.7702 9.7702 10.0999 10.0999 10.1003 10.1003 12.4353 12.4353 12.4356 12.4356 k = 0.5000 0.5000 0.2554 ( 3176 PWs) bands (ev): -30.6581 -30.6581 -30.6581 -30.6581 -12.1001 -12.1001 -12.1001 -12.1001 -11.7763 -11.7763 -11.7763 -11.7763 -11.6349 -11.6349 -11.6349 -11.6349 -4.3101 -4.3101 -4.3091 -4.3091 2.8577 2.8577 2.8588 2.8588 4.6204 4.6204 4.6214 4.6214 5.0168 5.0168 5.0178 5.0178 7.4026 7.4026 7.4034 7.4034 7.7029 7.7029 7.7040 7.7040 8.3834 8.3834 8.3846 8.3846 9.6745 9.6745 9.6756 9.6756 9.7697 9.7697 9.7702 9.7702 10.0999 10.0999 10.1003 10.1003 12.4353 12.4353 12.4356 12.4356 k = 0.4921 0.4921 0.2554 ( 3172 PWs) bands (ev): -30.6581 -30.6581 -30.6581 -30.6581 -12.1007 -12.1007 -12.0994 -12.0994 -11.7763 -11.7763 -11.7760 -11.7760 -11.6355 -11.6355 -11.6343 -11.6343 -4.3108 -4.3108 -4.3097 -4.3097 2.8593 2.8593 2.8604 2.8604 4.6210 4.6210 4.6220 4.6220 5.0172 5.0172 5.0184 5.0184 7.4024 7.4024 7.4037 7.4037 7.7026 7.7026 7.7045 7.7045 8.3813 8.3813 8.3826 8.3826 9.6514 9.6514 9.6701 9.6701 9.7697 9.7697 9.7909 9.7909 10.1020 10.1020 10.1084 10.1084 12.4357 12.4357 12.4375 12.4375 k = 0.4841 0.4841 0.2554 ( 3176 PWs) bands (ev): -30.6582 -30.6582 -30.6582 -30.6582 -12.1011 -12.1011 -12.0985 -12.0985 -11.7761 -11.7761 -11.7756 -11.7756 -11.6362 -11.6362 -11.6337 -11.6337 -4.3129 -4.3129 -4.3117 -4.3117 2.8642 2.8642 2.8653 2.8653 4.6226 4.6226 4.6237 4.6237 5.0183 5.0183 5.0200 5.0200 7.4019 7.4019 7.4042 7.4042 7.7020 7.7020 7.7053 7.7053 8.3749 8.3749 8.3767 8.3767 9.6160 9.6160 9.6405 9.6405 9.7863 9.7863 9.8148 9.8148 10.1148 10.1148 10.1265 10.1265 12.4383 12.4383 12.4419 12.4419 k = 0.4762 0.4762 0.2554 ( 3180 PWs) bands (ev): -30.6583 -30.6583 -30.6583 -30.6583 -12.1014 -12.1014 -12.0974 -12.0974 -11.7757 -11.7757 -11.7749 -11.7749 -11.6369 -11.6369 -11.6332 -11.6332 -4.3164 -4.3164 -4.3150 -4.3150 2.8723 2.8723 2.8734 2.8734 4.6253 4.6253 4.6266 4.6266 5.0203 5.0203 5.0225 5.0225 7.4012 7.4012 7.4047 7.4047 7.7015 7.7015 7.7061 7.7061 8.3646 8.3646 8.3669 8.3669 9.5771 9.5771 9.6030 9.6030 9.8029 9.8029 9.8323 9.8323 10.1397 10.1397 10.1548 10.1548 12.4431 12.4431 12.4485 12.4485 k = 0.4683 0.4683 0.2554 ( 3180 PWs) bands (ev): -30.6584 -30.6584 -30.6584 -30.6584 -12.1015 -12.1015 -12.0961 -12.0961 -11.7751 -11.7751 -11.7740 -11.7740 -11.6377 -11.6377 -11.6327 -11.6327 -4.3213 -4.3213 -4.3196 -4.3196 2.8837 2.8837 2.8848 2.8848 4.6292 4.6292 4.6307 4.6307 5.0231 5.0231 5.0259 5.0259 7.4004 7.4004 7.4051 7.4051 7.7010 7.7010 7.7071 7.7071 8.3504 8.3504 8.3532 8.3532 9.5375 9.5375 9.5639 9.5639 9.8134 9.8134 9.8408 9.8408 10.1764 10.1764 10.1928 10.1928 12.4502 12.4502 12.4573 12.4573 k = 0.4603 0.4603 0.2554 ( 3180 PWs) bands (ev): -30.6586 -30.6586 -30.6586 -30.6586 -12.1014 -12.1014 -12.0947 -12.0947 -11.7742 -11.7742 -11.7729 -11.7729 -11.6386 -11.6386 -11.6323 -11.6323 -4.3275 -4.3275 -4.3255 -4.3255 2.8982 2.8982 2.8994 2.8994 4.6342 4.6342 4.6359 4.6359 5.0268 5.0268 5.0303 5.0303 7.3995 7.3995 7.4055 7.4055 7.7007 7.7007 7.7080 7.7080 8.3326 8.3326 8.3361 8.3361 9.4985 9.4985 9.5252 9.5252 9.8166 9.8166 9.8405 9.8405 10.2232 10.2232 10.2395 10.2395 12.4594 12.4594 12.4682 12.4682 k = 0.4524 0.4524 0.2554 ( 3184 PWs) bands (ev): -30.6588 -30.6588 -30.6588 -30.6588 -12.1011 -12.1011 -12.0932 -12.0932 -11.7732 -11.7732 -11.7715 -11.7715 -11.6394 -11.6394 -11.6320 -11.6320 -4.3350 -4.3350 -4.3328 -4.3328 2.9160 2.9160 2.9171 2.9171 4.6402 4.6402 4.6422 4.6422 5.0313 5.0313 5.0355 5.0355 7.3983 7.3983 7.4058 7.4058 7.7004 7.7004 7.7088 7.7088 8.3116 8.3116 8.3156 8.3156 9.4606 9.4606 9.4878 9.4878 9.8131 9.8131 9.8330 9.8330 10.2777 10.2777 10.2934 10.2934 12.4707 12.4707 12.4811 12.4811 k = 0.4444 0.4444 0.2554 ( 3188 PWs) bands (ev): -30.6591 -30.6591 -30.6591 -30.6591 -12.1007 -12.1007 -12.0914 -12.0914 -11.7719 -11.7719 -11.7700 -11.7700 -11.6404 -11.6404 -11.6317 -11.6317 -4.3437 -4.3437 -4.3412 -4.3412 2.9369 2.9369 2.9381 2.9381 4.6474 4.6474 4.6496 4.6496 5.0368 5.0368 5.0417 5.0417 7.3968 7.3968 7.4059 7.4059 7.7002 7.7002 7.7096 7.7096 8.2877 8.2877 8.2921 8.2921 9.4243 9.4243 9.4519 9.4519 9.8037 9.8037 9.8197 9.8197 10.3379 10.3379 10.3528 10.3528 12.4839 12.4839 12.4958 12.4958 k = 0.4365 0.4365 0.2554 ( 3188 PWs) bands (ev): -30.6594 -30.6594 -30.6594 -30.6594 -12.1002 -12.1002 -12.0896 -12.0896 -11.7704 -11.7704 -11.7682 -11.7682 -11.6413 -11.6413 -11.6314 -11.6314 -4.3538 -4.3538 -4.3510 -4.3510 2.9609 2.9609 2.9621 2.9621 4.6556 4.6556 4.6582 4.6582 5.0431 5.0431 5.0487 5.0487 7.3949 7.3949 7.4057 7.4057 7.7000 7.7000 7.7104 7.7104 8.2612 8.2612 8.2661 8.2661 9.3895 9.3895 9.4179 9.4179 9.7895 9.7895 9.8018 9.8018 10.4023 10.4023 10.4165 10.4165 12.4988 12.4988 12.5121 12.5121 k = 0.4286 0.4286 0.2554 ( 3192 PWs) bands (ev): -30.6597 -30.6597 -30.6597 -30.6597 -12.0995 -12.0995 -12.0875 -12.0875 -11.7687 -11.7687 -11.7662 -11.7662 -11.6423 -11.6423 -11.6312 -11.6312 -4.3650 -4.3650 -4.3619 -4.3619 2.9880 2.9880 2.9892 2.9892 4.6649 4.6649 4.6678 4.6678 5.0502 5.0502 5.0566 5.0566 7.3926 7.3926 7.4053 7.4053 7.6999 7.6999 7.7110 7.7110 8.2327 8.2327 8.2379 8.2379 9.3563 9.3563 9.3855 9.3855 9.7711 9.7711 9.7800 9.7800 10.4698 10.4698 10.4835 10.4835 12.5152 12.5152 12.5298 12.5298 k = 0.4206 0.4206 0.2554 ( 3192 PWs) bands (ev): -30.6601 -30.6601 -30.6601 -30.6601 -12.0986 -12.0986 -12.0854 -12.0854 -11.7668 -11.7668 -11.7640 -11.7640 -11.6433 -11.6433 -11.6311 -11.6311 -4.3773 -4.3773 -4.3740 -4.3740 3.0181 3.0181 3.0194 3.0194 4.6753 4.6753 4.6785 4.6785 5.0582 5.0582 5.0654 5.0654 7.3896 7.3896 7.4043 7.4043 7.6999 7.6999 7.7115 7.7115 8.2025 8.2025 8.2081 8.2081 9.3246 9.3246 9.3548 9.3548 9.7491 9.7491 9.7550 9.7550 10.5396 10.5396 10.5531 10.5531 12.5328 12.5328 12.5487 12.5487 k = 0.4127 0.4127 0.2554 ( 3192 PWs) bands (ev): -30.6605 -30.6605 -30.6605 -30.6605 -12.0975 -12.0975 -12.0831 -12.0831 -11.7647 -11.7647 -11.7616 -11.7616 -11.6443 -11.6443 -11.6309 -11.6309 -4.3908 -4.3908 -4.3871 -4.3871 3.0512 3.0512 3.0525 3.0525 4.6866 4.6866 4.6903 4.6903 5.0671 5.0671 5.0751 5.0751 7.3858 7.3858 7.4029 7.4029 7.6999 7.6999 7.7118 7.7118 8.1713 8.1713 8.1770 8.1770 9.2942 9.2942 9.3254 9.3254 9.7239 9.7239 9.7272 9.7272 10.6113 10.6113 10.6246 10.6246 12.5514 12.5514 12.5684 12.5684 k = 0.4048 0.4048 0.2554 ( 3188 PWs) bands (ev): -30.6610 -30.6610 -30.6610 -30.6610 -12.0963 -12.0963 -12.0806 -12.0806 -11.7625 -11.7625 -11.7590 -11.7590 -11.6453 -11.6453 -11.6308 -11.6308 -4.4053 -4.4053 -4.4014 -4.4014 3.0872 3.0872 3.0885 3.0885 4.6990 4.6990 4.7030 4.7030 5.0768 5.0768 5.0857 5.0857 7.3812 7.3812 7.4007 7.4007 7.7000 7.7000 7.7120 7.7120 8.1394 8.1394 8.1453 8.1453 9.2648 9.2648 9.2971 9.2971 9.6958 9.6958 9.6970 9.6970 10.6843 10.6843 10.6976 10.6976 12.5707 12.5707 12.5886 12.5886 k = 0.3968 0.3968 0.2554 ( 3188 PWs) bands (ev): -30.6614 -30.6614 -30.6614 -30.6614 -12.0950 -12.0950 -12.0780 -12.0780 -11.7600 -11.7600 -11.7562 -11.7562 -11.6463 -11.6463 -11.6308 -11.6308 -4.4208 -4.4208 -4.4166 -4.4166 3.1260 3.1260 3.1273 3.1273 4.7123 4.7123 4.7167 4.7167 5.0874 5.0874 5.0972 5.0972 7.3755 7.3755 7.3976 7.3976 7.7000 7.7000 7.7119 7.7119 8.1074 8.1074 8.1134 8.1134 9.2364 9.2364 9.2699 9.2699 9.6640 9.6640 9.6656 9.6656 10.7585 10.7585 10.7719 10.7719 12.5902 12.5902 12.6089 12.6089 k = 0.3889 0.3889 0.2554 ( 3188 PWs) bands (ev): -30.6620 -30.6620 -30.6620 -30.6620 -12.0936 -12.0936 -12.0754 -12.0754 -11.7574 -11.7574 -11.7532 -11.7532 -11.6473 -11.6473 -11.6307 -11.6307 -4.4372 -4.4372 -4.4329 -4.4329 3.1676 3.1676 3.1690 3.1690 4.7265 4.7265 4.7314 4.7314 5.0987 5.0987 5.1095 5.1095 7.3686 7.3686 7.3934 7.3934 7.6999 7.6999 7.7116 7.7116 8.0757 8.0757 8.0818 8.0818 9.2086 9.2086 9.2433 9.2433 9.6293 9.6293 9.6327 9.6327 10.8335 10.8335 10.8470 10.8470 12.6095 12.6095 12.6290 12.6290 k = 0.3810 0.3810 0.2554 ( 3184 PWs) bands (ev): -30.6625 -30.6625 -30.6625 -30.6625 -12.0920 -12.0920 -12.0725 -12.0725 -11.7546 -11.7546 -11.7501 -11.7501 -11.6483 -11.6483 -11.6307 -11.6307 -4.4546 -4.4546 -4.4500 -4.4500 3.2119 3.2119 3.2133 3.2133 4.7417 4.7417 4.7470 4.7470 5.1110 5.1110 5.1228 5.1228 7.3604 7.3604 7.3880 7.3880 7.6998 7.6998 7.7111 7.7111 8.0449 8.0449 8.0510 8.0510 9.1812 9.1812 9.2173 9.2173 9.5927 9.5927 9.5978 9.5978 10.9090 10.9090 10.9228 10.9228 12.6282 12.6282 12.6482 12.6482 k = 0.3730 0.3730 0.2554 ( 3188 PWs) bands (ev): -30.6631 -30.6631 -30.6631 -30.6631 -12.0903 -12.0903 -12.0697 -12.0697 -11.7517 -11.7517 -11.7467 -11.7467 -11.6493 -11.6493 -11.6308 -11.6308 -4.4728 -4.4728 -4.4679 -4.4679 3.2589 3.2589 3.2602 3.2602 4.7577 4.7577 4.7634 4.7634 5.1241 5.1241 5.1369 5.1369 7.3507 7.3507 7.3810 7.3810 7.6994 7.6994 7.7104 7.7104 8.0153 8.0153 8.0213 8.0213 9.1541 9.1541 9.1916 9.1916 9.5543 9.5543 9.5610 9.5610 10.9851 10.9851 10.9990 10.9990 12.6456 12.6456 12.6661 12.6661 k = 0.3651 0.3651 0.2554 ( 3188 PWs) bands (ev): -30.6637 -30.6637 -30.6637 -30.6637 -12.0885 -12.0885 -12.0667 -12.0667 -11.7486 -11.7486 -11.7432 -11.7432 -11.6502 -11.6502 -11.6308 -11.6308 -4.4917 -4.4917 -4.4866 -4.4866 3.3083 3.3083 3.3098 3.3098 4.7744 4.7744 4.7807 4.7807 5.1380 5.1380 5.1519 5.1519 7.3393 7.3393 7.3724 7.3724 7.6989 7.6989 7.7095 7.7095 7.9875 7.9875 7.9933 7.9933 9.1270 9.1270 9.1659 9.1659 9.5144 9.5144 9.5225 9.5225 11.0613 11.0613 11.0755 11.0755 12.6614 12.6614 12.6822 12.6822 k = 0.3571 0.3571 0.2554 ( 3192 PWs) bands (ev): -30.6643 -30.6643 -30.6643 -30.6643 -12.0866 -12.0866 -12.0636 -12.0636 -11.7454 -11.7454 -11.7396 -11.7396 -11.6510 -11.6510 -11.6309 -11.6309 -4.5113 -4.5113 -4.5061 -4.5061 3.3603 3.3603 3.3617 3.3617 4.7919 4.7919 4.7987 4.7987 5.1528 5.1528 5.1678 5.1678 7.3262 7.3262 7.3620 7.3620 7.6981 7.6981 7.7084 7.7084 7.9615 7.9615 7.9673 7.9673 9.0998 9.0998 9.1401 9.1401 9.4731 9.4731 9.4825 9.4825 11.1376 11.1376 11.1521 11.1521 12.6747 12.6747 12.6958 12.6958 k = 0.3492 0.3492 0.2554 ( 3188 PWs) bands (ev): -30.6650 -30.6650 -30.6650 -30.6650 -12.0846 -12.0846 -12.0605 -12.0605 -11.7421 -11.7421 -11.7358 -11.7358 -11.6518 -11.6518 -11.6309 -11.6309 -4.5316 -4.5316 -4.5262 -4.5262 3.4146 3.4146 3.4161 3.4161 4.8101 4.8101 4.8173 4.8173 5.1684 5.1684 5.1846 5.1846 7.3114 7.3114 7.3497 7.3497 7.6969 7.6969 7.7073 7.7073 7.9378 7.9378 7.9436 7.9436 9.0722 9.0722 9.1141 9.1141 9.4306 9.4306 9.4411 9.4411 11.2138 11.2138 11.2285 11.2285 12.6852 12.6852 12.7063 12.7063 k = 0.3413 0.3413 0.2554 ( 3188 PWs) bands (ev): -30.6656 -30.6656 -30.6656 -30.6656 -12.0825 -12.0825 -12.0573 -12.0573 -11.7387 -11.7387 -11.7318 -11.7318 -11.6525 -11.6525 -11.6310 -11.6310 -4.5525 -4.5525 -4.5468 -4.5468 3.4713 3.4713 3.4728 3.4728 4.8289 4.8289 4.8366 4.8366 5.1849 5.1849 5.2022 5.2022 7.2949 7.2949 7.3353 7.3353 7.6952 7.6952 7.7062 7.7062 7.9165 7.9165 7.9224 7.9224 9.0442 9.0442 9.0877 9.0877 9.3869 9.3869 9.3985 9.3985 11.2897 11.2897 11.3046 11.3046 12.6921 12.6921 12.7132 12.7132 k = 0.3333 0.3333 0.2554 ( 3184 PWs) bands (ev): -30.6664 -30.6664 -30.6664 -30.6664 -12.0803 -12.0803 -12.0541 -12.0541 -11.7353 -11.7353 -11.7277 -11.7277 -11.6531 -11.6531 -11.6310 -11.6310 -4.5738 -4.5738 -4.5680 -4.5680 3.5302 3.5302 3.5317 3.5317 4.8483 4.8483 4.8564 4.8564 5.2024 5.2024 5.2209 5.2209 7.2767 7.2767 7.3191 7.3191 7.6929 7.6929 7.7051 7.7051 7.8975 7.8975 7.9039 7.9039 9.0157 9.0157 9.0609 9.0609 9.3423 9.3423 9.3547 9.3547 11.3651 11.3651 11.3802 11.3802 12.6950 12.6950 12.7160 12.7160 k = 0.3254 0.3254 0.2554 ( 3192 PWs) bands (ev): -30.6671 -30.6671 -30.6671 -30.6671 -12.0780 -12.0780 -12.0508 -12.0508 -11.7318 -11.7318 -11.7236 -11.7236 -11.6535 -11.6535 -11.6311 -11.6311 -4.5957 -4.5957 -4.5897 -4.5897 3.5912 3.5912 3.5928 3.5928 4.8680 4.8680 4.8766 4.8766 5.2207 5.2207 5.2404 5.2404 7.2569 7.2569 7.3012 7.3012 7.6900 7.6900 7.7039 7.7039 7.8808 7.8808 7.8882 7.8882 8.9864 8.9864 9.0333 9.0333 9.2969 9.2969 9.3100 9.3100 11.4396 11.4396 11.4549 11.4549 12.6935 12.6935 12.7143 12.7143 k = 0.3175 0.3175 0.2554 ( 3188 PWs) bands (ev): -30.6678 -30.6678 -30.6678 -30.6678 -12.0757 -12.0757 -12.0475 -12.0475 -11.7282 -11.7282 -11.7193 -11.7193 -11.6538 -11.6538 -11.6311 -11.6311 -4.6179 -4.6179 -4.6118 -4.6118 3.6543 3.6543 3.6559 3.6559 4.8881 4.8881 4.8970 4.8970 5.2401 5.2401 5.2610 5.2610 7.2359 7.2359 7.2816 7.2816 7.6863 7.6863 7.7029 7.7029 7.8665 7.8665 7.8752 7.8752 8.9564 8.9564 9.0052 9.0052 9.2507 9.2507 9.2644 9.2644 11.5132 11.5132 11.5286 11.5286 12.6874 12.6874 12.7079 12.7079 k = 0.3095 0.3095 0.2554 ( 3188 PWs) bands (ev): -30.6686 -30.6686 -30.6686 -30.6686 -12.0733 -12.0733 -12.0442 -12.0442 -11.7247 -11.7247 -11.7149 -11.7149 -11.6540 -11.6540 -11.6311 -11.6311 -4.6404 -4.6404 -4.6342 -4.6342 3.7193 3.7193 3.7210 3.7210 4.9084 4.9084 4.9176 4.9176 5.2606 5.2606 5.2825 5.2825 7.2138 7.2138 7.2609 7.2609 7.6819 7.6819 7.7018 7.7018 7.8542 7.8542 7.8649 7.8649 8.9256 8.9256 8.9762 8.9762 9.2039 9.2039 9.2182 9.2182 11.5854 11.5854 11.6007 11.6007 12.6767 12.6767 12.6967 12.6967 k = 0.3016 0.3016 0.2554 ( 3188 PWs) bands (ev): -30.6694 -30.6694 -30.6694 -30.6694 -12.0708 -12.0708 -12.0409 -12.0409 -11.7212 -11.7212 -11.7104 -11.7104 -11.6539 -11.6539 -11.6310 -11.6310 -4.6632 -4.6632 -4.6569 -4.6569 3.7862 3.7862 3.7879 3.7879 4.9288 4.9288 4.9383 4.9383 5.2821 5.2821 5.3051 5.3051 7.1909 7.1909 7.2391 7.2391 7.6767 7.6767 7.7007 7.7007 7.8439 7.8439 7.8570 7.8570 8.8939 8.8939 8.9465 8.9465 9.1566 9.1566 9.1713 9.1713 11.6557 11.6557 11.6709 11.6709 12.6615 12.6615 12.6811 12.6811 k = 0.2937 0.2937 0.2554 ( 3186 PWs) bands (ev): -30.6702 -30.6702 -30.6702 -30.6702 -12.0683 -12.0683 -12.0376 -12.0376 -11.7178 -11.7178 -11.7059 -11.7059 -11.6535 -11.6535 -11.6309 -11.6309 -4.6862 -4.6862 -4.6798 -4.6798 3.8549 3.8549 3.8566 3.8566 4.9492 4.9492 4.9589 4.9589 5.3048 5.3048 5.3288 5.3288 7.1675 7.1675 7.2168 7.2168 7.6709 7.6709 7.6993 7.6993 7.8355 7.8355 7.8513 7.8513 8.8613 8.8613 8.9160 8.9160 9.1089 9.1089 9.1239 9.1239 11.7235 11.7235 11.7386 11.7386 12.6423 12.6423 12.6615 12.6615 k = 0.2857 0.2857 0.2554 ( 3186 PWs) bands (ev): -30.6710 -30.6710 -30.6710 -30.6710 -12.0658 -12.0658 -12.0344 -12.0344 -11.7145 -11.7145 -11.7013 -11.7013 -11.6529 -11.6529 -11.6308 -11.6308 -4.7093 -4.7093 -4.7029 -4.7029 3.9252 3.9252 3.9270 3.9270 4.9694 4.9694 4.9791 4.9791 5.3287 5.3287 5.3537 5.3537 7.1439 7.1439 7.1942 7.1942 7.6645 7.6645 7.6976 7.6976 7.8288 7.8288 7.8475 7.8475 8.8278 8.8278 8.8845 8.8845 9.0609 9.0609 9.0761 9.0761 11.7883 11.7883 11.8030 11.8030 12.6199 12.6199 12.6385 12.6385 k = 0.2778 0.2778 0.2554 ( 3202 PWs) bands (ev): -30.6718 -30.6718 -30.6718 -30.6718 -12.0633 -12.0633 -12.0312 -12.0312 -11.7113 -11.7113 -11.6967 -11.6967 -11.6521 -11.6521 -11.6306 -11.6306 -4.7326 -4.7326 -4.7261 -4.7261 3.9970 3.9970 3.9988 3.9988 4.9893 4.9893 4.9990 4.9990 5.3538 5.3538 5.3796 5.3796 7.1204 7.1204 7.1717 7.1717 7.6575 7.6575 7.6952 7.6952 7.8238 7.8238 7.8453 7.8453 8.7932 8.7932 8.8520 8.8520 9.0125 9.0125 9.0278 9.0278 11.8490 11.8490 11.8631 11.8631 12.5951 12.5951 12.6131 12.6131 k = 0.2698 0.2698 0.2554 ( 3202 PWs) bands (ev): -30.6726 -30.6726 -30.6726 -30.6726 -12.0608 -12.0608 -12.0280 -12.0280 -11.7083 -11.7083 -11.6921 -11.6921 -11.6509 -11.6509 -11.6303 -11.6303 -4.7558 -4.7558 -4.7493 -4.7493 4.0703 4.0703 4.0722 4.0722 5.0089 5.0089 5.0183 5.0183 5.3803 5.3803 5.4068 5.4068 7.0973 7.0973 7.1496 7.1496 7.6501 7.6501 7.6923 7.6923 7.8204 7.8204 7.8445 7.8445 8.7579 8.7579 8.8188 8.8188 8.9640 8.9640 8.9794 8.9794 11.9046 11.9046 11.9178 11.9178 12.5693 12.5693 12.5865 12.5865 k = 0.2619 0.2619 0.2554 ( 3194 PWs) bands (ev): -30.6734 -30.6734 -30.6734 -30.6734 -12.0582 -12.0582 -12.0249 -12.0249 -11.7055 -11.7055 -11.6875 -11.6875 -11.6492 -11.6492 -11.6299 -11.6299 -4.7790 -4.7790 -4.7724 -4.7724 4.1450 4.1450 4.1469 4.1469 5.0279 5.0279 5.0369 5.0369 5.4083 5.4083 5.4353 5.4353 7.0748 7.0748 7.1281 7.1281 7.6423 7.6423 7.6886 7.6886 7.8185 7.8185 7.8448 7.8448 8.7217 8.7217 8.7848 8.7848 8.9154 8.9154 8.9309 8.9309 11.9536 11.9536 11.9656 11.9656 12.5438 12.5438 12.5599 12.5599 k = 0.2540 0.2540 0.2554 ( 3198 PWs) bands (ev): -30.6743 -30.6743 -30.6743 -30.6743 -12.0556 -12.0556 -12.0219 -12.0219 -11.7029 -11.7029 -11.6830 -11.6830 -11.6473 -11.6473 -11.6294 -11.6294 -4.8021 -4.8021 -4.7956 -4.7956 4.2209 4.2209 4.2229 4.2229 5.0463 5.0463 5.0547 5.0547 5.4376 5.4376 5.4650 5.4650 7.0532 7.0532 7.1074 7.1074 7.6342 7.6342 7.6840 7.6840 7.8179 7.8179 7.8460 7.8460 8.6847 8.6847 8.7498 8.7498 8.8666 8.8666 8.8822 8.8822 11.9945 11.9945 12.0047 12.0047 12.5203 12.5203 12.5349 12.5349 k = 0.2460 0.2460 0.2554 ( 3198 PWs) bands (ev): -30.6751 -30.6751 -30.6751 -30.6751 -12.0530 -12.0530 -12.0190 -12.0190 -11.7004 -11.7004 -11.6786 -11.6786 -11.6450 -11.6450 -11.6288 -11.6288 -4.8251 -4.8251 -4.8186 -4.8186 4.2979 4.2979 4.2999 4.2999 5.0638 5.0638 5.0715 5.0715 5.4685 5.4685 5.4961 5.4961 7.0326 7.0326 7.0879 7.0879 7.6257 7.6257 7.6787 7.6787 7.8186 7.8186 7.8479 7.8479 8.6470 8.6470 8.7140 8.7140 8.8177 8.8177 8.8335 8.8335 12.0254 12.0254 12.0331 12.0331 12.5004 12.5004 12.5130 12.5130 k = 0.2381 0.2381 0.2554 ( 3198 PWs) bands (ev): -30.6759 -30.6759 -30.6759 -30.6759 -12.0505 -12.0505 -12.0162 -12.0162 -11.6982 -11.6982 -11.6742 -11.6742 -11.6424 -11.6424 -11.6280 -11.6280 -4.8479 -4.8479 -4.8414 -4.8414 4.3759 4.3759 4.3780 4.3780 5.0804 5.0804 5.0873 5.0873 5.5008 5.5008 5.5285 5.5285 7.0134 7.0134 7.0696 7.0696 7.6171 7.6171 7.6725 7.6725 7.8202 7.8202 7.8502 7.8502 8.6085 8.6085 8.6774 8.6774 8.7688 8.7688 8.7849 8.7849 12.0447 12.0447 12.0494 12.0494 12.4856 12.4856 12.4957 12.4957 k = 0.2302 0.2302 0.2554 ( 3196 PWs) bands (ev): -30.6768 -30.6768 -30.6768 -30.6768 -12.0479 -12.0479 -12.0135 -12.0135 -11.6961 -11.6961 -11.6701 -11.6701 -11.6394 -11.6394 -11.6270 -11.6270 -4.8704 -4.8704 -4.8639 -4.8639 4.4548 4.4548 4.4570 4.4570 5.0960 5.0960 5.1020 5.1020 5.5347 5.5347 5.5622 5.5622 6.9955 6.9955 7.0528 7.0528 7.6082 7.6082 7.6656 7.6656 7.8228 7.8228 7.8530 7.8530 8.5696 8.5696 8.6399 8.6399 8.7197 8.7197 8.7365 8.7365 12.0516 12.0516 12.0529 12.0529 12.4759 12.4759 12.4832 12.4832 k = 0.2222 0.2222 0.2554 ( 3200 PWs) bands (ev): -30.6776 -30.6776 -30.6776 -30.6776 -12.0454 -12.0454 -12.0110 -12.0110 -11.6942 -11.6942 -11.6662 -11.6662 -11.6362 -11.6362 -11.6257 -11.6257 -4.8927 -4.8927 -4.8862 -4.8862 4.5344 4.5344 4.5367 4.5367 5.1106 5.1106 5.1154 5.1154 5.5700 5.5700 5.5973 5.5973 6.9793 6.9793 7.0375 7.0375 7.5991 7.5991 7.6580 7.6580 7.8260 7.8260 7.8561 7.8561 8.5302 8.5302 8.6014 8.6014 8.6706 8.6706 8.6884 8.6884 12.0444 12.0444 12.0465 12.0465 12.4701 12.4701 12.4748 12.4748 k = 0.2143 0.2143 0.2554 ( 3204 PWs) bands (ev): -30.6784 -30.6784 -30.6784 -30.6784 -12.0430 -12.0430 -12.0085 -12.0085 -11.6925 -11.6925 -11.6626 -11.6626 -11.6328 -11.6328 -11.6242 -11.6242 -4.9146 -4.9146 -4.9082 -4.9082 4.6145 4.6145 4.6169 4.6169 5.1240 5.1240 5.1277 5.1277 5.6067 5.6067 5.6337 5.6337 6.9647 6.9647 7.0239 7.0239 7.5898 7.5898 7.6498 7.6498 7.8298 7.8298 7.8593 7.8593 8.4904 8.4904 8.5620 8.5620 8.6214 8.6214 8.6408 8.6408 12.0261 12.0261 12.0312 12.0312 12.4660 12.4660 12.4686 12.4686 k = 0.2063 0.2063 0.2554 ( 3204 PWs) bands (ev): -30.6792 -30.6792 -30.6792 -30.6792 -12.0406 -12.0406 -12.0062 -12.0062 -11.6908 -11.6908 -11.6593 -11.6593 -11.6291 -11.6291 -11.6224 -11.6224 -4.9361 -4.9361 -4.9298 -4.9298 4.6951 4.6951 4.6977 4.6977 5.1362 5.1362 5.1387 5.1387 5.6449 5.6449 5.6714 5.6714 6.9520 6.9520 7.0121 7.0121 7.5803 7.5803 7.6411 7.6411 7.8341 7.8341 7.8626 7.8626 8.4504 8.4504 8.5214 8.5214 8.5721 8.5721 8.5941 8.5941 12.0003 12.0003 12.0078 12.0078 12.4609 12.4609 12.4620 12.4620 k = 0.1984 0.1984 0.2554 ( 3204 PWs) bands (ev): -30.6800 -30.6800 -30.6800 -30.6800 -12.0382 -12.0382 -12.0041 -12.0041 -11.6892 -11.6892 -11.6563 -11.6563 -11.6253 -11.6253 -11.6202 -11.6202 -4.9572 -4.9572 -4.9510 -4.9510 4.7760 4.7760 4.7787 4.7787 5.1472 5.1472 5.1485 5.1485 5.6844 5.6844 5.7104 5.7104 6.9412 6.9412 7.0021 7.0021 7.5707 7.5707 7.6319 7.6319 7.8386 7.8386 7.8659 7.8659 8.4101 8.4101 8.4795 8.4795 8.5228 8.5228 8.5483 8.5483 11.9693 11.9693 11.9786 11.9786 12.4525 12.4525 12.4531 12.4531 k = 0.1905 0.1905 0.2554 ( 3204 PWs) bands (ev): -30.6808 -30.6808 -30.6808 -30.6808 -12.0358 -12.0358 -12.0021 -12.0021 -11.6876 -11.6876 -11.6537 -11.6537 -11.6214 -11.6214 -11.6177 -11.6177 -4.9778 -4.9778 -4.9717 -4.9717 4.8570 4.8570 4.8598 4.8598 5.1569 5.1569 5.1571 5.1571 5.7252 5.7252 5.7506 5.7506 6.9323 6.9323 6.9939 6.9939 7.5610 7.5610 7.6223 7.6223 7.8433 7.8433 7.8691 7.8691 8.3698 8.3698 8.4361 8.4361 8.4735 8.4735 8.5039 8.5039 11.9348 11.9348 11.9455 11.9455 12.4395 12.4395 12.4403 12.4403 k = 0.1825 0.1825 0.2554 ( 3200 PWs) bands (ev): -30.6816 -30.6816 -30.6816 -30.6816 -12.0335 -12.0335 -12.0003 -12.0003 -11.6860 -11.6860 -11.6515 -11.6515 -11.6174 -11.6174 -11.6148 -11.6148 -4.9979 -4.9979 -4.9919 -4.9919 4.9378 4.9378 4.9409 4.9409 5.1645 5.1645 5.1658 5.1658 5.7672 5.7672 5.7920 5.7920 6.9254 6.9254 6.9876 6.9876 7.5512 7.5512 7.6124 7.6124 7.8482 7.8482 7.8721 7.8721 8.3294 8.3294 8.3913 8.3913 8.4244 8.4244 8.4610 8.4610 11.8981 11.8981 11.9098 11.9098 12.4214 12.4214 12.4223 12.4223 k = 0.1746 0.1746 0.2554 ( 3208 PWs) bands (ev): -30.6823 -30.6823 -30.6823 -30.6823 -12.0313 -12.0313 -11.9987 -11.9987 -11.6844 -11.6844 -11.6497 -11.6497 -11.6134 -11.6134 -11.6117 -11.6117 -5.0174 -5.0174 -5.0115 -5.0115 5.0179 5.0179 5.0215 5.0215 5.1710 5.1710 5.1736 5.1736 5.8103 5.8103 5.8344 5.8344 6.9205 6.9205 6.9831 6.9831 7.5412 7.5412 7.6021 7.6021 7.8530 7.8530 7.8748 7.8748 8.2888 8.2888 8.3450 8.3450 8.3754 8.3754 8.4195 8.4195 11.8600 11.8600 11.8725 11.8725 12.3980 12.3980 12.3989 12.3989 k = 0.1667 0.1667 0.2554 ( 3212 PWs) bands (ev): -30.6831 -30.6831 -30.6831 -30.6831 -12.0292 -12.0292 -11.9972 -11.9972 -11.6828 -11.6828 -11.6481 -11.6481 -11.6094 -11.6094 -11.6084 -11.6084 -5.0363 -5.0363 -5.0306 -5.0306 5.0962 5.0962 5.1008 5.1008 5.1773 5.1773 5.1818 5.1818 5.8546 5.8546 5.8780 5.8780 6.9175 6.9175 6.9805 6.9805 7.5311 7.5311 7.5915 7.5915 7.8576 7.8576 7.8771 7.8771 8.2480 8.2480 8.2977 8.2977 8.3270 8.3270 8.3794 8.3794 11.8213 11.8213 11.8343 11.8343 12.3695 12.3695 12.3704 12.3704 k = 0.1587 0.1587 0.2554 ( 3210 PWs) bands (ev): -30.6838 -30.6838 -30.6838 -30.6838 -12.0271 -12.0271 -11.9959 -11.9959 -11.6812 -11.6812 -11.6468 -11.6468 -11.6053 -11.6053 -11.6050 -11.6050 -5.0546 -5.0546 -5.0491 -5.0491 5.1614 5.1614 5.1663 5.1663 5.1958 5.1958 5.2014 5.2014 5.8999 5.8999 5.9225 5.9225 6.9166 6.9166 6.9797 6.9797 7.5210 7.5210 7.5807 7.5807 7.8621 7.8621 7.8788 7.8788 8.2067 8.2067 8.2496 8.2496 8.2796 8.2796 8.3406 8.3406 11.7825 11.7825 11.7957 11.7957 12.3365 12.3365 12.3371 12.3371 k = 0.1508 0.1508 0.2554 ( 3208 PWs) bands (ev): -30.6845 -30.6845 -30.6845 -30.6845 -12.0250 -12.0250 -11.9947 -11.9947 -11.6795 -11.6795 -11.6458 -11.6458 -11.6014 -11.6014 -11.6014 -11.6014 -5.0722 -5.0722 -5.0669 -5.0669 5.1786 5.1786 5.1801 5.1801 5.2651 5.2651 5.2661 5.2661 5.9461 5.9461 5.9680 5.9680 6.9175 6.9175 6.9805 6.9805 7.5109 7.5109 7.5696 7.5696 7.8663 7.8663 7.8798 7.8798 8.1646 8.1646 8.2010 8.2010 8.2337 8.2337 8.3030 8.3030 11.7436 11.7436 11.7570 11.7570 12.2993 12.2993 12.2999 12.2999 k = 0.1429 0.1429 0.2554 ( 3212 PWs) bands (ev): -30.6852 -30.6852 -30.6852 -30.6852 -12.0230 -12.0230 -11.9937 -11.9937 -11.6778 -11.6778 -11.6449 -11.6449 -11.5978 -11.5978 -11.5975 -11.5975 -5.0891 -5.0891 -5.0840 -5.0840 5.1818 5.1818 5.1850 5.1850 5.3413 5.3413 5.3430 5.3430 5.9932 5.9932 6.0143 6.0143 6.9202 6.9202 6.9830 6.9830 7.5008 7.5008 7.5583 7.5583 7.8699 7.8699 7.8796 7.8796 8.1211 8.1211 8.1526 8.1526 8.1901 8.1901 8.2666 8.2666 11.7051 11.7051 11.7185 11.7185 12.2589 12.2589 12.2595 12.2595 k = 0.1349 0.1349 0.2554 ( 3216 PWs) bands (ev): -30.6858 -30.6858 -30.6858 -30.6858 -12.0211 -12.0211 -11.9929 -11.9929 -11.6761 -11.6761 -11.6442 -11.6442 -11.5943 -11.5943 -11.5937 -11.5937 -5.1053 -5.1053 -5.1003 -5.1003 5.1833 5.1833 5.1874 5.1874 5.4176 5.4176 5.4197 5.4197 6.0411 6.0411 6.0614 6.0614 6.9246 6.9246 6.9869 6.9869 7.4906 7.4906 7.5468 7.5468 7.8730 7.8730 7.8779 7.8779 8.0760 8.0760 8.1048 8.1048 8.1493 8.1493 8.2313 8.2313 11.6671 11.6671 11.6803 11.6803 12.2161 12.2161 12.2168 12.2168 k = 0.1270 0.1270 0.2554 ( 3208 PWs) bands (ev): -30.6864 -30.6864 -30.6864 -30.6864 -12.0192 -12.0192 -11.9922 -11.9922 -11.6743 -11.6743 -11.6436 -11.6436 -11.5907 -11.5907 -11.5900 -11.5900 -5.1207 -5.1207 -5.1159 -5.1159 5.1839 5.1839 5.1886 5.1886 5.4927 5.4927 5.4951 5.4951 6.0896 6.0896 6.1091 6.1091 6.9307 6.9307 6.9923 6.9923 7.4805 7.4805 7.5350 7.5350 7.8734 7.8734 7.8753 7.8753 8.0295 8.0295 8.0588 8.0588 8.1119 8.1119 8.1973 8.1973 11.6296 11.6297 11.6426 11.6426 12.1717 12.1717 12.1726 12.1726 k = 0.1190 0.1190 0.2554 ( 3204 PWs) bands (ev): -30.6870 -30.6870 -30.6870 -30.6870 -12.0174 -12.0174 -11.9917 -11.9917 -11.6726 -11.6726 -11.6431 -11.6431 -11.5872 -11.5872 -11.5864 -11.5864 -5.1352 -5.1352 -5.1308 -5.1308 5.1837 5.1837 5.1888 5.1888 5.5662 5.5662 5.5687 5.5687 6.1387 6.1387 6.1575 6.1575 6.9382 6.9382 6.9988 6.9988 7.4704 7.4704 7.5231 7.5231 7.8649 7.8649 7.8759 7.8759 7.9817 7.9817 8.0161 8.0161 8.0779 8.0779 8.1646 8.1646 11.5928 11.5928 11.6054 11.6054 12.1266 12.1266 12.1278 12.1278 k = 0.1111 0.1111 0.2554 ( 3212 PWs) bands (ev): -30.6876 -30.6876 -30.6876 -30.6876 -12.0157 -12.0157 -11.9913 -11.9913 -11.6708 -11.6708 -11.6428 -11.6428 -11.5839 -11.5839 -11.5831 -11.5831 -5.1490 -5.1490 -5.1448 -5.1448 5.1830 5.1830 5.1883 5.1883 5.6377 5.6377 5.6404 5.6404 6.1883 6.1883 6.2062 6.2062 6.9470 6.9470 7.0064 7.0064 7.4602 7.4602 7.5107 7.5107 7.8492 7.8492 7.8741 7.8741 7.9339 7.9339 7.9795 7.9795 8.0477 8.0477 8.1336 8.1336 11.5568 11.5568 11.5688 11.5688 12.0816 12.0816 12.0830 12.0830 k = 0.1032 0.1032 0.2554 ( 3216 PWs) bands (ev): -30.6881 -30.6881 -30.6881 -30.6881 -12.0140 -12.0140 -11.9911 -11.9911 -11.6690 -11.6690 -11.6425 -11.6425 -11.5807 -11.5807 -11.5799 -11.5799 -5.1620 -5.1620 -5.1580 -5.1580 5.1818 5.1818 5.1872 5.1872 5.7069 5.7069 5.7096 5.7096 6.2382 6.2382 6.2553 6.2553 6.9570 6.9570 7.0148 7.0148 7.4500 7.4500 7.4981 7.4981 7.8239 7.8239 7.8647 7.8647 7.8909 7.8909 7.9515 7.9515 8.0218 8.0218 8.1046 8.1046 11.5216 11.5216 11.5330 11.5330 12.0375 12.0375 12.0390 12.0390 k = 0.0952 0.0952 0.2554 ( 3210 PWs) bands (ev): -30.6886 -30.6886 -30.6886 -30.6886 -12.0124 -12.0124 -11.9909 -11.9909 -11.6671 -11.6671 -11.6424 -11.6424 -11.5777 -11.5777 -11.5768 -11.5768 -5.1740 -5.1740 -5.1703 -5.1703 5.1802 5.1802 5.1856 5.1856 5.7734 5.7734 5.7761 5.7761 6.2883 6.2883 6.3046 6.3046 6.9680 6.9680 7.0238 7.0238 7.4399 7.4399 7.4852 7.4852 7.7891 7.7891 7.8280 7.8280 7.8723 7.8723 7.9318 7.9318 8.0009 8.0009 8.0781 8.0781 11.4873 11.4873 11.4981 11.4981 11.9949 11.9949 11.9966 11.9966 k = 0.0873 0.0873 0.2554 ( 3206 PWs) bands (ev): -30.6890 -30.6890 -30.6890 -30.6890 -12.0108 -12.0108 -11.9909 -11.9909 -11.6653 -11.6653 -11.6423 -11.6423 -11.5748 -11.5748 -11.5740 -11.5740 -5.1852 -5.1852 -5.1817 -5.1817 5.1784 5.1784 5.1837 5.1837 5.8368 5.8368 5.8395 5.8395 6.3385 6.3385 6.3539 6.3539 6.9796 6.9796 7.0333 7.0333 7.4298 7.4298 7.4719 7.4719 7.7482 7.7482 7.7806 7.7806 7.8611 7.8611 7.9168 7.9168 7.9854 7.9854 8.0545 8.0545 11.4541 11.4541 11.4642 11.4642 11.9544 11.9544 11.9562 11.9562 k = 0.0794 0.0794 0.2554 ( 3208 PWs) bands (ev): -30.6894 -30.6894 -30.6894 -30.6894 -12.0093 -12.0093 -11.9910 -11.9910 -11.6635 -11.6635 -11.6424 -11.6424 -11.5722 -11.5722 -11.5714 -11.5714 -5.1954 -5.1954 -5.1922 -5.1922 5.1765 5.1765 5.1815 5.1815 5.8968 5.8968 5.8995 5.8995 6.3884 6.3884 6.4030 6.4030 6.9918 6.9918 7.0428 7.0428 7.4195 7.4195 7.4581 7.4581 7.7044 7.7044 7.7327 7.7327 7.8481 7.8481 7.9031 7.9031 7.9749 7.9749 8.0345 8.0345 11.4222 11.4222 11.4315 11.4315 11.9165 11.9165 11.9185 11.9185 k = 0.0714 0.0714 0.2554 ( 3216 PWs) bands (ev): -30.6898 -30.6898 -30.6898 -30.6898 -12.0079 -12.0079 -11.9913 -11.9913 -11.6618 -11.6618 -11.6425 -11.6425 -11.5697 -11.5697 -11.5690 -11.5690 -5.2048 -5.2048 -5.2018 -5.2018 5.1744 5.1744 5.1792 5.1792 5.9530 5.9530 5.9556 5.9556 6.4380 6.4380 6.4516 6.4516 7.0041 7.0041 7.0520 7.0520 7.4092 7.4092 7.4439 7.4439 7.6598 7.6598 7.6856 7.6856 7.8335 7.8335 7.8888 7.8888 7.9686 7.9686 8.0182 8.0182 11.3918 11.3918 11.4002 11.4002 11.8817 11.8817 11.8837 11.8837 k = 0.0635 0.0635 0.2554 ( 3210 PWs) bands (ev): -30.6902 -30.6902 -30.6902 -30.6902 -12.0065 -12.0065 -11.9916 -11.9916 -11.6600 -11.6600 -11.6428 -11.6428 -11.5674 -11.5674 -11.5668 -11.5668 -5.2131 -5.2131 -5.2104 -5.2104 5.1724 5.1724 5.1768 5.1768 6.0050 6.0050 6.0074 6.0074 6.4868 6.4868 6.4994 6.4994 7.0163 7.0163 7.0605 7.0605 7.3990 7.3990 7.4294 7.4294 7.6159 7.6159 7.6401 7.6401 7.8184 7.8184 7.8733 7.8733 7.9653 7.9653 8.0057 8.0057 11.3632 11.3632 11.3707 11.3707 11.8503 11.8503 11.8523 11.8523 k = 0.0556 0.0556 0.2554 ( 3214 PWs) bands (ev): -30.6905 -30.6905 -30.6905 -30.6905 -12.0051 -12.0051 -11.9920 -11.9920 -11.6583 -11.6583 -11.6432 -11.6432 -11.5654 -11.5654 -11.5648 -11.5648 -5.2205 -5.2205 -5.2181 -5.2181 5.1705 5.1705 5.1745 5.1745 6.0522 6.0522 6.0545 6.0545 6.5344 6.5344 6.5460 6.5460 7.0279 7.0279 7.0679 7.0679 7.3886 7.3886 7.4147 7.4147 7.5739 7.5739 7.5967 7.5967 7.8040 7.8040 7.8569 7.8569 7.9638 7.9638 7.9963 7.9963 11.3367 11.3367 11.3433 11.3433 11.8223 11.8223 11.8243 11.8243 k = 0.0476 0.0476 0.2554 ( 3214 PWs) bands (ev): -30.6908 -30.6908 -30.6908 -30.6908 -12.0038 -12.0038 -11.9925 -11.9925 -11.6567 -11.6567 -11.6436 -11.6436 -11.5637 -11.5637 -11.5632 -11.5632 -5.2269 -5.2269 -5.2248 -5.2248 5.1687 5.1687 5.1722 5.1722 6.0944 6.0944 6.0964 6.0964 6.5803 6.5803 6.5909 6.5909 7.0383 7.0383 7.0735 7.0735 7.3782 7.3782 7.4001 7.4001 7.5349 7.5349 7.5563 7.5563 7.7912 7.7912 7.8403 7.8403 7.9635 7.9635 7.9894 7.9894 11.3128 11.3128 11.3185 11.3185 11.7981 11.7981 11.7999 11.7999 k = 0.0397 0.0397 0.2554 ( 3206 PWs) bands (ev): -30.6910 -30.6910 -30.6910 -30.6910 -12.0026 -12.0026 -11.9931 -11.9931 -11.6551 -11.6551 -11.6441 -11.6441 -11.5622 -11.5622 -11.5617 -11.5617 -5.2324 -5.2324 -5.2305 -5.2305 5.1672 5.1672 5.1702 5.1702 6.1310 6.1310 6.1328 6.1328 6.6239 6.6239 6.6332 6.6332 7.0471 7.0471 7.0769 7.0769 7.3681 7.3681 7.3861 7.3861 7.5001 7.5001 7.5196 7.5196 7.7806 7.7806 7.8241 7.8241 7.9641 7.9641 7.9844 7.9844 11.2918 11.2918 11.2965 11.2965 11.7777 11.7777 11.7793 11.7793 k = 0.0317 0.0317 0.2554 ( 3210 PWs) bands (ev): -30.6912 -30.6912 -30.6912 -30.6912 -12.0014 -12.0014 -11.9938 -11.9938 -11.6536 -11.6536 -11.6448 -11.6448 -11.5609 -11.5609 -11.5605 -11.5605 -5.2368 -5.2368 -5.2352 -5.2352 5.1659 5.1659 5.1684 5.1684 6.1616 6.1616 6.1632 6.1632 6.6639 6.6639 6.6719 6.6719 7.0536 7.0536 7.0775 7.0775 7.3586 7.3586 7.3732 7.3732 7.4706 7.4706 7.4874 7.4874 7.7724 7.7724 7.8090 7.8090 7.9650 7.9650 7.9805 7.9805 11.2740 11.2740 11.2778 11.2778 11.7610 11.7610 11.7624 11.7624 k = 0.0238 0.0238 0.2554 ( 3218 PWs) bands (ev): -30.6913 -30.6913 -30.6913 -30.6913 -12.0003 -12.0003 -11.9945 -11.9945 -11.6522 -11.6522 -11.6456 -11.6456 -11.5600 -11.5600 -11.5597 -11.5597 -5.2403 -5.2403 -5.2389 -5.2389 5.1650 5.1650 5.1668 5.1668 6.1859 6.1859 6.1872 6.1872 6.6989 6.6989 6.7054 6.7054 7.0575 7.0575 7.0753 7.0753 7.3506 7.3506 7.3621 7.3621 7.4473 7.4473 7.4605 7.4605 7.7670 7.7670 7.7954 7.7954 7.9663 7.9663 7.9775 7.9775 11.2599 11.2599 11.2628 11.2628 11.7482 11.7482 11.7493 11.7493 k = 0.0159 0.0159 0.2554 ( 3218 PWs) bands (ev): -30.6914 -30.6914 -30.6914 -30.6914 -11.9992 -11.9992 -11.9953 -11.9953 -11.6509 -11.6509 -11.6464 -11.6464 -11.5592 -11.5592 -11.5590 -11.5590 -5.2427 -5.2427 -5.2416 -5.2416 5.1643 5.1643 5.1656 5.1656 6.2035 6.2035 6.2047 6.2047 6.7271 6.7271 6.7317 6.7317 7.0594 7.0594 7.0711 7.0711 7.3450 7.3450 7.3534 7.3534 7.4310 7.4310 7.4399 7.4399 7.7646 7.7646 7.7840 7.7840 7.9677 7.9677 7.9750 7.9750 11.2498 11.2498 11.2517 11.2517 11.7391 11.7391 11.7399 11.7399 k = 0.0079 0.0079 0.2554 ( 3218 PWs) bands (ev): -30.6915 -30.6915 -30.6915 -30.6915 -11.9981 -11.9981 -11.9962 -11.9962 -11.6496 -11.6496 -11.6474 -11.6474 -11.5588 -11.5588 -11.5587 -11.5587 -5.2442 -5.2442 -5.2432 -5.2432 5.1641 5.1641 5.1647 5.1647 6.2141 6.2141 6.2152 6.2152 6.7459 6.7459 6.7485 6.7485 7.0605 7.0605 7.0663 7.0663 7.3425 7.3425 7.3472 7.3472 7.4218 7.4218 7.4263 7.4263 7.7651 7.7651 7.7750 7.7750 7.9692 7.9692 7.9729 7.9729 11.2438 11.2438 11.2448 11.2448 11.7336 11.7336 11.7342 11.7342 k = 0.0000 0.0000 0.2554 ( 3220 PWs) bands (ev): -30.6915 -30.6915 -30.6915 -30.6915 -11.9972 -11.9972 -11.9971 -11.9971 -11.6485 -11.6485 -11.6485 -11.6485 -11.5586 -11.5586 -11.5586 -11.5586 -5.2447 -5.2447 -5.2437 -5.2437 5.1641 5.1641 5.1643 5.1643 6.2177 6.2177 6.2187 6.2187 6.7530 6.7530 6.7539 6.7539 7.0622 7.0622 7.0629 7.0629 7.3428 7.3428 7.3440 7.3440 7.4196 7.4196 7.4208 7.4208 7.7682 7.7682 7.7690 7.7690 7.9704 7.9704 7.9715 7.9715 11.2420 11.2420 11.2423 11.2423 11.7318 11.7318 11.7322 11.7322 k = 0.0000 0.5000-0.0000 ( 3206 PWs) bands (ev): -30.6856 -30.6856 -30.6635 -30.6635 -12.0932 -12.0932 -12.0826 -12.0826 -11.7810 -11.7810 -11.6814 -11.6814 -11.5785 -11.5785 -11.5105 -11.5105 -5.1197 -5.1197 -4.4340 -4.4340 2.7189 2.7189 4.7650 4.7650 5.2020 5.2020 5.4003 5.4003 6.2292 6.2292 6.3439 6.3439 6.5644 6.5644 7.1733 7.1733 7.2930 7.2930 7.3779 7.3779 7.6846 7.6846 7.9553 7.9553 8.1196 8.1196 8.3539 8.3539 9.7530 9.7530 9.9693 9.9693 10.9934 10.9934 11.3479 11.3479 13.5781 13.5781 13.7199 13.7199 k = 0.0000 0.5000 0.0111 ( 3200 PWs) bands (ev): -30.6855 -30.6855 -30.6635 -30.6635 -12.0932 -12.0932 -12.0824 -12.0824 -11.7809 -11.7809 -11.6814 -11.6814 -11.5785 -11.5785 -11.5107 -11.5107 -5.1197 -5.1197 -4.4339 -4.4339 2.7189 2.7189 4.7639 4.7639 5.2021 5.2021 5.4017 5.4017 6.2285 6.2285 6.3439 6.3439 6.5656 6.5656 7.1733 7.1733 7.2931 7.2931 7.3782 7.3782 7.6842 7.6842 7.9553 7.9553 8.1195 8.1195 8.3526 8.3526 9.7522 9.7522 9.9693 9.9693 10.9966 10.9966 11.3483 11.3483 13.5772 13.5772 13.7133 13.7133 k = 0.0000 0.5000 0.0222 ( 3204 PWs) bands (ev): -30.6855 -30.6855 -30.6636 -30.6636 -12.0933 -12.0933 -12.0818 -12.0818 -11.7806 -11.7806 -11.6815 -11.6815 -11.5786 -11.5786 -11.5115 -11.5115 -5.1196 -5.1196 -4.4338 -4.4338 2.7190 2.7190 4.7607 4.7607 5.2022 5.2022 5.4058 5.4058 6.2264 6.2264 6.3437 6.3437 6.5691 6.5691 7.1733 7.1733 7.2933 7.2933 7.3791 7.3791 7.6832 7.6832 7.9548 7.9548 8.1192 8.1192 8.3487 8.3487 9.7498 9.7498 9.9693 9.9693 11.0064 11.0064 11.3493 11.3493 13.5744 13.5744 13.6948 13.6948 k = 0.0000 0.5000 0.0333 ( 3204 PWs) bands (ev): -30.6853 -30.6853 -30.6637 -30.6637 -12.0935 -12.0935 -12.0808 -12.0808 -11.7802 -11.7802 -11.6815 -11.6815 -11.5787 -11.5787 -11.5128 -11.5128 -5.1196 -5.1196 -4.4335 -4.4335 2.7190 2.7190 4.7555 4.7555 5.2023 5.2023 5.4124 5.4124 6.2229 6.2229 6.3434 6.3434 6.5748 6.5748 7.1732 7.1732 7.2935 7.2935 7.3808 7.3808 7.6816 7.6816 7.9540 7.9540 8.1187 8.1187 8.3422 8.3422 9.7460 9.7460 9.9692 9.9692 11.0225 11.0225 11.3511 11.3511 13.5698 13.5698 13.6664 13.6664 k = 0.0000 0.5000 0.0444 ( 3212 PWs) bands (ev): -30.6852 -30.6852 -30.6639 -30.6639 -12.0936 -12.0936 -12.0795 -12.0795 -11.7797 -11.7797 -11.6816 -11.6816 -11.5789 -11.5789 -11.5145 -11.5145 -5.1195 -5.1195 -4.4331 -4.4331 2.7191 2.7191 4.7485 4.7485 5.2026 5.2026 5.4214 5.4214 6.2184 6.2184 6.3431 6.3431 6.5825 6.5825 7.1730 7.1730 7.2938 7.2938 7.3831 7.3831 7.6793 7.6793 7.9528 7.9528 8.1180 8.1180 8.3333 8.3333 9.7407 9.7407 9.9691 9.9691 11.0448 11.0448 11.3535 11.3535 13.5637 13.5637 13.6301 13.6301 k = 0.0000 0.5000 0.0555 ( 3196 PWs) bands (ev): -30.6849 -30.6849 -30.6641 -30.6641 -12.0937 -12.0937 -12.0779 -12.0779 -11.7788 -11.7788 -11.6817 -11.6817 -11.5791 -11.5791 -11.5166 -11.5166 -5.1194 -5.1194 -4.4327 -4.4327 2.7192 2.7192 4.7401 4.7401 5.2029 5.2029 5.4325 5.4325 6.2129 6.2129 6.3426 6.3426 6.5919 6.5919 7.1729 7.1729 7.2943 7.2943 7.3862 7.3862 7.6766 7.6766 7.9516 7.9516 8.1171 8.1171 8.3223 8.3223 9.7345 9.7345 9.9690 9.9690 11.0730 11.0730 11.3566 11.3566 13.5561 13.5561 13.5876 13.5876 k = 0.0000 0.5000 0.0666 ( 3192 PWs) bands (ev): -30.6846 -30.6846 -30.6644 -30.6644 -12.0937 -12.0937 -12.0761 -12.0761 -11.7779 -11.7779 -11.6819 -11.6819 -11.5794 -11.5794 -11.5191 -11.5191 -5.1194 -5.1194 -4.4321 -4.4321 2.7194 2.7194 4.7304 4.7304 5.2033 5.2033 5.4452 5.4452 6.2067 6.2067 6.3421 6.3421 6.6029 6.6029 7.1726 7.1726 7.2949 7.2949 7.3901 7.3901 7.6733 7.6733 7.9498 7.9498 8.1159 8.1159 8.3092 8.3092 9.7272 9.7272 9.9689 9.9689 11.1068 11.1068 11.3601 11.3601 13.5390 13.5390 13.5480 13.5480 k = 0.0000 0.5000 0.0777 ( 3204 PWs) bands (ev): -30.6843 -30.6843 -30.6647 -30.6647 -12.0938 -12.0938 -12.0742 -12.0742 -11.7768 -11.7768 -11.6822 -11.6822 -11.5797 -11.5797 -11.5222 -11.5222 -5.1193 -5.1193 -4.4315 -4.4315 2.7195 2.7195 4.7198 4.7198 5.2037 5.2037 5.4593 5.4593 6.2000 6.2000 6.3415 6.3415 6.6150 6.6150 7.1724 7.1724 7.2954 7.2954 7.3944 7.3944 7.6694 7.6694 7.9476 7.9476 8.1142 8.1142 8.2944 8.2944 9.7192 9.7192 9.9688 9.9688 11.1458 11.1458 11.3640 11.3640 13.4862 13.4862 13.5380 13.5380 k = 0.0000 0.5000 0.0888 ( 3212 PWs) bands (ev): -30.6840 -30.6840 -30.6651 -30.6651 -12.0937 -12.0937 -12.0721 -12.0721 -11.7755 -11.7755 -11.6825 -11.6825 -11.5801 -11.5801 -11.5255 -11.5255 -5.1192 -5.1192 -4.4308 -4.4308 2.7196 2.7196 4.7084 4.7084 5.2041 5.2041 5.4744 5.4744 6.1929 6.1929 6.3409 6.3409 6.6279 6.6279 7.1720 7.1720 7.2960 7.2960 7.3996 7.3996 7.6652 7.6652 7.9451 7.9451 8.1121 8.1121 8.2783 8.2783 9.7108 9.7108 9.9687 9.9687 11.1899 11.1899 11.3683 11.3683 13.4286 13.4286 13.5277 13.5277 k = 0.0000 0.5000 0.1000 ( 3216 PWs) bands (ev): -30.6835 -30.6835 -30.6655 -30.6655 -12.0936 -12.0936 -12.0699 -12.0699 -11.7740 -11.7740 -11.6829 -11.6829 -11.5804 -11.5804 -11.5291 -11.5291 -5.1190 -5.1190 -4.4301 -4.4301 2.7198 2.7198 4.6967 4.6967 5.2046 5.2046 5.4901 5.4901 6.1858 6.1858 6.3402 6.3402 6.6416 6.6416 7.1717 7.1717 7.2967 7.2967 7.4054 7.4054 7.6607 7.6607 7.9421 7.9421 8.1095 8.1095 8.2615 8.2615 9.7020 9.7020 9.9686 9.9686 11.2385 11.2385 11.3728 11.3728 13.3670 13.3670 13.5170 13.5170 k = 0.0000 0.5000 0.1111 ( 3208 PWs) bands (ev): -30.6831 -30.6831 -30.6659 -30.6659 -12.0934 -12.0934 -12.0676 -12.0676 -11.7722 -11.7722 -11.6835 -11.6835 -11.5807 -11.5807 -11.5329 -11.5329 -5.1189 -5.1189 -4.4293 -4.4293 2.7200 2.7200 4.6850 4.6850 5.2052 5.2052 5.5063 5.5063 6.1786 6.1786 6.3396 6.3396 6.6558 6.6558 7.1714 7.1714 7.2974 7.2974 7.4119 7.4119 7.6560 7.6560 7.9388 7.9388 8.1062 8.1062 8.2443 8.2443 9.6933 9.6933 9.9686 9.9686 11.2914 11.2914 11.3774 11.3774 13.3017 13.3017 13.5062 13.5062 k = 0.0000 0.5000 0.1222 ( 3196 PWs) bands (ev): -30.6826 -30.6826 -30.6664 -30.6664 -12.0932 -12.0932 -12.0652 -12.0652 -11.7702 -11.7702 -11.6841 -11.6841 -11.5809 -11.5809 -11.5369 -11.5369 -5.1188 -5.1188 -4.4286 -4.4286 2.7203 2.7203 4.6733 4.6733 5.2059 5.2059 5.5225 5.5225 6.1716 6.1716 6.3389 6.3389 6.6701 6.6701 7.1711 7.1711 7.2981 7.2981 7.4190 7.4190 7.6513 7.6513 7.9349 7.9349 8.1020 8.1020 8.2276 8.2276 9.6847 9.6847 9.9686 9.9686 11.3480 11.3480 11.3824 11.3824 13.2329 13.2329 13.4954 13.4954 k = 0.0000 0.5000 0.1333 ( 3196 PWs) bands (ev): -30.6821 -30.6821 -30.6670 -30.6670 -12.0929 -12.0929 -12.0629 -12.0629 -11.7681 -11.7681 -11.6849 -11.6849 -11.5812 -11.5812 -11.5410 -11.5410 -5.1186 -5.1186 -4.4278 -4.4278 2.7205 2.7205 4.6619 4.6619 5.2065 5.2065 5.5385 5.5385 6.1649 6.1649 6.3382 6.3382 6.6843 6.6843 7.1707 7.1707 7.2988 7.2988 7.4267 7.4267 7.6464 7.6464 7.9304 7.9304 8.0966 8.0966 8.2117 8.2117 9.6763 9.6763 9.9686 9.9686 11.3859 11.3859 11.4096 11.4096 13.1610 13.1610 13.4847 13.4847 k = 0.0000 0.5000 0.1444 ( 3192 PWs) bands (ev): -30.6815 -30.6815 -30.6675 -30.6675 -12.0926 -12.0926 -12.0606 -12.0606 -11.7658 -11.7658 -11.6858 -11.6858 -11.5815 -11.5815 -11.5451 -11.5451 -5.1185 -5.1185 -4.4270 -4.4270 2.7207 2.7207 4.6509 4.6509 5.2071 5.2071 5.5539 5.5539 6.1585 6.1585 6.3375 6.3375 6.6982 6.6982 7.1703 7.1703 7.2994 7.2994 7.4350 7.4350 7.6416 7.6416 7.9252 7.9252 8.0899 8.0899 8.1974 8.1974 9.6684 9.6684 9.9686 9.9686 11.3908 11.3908 11.4731 11.4731 13.0865 13.0865 13.4745 13.4745 k = 0.0000 0.5000 0.1555 ( 3196 PWs) bands (ev): -30.6809 -30.6809 -30.6681 -30.6681 -12.0924 -12.0924 -12.0584 -12.0584 -11.7633 -11.7633 -11.6870 -11.6870 -11.5817 -11.5817 -11.5493 -11.5493 -5.1184 -5.1184 -4.4262 -4.4262 2.7208 2.7208 4.6405 4.6405 5.2077 5.2077 5.5687 5.5687 6.1525 6.1525 6.3368 6.3368 6.7115 6.7115 7.1700 7.1700 7.3000 7.3000 7.4436 7.4436 7.6369 7.6369 7.9192 7.9192 8.0819 8.0819 8.1853 8.1853 9.6609 9.6609 9.9686 9.9686 11.3952 11.3952 11.5399 11.5399 13.0096 13.0096 13.4648 13.4648 k = 0.0000 0.5000 0.1666 ( 3196 PWs) bands (ev): -30.6803 -30.6803 -30.6688 -30.6688 -12.0921 -12.0921 -12.0563 -12.0563 -11.7607 -11.7607 -11.6883 -11.6883 -11.5818 -11.5818 -11.5533 -11.5533 -5.1182 -5.1182 -4.4255 -4.4255 2.7210 2.7210 4.6310 4.6310 5.2083 5.2083 5.5825 5.5825 6.1470 6.1470 6.3362 6.3362 6.7241 6.7241 7.1696 7.1696 7.3006 7.3006 7.4526 7.4526 7.6325 7.6325 7.9124 7.9124 8.0728 8.0728 8.1755 8.1755 9.6541 9.6541 9.9687 9.9687 11.3992 11.3992 11.6096 11.6096 12.9307 12.9307 13.4558 13.4558 k = 0.0000 0.5000 0.1777 ( 3196 PWs) bands (ev): -30.6796 -30.6796 -30.6694 -30.6694 -12.0918 -12.0918 -12.0544 -12.0544 -11.7580 -11.7580 -11.6897 -11.6897 -11.5818 -11.5818 -11.5572 -11.5572 -5.1181 -5.1181 -4.4248 -4.4248 2.7212 2.7212 4.6222 4.6222 5.2088 5.2088 5.5951 5.5951 6.1421 6.1421 6.3356 6.3356 6.7358 6.7358 7.1692 7.1692 7.3011 7.3011 7.4617 7.4617 7.6284 7.6284 7.9048 7.9048 8.0632 8.0632 8.1679 8.1679 9.6478 9.6478 9.9687 9.9687 11.4028 11.4028 11.6817 11.6817 12.8501 12.8501 13.4475 13.4475 k = 0.0000 0.5000 0.1888 ( 3192 PWs) bands (ev): -30.6789 -30.6789 -30.6701 -30.6701 -12.0915 -12.0915 -12.0526 -12.0526 -11.7552 -11.7552 -11.6913 -11.6913 -11.5817 -11.5817 -11.5609 -11.5609 -5.1180 -5.1180 -4.4242 -4.4242 2.7213 2.7213 4.6145 4.6145 5.2094 5.2094 5.6065 5.6065 6.1377 6.1377 6.3351 6.3351 6.7464 6.7464 7.1689 7.1689 7.3015 7.3015 7.4707 7.4707 7.6248 7.6248 7.8965 7.8965 8.0539 8.0539 8.1622 8.1622 9.6424 9.6424 9.9688 9.9688 11.4061 11.4061 11.7560 11.7560 12.7684 12.7684 13.4402 13.4402 k = 0.0000 0.5000 0.1999 ( 3192 PWs) bands (ev): -30.6782 -30.6782 -30.6708 -30.6708 -12.0913 -12.0913 -12.0511 -12.0511 -11.7526 -11.7526 -11.6929 -11.6929 -11.5815 -11.5815 -11.5642 -11.5642 -5.1179 -5.1179 -4.4236 -4.4236 2.7215 2.7215 4.6079 4.6079 5.2098 5.2098 5.6163 5.6163 6.1339 6.1339 6.3346 6.3346 6.7557 6.7557 7.1687 7.1687 7.3019 7.3019 7.4793 7.4793 7.6216 7.6216 7.8880 7.8880 8.0455 8.0455 8.1580 8.1580 9.6377 9.6377 9.9688 9.9688 11.4089 11.4089 11.8320 11.8320 12.6859 12.6859 13.4339 13.4339 k = 0.0000 0.5000 0.2110 ( 3194 PWs) bands (ev): -30.6775 -30.6775 -30.6715 -30.6715 -12.0911 -12.0911 -12.0498 -12.0498 -11.7501 -11.7501 -11.6945 -11.6945 -11.5811 -11.5811 -11.5674 -11.5674 -5.1178 -5.1178 -4.4232 -4.4232 2.7216 2.7216 4.6023 4.6023 5.2101 5.2101 5.6246 5.6246 6.1308 6.1308 6.3342 6.3342 6.7635 6.7635 7.1684 7.1684 7.3022 7.3022 7.4871 7.4871 7.6191 7.6191 7.8795 7.8795 8.0383 8.0383 8.1549 8.1549 9.6338 9.6338 9.9689 9.9689 11.4113 11.4113 11.9091 11.9091 12.6033 12.6033 13.4286 13.4286 k = 0.0000 0.5000 0.2221 ( 3194 PWs) bands (ev): -30.6768 -30.6768 -30.6722 -30.6722 -12.0909 -12.0909 -12.0488 -12.0488 -11.7479 -11.7479 -11.6960 -11.6960 -11.5805 -11.5805 -11.5701 -11.5701 -5.1178 -5.1178 -4.4228 -4.4228 2.7217 2.7217 4.5980 4.5980 5.2105 5.2105 5.6311 5.6311 6.1284 6.1284 6.3339 6.3339 6.7697 6.7697 7.1682 7.1682 7.3024 7.3024 7.4939 7.4939 7.6171 7.6171 7.8719 7.8719 8.0326 8.0326 8.1528 8.1528 9.6307 9.6307 9.9689 9.9689 11.4131 11.4131 11.9866 11.9866 12.5215 12.5215 13.4244 13.4244 k = 0.0000 0.5000 0.2332 ( 3198 PWs) bands (ev): -30.6760 -30.6760 -30.6730 -30.6730 -12.0908 -12.0908 -12.0481 -12.0481 -11.7461 -11.7461 -11.6972 -11.6972 -11.5798 -11.5798 -11.5724 -11.5724 -5.1177 -5.1177 -4.4226 -4.4226 2.7217 2.7217 4.5948 4.5948 5.2107 5.2107 5.6358 5.6358 6.1266 6.1266 6.3337 6.3337 6.7742 6.7742 7.1680 7.1680 7.3026 7.3026 7.4990 7.4990 7.6156 7.6156 7.8659 7.8659 8.0287 8.0287 8.1514 8.1514 9.6284 9.6284 9.9689 9.9689 11.4145 11.4145 12.0625 12.0625 12.4426 12.4426 13.4214 13.4214 k = 0.0000 0.5000 0.2443 ( 3204 PWs) bands (ev): -30.6753 -30.6753 -30.6737 -30.6737 -12.0908 -12.0908 -12.0476 -12.0476 -11.7450 -11.7450 -11.6981 -11.6981 -11.5790 -11.5790 -11.5742 -11.5742 -5.1177 -5.1177 -4.4224 -4.4224 2.7217 2.7217 4.5929 4.5929 5.2108 5.2108 5.6387 5.6387 6.1255 6.1255 6.3335 6.3335 6.7770 6.7770 7.1679 7.1679 7.3026 7.3026 7.5023 7.5023 7.6148 7.6148 7.8619 7.8619 8.0262 8.0262 8.1505 8.1505 9.6271 9.6271 9.9689 9.9689 11.4153 11.4153 12.1303 12.1303 12.3728 12.3728 13.4196 13.4196 k = 0.0000 0.5000 0.2554 ( 3204 PWs) bands (ev): -30.6747 -30.6747 -30.6743 -30.6743 -12.0908 -12.0908 -12.0475 -12.0475 -11.7446 -11.7446 -11.6983 -11.6983 -11.5785 -11.5785 -11.5749 -11.5749 -5.1177 -5.1177 -4.4223 -4.4223 2.7218 2.7218 4.5923 4.5923 5.2108 5.2108 5.6396 5.6396 6.1252 6.1252 6.3335 6.3335 6.7779 6.7779 7.1679 7.1679 7.3027 7.3027 7.5034 7.5034 7.6145 7.6145 7.8606 7.8606 8.0254 8.0254 8.1503 8.1503 9.6266 9.6266 9.9689 9.9689 11.4156 11.4156 12.1645 12.1645 12.3381 12.3381 13.4190 13.4190 k = 0.5000 0.5000-0.0000 ( 3204 PWs) bands (ev): -30.6688 -30.6688 -30.6474 -30.6474 -12.1167 -12.1167 -12.0985 -12.0985 -11.8205 -11.8205 -11.7333 -11.7333 -11.7284 -11.7284 -11.5206 -11.5206 -4.3162 -4.3162 -4.3062 -4.3062 2.7269 2.7269 2.9846 2.9846 4.2533 4.2533 4.9746 4.9746 5.0182 5.0182 5.0218 5.0218 6.8341 6.8341 7.6995 7.6995 7.7009 7.7009 8.2716 8.2716 8.3530 8.3530 9.2114 9.2114 9.5047 9.5047 9.6458 9.6458 9.8700 9.8700 9.9207 9.9207 9.9227 9.9227 9.9292 9.9292 9.9377 9.9377 14.6122 14.6122 k = 0.5000 0.5000 0.0111 ( 3200 PWs) bands (ev): -30.6688 -30.6688 -30.6474 -30.6474 -12.1167 -12.1167 -12.0984 -12.0984 -11.8204 -11.8204 -11.7334 -11.7334 -11.7282 -11.7282 -11.5209 -11.5209 -4.3162 -4.3162 -4.3062 -4.3062 2.7272 2.7272 2.9843 2.9843 4.2541 4.2541 4.9739 4.9739 5.0181 5.0181 5.0218 5.0218 6.8352 6.8352 7.6995 7.6995 7.7009 7.7009 8.2708 8.2708 8.3531 8.3531 9.1887 9.1887 9.5029 9.5029 9.6733 9.6733 9.8688 9.8688 9.9113 9.9113 9.9243 9.9243 9.9328 9.9328 9.9434 9.9434 14.6063 14.6063 k = 0.5000 0.5000 0.0222 ( 3200 PWs) bands (ev): -30.6687 -30.6687 -30.6475 -30.6475 -12.1165 -12.1165 -12.0984 -12.0984 -11.8201 -11.8201 -11.7337 -11.7337 -11.7277 -11.7277 -11.5218 -11.5218 -4.3161 -4.3161 -4.3062 -4.3062 2.7281 2.7281 2.9834 2.9834 4.2567 4.2567 4.9716 4.9716 5.0180 5.0180 5.0218 5.0218 6.8382 6.8382 7.6995 7.6995 7.7009 7.7009 8.2684 8.2684 8.3531 8.3531 9.1318 9.1318 9.5011 9.5011 9.7406 9.7406 9.8654 9.8654 9.9024 9.9024 9.9175 9.9175 9.9440 9.9440 9.9524 9.9524 14.5885 14.5885 k = 0.5000 0.5000 0.0333 ( 3216 PWs) bands (ev): -30.6686 -30.6686 -30.6476 -30.6476 -12.1163 -12.1163 -12.0984 -12.0984 -11.8196 -11.8196 -11.7343 -11.7343 -11.7268 -11.7268 -11.5233 -11.5233 -4.3160 -4.3160 -4.3062 -4.3062 2.7297 2.7297 2.9820 2.9820 4.2611 4.2611 4.9677 4.9677 5.0177 5.0177 5.0216 5.0216 6.8435 6.8435 7.6991 7.6991 7.7006 7.7006 8.2642 8.2642 8.3533 8.3533 9.0583 9.0583 9.5012 9.5012 9.8227 9.8227 9.8599 9.8599 9.9001 9.9001 9.9108 9.9108 9.9555 9.9555 9.9622 9.9622 14.5590 14.5590 k = 0.5000 0.5000 0.0444 ( 3216 PWs) bands (ev): -30.6684 -30.6684 -30.6478 -30.6478 -12.1159 -12.1159 -12.0982 -12.0982 -11.8189 -11.8189 -11.7349 -11.7349 -11.7255 -11.7255 -11.5252 -11.5252 -4.3159 -4.3159 -4.3063 -4.3063 2.7318 2.7318 2.9800 2.9800 4.2671 4.2671 4.9623 4.9623 5.0175 5.0175 5.0215 5.0215 6.8509 6.8509 7.6988 7.6988 7.7005 7.7005 8.2578 8.2578 8.3537 8.3537 8.9786 8.9786 9.5030 9.5030 9.8531 9.8531 9.8631 9.8631 9.9045 9.9045 9.9487 9.9487 9.9700 9.9700 9.9724 9.9724 14.5183 14.5183 k = 0.5000 0.5000 0.0555 ( 3216 PWs) bands (ev): -30.6682 -30.6682 -30.6480 -30.6480 -12.1155 -12.1155 -12.0980 -12.0980 -11.8181 -11.8181 -11.7358 -11.7358 -11.7238 -11.7238 -11.5277 -11.5277 -4.3157 -4.3157 -4.3063 -4.3063 2.7346 2.7346 2.9774 2.9774 4.2747 4.2747 4.9553 4.9553 5.0172 5.0172 5.0214 5.0214 6.8605 6.8605 7.6984 7.6984 7.7003 7.7003 8.2490 8.2490 8.3541 8.3541 8.8983 8.8983 9.5060 9.5060 9.8453 9.8453 9.8599 9.8599 9.8981 9.8981 9.9762 9.9762 9.9828 9.9828 10.0566 10.0566 14.4668 14.4668 k = 0.5000 0.5000 0.0666 ( 3216 PWs) bands (ev): -30.6679 -30.6679 -30.6483 -30.6483 -12.1150 -12.1150 -12.0978 -12.0978 -11.8170 -11.8170 -11.7369 -11.7369 -11.7217 -11.7217 -11.5308 -11.5308 -4.3155 -4.3155 -4.3063 -4.3063 2.7379 2.7379 2.9743 2.9743 4.2841 4.2841 4.9467 4.9467 5.0170 5.0170 5.0212 5.0212 6.8722 6.8722 7.6978 7.6978 7.7001 7.7001 8.2370 8.2370 8.3547 8.3547 8.8204 8.8204 9.5100 9.5100 9.8369 9.8369 9.8518 9.8518 9.8915 9.8915 9.9878 9.9878 9.9932 9.9932 10.1694 10.1694 14.4051 14.4051 k = 0.5000 0.5000 0.0777 ( 3208 PWs) bands (ev): -30.6676 -30.6676 -30.6486 -30.6486 -12.1144 -12.1144 -12.0976 -12.0976 -11.8157 -11.8157 -11.7381 -11.7381 -11.7192 -11.7192 -11.5343 -11.5343 -4.3153 -4.3153 -4.3064 -4.3064 2.7418 2.7418 2.9707 2.9707 4.2950 4.2950 4.9367 4.9367 5.0168 5.0168 5.0211 5.0211 6.8861 6.8861 7.6972 7.6972 7.6999 7.6999 8.2209 8.2209 8.3554 8.3554 8.7469 8.7469 9.5149 9.5149 9.8282 9.8282 9.8431 9.8431 9.8844 9.8844 9.9988 9.9988 10.0036 10.0036 10.2874 10.2874 14.3339 14.3339 k = 0.5000 0.5000 0.0888 ( 3208 PWs) bands (ev): -30.6672 -30.6672 -30.6490 -30.6490 -12.1137 -12.1137 -12.0973 -12.0973 -11.8143 -11.8143 -11.7395 -11.7395 -11.7164 -11.7164 -11.5383 -11.5383 -4.3150 -4.3150 -4.3065 -4.3065 2.7462 2.7462 2.9665 2.9665 4.3074 4.3074 4.9251 4.9251 5.0166 5.0166 5.0209 5.0209 6.9021 6.9021 7.6964 7.6964 7.6997 7.6997 8.1995 8.1995 8.3561 8.3561 8.6798 8.6798 9.5206 9.5206 9.8194 9.8194 9.8343 9.8343 9.8769 9.8769 10.0095 10.0095 10.0137 10.0137 10.4090 10.4090 14.2539 14.2539 k = 0.5000 0.5000 0.1000 ( 3216 PWs) bands (ev): -30.6669 -30.6669 -30.6494 -30.6494 -12.1131 -12.1131 -12.0971 -12.0971 -11.8128 -11.8128 -11.7411 -11.7411 -11.7132 -11.7132 -11.5428 -11.5428 -4.3147 -4.3147 -4.3066 -4.3066 2.7512 2.7512 2.9618 2.9618 4.3212 4.3212 4.9121 4.9121 5.0165 5.0165 5.0207 5.0207 6.9202 6.9202 7.6955 7.6955 7.6995 7.6995 8.1718 8.1718 8.3570 8.3570 8.6205 8.6205 9.5271 9.5271 9.8106 9.8106 9.8259 9.8259 9.8688 9.8688 10.0198 10.0198 10.0236 10.0236 10.5335 10.5335 14.1658 14.1658 k = 0.5000 0.5000 0.1111 ( 3208 PWs) bands (ev): -30.6664 -30.6664 -30.6498 -30.6498 -12.1123 -12.1123 -12.0969 -12.0969 -11.8110 -11.8110 -11.7428 -11.7428 -11.7096 -11.7096 -11.5476 -11.5476 -4.3144 -4.3144 -4.3067 -4.3067 2.7567 2.7567 2.9566 2.9566 4.3365 4.3365 4.8977 4.8977 5.0164 5.0164 5.0205 5.0205 6.9406 6.9406 7.6944 7.6944 7.6993 7.6993 8.1371 8.1371 8.3580 8.3580 8.5702 8.5702 9.5343 9.5343 9.8019 9.8019 9.8179 9.8179 9.8603 9.8603 10.0297 10.0297 10.0331 10.0331 10.6605 10.6605 14.0703 14.0703 k = 0.5000 0.5000 0.1222 ( 3196 PWs) bands (ev): -30.6659 -30.6659 -30.6503 -30.6503 -12.1114 -12.1114 -12.0967 -12.0967 -11.8090 -11.8090 -11.7447 -11.7447 -11.7056 -11.7056 -11.5529 -11.5529 -4.3141 -4.3141 -4.3068 -4.3068 2.7626 2.7626 2.9510 2.9510 4.3531 4.3531 4.8820 4.8820 5.0164 5.0164 5.0203 5.0203 6.9633 6.9633 7.6932 7.6932 7.6992 7.6992 8.0952 8.0952 8.3592 8.3592 8.5293 8.5293 9.5422 9.5422 9.7934 9.7934 9.8104 9.8104 9.8513 9.8513 10.0392 10.0392 10.0423 10.0423 10.7897 10.7897 13.9681 13.9681 k = 0.5000 0.5000 0.1333 ( 3196 PWs) bands (ev): -30.6654 -30.6654 -30.6508 -30.6508 -12.1105 -12.1105 -12.0966 -12.0966 -11.8069 -11.8069 -11.7467 -11.7467 -11.7013 -11.7013 -11.5586 -11.5586 -4.3137 -4.3137 -4.3069 -4.3069 2.7690 2.7690 2.9450 2.9450 4.3710 4.3710 4.8650 4.8650 5.0163 5.0163 5.0201 5.0201 6.9880 6.9880 7.6917 7.6917 7.6990 7.6990 8.0470 8.0470 8.3604 8.3604 8.4970 8.4970 9.5507 9.5507 9.7850 9.7850 9.8033 9.8033 9.8420 9.8420 10.0481 10.0481 10.0510 10.0510 10.9208 10.9208 13.8599 13.8599 k = 0.5000 0.5000 0.1444 ( 3196 PWs) bands (ev): -30.6649 -30.6649 -30.6513 -30.6513 -12.1096 -12.1096 -12.0965 -12.0965 -11.8046 -11.8046 -11.7489 -11.7489 -11.6967 -11.6967 -11.5646 -11.5646 -4.3134 -4.3134 -4.3070 -4.3070 2.7758 2.7758 2.9385 2.9385 4.3900 4.3900 4.8468 4.8468 5.0163 5.0163 5.0198 5.0198 7.0149 7.0149 7.6897 7.6897 7.6989 7.6989 7.9942 7.9942 8.3618 8.3618 8.4720 8.4720 9.5599 9.5599 9.7766 9.7766 9.7969 9.7969 9.8326 9.8326 10.0565 10.0565 10.0591 10.0591 11.0536 11.0536 13.7465 13.7465 k = 0.5000 0.5000 0.1555 ( 3196 PWs) bands (ev): -30.6643 -30.6643 -30.6519 -30.6519 -12.1086 -12.1086 -12.0965 -12.0965 -11.8022 -11.8022 -11.7512 -11.7512 -11.6917 -11.6917 -11.5710 -11.5710 -4.3130 -4.3130 -4.3072 -4.3072 2.7830 2.7830 2.9316 2.9316 4.4100 4.4100 4.8276 4.8276 5.0163 5.0163 5.0196 5.0196 7.0440 7.0440 7.6870 7.6870 7.6988 7.6988 7.9386 7.9386 8.3632 8.3632 8.4526 8.4526 9.5697 9.5697 9.7683 9.7683 9.7910 9.7910 9.8231 9.8231 10.0643 10.0643 10.0666 10.0666 11.1880 11.1880 13.6283 13.6283 k = 0.5000 0.5000 0.1666 ( 3184 PWs) bands (ev): -30.6637 -30.6637 -30.6525 -30.6525 -12.1076 -12.1076 -12.0965 -12.0965 -11.7996 -11.7996 -11.7536 -11.7536 -11.6864 -11.6864 -11.5776 -11.5776 -4.3126 -4.3126 -4.3074 -4.3074 2.7905 2.7905 2.9245 2.9245 4.4311 4.4311 4.8074 4.8074 5.0163 5.0163 5.0193 5.0193 7.0753 7.0753 7.6831 7.6831 7.6988 7.6988 7.8824 7.8824 8.3648 8.3648 8.4377 8.4377 9.5801 9.5801 9.7599 9.7599 9.7858 9.7858 9.8139 9.8139 10.0715 10.0715 10.0735 10.0735 11.3237 11.3237 13.5060 13.5060 k = 0.5000 0.5000 0.1777 ( 3184 PWs) bands (ev): -30.6630 -30.6630 -30.6532 -30.6532 -12.1066 -12.1066 -12.0967 -12.0967 -11.7969 -11.7969 -11.7561 -11.7561 -11.6809 -11.6809 -11.5844 -11.5844 -4.3122 -4.3122 -4.3076 -4.3076 2.7983 2.7983 2.9170 2.9170 4.4530 4.4530 4.7863 4.7863 5.0163 5.0163 5.0190 5.0190 7.1088 7.1088 7.6766 7.6766 7.6989 7.6989 7.8279 7.8279 8.3665 8.3665 8.4259 8.4259 9.5909 9.5909 9.7511 9.7511 9.7812 9.7812 9.8050 9.8050 10.0779 10.0779 10.0797 10.0797 11.4606 11.4606 13.3800 13.3800 k = 0.5000 0.5000 0.1888 ( 3176 PWs) bands (ev): -30.6624 -30.6624 -30.6538 -30.6538 -12.1056 -12.1056 -12.0969 -12.0969 -11.7942 -11.7942 -11.7588 -11.7588 -11.6749 -11.6749 -11.5914 -11.5914 -4.3119 -4.3119 -4.3078 -4.3078 2.8064 2.8064 2.9092 2.9092 4.4756 4.4756 4.7643 4.7643 5.0165 5.0165 5.0189 5.0189 7.1445 7.1445 7.6643 7.6643 7.6991 7.6991 7.7794 7.7794 8.3684 8.3684 8.4163 8.4163 9.6021 9.6021 9.7420 9.7420 9.7773 9.7773 9.7969 9.7969 10.0835 10.0835 10.0851 10.0851 11.5984 11.5984 13.2510 13.2510 k = 0.5000 0.5000 0.1999 ( 3176 PWs) bands (ev): -30.6617 -30.6617 -30.6545 -30.6545 -12.1046 -12.1046 -12.0972 -12.0972 -11.7913 -11.7913 -11.7615 -11.7615 -11.6688 -11.6688 -11.5985 -11.5985 -4.3115 -4.3115 -4.3080 -4.3080 2.8147 2.8147 2.9011 2.9011 4.4989 4.4989 4.7416 4.7416 5.0165 5.0165 5.0186 5.0186 7.1824 7.1824 7.6400 7.6400 7.6993 7.6993 7.7437 7.7437 8.3705 8.3705 8.4085 8.4085 9.6137 9.6137 9.7322 9.7322 9.7741 9.7741 9.7897 9.7897 10.0884 10.0884 10.0897 10.0897 11.7371 11.7371 13.1194 13.1194 k = 0.5000 0.5000 0.2110 ( 3168 PWs) bands (ev): -30.6610 -30.6610 -30.6552 -30.6552 -12.1037 -12.1037 -12.0976 -12.0976 -11.7884 -11.7884 -11.7643 -11.7643 -11.6623 -11.6623 -11.6058 -11.6058 -4.3111 -4.3111 -4.3082 -4.3082 2.8232 2.8232 2.8928 2.8928 4.5227 4.5227 4.7182 4.7182 5.0166 5.0166 5.0184 5.0184 7.2225 7.2225 7.6011 7.6011 7.6997 7.6997 7.7239 7.7239 8.3727 8.3727 8.4021 8.4021 9.6256 9.6256 9.7218 9.7218 9.7717 9.7717 9.7835 9.7835 10.0925 10.0925 10.0936 10.0936 11.8764 11.8764 12.9855 12.9855 k = 0.5000 0.5000 0.2221 ( 3168 PWs) bands (ev): -30.6603 -30.6603 -30.6559 -30.6559 -12.1027 -12.1027 -12.0981 -12.0981 -11.7854 -11.7854 -11.7672 -11.7672 -11.6556 -11.6556 -11.6131 -11.6131 -4.3107 -4.3107 -4.3085 -4.3085 2.8319 2.8319 2.8843 2.8843 4.5469 4.5469 4.6944 4.6944 5.0167 5.0167 5.0182 5.0182 7.2647 7.2647 7.5535 7.5535 7.7003 7.7003 7.7141 7.7141 8.3751 8.3751 8.3966 8.3966 9.6378 9.6378 9.7108 9.7108 9.7700 9.7700 9.7785 9.7785 10.0957 10.0957 10.0965 10.0965 12.0161 12.0161 12.8498 12.8498 k = 0.5000 0.5000 0.2332 ( 3160 PWs) bands (ev): -30.6595 -30.6595 -30.6566 -30.6566 -12.1018 -12.1018 -12.0987 -12.0987 -11.7823 -11.7823 -11.7702 -11.7702 -11.6488 -11.6488 -11.6204 -11.6204 -4.3104 -4.3104 -4.3087 -4.3087 2.8406 2.8406 2.8758 2.8758 4.5715 4.5715 4.6702 4.6702 5.0168 5.0168 5.0181 5.0181 7.3088 7.3088 7.5032 7.5032 7.7010 7.7010 7.7089 7.7089 8.3778 8.3778 8.3919 8.3919 9.6502 9.6502 9.6993 9.6993 9.7691 9.7691 9.7746 9.7746 10.0980 10.0980 10.0987 10.0987 12.1560 12.1560 12.7128 12.7128 k = 0.5000 0.5000 0.2443 ( 3160 PWs) bands (ev): -30.6588 -30.6588 -30.6573 -30.6573 -12.1009 -12.1009 -12.0993 -12.0993 -11.7793 -11.7793 -11.7732 -11.7732 -11.6418 -11.6418 -11.6277 -11.6277 -4.3102 -4.3102 -4.3090 -4.3090 2.8494 2.8494 2.8671 2.8671 4.5962 4.5962 4.6457 4.6457 5.0169 5.0169 5.0179 5.0179 7.3550 7.3550 7.4527 7.4527 7.7021 7.7021 7.7058 7.7058 8.3807 8.3807 8.3878 8.3878 9.6626 9.6626 9.6873 9.6873 9.7691 9.7691 9.7718 9.7718 10.0995 10.0995 10.0999 10.0999 12.2959 12.2959 12.5745 12.5745 k = 0.5000 0.5000 0.2554 ( 3176 PWs) bands (ev): -30.6581 -30.6581 -30.6581 -30.6581 -12.1001 -12.1001 -12.1001 -12.1001 -11.7763 -11.7763 -11.7763 -11.7763 -11.6349 -11.6349 -11.6349 -11.6349 -4.3101 -4.3101 -4.3091 -4.3091 2.8577 2.8577 2.8588 2.8588 4.6204 4.6204 4.6214 4.6214 5.0168 5.0168 5.0178 5.0178 7.4026 7.4026 7.4034 7.4034 7.7029 7.7029 7.7040 7.7040 8.3834 8.3834 8.3846 8.3846 9.6745 9.6745 9.6756 9.6756 9.7697 9.7697 9.7702 9.7702 10.0999 10.0999 10.1003 10.1003 12.4353 12.4353 12.4356 12.4356 Writing output data file CaNiN.save init_run : 0.31s CPU 0.68s WALL ( 1 calls) electrons : 280.69s CPU 287.05s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.14s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 280.68s CPU 287.04s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.06s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.08s WALL ( 380 calls) cegterg : 266.23s CPU 270.34s WALL ( 867 calls) Called by sum_band: Called by *egterg: h_psi : 112.62s CPU 115.42s WALL ( 15980 calls) s_psi : 10.73s CPU 10.72s WALL ( 15980 calls) g_psi : 0.33s CPU 0.38s WALL ( 14733 calls) cdiaghg : 126.68s CPU 128.08s WALL ( 15113 calls) cegterg:over : 10.42s CPU 10.42s WALL ( 14733 calls) cegterg:upda : 8.37s CPU 8.67s WALL ( 14733 calls) cegterg:last : 4.36s CPU 4.60s WALL ( 2110 calls) cdiaghg:chol : 6.91s CPU 7.02s WALL ( 15113 calls) cdiaghg:inve : 4.92s CPU 4.85s WALL ( 15113 calls) cdiaghg:para : 7.73s CPU 7.99s WALL ( 30226 calls) Called by h_psi: h_psi:vloc : 88.95s CPU 91.50s WALL ( 15980 calls) h_psi:vnl : 23.22s CPU 23.55s WALL ( 15980 calls) add_vuspsi : 12.32s CPU 12.80s WALL ( 15980 calls) General routines calbec : 10.86s CPU 10.70s WALL ( 15980 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 82.64s CPU 85.10s WALL ( 1509592 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.18s CPU 0.28s WALL ( 760 calls) Parallel routines fft_scatter : 35.12s CPU 35.85s WALL ( 1509615 calls) PWSCF : 4m59.58s CPU 5m36.41s WALL This run was terminated on: 16:34:53 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=