Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16: 4: 4 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: ./InBrO.save/ file In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D renormalized file Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 37 23 6 2333 1117 178 Max 39 24 7 2344 1142 187 Sum 1349 837 251 84057 40761 6663 bravais-lattice index = 14 lattice parameter (alat) = 6.8238 a.u. unit-cell volume = 853.3706 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.823801 celldm(2)= 1.121296 celldm(3)= 2.395181 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 1.121296 0.000000 ) a(3) = ( 0.000000 0.000000 2.395181 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.891825 -0.000000 ) b(3) = ( 0.000000 0.000000 0.417505 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for In read from file: /users/gautes/Pseudo/In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 52ff8a85f9af3f41268f91f861ab85bf Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1241 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Br read from file: /users/gautes/Pseudo/Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5d639767687de88634f0d235e6526498 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1213 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) In 13.00 114.81800 In( 1.00) Br 7.00 79.90400 Br( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) (note: 4 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [1,0,0] -C2 -2 180 deg rotation - cart. axis [1,0,0] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [1,0,0] -s_h -4 inv. 180 deg rotation - cart. axis [1,0,0] E Cartesian axes number of k points= 420 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 2) = ( 0.0113636 -0.0000000 -0.0000000), wk = 0.0023810 k( 3) = ( 0.0227273 -0.0000000 -0.0000000), wk = 0.0023810 k( 4) = ( 0.0340909 -0.0000000 -0.0000000), wk = 0.0023810 k( 5) = ( 0.0454546 -0.0000000 -0.0000000), wk = 0.0023810 k( 6) = ( 0.0568182 -0.0000000 -0.0000000), wk = 0.0023810 k( 7) = ( 0.0681818 -0.0000000 -0.0000000), wk = 0.0023810 k( 8) = ( 0.0795455 -0.0000000 -0.0000000), wk = 0.0023810 k( 9) = ( 0.0909091 -0.0000000 -0.0000000), wk = 0.0023810 k( 10) = ( 0.1022727 -0.0000000 -0.0000000), wk = 0.0023810 k( 11) = ( 0.1136364 -0.0000000 -0.0000000), wk = 0.0023810 k( 12) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0023810 k( 13) = ( 0.1363636 -0.0000000 -0.0000000), wk = 0.0023810 k( 14) = ( 0.1477273 -0.0000000 -0.0000000), wk = 0.0023810 k( 15) = ( 0.1590909 -0.0000000 -0.0000000), wk = 0.0023810 k( 16) = ( 0.1704546 -0.0000000 -0.0000000), wk = 0.0023810 k( 17) = ( 0.1818182 -0.0000000 -0.0000000), wk = 0.0023810 k( 18) = ( 0.1931818 -0.0000000 -0.0000000), wk = 0.0023810 k( 19) = ( 0.2045454 -0.0000000 -0.0000000), wk = 0.0023810 k( 20) = ( 0.2159091 -0.0000000 -0.0000000), wk = 0.0023810 k( 21) = ( 0.2272727 -0.0000000 -0.0000000), wk = 0.0023810 k( 22) = ( 0.2386364 -0.0000000 -0.0000000), wk = 0.0023810 k( 23) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0023810 k( 24) = ( 0.2613636 -0.0000000 -0.0000000), wk = 0.0023810 k( 25) = ( 0.2727273 -0.0000000 -0.0000000), wk = 0.0023810 k( 26) = ( 0.2840909 -0.0000000 -0.0000000), wk = 0.0023810 k( 27) = ( 0.2954545 -0.0000000 -0.0000000), wk = 0.0023810 k( 28) = ( 0.3068182 -0.0000000 -0.0000000), wk = 0.0023810 k( 29) = ( 0.3181818 -0.0000000 -0.0000000), wk = 0.0023810 k( 30) = ( 0.3295455 -0.0000000 -0.0000000), wk = 0.0023810 k( 31) = ( 0.3409091 -0.0000000 -0.0000000), wk = 0.0023810 k( 32) = ( 0.3522727 -0.0000000 -0.0000000), wk = 0.0023810 k( 33) = ( 0.3636364 -0.0000000 -0.0000000), wk = 0.0023810 k( 34) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0023810 k( 35) = ( 0.3863636 -0.0000000 -0.0000000), wk = 0.0023810 k( 36) = ( 0.3977273 -0.0000000 -0.0000000), wk = 0.0023810 k( 37) = ( 0.4090909 -0.0000000 -0.0000000), wk = 0.0023810 k( 38) = ( 0.4204545 -0.0000000 -0.0000000), wk = 0.0023810 k( 39) = ( 0.4318182 -0.0000000 -0.0000000), wk = 0.0023810 k( 40) = ( 0.4431818 -0.0000000 -0.0000000), wk = 0.0023810 k( 41) = ( 0.4545455 -0.0000000 -0.0000000), wk = 0.0023810 k( 42) = ( 0.4659091 -0.0000000 -0.0000000), wk = 0.0023810 k( 43) = ( 0.4772727 -0.0000000 -0.0000000), wk = 0.0023810 k( 44) = ( 0.4886364 -0.0000000 -0.0000000), wk = 0.0023810 k( 45) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023810 k( 46) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023810 k( 47) = ( 0.5000000 0.0114337 -0.0000000), wk = 0.0023810 k( 48) = ( 0.5000000 0.0228673 -0.0000000), wk = 0.0023810 k( 49) = ( 0.5000000 0.0343010 -0.0000000), wk = 0.0023810 k( 50) = ( 0.5000000 0.0457346 -0.0000000), wk = 0.0023810 k( 51) = ( 0.5000000 0.0571683 -0.0000000), wk = 0.0023810 k( 52) = ( 0.5000000 0.0686019 -0.0000000), wk = 0.0023810 k( 53) = ( 0.5000000 0.0800356 -0.0000000), wk = 0.0023810 k( 54) = ( 0.5000000 0.0914692 -0.0000000), wk = 0.0023810 k( 55) = ( 0.5000000 0.1029029 -0.0000000), wk = 0.0023810 k( 56) = ( 0.5000000 0.1143366 -0.0000000), wk = 0.0023810 k( 57) = ( 0.5000000 0.1257702 -0.0000000), wk = 0.0023810 k( 58) = ( 0.5000000 0.1372039 -0.0000000), wk = 0.0023810 k( 59) = ( 0.5000000 0.1486375 -0.0000000), wk = 0.0023810 k( 60) = ( 0.5000000 0.1600712 -0.0000000), wk = 0.0023810 k( 61) = ( 0.5000000 0.1715048 -0.0000000), wk = 0.0023810 k( 62) = ( 0.5000000 0.1829385 -0.0000000), wk = 0.0023810 k( 63) = ( 0.5000000 0.1943721 -0.0000000), wk = 0.0023810 k( 64) = ( 0.5000000 0.2058058 -0.0000000), wk = 0.0023810 k( 65) = ( 0.5000000 0.2172395 -0.0000000), wk = 0.0023810 k( 66) = ( 0.5000000 0.2286731 -0.0000000), wk = 0.0023810 k( 67) = ( 0.5000000 0.2401068 -0.0000000), wk = 0.0023810 k( 68) = ( 0.5000000 0.2515404 -0.0000000), wk = 0.0023810 k( 69) = ( 0.5000000 0.2629741 -0.0000000), wk = 0.0023810 k( 70) = ( 0.5000000 0.2744077 -0.0000000), wk = 0.0023810 k( 71) = ( 0.5000000 0.2858414 -0.0000000), wk = 0.0023810 k( 72) = ( 0.5000000 0.2972750 -0.0000000), wk = 0.0023810 k( 73) = ( 0.5000000 0.3087087 -0.0000000), wk = 0.0023810 k( 74) = ( 0.5000000 0.3201424 -0.0000000), wk = 0.0023810 k( 75) = ( 0.5000000 0.3315760 -0.0000000), wk = 0.0023810 k( 76) = ( 0.5000000 0.3430097 -0.0000000), wk = 0.0023810 k( 77) = ( 0.5000000 0.3544433 -0.0000000), wk = 0.0023810 k( 78) = ( 0.5000000 0.3658770 -0.0000000), wk = 0.0023810 k( 79) = ( 0.5000000 0.3773106 -0.0000000), wk = 0.0023810 k( 80) = ( 0.5000000 0.3887443 -0.0000000), wk = 0.0023810 k( 81) = ( 0.5000000 0.4001779 -0.0000000), wk = 0.0023810 k( 82) = ( 0.5000000 0.4116116 -0.0000000), wk = 0.0023810 k( 83) = ( 0.5000000 0.4230453 -0.0000000), wk = 0.0023810 k( 84) = ( 0.5000000 0.4344789 -0.0000000), wk = 0.0023810 k( 85) = ( 0.5000000 0.4459126 -0.0000000), wk = 0.0023810 k( 86) = ( 0.5000000 0.4459126 -0.0000000), wk = 0.0023810 k( 87) = ( 0.4886364 0.4459126 -0.0000000), wk = 0.0023810 k( 88) = ( 0.4772727 0.4459126 -0.0000000), wk = 0.0023810 k( 89) = ( 0.4659091 0.4459126 -0.0000000), wk = 0.0023810 k( 90) = ( 0.4545455 0.4459126 -0.0000000), wk = 0.0023810 k( 91) = ( 0.4431818 0.4459126 -0.0000000), wk = 0.0023810 k( 92) = ( 0.4318182 0.4459126 -0.0000000), wk = 0.0023810 k( 93) = ( 0.4204545 0.4459126 -0.0000000), wk = 0.0023810 k( 94) = ( 0.4090909 0.4459126 -0.0000000), wk = 0.0023810 k( 95) = ( 0.3977273 0.4459126 -0.0000000), wk = 0.0023810 k( 96) = ( 0.3863636 0.4459126 -0.0000000), wk = 0.0023810 k( 97) = ( 0.3750000 0.4459126 -0.0000000), wk = 0.0023810 k( 98) = ( 0.3636364 0.4459126 -0.0000000), wk = 0.0023810 k( 99) = ( 0.3522727 0.4459126 -0.0000000), wk = 0.0023810 k( 100) = ( 0.3409091 0.4459126 -0.0000000), wk = 0.0023810 k( 101) = ( 0.3295455 0.4459126 -0.0000000), wk = 0.0023810 k( 102) = ( 0.3181818 0.4459126 -0.0000000), wk = 0.0023810 k( 103) = ( 0.3068182 0.4459126 -0.0000000), wk = 0.0023810 k( 104) = ( 0.2954545 0.4459126 -0.0000000), wk = 0.0023810 k( 105) = ( 0.2840909 0.4459126 -0.0000000), wk = 0.0023810 k( 106) = ( 0.2727273 0.4459126 -0.0000000), wk = 0.0023810 k( 107) = ( 0.2613636 0.4459126 -0.0000000), wk = 0.0023810 k( 108) = ( 0.2500000 0.4459126 -0.0000000), wk = 0.0023810 k( 109) = ( 0.2386364 0.4459126 -0.0000000), wk = 0.0023810 k( 110) = ( 0.2272727 0.4459126 -0.0000000), wk = 0.0023810 k( 111) = ( 0.2159091 0.4459126 -0.0000000), wk = 0.0023810 k( 112) = ( 0.2045454 0.4459126 -0.0000000), wk = 0.0023810 k( 113) = ( 0.1931818 0.4459126 -0.0000000), wk = 0.0023810 k( 114) = ( 0.1818182 0.4459126 -0.0000000), wk = 0.0023810 k( 115) = ( 0.1704546 0.4459126 -0.0000000), wk = 0.0023810 k( 116) = ( 0.1590909 0.4459126 -0.0000000), wk = 0.0023810 k( 117) = ( 0.1477273 0.4459126 -0.0000000), wk = 0.0023810 k( 118) = ( 0.1363636 0.4459126 -0.0000000), wk = 0.0023810 k( 119) = ( 0.1250000 0.4459126 -0.0000000), wk = 0.0023810 k( 120) = ( 0.1136364 0.4459126 -0.0000000), wk = 0.0023810 k( 121) = ( 0.1022727 0.4459126 -0.0000000), wk = 0.0023810 k( 122) = ( 0.0909091 0.4459126 -0.0000000), wk = 0.0023810 k( 123) = ( 0.0795455 0.4459126 -0.0000000), wk = 0.0023810 k( 124) = ( 0.0681818 0.4459126 -0.0000000), wk = 0.0023810 k( 125) = ( 0.0568182 0.4459126 -0.0000000), wk = 0.0023810 k( 126) = ( 0.0454546 0.4459126 -0.0000000), wk = 0.0023810 k( 127) = ( 0.0340909 0.4459126 -0.0000000), wk = 0.0023810 k( 128) = ( 0.0227273 0.4459126 -0.0000000), wk = 0.0023810 k( 129) = ( 0.0113636 0.4459126 -0.0000000), wk = 0.0023810 k( 130) = ( 0.0000000 0.4459126 -0.0000000), wk = 0.0023810 k( 131) = ( 0.0000000 0.4459126 -0.0000000), wk = 0.0023810 k( 132) = ( 0.0000000 0.4344789 -0.0000000), wk = 0.0023810 k( 133) = ( 0.0000000 0.4230453 -0.0000000), wk = 0.0023810 k( 134) = ( 0.0000000 0.4116116 -0.0000000), wk = 0.0023810 k( 135) = ( 0.0000000 0.4001779 -0.0000000), wk = 0.0023810 k( 136) = ( 0.0000000 0.3887443 -0.0000000), wk = 0.0023810 k( 137) = ( 0.0000000 0.3773106 -0.0000000), wk = 0.0023810 k( 138) = ( 0.0000000 0.3658770 -0.0000000), wk = 0.0023810 k( 139) = ( 0.0000000 0.3544433 -0.0000000), wk = 0.0023810 k( 140) = ( 0.0000000 0.3430097 -0.0000000), wk = 0.0023810 k( 141) = ( 0.0000000 0.3315760 -0.0000000), wk = 0.0023810 k( 142) = ( 0.0000000 0.3201424 -0.0000000), wk = 0.0023810 k( 143) = ( 0.0000000 0.3087087 -0.0000000), wk = 0.0023810 k( 144) = ( 0.0000000 0.2972750 -0.0000000), wk = 0.0023810 k( 145) = ( 0.0000000 0.2858414 -0.0000000), wk = 0.0023810 k( 146) = ( 0.0000000 0.2744077 -0.0000000), wk = 0.0023810 k( 147) = ( 0.0000000 0.2629741 -0.0000000), wk = 0.0023810 k( 148) = ( 0.0000000 0.2515404 -0.0000000), wk = 0.0023810 k( 149) = ( 0.0000000 0.2401068 -0.0000000), wk = 0.0023810 k( 150) = ( 0.0000000 0.2286731 -0.0000000), wk = 0.0023810 k( 151) = ( 0.0000000 0.2172395 -0.0000000), wk = 0.0023810 k( 152) = ( 0.0000000 0.2058058 -0.0000000), wk = 0.0023810 k( 153) = ( 0.0000000 0.1943721 -0.0000000), wk = 0.0023810 k( 154) = ( 0.0000000 0.1829385 -0.0000000), wk = 0.0023810 k( 155) = ( 0.0000000 0.1715048 -0.0000000), wk = 0.0023810 k( 156) = ( 0.0000000 0.1600712 -0.0000000), wk = 0.0023810 k( 157) = ( 0.0000000 0.1486375 -0.0000000), wk = 0.0023810 k( 158) = ( 0.0000000 0.1372039 -0.0000000), wk = 0.0023810 k( 159) = ( 0.0000000 0.1257702 -0.0000000), wk = 0.0023810 k( 160) = ( 0.0000000 0.1143366 -0.0000000), wk = 0.0023810 k( 161) = ( 0.0000000 0.1029029 -0.0000000), wk = 0.0023810 k( 162) = ( 0.0000000 0.0914692 -0.0000000), wk = 0.0023810 k( 163) = ( 0.0000000 0.0800356 -0.0000000), wk = 0.0023810 k( 164) = ( 0.0000000 0.0686019 -0.0000000), wk = 0.0023810 k( 165) = ( 0.0000000 0.0571683 -0.0000000), wk = 0.0023810 k( 166) = ( 0.0000000 0.0457346 -0.0000000), wk = 0.0023810 k( 167) = ( 0.0000000 0.0343010 -0.0000000), wk = 0.0023810 k( 168) = ( 0.0000000 0.0228673 -0.0000000), wk = 0.0023810 k( 169) = ( 0.0000000 0.0114337 -0.0000000), wk = 0.0023810 k( 170) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 171) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 172) = ( 0.0000000 0.0000000 0.0109870), wk = 0.0023810 k( 173) = ( 0.0000000 0.0000000 0.0219739), wk = 0.0023810 k( 174) = ( 0.0000000 0.0000000 0.0329609), wk = 0.0023810 k( 175) = ( 0.0000000 0.0000000 0.0439479), wk = 0.0023810 k( 176) = ( 0.0000000 0.0000000 0.0549349), wk = 0.0023810 k( 177) = ( 0.0000000 0.0000000 0.0659218), wk = 0.0023810 k( 178) = ( 0.0000000 0.0000000 0.0769088), wk = 0.0023810 k( 179) = ( 0.0000000 0.0000000 0.0878958), wk = 0.0023810 k( 180) = ( 0.0000000 0.0000000 0.0988827), wk = 0.0023810 k( 181) = ( 0.0000000 0.0000000 0.1098697), wk = 0.0023810 k( 182) = ( 0.0000000 0.0000000 0.1208567), wk = 0.0023810 k( 183) = ( 0.0000000 0.0000000 0.1318437), wk = 0.0023810 k( 184) = ( 0.0000000 0.0000000 0.1428306), wk = 0.0023810 k( 185) = ( 0.0000000 0.0000000 0.1538176), wk = 0.0023810 k( 186) = ( 0.0000000 0.0000000 0.1648046), wk = 0.0023810 k( 187) = ( 0.0000000 0.0000000 0.1757915), wk = 0.0023810 k( 188) = ( 0.0000000 0.0000000 0.1867785), wk = 0.0023810 k( 189) = ( 0.0000000 0.0000000 0.1977655), wk = 0.0023810 k( 190) = ( 0.0000000 0.0000000 0.2087525), wk = 0.0023810 k( 191) = ( 0.0000000 0.0000000 0.2087525), wk = 0.0023810 k( 192) = ( 0.0113636 -0.0000000 0.2087525), wk = 0.0023810 k( 193) = ( 0.0227273 -0.0000000 0.2087525), wk = 0.0023810 k( 194) = ( 0.0340909 -0.0000000 0.2087525), wk = 0.0023810 k( 195) = ( 0.0454546 -0.0000000 0.2087525), wk = 0.0023810 k( 196) = ( 0.0568182 -0.0000000 0.2087525), wk = 0.0023810 k( 197) = ( 0.0681818 -0.0000000 0.2087525), wk = 0.0023810 k( 198) = ( 0.0795455 -0.0000000 0.2087525), wk = 0.0023810 k( 199) = ( 0.0909091 -0.0000000 0.2087525), wk = 0.0023810 k( 200) = ( 0.1022727 -0.0000000 0.2087525), wk = 0.0023810 k( 201) = ( 0.1136364 -0.0000000 0.2087525), wk = 0.0023810 k( 202) = ( 0.1250000 -0.0000000 0.2087525), wk = 0.0023810 k( 203) = ( 0.1363636 -0.0000000 0.2087525), wk = 0.0023810 k( 204) = ( 0.1477273 -0.0000000 0.2087525), wk = 0.0023810 k( 205) = ( 0.1590909 -0.0000000 0.2087525), wk = 0.0023810 k( 206) = ( 0.1704546 -0.0000000 0.2087525), wk = 0.0023810 k( 207) = ( 0.1818182 -0.0000000 0.2087525), wk = 0.0023810 k( 208) = ( 0.1931818 -0.0000000 0.2087525), wk = 0.0023810 k( 209) = ( 0.2045454 -0.0000000 0.2087525), wk = 0.0023810 k( 210) = ( 0.2159091 -0.0000000 0.2087525), wk = 0.0023810 k( 211) = ( 0.2272727 -0.0000000 0.2087525), wk = 0.0023810 k( 212) = ( 0.2386364 -0.0000000 0.2087525), wk = 0.0023810 k( 213) = ( 0.2500000 -0.0000000 0.2087525), wk = 0.0023810 k( 214) = ( 0.2613636 -0.0000000 0.2087525), wk = 0.0023810 k( 215) = ( 0.2727273 -0.0000000 0.2087525), wk = 0.0023810 k( 216) = ( 0.2840909 -0.0000000 0.2087525), wk = 0.0023810 k( 217) = ( 0.2954545 -0.0000000 0.2087525), wk = 0.0023810 k( 218) = ( 0.3068182 -0.0000000 0.2087525), wk = 0.0023810 k( 219) = ( 0.3181818 -0.0000000 0.2087525), wk = 0.0023810 k( 220) = ( 0.3295455 -0.0000000 0.2087525), wk = 0.0023810 k( 221) = ( 0.3409091 -0.0000000 0.2087525), wk = 0.0023810 k( 222) = ( 0.3522727 -0.0000000 0.2087525), wk = 0.0023810 k( 223) = ( 0.3636364 -0.0000000 0.2087525), wk = 0.0023810 k( 224) = ( 0.3750000 -0.0000000 0.2087525), wk = 0.0023810 k( 225) = ( 0.3863636 -0.0000000 0.2087525), wk = 0.0023810 k( 226) = ( 0.3977273 -0.0000000 0.2087525), wk = 0.0023810 k( 227) = ( 0.4090909 -0.0000000 0.2087525), wk = 0.0023810 k( 228) = ( 0.4204545 -0.0000000 0.2087525), wk = 0.0023810 k( 229) = ( 0.4318182 -0.0000000 0.2087525), wk = 0.0023810 k( 230) = ( 0.4431818 -0.0000000 0.2087525), wk = 0.0023810 k( 231) = ( 0.4545455 -0.0000000 0.2087525), wk = 0.0023810 k( 232) = ( 0.4659091 -0.0000000 0.2087525), wk = 0.0023810 k( 233) = ( 0.4772727 -0.0000000 0.2087525), wk = 0.0023810 k( 234) = ( 0.4886364 -0.0000000 0.2087525), wk = 0.0023810 k( 235) = ( 0.5000000 -0.0000000 0.2087525), wk = 0.0023810 k( 236) = ( 0.5000000 -0.0000000 0.2087525), wk = 0.0023810 k( 237) = ( 0.5000000 0.0114337 0.2087525), wk = 0.0023810 k( 238) = ( 0.5000000 0.0228673 0.2087525), wk = 0.0023810 k( 239) = ( 0.5000000 0.0343010 0.2087525), wk = 0.0023810 k( 240) = ( 0.5000000 0.0457346 0.2087525), wk = 0.0023810 k( 241) = ( 0.5000000 0.0571683 0.2087525), wk = 0.0023810 k( 242) = ( 0.5000000 0.0686019 0.2087525), wk = 0.0023810 k( 243) = ( 0.5000000 0.0800356 0.2087525), wk = 0.0023810 k( 244) = ( 0.5000000 0.0914692 0.2087525), wk = 0.0023810 k( 245) = ( 0.5000000 0.1029029 0.2087525), wk = 0.0023810 k( 246) = ( 0.5000000 0.1143366 0.2087525), wk = 0.0023810 k( 247) = ( 0.5000000 0.1257702 0.2087525), wk = 0.0023810 k( 248) = ( 0.5000000 0.1372039 0.2087525), wk = 0.0023810 k( 249) = ( 0.5000000 0.1486375 0.2087525), wk = 0.0023810 k( 250) = ( 0.5000000 0.1600712 0.2087525), wk = 0.0023810 k( 251) = ( 0.5000000 0.1715048 0.2087525), wk = 0.0023810 k( 252) = ( 0.5000000 0.1829385 0.2087525), wk = 0.0023810 k( 253) = ( 0.5000000 0.1943721 0.2087525), wk = 0.0023810 k( 254) = ( 0.5000000 0.2058058 0.2087525), wk = 0.0023810 k( 255) = ( 0.5000000 0.2172395 0.2087525), wk = 0.0023810 k( 256) = ( 0.5000000 0.2286731 0.2087525), wk = 0.0023810 k( 257) = ( 0.5000000 0.2401068 0.2087525), wk = 0.0023810 k( 258) = ( 0.5000000 0.2515404 0.2087525), wk = 0.0023810 k( 259) = ( 0.5000000 0.2629741 0.2087525), wk = 0.0023810 k( 260) = ( 0.5000000 0.2744077 0.2087525), wk = 0.0023810 k( 261) = ( 0.5000000 0.2858414 0.2087525), wk = 0.0023810 k( 262) = ( 0.5000000 0.2972750 0.2087525), wk = 0.0023810 k( 263) = ( 0.5000000 0.3087087 0.2087525), wk = 0.0023810 k( 264) = ( 0.5000000 0.3201424 0.2087525), wk = 0.0023810 k( 265) = ( 0.5000000 0.3315760 0.2087525), wk = 0.0023810 k( 266) = ( 0.5000000 0.3430097 0.2087525), wk = 0.0023810 k( 267) = ( 0.5000000 0.3544433 0.2087525), wk = 0.0023810 k( 268) = ( 0.5000000 0.3658770 0.2087525), wk = 0.0023810 k( 269) = ( 0.5000000 0.3773106 0.2087525), wk = 0.0023810 k( 270) = ( 0.5000000 0.3887443 0.2087525), wk = 0.0023810 k( 271) = ( 0.5000000 0.4001779 0.2087525), wk = 0.0023810 k( 272) = ( 0.5000000 0.4116116 0.2087525), wk = 0.0023810 k( 273) = ( 0.5000000 0.4230453 0.2087525), wk = 0.0023810 k( 274) = ( 0.5000000 0.4344789 0.2087525), wk = 0.0023810 k( 275) = ( 0.5000000 0.4459126 0.2087525), wk = 0.0023810 k( 276) = ( 0.5000000 0.4459126 0.2087525), wk = 0.0023810 k( 277) = ( 0.4886364 0.4459126 0.2087525), wk = 0.0023810 k( 278) = ( 0.4772727 0.4459126 0.2087525), wk = 0.0023810 k( 279) = ( 0.4659091 0.4459126 0.2087525), wk = 0.0023810 k( 280) = ( 0.4545455 0.4459126 0.2087525), wk = 0.0023810 k( 281) = ( 0.4431818 0.4459126 0.2087525), wk = 0.0023810 k( 282) = ( 0.4318182 0.4459126 0.2087525), wk = 0.0023810 k( 283) = ( 0.4204545 0.4459126 0.2087525), wk = 0.0023810 k( 284) = ( 0.4090909 0.4459126 0.2087525), wk = 0.0023810 k( 285) = ( 0.3977273 0.4459126 0.2087525), wk = 0.0023810 k( 286) = ( 0.3863636 0.4459126 0.2087525), wk = 0.0023810 k( 287) = ( 0.3750000 0.4459126 0.2087525), wk = 0.0023810 k( 288) = ( 0.3636364 0.4459126 0.2087525), wk = 0.0023810 k( 289) = ( 0.3522727 0.4459126 0.2087525), wk = 0.0023810 k( 290) = ( 0.3409091 0.4459126 0.2087525), wk = 0.0023810 k( 291) = ( 0.3295455 0.4459126 0.2087525), wk = 0.0023810 k( 292) = ( 0.3181818 0.4459126 0.2087525), wk = 0.0023810 k( 293) = ( 0.3068182 0.4459126 0.2087525), wk = 0.0023810 k( 294) = ( 0.2954545 0.4459126 0.2087525), wk = 0.0023810 k( 295) = ( 0.2840909 0.4459126 0.2087525), wk = 0.0023810 k( 296) = ( 0.2727273 0.4459126 0.2087525), wk = 0.0023810 k( 297) = ( 0.2613636 0.4459126 0.2087525), wk = 0.0023810 k( 298) = ( 0.2500000 0.4459126 0.2087525), wk = 0.0023810 k( 299) = ( 0.2386364 0.4459126 0.2087525), wk = 0.0023810 k( 300) = ( 0.2272727 0.4459126 0.2087525), wk = 0.0023810 k( 301) = ( 0.2159091 0.4459126 0.2087525), wk = 0.0023810 k( 302) = ( 0.2045454 0.4459126 0.2087525), wk = 0.0023810 k( 303) = ( 0.1931818 0.4459126 0.2087525), wk = 0.0023810 k( 304) = ( 0.1818182 0.4459126 0.2087525), wk = 0.0023810 k( 305) = ( 0.1704546 0.4459126 0.2087525), wk = 0.0023810 k( 306) = ( 0.1590909 0.4459126 0.2087525), wk = 0.0023810 k( 307) = ( 0.1477273 0.4459126 0.2087525), wk = 0.0023810 k( 308) = ( 0.1363636 0.4459126 0.2087525), wk = 0.0023810 k( 309) = ( 0.1250000 0.4459126 0.2087525), wk = 0.0023810 k( 310) = ( 0.1136364 0.4459126 0.2087525), wk = 0.0023810 k( 311) = ( 0.1022727 0.4459126 0.2087525), wk = 0.0023810 k( 312) = ( 0.0909091 0.4459126 0.2087525), wk = 0.0023810 k( 313) = ( 0.0795455 0.4459126 0.2087525), wk = 0.0023810 k( 314) = ( 0.0681818 0.4459126 0.2087525), wk = 0.0023810 k( 315) = ( 0.0568182 0.4459126 0.2087525), wk = 0.0023810 k( 316) = ( 0.0454546 0.4459126 0.2087525), wk = 0.0023810 k( 317) = ( 0.0340909 0.4459126 0.2087525), wk = 0.0023810 k( 318) = ( 0.0227273 0.4459126 0.2087525), wk = 0.0023810 k( 319) = ( 0.0113636 0.4459126 0.2087525), wk = 0.0023810 k( 320) = ( 0.0000000 0.4459126 0.2087525), wk = 0.0023810 k( 321) = ( 0.0000000 0.4459126 0.2087525), wk = 0.0023810 k( 322) = ( 0.0000000 0.4344789 0.2087525), wk = 0.0023810 k( 323) = ( 0.0000000 0.4230453 0.2087525), wk = 0.0023810 k( 324) = ( 0.0000000 0.4116116 0.2087525), wk = 0.0023810 k( 325) = ( 0.0000000 0.4001779 0.2087525), wk = 0.0023810 k( 326) = ( 0.0000000 0.3887443 0.2087525), wk = 0.0023810 k( 327) = ( 0.0000000 0.3773106 0.2087525), wk = 0.0023810 k( 328) = ( 0.0000000 0.3658770 0.2087525), wk = 0.0023810 k( 329) = ( 0.0000000 0.3544433 0.2087525), wk = 0.0023810 k( 330) = ( 0.0000000 0.3430097 0.2087525), wk = 0.0023810 k( 331) = ( 0.0000000 0.3315760 0.2087525), wk = 0.0023810 k( 332) = ( 0.0000000 0.3201424 0.2087525), wk = 0.0023810 k( 333) = ( 0.0000000 0.3087087 0.2087525), wk = 0.0023810 k( 334) = ( 0.0000000 0.2972750 0.2087525), wk = 0.0023810 k( 335) = ( 0.0000000 0.2858414 0.2087525), wk = 0.0023810 k( 336) = ( 0.0000000 0.2744077 0.2087525), wk = 0.0023810 k( 337) = ( 0.0000000 0.2629741 0.2087525), wk = 0.0023810 k( 338) = ( 0.0000000 0.2515404 0.2087525), wk = 0.0023810 k( 339) = ( 0.0000000 0.2401068 0.2087525), wk = 0.0023810 k( 340) = ( 0.0000000 0.2286731 0.2087525), wk = 0.0023810 k( 341) = ( 0.0000000 0.2172395 0.2087525), wk = 0.0023810 k( 342) = ( 0.0000000 0.2058058 0.2087525), wk = 0.0023810 k( 343) = ( 0.0000000 0.1943721 0.2087525), wk = 0.0023810 k( 344) = ( 0.0000000 0.1829385 0.2087525), wk = 0.0023810 k( 345) = ( 0.0000000 0.1715048 0.2087525), wk = 0.0023810 k( 346) = ( 0.0000000 0.1600712 0.2087525), wk = 0.0023810 k( 347) = ( 0.0000000 0.1486375 0.2087525), wk = 0.0023810 k( 348) = ( 0.0000000 0.1372039 0.2087525), wk = 0.0023810 k( 349) = ( 0.0000000 0.1257702 0.2087525), wk = 0.0023810 k( 350) = ( 0.0000000 0.1143366 0.2087525), wk = 0.0023810 k( 351) = ( 0.0000000 0.1029029 0.2087525), wk = 0.0023810 k( 352) = ( 0.0000000 0.0914692 0.2087525), wk = 0.0023810 k( 353) = ( 0.0000000 0.0800356 0.2087525), wk = 0.0023810 k( 354) = ( 0.0000000 0.0686019 0.2087525), wk = 0.0023810 k( 355) = ( 0.0000000 0.0571683 0.2087525), wk = 0.0023810 k( 356) = ( 0.0000000 0.0457346 0.2087525), wk = 0.0023810 k( 357) = ( 0.0000000 0.0343010 0.2087525), wk = 0.0023810 k( 358) = ( 0.0000000 0.0228673 0.2087525), wk = 0.0023810 k( 359) = ( 0.0000000 0.0114337 0.2087525), wk = 0.0023810 k( 360) = ( 0.0000000 0.0000000 0.2087525), wk = 0.0023810 k( 361) = ( 0.0000000 0.4459126 -0.0000000), wk = 0.0023810 k( 362) = ( 0.0000000 0.4459126 0.0109870), wk = 0.0023810 k( 363) = ( 0.0000000 0.4459126 0.0219739), wk = 0.0023810 k( 364) = ( 0.0000000 0.4459126 0.0329609), wk = 0.0023810 k( 365) = ( 0.0000000 0.4459126 0.0439479), wk = 0.0023810 k( 366) = ( 0.0000000 0.4459126 0.0549349), wk = 0.0023810 k( 367) = ( 0.0000000 0.4459126 0.0659218), wk = 0.0023810 k( 368) = ( 0.0000000 0.4459126 0.0769088), wk = 0.0023810 k( 369) = ( 0.0000000 0.4459126 0.0878958), wk = 0.0023810 k( 370) = ( 0.0000000 0.4459126 0.0988827), wk = 0.0023810 k( 371) = ( 0.0000000 0.4459126 0.1098697), wk = 0.0023810 k( 372) = ( 0.0000000 0.4459126 0.1208567), wk = 0.0023810 k( 373) = ( 0.0000000 0.4459126 0.1318437), wk = 0.0023810 k( 374) = ( 0.0000000 0.4459126 0.1428306), wk = 0.0023810 k( 375) = ( 0.0000000 0.4459126 0.1538176), wk = 0.0023810 k( 376) = ( 0.0000000 0.4459126 0.1648046), wk = 0.0023810 k( 377) = ( 0.0000000 0.4459126 0.1757915), wk = 0.0023810 k( 378) = ( 0.0000000 0.4459126 0.1867785), wk = 0.0023810 k( 379) = ( 0.0000000 0.4459126 0.1977655), wk = 0.0023810 k( 380) = ( 0.0000000 0.4459126 0.2087525), wk = 0.0023810 k( 381) = ( 0.5000000 -0.0000000 0.2087525), wk = 0.0023810 k( 382) = ( 0.5000000 -0.0000000 0.1977655), wk = 0.0023810 k( 383) = ( 0.5000000 -0.0000000 0.1867785), wk = 0.0023810 k( 384) = ( 0.5000000 -0.0000000 0.1757915), wk = 0.0023810 k( 385) = ( 0.5000000 -0.0000000 0.1648046), wk = 0.0023810 k( 386) = ( 0.5000000 -0.0000000 0.1538176), wk = 0.0023810 k( 387) = ( 0.5000000 -0.0000000 0.1428306), wk = 0.0023810 k( 388) = ( 0.5000000 -0.0000000 0.1318437), wk = 0.0023810 k( 389) = ( 0.5000000 -0.0000000 0.1208567), wk = 0.0023810 k( 390) = ( 0.5000000 -0.0000000 0.1098697), wk = 0.0023810 k( 391) = ( 0.5000000 -0.0000000 0.0988827), wk = 0.0023810 k( 392) = ( 0.5000000 -0.0000000 0.0878958), wk = 0.0023810 k( 393) = ( 0.5000000 -0.0000000 0.0769088), wk = 0.0023810 k( 394) = ( 0.5000000 -0.0000000 0.0659218), wk = 0.0023810 k( 395) = ( 0.5000000 -0.0000000 0.0549349), wk = 0.0023810 k( 396) = ( 0.5000000 -0.0000000 0.0439479), wk = 0.0023810 k( 397) = ( 0.5000000 -0.0000000 0.0329609), wk = 0.0023810 k( 398) = ( 0.5000000 -0.0000000 0.0219739), wk = 0.0023810 k( 399) = ( 0.5000000 -0.0000000 0.0109870), wk = 0.0023810 k( 400) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023810 k( 401) = ( 0.5000000 0.4459126 -0.0000000), wk = 0.0023810 k( 402) = ( 0.5000000 0.4459126 0.0109870), wk = 0.0023810 k( 403) = ( 0.5000000 0.4459126 0.0219739), wk = 0.0023810 k( 404) = ( 0.5000000 0.4459126 0.0329609), wk = 0.0023810 k( 405) = ( 0.5000000 0.4459126 0.0439479), wk = 0.0023810 k( 406) = ( 0.5000000 0.4459126 0.0549349), wk = 0.0023810 k( 407) = ( 0.5000000 0.4459126 0.0659218), wk = 0.0023810 k( 408) = ( 0.5000000 0.4459126 0.0769088), wk = 0.0023810 k( 409) = ( 0.5000000 0.4459126 0.0878958), wk = 0.0023810 k( 410) = ( 0.5000000 0.4459126 0.0988827), wk = 0.0023810 k( 411) = ( 0.5000000 0.4459126 0.1098697), wk = 0.0023810 k( 412) = ( 0.5000000 0.4459126 0.1208567), wk = 0.0023810 k( 413) = ( 0.5000000 0.4459126 0.1318437), wk = 0.0023810 k( 414) = ( 0.5000000 0.4459126 0.1428306), wk = 0.0023810 k( 415) = ( 0.5000000 0.4459126 0.1538176), wk = 0.0023810 k( 416) = ( 0.5000000 0.4459126 0.1648046), wk = 0.0023810 k( 417) = ( 0.5000000 0.4459126 0.1757915), wk = 0.0023810 k( 418) = ( 0.5000000 0.4459126 0.1867785), wk = 0.0023810 k( 419) = ( 0.5000000 0.4459126 0.1977655), wk = 0.0023810 k( 420) = ( 0.5000000 0.4459126 0.2087525), wk = 0.0023810 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 2) = ( 0.0113636 0.0000000 0.0000000), wk = 0.0023810 k( 3) = ( 0.0227273 0.0000000 0.0000000), wk = 0.0023810 k( 4) = ( 0.0340909 0.0000000 0.0000000), wk = 0.0023810 k( 5) = ( 0.0454546 -0.0000000 -0.0000000), wk = 0.0023810 k( 6) = ( 0.0568182 -0.0000000 -0.0000000), wk = 0.0023810 k( 7) = ( 0.0681818 0.0000000 0.0000000), wk = 0.0023810 k( 8) = ( 0.0795455 0.0000000 -0.0000000), wk = 0.0023810 k( 9) = ( 0.0909091 -0.0000000 0.0000000), wk = 0.0023810 k( 10) = ( 0.1022727 0.0000000 0.0000000), wk = 0.0023810 k( 11) = ( 0.1136364 -0.0000000 -0.0000000), wk = 0.0023810 k( 12) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0023810 k( 13) = ( 0.1363636 0.0000000 0.0000000), wk = 0.0023810 k( 14) = ( 0.1477273 0.0000000 0.0000000), wk = 0.0023810 k( 15) = ( 0.1590909 -0.0000000 -0.0000000), wk = 0.0023810 k( 16) = ( 0.1704546 0.0000000 -0.0000000), wk = 0.0023810 k( 17) = ( 0.1818182 -0.0000000 0.0000000), wk = 0.0023810 k( 18) = ( 0.1931818 0.0000000 -0.0000000), wk = 0.0023810 k( 19) = ( 0.2045454 0.0000000 0.0000000), wk = 0.0023810 k( 20) = ( 0.2159091 0.0000000 0.0000000), wk = 0.0023810 k( 21) = ( 0.2272727 0.0000000 0.0000000), wk = 0.0023810 k( 22) = ( 0.2386364 0.0000000 0.0000000), wk = 0.0023810 k( 23) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0023810 k( 24) = ( 0.2613636 0.0000000 0.0000000), wk = 0.0023810 k( 25) = ( 0.2727273 -0.0000000 -0.0000000), wk = 0.0023810 k( 26) = ( 0.2840909 0.0000000 0.0000000), wk = 0.0023810 k( 27) = ( 0.2954545 -0.0000000 0.0000000), wk = 0.0023810 k( 28) = ( 0.3068182 0.0000000 0.0000000), wk = 0.0023810 k( 29) = ( 0.3181818 -0.0000000 -0.0000000), wk = 0.0023810 k( 30) = ( 0.3295455 0.0000000 0.0000000), wk = 0.0023810 k( 31) = ( 0.3409091 0.0000000 -0.0000000), wk = 0.0023810 k( 32) = ( 0.3522727 0.0000000 0.0000000), wk = 0.0023810 k( 33) = ( 0.3636364 -0.0000000 0.0000000), wk = 0.0023810 k( 34) = ( 0.3750000 0.0000000 0.0000000), wk = 0.0023810 k( 35) = ( 0.3863636 0.0000000 -0.0000000), wk = 0.0023810 k( 36) = ( 0.3977273 -0.0000000 0.0000000), wk = 0.0023810 k( 37) = ( 0.4090909 0.0000000 -0.0000000), wk = 0.0023810 k( 38) = ( 0.4204545 -0.0000000 0.0000000), wk = 0.0023810 k( 39) = ( 0.4318182 0.0000000 0.0000000), wk = 0.0023810 k( 40) = ( 0.4431818 -0.0000000 0.0000000), wk = 0.0023810 k( 41) = ( 0.4545455 0.0000000 0.0000000), wk = 0.0023810 k( 42) = ( 0.4659091 0.0000000 -0.0000000), wk = 0.0023810 k( 43) = ( 0.4772727 0.0000000 0.0000000), wk = 0.0023810 k( 44) = ( 0.4886364 -0.0000000 -0.0000000), wk = 0.0023810 k( 45) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023810 k( 46) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023810 k( 47) = ( 0.5000000 0.0128205 0.0000000), wk = 0.0023810 k( 48) = ( 0.5000000 0.0256410 0.0000000), wk = 0.0023810 k( 49) = ( 0.5000000 0.0384615 0.0000000), wk = 0.0023810 k( 50) = ( 0.5000000 0.0512821 -0.0000000), wk = 0.0023810 k( 51) = ( 0.5000000 0.0641026 -0.0000000), wk = 0.0023810 k( 52) = ( 0.5000000 0.0769231 -0.0000000), wk = 0.0023810 k( 53) = ( 0.5000000 0.0897436 0.0000000), wk = 0.0023810 k( 54) = ( 0.5000000 0.1025641 0.0000000), wk = 0.0023810 k( 55) = ( 0.5000000 0.1153846 0.0000000), wk = 0.0023810 k( 56) = ( 0.5000000 0.1282051 -0.0000000), wk = 0.0023810 k( 57) = ( 0.5000000 0.1410256 0.0000000), wk = 0.0023810 k( 58) = ( 0.5000000 0.1538461 0.0000000), wk = 0.0023810 k( 59) = ( 0.5000000 0.1666667 0.0000000), wk = 0.0023810 k( 60) = ( 0.5000000 0.1794872 -0.0000000), wk = 0.0023810 k( 61) = ( 0.5000000 0.1923077 -0.0000000), wk = 0.0023810 k( 62) = ( 0.5000000 0.2051282 0.0000000), wk = 0.0023810 k( 63) = ( 0.5000000 0.2179487 -0.0000000), wk = 0.0023810 k( 64) = ( 0.5000000 0.2307692 0.0000000), wk = 0.0023810 k( 65) = ( 0.5000000 0.2435897 0.0000000), wk = 0.0023810 k( 66) = ( 0.5000000 0.2564103 -0.0000000), wk = 0.0023810 k( 67) = ( 0.5000000 0.2692308 -0.0000000), wk = 0.0023810 k( 68) = ( 0.5000000 0.2820513 -0.0000000), wk = 0.0023810 k( 69) = ( 0.5000000 0.2948718 -0.0000000), wk = 0.0023810 k( 70) = ( 0.5000000 0.3076923 0.0000000), wk = 0.0023810 k( 71) = ( 0.5000000 0.3205128 0.0000000), wk = 0.0023810 k( 72) = ( 0.5000000 0.3333333 -0.0000000), wk = 0.0023810 k( 73) = ( 0.5000000 0.3461538 0.0000000), wk = 0.0023810 k( 74) = ( 0.5000000 0.3589744 0.0000000), wk = 0.0023810 k( 75) = ( 0.5000000 0.3717949 -0.0000000), wk = 0.0023810 k( 76) = ( 0.5000000 0.3846154 0.0000000), wk = 0.0023810 k( 77) = ( 0.5000000 0.3974359 0.0000000), wk = 0.0023810 k( 78) = ( 0.5000000 0.4102564 0.0000000), wk = 0.0023810 k( 79) = ( 0.5000000 0.4230769 0.0000000), wk = 0.0023810 k( 80) = ( 0.5000000 0.4358974 -0.0000000), wk = 0.0023810 k( 81) = ( 0.5000000 0.4487179 -0.0000000), wk = 0.0023810 k( 82) = ( 0.5000000 0.4615385 0.0000000), wk = 0.0023810 k( 83) = ( 0.5000000 0.4743590 0.0000000), wk = 0.0023810 k( 84) = ( 0.5000000 0.4871795 -0.0000000), wk = 0.0023810 k( 85) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023810 k( 86) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023810 k( 87) = ( 0.4886364 0.5000000 0.0000000), wk = 0.0023810 k( 88) = ( 0.4772727 0.5000000 -0.0000000), wk = 0.0023810 k( 89) = ( 0.4659091 0.5000000 -0.0000000), wk = 0.0023810 k( 90) = ( 0.4545455 0.5000000 -0.0000000), wk = 0.0023810 k( 91) = ( 0.4431818 0.5000000 -0.0000000), wk = 0.0023810 k( 92) = ( 0.4318182 0.5000000 -0.0000000), wk = 0.0023810 k( 93) = ( 0.4204545 0.5000000 -0.0000000), wk = 0.0023810 k( 94) = ( 0.4090909 0.5000000 -0.0000000), wk = 0.0023810 k( 95) = ( 0.3977273 0.5000000 -0.0000000), wk = 0.0023810 k( 96) = ( 0.3863636 0.5000000 0.0000000), wk = 0.0023810 k( 97) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0023810 k( 98) = ( 0.3636364 0.5000000 -0.0000000), wk = 0.0023810 k( 99) = ( 0.3522727 0.5000000 -0.0000000), wk = 0.0023810 k( 100) = ( 0.3409091 0.5000000 0.0000000), wk = 0.0023810 k( 101) = ( 0.3295455 0.5000000 -0.0000000), wk = 0.0023810 k( 102) = ( 0.3181818 0.5000000 -0.0000000), wk = 0.0023810 k( 103) = ( 0.3068182 0.5000000 0.0000000), wk = 0.0023810 k( 104) = ( 0.2954545 0.5000000 -0.0000000), wk = 0.0023810 k( 105) = ( 0.2840909 0.5000000 -0.0000000), wk = 0.0023810 k( 106) = ( 0.2727273 0.5000000 0.0000000), wk = 0.0023810 k( 107) = ( 0.2613636 0.5000000 0.0000000), wk = 0.0023810 k( 108) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0023810 k( 109) = ( 0.2386364 0.5000000 0.0000000), wk = 0.0023810 k( 110) = ( 0.2272727 0.5000000 0.0000000), wk = 0.0023810 k( 111) = ( 0.2159091 0.5000000 -0.0000000), wk = 0.0023810 k( 112) = ( 0.2045454 0.5000000 -0.0000000), wk = 0.0023810 k( 113) = ( 0.1931818 0.5000000 0.0000000), wk = 0.0023810 k( 114) = ( 0.1818182 0.5000000 0.0000000), wk = 0.0023810 k( 115) = ( 0.1704546 0.5000000 0.0000000), wk = 0.0023810 k( 116) = ( 0.1590909 0.5000000 0.0000000), wk = 0.0023810 k( 117) = ( 0.1477273 0.5000000 0.0000000), wk = 0.0023810 k( 118) = ( 0.1363636 0.5000000 0.0000000), wk = 0.0023810 k( 119) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0023810 k( 120) = ( 0.1136364 0.5000000 0.0000000), wk = 0.0023810 k( 121) = ( 0.1022727 0.5000000 0.0000000), wk = 0.0023810 k( 122) = ( 0.0909091 0.5000000 0.0000000), wk = 0.0023810 k( 123) = ( 0.0795455 0.5000000 0.0000000), wk = 0.0023810 k( 124) = ( 0.0681818 0.5000000 0.0000000), wk = 0.0023810 k( 125) = ( 0.0568182 0.5000000 0.0000000), wk = 0.0023810 k( 126) = ( 0.0454546 0.5000000 0.0000000), wk = 0.0023810 k( 127) = ( 0.0340909 0.5000000 0.0000000), wk = 0.0023810 k( 128) = ( 0.0227273 0.5000000 0.0000000), wk = 0.0023810 k( 129) = ( 0.0113636 0.5000000 0.0000000), wk = 0.0023810 k( 130) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023810 k( 131) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023810 k( 132) = ( 0.0000000 0.4871795 0.0000000), wk = 0.0023810 k( 133) = ( 0.0000000 0.4743590 -0.0000000), wk = 0.0023810 k( 134) = ( 0.0000000 0.4615385 -0.0000000), wk = 0.0023810 k( 135) = ( 0.0000000 0.4487179 -0.0000000), wk = 0.0023810 k( 136) = ( 0.0000000 0.4358974 0.0000000), wk = 0.0023810 k( 137) = ( 0.0000000 0.4230769 -0.0000000), wk = 0.0023810 k( 138) = ( 0.0000000 0.4102564 -0.0000000), wk = 0.0023810 k( 139) = ( 0.0000000 0.3974359 -0.0000000), wk = 0.0023810 k( 140) = ( 0.0000000 0.3846154 -0.0000000), wk = 0.0023810 k( 141) = ( 0.0000000 0.3717949 -0.0000000), wk = 0.0023810 k( 142) = ( 0.0000000 0.3589744 -0.0000000), wk = 0.0023810 k( 143) = ( 0.0000000 0.3461538 -0.0000000), wk = 0.0023810 k( 144) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0023810 k( 145) = ( 0.0000000 0.3205128 -0.0000000), wk = 0.0023810 k( 146) = ( 0.0000000 0.3076923 -0.0000000), wk = 0.0023810 k( 147) = ( 0.0000000 0.2948718 -0.0000000), wk = 0.0023810 k( 148) = ( 0.0000000 0.2820513 0.0000000), wk = 0.0023810 k( 149) = ( 0.0000000 0.2692308 -0.0000000), wk = 0.0023810 k( 150) = ( 0.0000000 0.2564103 -0.0000000), wk = 0.0023810 k( 151) = ( 0.0000000 0.2435897 0.0000000), wk = 0.0023810 k( 152) = ( 0.0000000 0.2307692 -0.0000000), wk = 0.0023810 k( 153) = ( 0.0000000 0.2179487 0.0000000), wk = 0.0023810 k( 154) = ( 0.0000000 0.2051282 0.0000000), wk = 0.0023810 k( 155) = ( 0.0000000 0.1923077 -0.0000000), wk = 0.0023810 k( 156) = ( 0.0000000 0.1794872 -0.0000000), wk = 0.0023810 k( 157) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0023810 k( 158) = ( 0.0000000 0.1538461 -0.0000000), wk = 0.0023810 k( 159) = ( 0.0000000 0.1410256 0.0000000), wk = 0.0023810 k( 160) = ( 0.0000000 0.1282051 -0.0000000), wk = 0.0023810 k( 161) = ( 0.0000000 0.1153846 -0.0000000), wk = 0.0023810 k( 162) = ( 0.0000000 0.1025641 0.0000000), wk = 0.0023810 k( 163) = ( 0.0000000 0.0897436 -0.0000000), wk = 0.0023810 k( 164) = ( 0.0000000 0.0769231 -0.0000000), wk = 0.0023810 k( 165) = ( 0.0000000 0.0641026 -0.0000000), wk = 0.0023810 k( 166) = ( 0.0000000 0.0512821 0.0000000), wk = 0.0023810 k( 167) = ( 0.0000000 0.0384615 -0.0000000), wk = 0.0023810 k( 168) = ( 0.0000000 0.0256410 0.0000000), wk = 0.0023810 k( 169) = ( 0.0000000 0.0128205 0.0000000), wk = 0.0023810 k( 170) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 171) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 172) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0023810 k( 173) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0023810 k( 174) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0023810 k( 175) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0023810 k( 176) = ( 0.0000000 0.0000000 0.1315789), wk = 0.0023810 k( 177) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0023810 k( 178) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0023810 k( 179) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0023810 k( 180) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0023810 k( 181) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0023810 k( 182) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0023810 k( 183) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0023810 k( 184) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0023810 k( 185) = ( 0.0000000 0.0000000 0.3684211), wk = 0.0023810 k( 186) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0023810 k( 187) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0023810 k( 188) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0023810 k( 189) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0023810 k( 190) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023810 k( 191) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023810 k( 192) = ( 0.0113636 0.0000000 0.5000000), wk = 0.0023810 k( 193) = ( 0.0227273 0.0000000 0.5000000), wk = 0.0023810 k( 194) = ( 0.0340909 0.0000000 0.5000000), wk = 0.0023810 k( 195) = ( 0.0454546 -0.0000000 0.5000000), wk = 0.0023810 k( 196) = ( 0.0568182 -0.0000000 0.5000000), wk = 0.0023810 k( 197) = ( 0.0681818 0.0000000 0.5000000), wk = 0.0023810 k( 198) = ( 0.0795455 0.0000000 0.5000000), wk = 0.0023810 k( 199) = ( 0.0909091 -0.0000000 0.5000000), wk = 0.0023810 k( 200) = ( 0.1022727 0.0000000 0.5000000), wk = 0.0023810 k( 201) = ( 0.1136364 -0.0000000 0.5000000), wk = 0.0023810 k( 202) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0023810 k( 203) = ( 0.1363636 0.0000000 0.5000000), wk = 0.0023810 k( 204) = ( 0.1477273 0.0000000 0.5000000), wk = 0.0023810 k( 205) = ( 0.1590909 -0.0000000 0.5000000), wk = 0.0023810 k( 206) = ( 0.1704546 0.0000000 0.5000000), wk = 0.0023810 k( 207) = ( 0.1818182 -0.0000000 0.5000000), wk = 0.0023810 k( 208) = ( 0.1931818 0.0000000 0.5000000), wk = 0.0023810 k( 209) = ( 0.2045454 0.0000000 0.5000000), wk = 0.0023810 k( 210) = ( 0.2159091 0.0000000 0.5000000), wk = 0.0023810 k( 211) = ( 0.2272727 0.0000000 0.5000000), wk = 0.0023810 k( 212) = ( 0.2386364 0.0000000 0.5000000), wk = 0.0023810 k( 213) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0023810 k( 214) = ( 0.2613636 0.0000000 0.5000000), wk = 0.0023810 k( 215) = ( 0.2727273 -0.0000000 0.5000000), wk = 0.0023810 k( 216) = ( 0.2840909 0.0000000 0.5000000), wk = 0.0023810 k( 217) = ( 0.2954545 -0.0000000 0.5000000), wk = 0.0023810 k( 218) = ( 0.3068182 0.0000000 0.5000000), wk = 0.0023810 k( 219) = ( 0.3181818 -0.0000000 0.5000000), wk = 0.0023810 k( 220) = ( 0.3295455 0.0000000 0.5000000), wk = 0.0023810 k( 221) = ( 0.3409091 0.0000000 0.5000000), wk = 0.0023810 k( 222) = ( 0.3522727 0.0000000 0.5000000), wk = 0.0023810 k( 223) = ( 0.3636364 -0.0000000 0.5000000), wk = 0.0023810 k( 224) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0023810 k( 225) = ( 0.3863636 0.0000000 0.5000000), wk = 0.0023810 k( 226) = ( 0.3977273 -0.0000000 0.5000000), wk = 0.0023810 k( 227) = ( 0.4090909 0.0000000 0.5000000), wk = 0.0023810 k( 228) = ( 0.4204545 -0.0000000 0.5000000), wk = 0.0023810 k( 229) = ( 0.4318182 0.0000000 0.5000000), wk = 0.0023810 k( 230) = ( 0.4431818 -0.0000000 0.5000000), wk = 0.0023810 k( 231) = ( 0.4545455 0.0000000 0.5000000), wk = 0.0023810 k( 232) = ( 0.4659091 0.0000000 0.5000000), wk = 0.0023810 k( 233) = ( 0.4772727 0.0000000 0.5000000), wk = 0.0023810 k( 234) = ( 0.4886364 -0.0000000 0.5000000), wk = 0.0023810 k( 235) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023810 k( 236) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023810 k( 237) = ( 0.5000000 0.0128205 0.5000000), wk = 0.0023810 k( 238) = ( 0.5000000 0.0256410 0.5000000), wk = 0.0023810 k( 239) = ( 0.5000000 0.0384615 0.5000000), wk = 0.0023810 k( 240) = ( 0.5000000 0.0512821 0.5000000), wk = 0.0023810 k( 241) = ( 0.5000000 0.0641026 0.5000000), wk = 0.0023810 k( 242) = ( 0.5000000 0.0769231 0.5000000), wk = 0.0023810 k( 243) = ( 0.5000000 0.0897436 0.5000000), wk = 0.0023810 k( 244) = ( 0.5000000 0.1025641 0.5000000), wk = 0.0023810 k( 245) = ( 0.5000000 0.1153846 0.5000000), wk = 0.0023810 k( 246) = ( 0.5000000 0.1282051 0.5000000), wk = 0.0023810 k( 247) = ( 0.5000000 0.1410256 0.5000000), wk = 0.0023810 k( 248) = ( 0.5000000 0.1538461 0.5000000), wk = 0.0023810 k( 249) = ( 0.5000000 0.1666667 0.5000000), wk = 0.0023810 k( 250) = ( 0.5000000 0.1794872 0.5000000), wk = 0.0023810 k( 251) = ( 0.5000000 0.1923077 0.5000000), wk = 0.0023810 k( 252) = ( 0.5000000 0.2051282 0.5000000), wk = 0.0023810 k( 253) = ( 0.5000000 0.2179487 0.5000000), wk = 0.0023810 k( 254) = ( 0.5000000 0.2307692 0.5000000), wk = 0.0023810 k( 255) = ( 0.5000000 0.2435897 0.5000000), wk = 0.0023810 k( 256) = ( 0.5000000 0.2564103 0.5000000), wk = 0.0023810 k( 257) = ( 0.5000000 0.2692308 0.5000000), wk = 0.0023810 k( 258) = ( 0.5000000 0.2820513 0.5000000), wk = 0.0023810 k( 259) = ( 0.5000000 0.2948718 0.5000000), wk = 0.0023810 k( 260) = ( 0.5000000 0.3076923 0.5000000), wk = 0.0023810 k( 261) = ( 0.5000000 0.3205128 0.5000000), wk = 0.0023810 k( 262) = ( 0.5000000 0.3333333 0.5000000), wk = 0.0023810 k( 263) = ( 0.5000000 0.3461538 0.5000000), wk = 0.0023810 k( 264) = ( 0.5000000 0.3589744 0.5000000), wk = 0.0023810 k( 265) = ( 0.5000000 0.3717949 0.5000000), wk = 0.0023810 k( 266) = ( 0.5000000 0.3846154 0.5000000), wk = 0.0023810 k( 267) = ( 0.5000000 0.3974359 0.5000000), wk = 0.0023810 k( 268) = ( 0.5000000 0.4102564 0.5000000), wk = 0.0023810 k( 269) = ( 0.5000000 0.4230769 0.5000000), wk = 0.0023810 k( 270) = ( 0.5000000 0.4358974 0.5000000), wk = 0.0023810 k( 271) = ( 0.5000000 0.4487179 0.5000000), wk = 0.0023810 k( 272) = ( 0.5000000 0.4615385 0.5000000), wk = 0.0023810 k( 273) = ( 0.5000000 0.4743590 0.5000000), wk = 0.0023810 k( 274) = ( 0.5000000 0.4871795 0.5000000), wk = 0.0023810 k( 275) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023810 k( 276) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023810 k( 277) = ( 0.4886364 0.5000000 0.5000000), wk = 0.0023810 k( 278) = ( 0.4772727 0.5000000 0.5000000), wk = 0.0023810 k( 279) = ( 0.4659091 0.5000000 0.5000000), wk = 0.0023810 k( 280) = ( 0.4545455 0.5000000 0.5000000), wk = 0.0023810 k( 281) = ( 0.4431818 0.5000000 0.5000000), wk = 0.0023810 k( 282) = ( 0.4318182 0.5000000 0.5000000), wk = 0.0023810 k( 283) = ( 0.4204545 0.5000000 0.5000000), wk = 0.0023810 k( 284) = ( 0.4090909 0.5000000 0.5000000), wk = 0.0023810 k( 285) = ( 0.3977273 0.5000000 0.5000000), wk = 0.0023810 k( 286) = ( 0.3863636 0.5000000 0.5000000), wk = 0.0023810 k( 287) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0023810 k( 288) = ( 0.3636364 0.5000000 0.5000000), wk = 0.0023810 k( 289) = ( 0.3522727 0.5000000 0.5000000), wk = 0.0023810 k( 290) = ( 0.3409091 0.5000000 0.5000000), wk = 0.0023810 k( 291) = ( 0.3295455 0.5000000 0.5000000), wk = 0.0023810 k( 292) = ( 0.3181818 0.5000000 0.5000000), wk = 0.0023810 k( 293) = ( 0.3068182 0.5000000 0.5000000), wk = 0.0023810 k( 294) = ( 0.2954545 0.5000000 0.5000000), wk = 0.0023810 k( 295) = ( 0.2840909 0.5000000 0.5000000), wk = 0.0023810 k( 296) = ( 0.2727273 0.5000000 0.5000000), wk = 0.0023810 k( 297) = ( 0.2613636 0.5000000 0.5000000), wk = 0.0023810 k( 298) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0023810 k( 299) = ( 0.2386364 0.5000000 0.5000000), wk = 0.0023810 k( 300) = ( 0.2272727 0.5000000 0.5000000), wk = 0.0023810 k( 301) = ( 0.2159091 0.5000000 0.5000000), wk = 0.0023810 k( 302) = ( 0.2045454 0.5000000 0.5000000), wk = 0.0023810 k( 303) = ( 0.1931818 0.5000000 0.5000000), wk = 0.0023810 k( 304) = ( 0.1818182 0.5000000 0.5000000), wk = 0.0023810 k( 305) = ( 0.1704546 0.5000000 0.5000000), wk = 0.0023810 k( 306) = ( 0.1590909 0.5000000 0.5000000), wk = 0.0023810 k( 307) = ( 0.1477273 0.5000000 0.5000000), wk = 0.0023810 k( 308) = ( 0.1363636 0.5000000 0.5000000), wk = 0.0023810 k( 309) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0023810 k( 310) = ( 0.1136364 0.5000000 0.5000000), wk = 0.0023810 k( 311) = ( 0.1022727 0.5000000 0.5000000), wk = 0.0023810 k( 312) = ( 0.0909091 0.5000000 0.5000000), wk = 0.0023810 k( 313) = ( 0.0795455 0.5000000 0.5000000), wk = 0.0023810 k( 314) = ( 0.0681818 0.5000000 0.5000000), wk = 0.0023810 k( 315) = ( 0.0568182 0.5000000 0.5000000), wk = 0.0023810 k( 316) = ( 0.0454546 0.5000000 0.5000000), wk = 0.0023810 k( 317) = ( 0.0340909 0.5000000 0.5000000), wk = 0.0023810 k( 318) = ( 0.0227273 0.5000000 0.5000000), wk = 0.0023810 k( 319) = ( 0.0113636 0.5000000 0.5000000), wk = 0.0023810 k( 320) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023810 k( 321) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023810 k( 322) = ( 0.0000000 0.4871795 0.5000000), wk = 0.0023810 k( 323) = ( 0.0000000 0.4743590 0.5000000), wk = 0.0023810 k( 324) = ( 0.0000000 0.4615385 0.5000000), wk = 0.0023810 k( 325) = ( 0.0000000 0.4487179 0.5000000), wk = 0.0023810 k( 326) = ( 0.0000000 0.4358974 0.5000000), wk = 0.0023810 k( 327) = ( 0.0000000 0.4230769 0.5000000), wk = 0.0023810 k( 328) = ( 0.0000000 0.4102564 0.5000000), wk = 0.0023810 k( 329) = ( 0.0000000 0.3974359 0.5000000), wk = 0.0023810 k( 330) = ( 0.0000000 0.3846154 0.5000000), wk = 0.0023810 k( 331) = ( 0.0000000 0.3717949 0.5000000), wk = 0.0023810 k( 332) = ( 0.0000000 0.3589744 0.5000000), wk = 0.0023810 k( 333) = ( 0.0000000 0.3461538 0.5000000), wk = 0.0023810 k( 334) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0023810 k( 335) = ( 0.0000000 0.3205128 0.5000000), wk = 0.0023810 k( 336) = ( 0.0000000 0.3076923 0.5000000), wk = 0.0023810 k( 337) = ( 0.0000000 0.2948718 0.5000000), wk = 0.0023810 k( 338) = ( 0.0000000 0.2820513 0.5000000), wk = 0.0023810 k( 339) = ( 0.0000000 0.2692308 0.5000000), wk = 0.0023810 k( 340) = ( 0.0000000 0.2564103 0.5000000), wk = 0.0023810 k( 341) = ( 0.0000000 0.2435897 0.5000000), wk = 0.0023810 k( 342) = ( 0.0000000 0.2307692 0.5000000), wk = 0.0023810 k( 343) = ( 0.0000000 0.2179487 0.5000000), wk = 0.0023810 k( 344) = ( 0.0000000 0.2051282 0.5000000), wk = 0.0023810 k( 345) = ( 0.0000000 0.1923077 0.5000000), wk = 0.0023810 k( 346) = ( 0.0000000 0.1794872 0.5000000), wk = 0.0023810 k( 347) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0023810 k( 348) = ( 0.0000000 0.1538461 0.5000000), wk = 0.0023810 k( 349) = ( 0.0000000 0.1410256 0.5000000), wk = 0.0023810 k( 350) = ( 0.0000000 0.1282051 0.5000000), wk = 0.0023810 k( 351) = ( 0.0000000 0.1153846 0.5000000), wk = 0.0023810 k( 352) = ( 0.0000000 0.1025641 0.5000000), wk = 0.0023810 k( 353) = ( 0.0000000 0.0897436 0.5000000), wk = 0.0023810 k( 354) = ( 0.0000000 0.0769231 0.5000000), wk = 0.0023810 k( 355) = ( 0.0000000 0.0641026 0.5000000), wk = 0.0023810 k( 356) = ( 0.0000000 0.0512821 0.5000000), wk = 0.0023810 k( 357) = ( 0.0000000 0.0384615 0.5000000), wk = 0.0023810 k( 358) = ( 0.0000000 0.0256410 0.5000000), wk = 0.0023810 k( 359) = ( 0.0000000 0.0128205 0.5000000), wk = 0.0023810 k( 360) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023810 k( 361) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023810 k( 362) = ( 0.0000000 0.5000000 0.0263158), wk = 0.0023810 k( 363) = ( 0.0000000 0.5000000 0.0526316), wk = 0.0023810 k( 364) = ( 0.0000000 0.5000000 0.0789474), wk = 0.0023810 k( 365) = ( 0.0000000 0.5000000 0.1052632), wk = 0.0023810 k( 366) = ( 0.0000000 0.5000000 0.1315790), wk = 0.0023810 k( 367) = ( 0.0000000 0.5000000 0.1578947), wk = 0.0023810 k( 368) = ( 0.0000000 0.5000000 0.1842105), wk = 0.0023810 k( 369) = ( 0.0000000 0.5000000 0.2105263), wk = 0.0023810 k( 370) = ( 0.0000000 0.5000000 0.2368421), wk = 0.0023810 k( 371) = ( 0.0000000 0.5000000 0.2631579), wk = 0.0023810 k( 372) = ( 0.0000000 0.5000000 0.2894737), wk = 0.0023810 k( 373) = ( 0.0000000 0.5000000 0.3157895), wk = 0.0023810 k( 374) = ( 0.0000000 0.5000000 0.3421053), wk = 0.0023810 k( 375) = ( 0.0000000 0.5000000 0.3684210), wk = 0.0023810 k( 376) = ( 0.0000000 0.5000000 0.3947368), wk = 0.0023810 k( 377) = ( 0.0000000 0.5000000 0.4210526), wk = 0.0023810 k( 378) = ( 0.0000000 0.5000000 0.4473684), wk = 0.0023810 k( 379) = ( 0.0000000 0.5000000 0.4736842), wk = 0.0023810 k( 380) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023810 k( 381) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023810 k( 382) = ( 0.5000000 0.0000000 0.4736842), wk = 0.0023810 k( 383) = ( 0.5000000 0.0000000 0.4473684), wk = 0.0023810 k( 384) = ( 0.5000000 0.0000000 0.4210526), wk = 0.0023810 k( 385) = ( 0.5000000 0.0000000 0.3947368), wk = 0.0023810 k( 386) = ( 0.5000000 0.0000000 0.3684210), wk = 0.0023810 k( 387) = ( 0.5000000 0.0000000 0.3421053), wk = 0.0023810 k( 388) = ( 0.5000000 0.0000000 0.3157895), wk = 0.0023810 k( 389) = ( 0.5000000 0.0000000 0.2894737), wk = 0.0023810 k( 390) = ( 0.5000000 0.0000000 0.2631579), wk = 0.0023810 k( 391) = ( 0.5000000 0.0000000 0.2368421), wk = 0.0023810 k( 392) = ( 0.5000000 0.0000000 0.2105263), wk = 0.0023810 k( 393) = ( 0.5000000 0.0000000 0.1842105), wk = 0.0023810 k( 394) = ( 0.5000000 0.0000000 0.1578947), wk = 0.0023810 k( 395) = ( 0.5000000 0.0000000 0.1315789), wk = 0.0023810 k( 396) = ( 0.5000000 0.0000000 0.1052632), wk = 0.0023810 k( 397) = ( 0.5000000 0.0000000 0.0789474), wk = 0.0023810 k( 398) = ( 0.5000000 0.0000000 0.0526316), wk = 0.0023810 k( 399) = ( 0.5000000 0.0000000 0.0263158), wk = 0.0023810 k( 400) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023810 k( 401) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023810 k( 402) = ( 0.5000000 0.5000000 0.0263158), wk = 0.0023810 k( 403) = ( 0.5000000 0.5000000 0.0526316), wk = 0.0023810 k( 404) = ( 0.5000000 0.5000000 0.0789474), wk = 0.0023810 k( 405) = ( 0.5000000 0.5000000 0.1052632), wk = 0.0023810 k( 406) = ( 0.5000000 0.5000000 0.1315789), wk = 0.0023810 k( 407) = ( 0.5000000 0.5000000 0.1578947), wk = 0.0023810 k( 408) = ( 0.5000000 0.5000000 0.1842105), wk = 0.0023810 k( 409) = ( 0.5000000 0.5000000 0.2105263), wk = 0.0023810 k( 410) = ( 0.5000000 0.5000000 0.2368421), wk = 0.0023810 k( 411) = ( 0.5000000 0.5000000 0.2631579), wk = 0.0023810 k( 412) = ( 0.5000000 0.5000000 0.2894737), wk = 0.0023810 k( 413) = ( 0.5000000 0.5000000 0.3157895), wk = 0.0023810 k( 414) = ( 0.5000000 0.5000000 0.3421053), wk = 0.0023810 k( 415) = ( 0.5000000 0.5000000 0.3684210), wk = 0.0023810 k( 416) = ( 0.5000000 0.5000000 0.3947368), wk = 0.0023810 k( 417) = ( 0.5000000 0.5000000 0.4210526), wk = 0.0023810 k( 418) = ( 0.5000000 0.5000000 0.4473684), wk = 0.0023810 k( 419) = ( 0.5000000 0.5000000 0.4736842), wk = 0.0023810 k( 420) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023810 Dense grid: 84057 G-vectors FFT dimensions: ( 40, 45, 96) Smooth grid: 40761 G-vectors FFT dimensions: ( 32, 36, 75) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.29 Mb ( 302, 62) NL pseudopotentials 0.29 Mb ( 151, 124) Each V/rho on FFT grid 0.08 Mb ( 5400) Each G-vector array 0.02 Mb ( 2334) G-vector shells 0.01 Mb ( 1140) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.14 Mb ( 302, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.23 Mb ( 124, 2, 62) The potential is recalculated from file : ./InBrO.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.8 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 5.2 secs Computing kpt #: 4 total cpu time spent up to now is 5.8 secs Computing kpt #: 5 total cpu time spent up to now is 6.5 secs Computing kpt #: 6 total cpu time spent up to now is 7.1 secs Computing kpt #: 7 total cpu time spent up to now is 7.8 secs Computing kpt #: 8 total cpu time spent up to now is 8.4 secs Computing kpt #: 9 total cpu time spent up to now is 9.0 secs Computing kpt #: 10 total cpu time spent up to now is 9.6 secs Computing kpt #: 11 total cpu time spent up to now is 10.2 secs Computing kpt #: 12 total cpu time spent up to now is 10.8 secs Computing kpt #: 13 total cpu time spent up to now is 11.4 secs Computing kpt #: 14 total cpu time spent up to now is 11.9 secs Computing kpt #: 15 total cpu time spent up to now is 12.5 secs Computing kpt #: 16 total cpu time spent up to now is 13.0 secs Computing kpt #: 17 total cpu time spent up to now is 13.5 secs Computing kpt #: 18 total cpu time spent up to now is 14.0 secs Computing kpt #: 19 total cpu time spent up to now is 14.5 secs Computing kpt #: 20 total cpu time spent up to now is 15.0 secs Computing kpt #: 21 total cpu time spent up to now is 15.5 secs Computing kpt #: 22 total cpu time spent up to now is 16.0 secs Computing kpt #: 23 total cpu time spent up to now is 16.5 secs Computing kpt #: 24 total cpu time spent up to now is 17.0 secs Computing kpt #: 25 total cpu time spent up to now is 17.6 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 19.8 secs Computing kpt #: 29 total cpu time spent up to now is 20.6 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 22.1 secs Computing kpt #: 32 total cpu time spent up to now is 22.9 secs Computing kpt #: 33 total cpu time spent up to now is 23.6 secs Computing kpt #: 34 total cpu time spent up to now is 24.4 secs Computing kpt #: 35 total cpu time spent up to now is 25.2 secs Computing kpt #: 36 total cpu time spent up to now is 25.9 secs Computing kpt #: 37 total cpu time spent up to now is 26.6 secs Computing kpt #: 38 total cpu time spent up to now is 27.3 secs Computing kpt #: 39 total cpu time spent up to now is 28.0 secs Computing kpt #: 40 total cpu time spent up to now is 28.8 secs Computing kpt #: 41 total cpu time spent up to now is 29.5 secs Computing kpt #: 42 total cpu time spent up to now is 30.3 secs Computing kpt #: 43 total cpu time spent up to now is 31.0 secs Computing kpt #: 44 total cpu time spent up to now is 32.1 secs Computing kpt #: 45 total cpu time spent up to now is 32.7 secs Computing kpt #: 46 total cpu time spent up to now is 33.3 secs Computing kpt #: 47 total cpu time spent up to now is 34.1 secs Computing kpt #: 48 total cpu time spent up to now is 35.0 secs Computing kpt #: 49 total cpu time spent up to now is 35.7 secs Computing kpt #: 50 total cpu time spent up to now is 36.3 secs Computing kpt #: 51 total cpu time spent up to now is 36.9 secs Computing kpt #: 52 total cpu time spent up to now is 37.5 secs Computing kpt #: 53 total cpu time spent up to now is 38.2 secs Computing kpt #: 54 total cpu time spent up to now is 38.8 secs Computing kpt #: 55 total cpu time spent up to now is 39.4 secs Computing kpt #: 56 total cpu time spent up to now is 40.0 secs Computing kpt #: 57 total cpu time spent up to now is 40.6 secs Computing kpt #: 58 total cpu time spent up to now is 41.2 secs Computing kpt #: 59 total cpu time spent up to now is 41.8 secs Computing kpt #: 60 total cpu time spent up to now is 42.4 secs Computing kpt #: 61 total cpu time spent up to now is 43.0 secs Computing kpt #: 62 total cpu time spent up to now is 43.6 secs Computing kpt #: 63 total cpu time spent up to now is 44.2 secs Computing kpt #: 64 total cpu time spent up to now is 44.8 secs Computing kpt #: 65 total cpu time spent up to now is 45.4 secs Computing kpt #: 66 total cpu time spent up to now is 46.0 secs Computing kpt #: 67 total cpu time spent up to now is 46.7 secs Computing kpt #: 68 total cpu time spent up to now is 47.3 secs Computing kpt #: 69 total cpu time spent up to now is 47.9 secs Computing kpt #: 70 total cpu time spent up to now is 48.6 secs Computing kpt #: 71 total cpu time spent up to now is 49.2 secs Computing kpt #: 72 total cpu time spent up to now is 49.9 secs Computing kpt #: 73 total cpu time spent up to now is 50.6 secs Computing kpt #: 74 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 52.2 secs Computing kpt #: 75 total cpu time spent up to now is 53.0 secs Computing kpt #: 76 total cpu time spent up to now is 53.6 secs Computing kpt #: 77 total cpu time spent up to now is 55.3 secs Computing kpt #: 78 total cpu time spent up to now is 56.2 secs Computing kpt #: 79 total cpu time spent up to now is 56.9 secs Computing kpt #: 80 total cpu time spent up to now is 57.9 secs Computing kpt #: 81 total cpu time spent up to now is 59.0 secs Computing kpt #: 82 total cpu time spent up to now is 59.7 secs Computing kpt #: 83 total cpu time spent up to now is 60.4 secs Computing kpt #: 84 total cpu time spent up to now is 61.0 secs Computing kpt #: 85 total cpu time spent up to now is 61.5 secs Computing kpt #: 86 total cpu time spent up to now is 62.1 secs Computing kpt #: 87 total cpu time spent up to now is 62.6 secs Computing kpt #: 88 total cpu time spent up to now is 63.1 secs Computing kpt #: 89 total cpu time spent up to now is 63.7 secs Computing kpt #: 90 total cpu time spent up to now is 64.4 secs Computing kpt #: 91 total cpu time spent up to now is 65.0 secs Computing kpt #: 92 total cpu time spent up to now is 65.6 secs Computing kpt #: 93 total cpu time spent up to now is 66.3 secs Computing kpt #: 94 total cpu time spent up to now is 67.0 secs Computing kpt #: 95 total cpu time spent up to now is 67.7 secs Computing kpt #: 96 total cpu time spent up to now is 68.3 secs Computing kpt #: 97 total cpu time spent up to now is 69.1 secs Computing kpt #: 98 total cpu time spent up to now is 69.8 secs Computing kpt #: 99 total cpu time spent up to now is 70.5 secs Computing kpt #: 100 total cpu time spent up to now is 71.1 secs Computing kpt #: 101 total cpu time spent up to now is 71.8 secs Computing kpt #: 102 total cpu time spent up to now is 72.5 secs Computing kpt #: 103 total cpu time spent up to now is 73.2 secs Computing kpt #: 104 total cpu time spent up to now is 73.9 secs Computing kpt #: 105 total cpu time spent up to now is 74.6 secs Computing kpt #: 106 total cpu time spent up to now is 75.2 secs Computing kpt #: 107 total cpu time spent up to now is 75.9 secs Computing kpt #: 108 total cpu time spent up to now is 76.6 secs Computing kpt #: 109 total cpu time spent up to now is 77.3 secs Computing kpt #: 110 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 78.9 secs Computing kpt #: 111 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 80.6 secs Computing kpt #: 112 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 82.3 secs Computing kpt #: 113 total cpu time spent up to now is 83.0 secs Computing kpt #: 114 total cpu time spent up to now is 83.9 secs Computing kpt #: 115 total cpu time spent up to now is 84.7 secs Computing kpt #: 116 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 86.4 secs Computing kpt #: 117 total cpu time spent up to now is 88.0 secs Computing kpt #: 118 total cpu time spent up to now is 88.9 secs Computing kpt #: 119 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 90.6 secs Computing kpt #: 120 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 92.4 secs Computing kpt #: 121 total cpu time spent up to now is 93.6 secs Computing kpt #: 122 total cpu time spent up to now is 94.4 secs Computing kpt #: 123 total cpu time spent up to now is 95.3 secs Computing kpt #: 124 total cpu time spent up to now is 96.2 secs Computing kpt #: 125 total cpu time spent up to now is 97.0 secs Computing kpt #: 126 total cpu time spent up to now is 97.9 secs Computing kpt #: 127 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 99.5 secs Computing kpt #: 128 total cpu time spent up to now is 100.4 secs Computing kpt #: 129 total cpu time spent up to now is 101.4 secs Computing kpt #: 130 total cpu time spent up to now is 101.9 secs Computing kpt #: 131 total cpu time spent up to now is 102.4 secs Computing kpt #: 132 total cpu time spent up to now is 103.6 secs Computing kpt #: 133 total cpu time spent up to now is 104.4 secs Computing kpt #: 134 total cpu time spent up to now is 105.2 secs Computing kpt #: 135 total cpu time spent up to now is 106.0 secs Computing kpt #: 136 total cpu time spent up to now is 106.7 secs Computing kpt #: 137 total cpu time spent up to now is 107.5 secs Computing kpt #: 138 total cpu time spent up to now is 108.3 secs Computing kpt #: 139 total cpu time spent up to now is 109.1 secs Computing kpt #: 140 total cpu time spent up to now is 109.8 secs Computing kpt #: 141 total cpu time spent up to now is 110.6 secs Computing kpt #: 142 total cpu time spent up to now is 111.4 secs Computing kpt #: 143 total cpu time spent up to now is 112.1 secs Computing kpt #: 144 total cpu time spent up to now is 112.8 secs Computing kpt #: 145 total cpu time spent up to now is 113.6 secs Computing kpt #: 146 total cpu time spent up to now is 114.3 secs Computing kpt #: 147 total cpu time spent up to now is 114.9 secs Computing kpt #: 148 total cpu time spent up to now is 115.5 secs Computing kpt #: 149 total cpu time spent up to now is 116.1 secs Computing kpt #: 150 total cpu time spent up to now is 116.6 secs Computing kpt #: 151 total cpu time spent up to now is 117.2 secs Computing kpt #: 152 total cpu time spent up to now is 117.7 secs Computing kpt #: 153 total cpu time spent up to now is 118.2 secs Computing kpt #: 154 total cpu time spent up to now is 118.7 secs Computing kpt #: 155 total cpu time spent up to now is 119.3 secs Computing kpt #: 156 total cpu time spent up to now is 119.8 secs Computing kpt #: 157 total cpu time spent up to now is 120.3 secs Computing kpt #: 158 total cpu time spent up to now is 120.8 secs Computing kpt #: 159 total cpu time spent up to now is 121.4 secs Computing kpt #: 160 total cpu time spent up to now is 121.9 secs Computing kpt #: 161 total cpu time spent up to now is 122.4 secs Computing kpt #: 162 total cpu time spent up to now is 122.9 secs Computing kpt #: 163 total cpu time spent up to now is 123.5 secs Computing kpt #: 164 total cpu time spent up to now is 124.1 secs Computing kpt #: 165 total cpu time spent up to now is 124.8 secs Computing kpt #: 166 total cpu time spent up to now is 125.4 secs Computing kpt #: 167 total cpu time spent up to now is 126.0 secs Computing kpt #: 168 total cpu time spent up to now is 126.6 secs Computing kpt #: 169 total cpu time spent up to now is 127.3 secs Computing kpt #: 170 total cpu time spent up to now is 128.0 secs Computing kpt #: 171 total cpu time spent up to now is 128.7 secs Computing kpt #: 172 total cpu time spent up to now is 129.4 secs Computing kpt #: 173 total cpu time spent up to now is 130.1 secs Computing kpt #: 174 total cpu time spent up to now is 130.8 secs Computing kpt #: 175 total cpu time spent up to now is 131.4 secs Computing kpt #: 176 total cpu time spent up to now is 132.0 secs Computing kpt #: 177 total cpu time spent up to now is 132.7 secs Computing kpt #: 178 total cpu time spent up to now is 133.3 secs Computing kpt #: 179 total cpu time spent up to now is 133.9 secs Computing kpt #: 180 total cpu time spent up to now is 134.5 secs Computing kpt #: 181 total cpu time spent up to now is 135.1 secs Computing kpt #: 182 total cpu time spent up to now is 135.7 secs Computing kpt #: 183 total cpu time spent up to now is 136.3 secs Computing kpt #: 184 total cpu time spent up to now is 137.0 secs Computing kpt #: 185 total cpu time spent up to now is 137.6 secs Computing kpt #: 186 total cpu time spent up to now is 138.2 secs Computing kpt #: 187 total cpu time spent up to now is 138.9 secs Computing kpt #: 188 total cpu time spent up to now is 139.5 secs Computing kpt #: 189 total cpu time spent up to now is 140.1 secs Computing kpt #: 190 total cpu time spent up to now is 140.7 secs Computing kpt #: 191 total cpu time spent up to now is 141.4 secs Computing kpt #: 192 total cpu time spent up to now is 142.0 secs Computing kpt #: 193 total cpu time spent up to now is 142.6 secs Computing kpt #: 194 total cpu time spent up to now is 143.3 secs Computing kpt #: 195 total cpu time spent up to now is 143.9 secs Computing kpt #: 196 total cpu time spent up to now is 144.5 secs Computing kpt #: 197 total cpu time spent up to now is 145.1 secs Computing kpt #: 198 total cpu time spent up to now is 145.7 secs Computing kpt #: 199 total cpu time spent up to now is 146.3 secs Computing kpt #: 200 total cpu time spent up to now is 146.9 secs Computing kpt #: 201 total cpu time spent up to now is 147.5 secs Computing kpt #: 202 total cpu time spent up to now is 148.1 secs Computing kpt #: 203 total cpu time spent up to now is 148.8 secs Computing kpt #: 204 total cpu time spent up to now is 149.4 secs Computing kpt #: 205 total cpu time spent up to now is 150.0 secs Computing kpt #: 206 total cpu time spent up to now is 150.5 secs Computing kpt #: 207 total cpu time spent up to now is 151.1 secs Computing kpt #: 208 total cpu time spent up to now is 151.7 secs Computing kpt #: 209 total cpu time spent up to now is 152.2 secs Computing kpt #: 210 total cpu time spent up to now is 152.8 secs Computing kpt #: 211 total cpu time spent up to now is 153.3 secs Computing kpt #: 212 total cpu time spent up to now is 153.9 secs Computing kpt #: 213 total cpu time spent up to now is 154.5 secs Computing kpt #: 214 total cpu time spent up to now is 155.0 secs Computing kpt #: 215 total cpu time spent up to now is 155.6 secs Computing kpt #: 216 total cpu time spent up to now is 156.1 secs Computing kpt #: 217 total cpu time spent up to now is 156.8 secs Computing kpt #: 218 total cpu time spent up to now is 157.4 secs Computing kpt #: 219 total cpu time spent up to now is 158.0 secs Computing kpt #: 220 total cpu time spent up to now is 158.7 secs Computing kpt #: 221 total cpu time spent up to now is 159.4 secs Computing kpt #: 222 total cpu time spent up to now is 160.0 secs Computing kpt #: 223 total cpu time spent up to now is 160.8 secs Computing kpt #: 224 total cpu time spent up to now is 161.7 secs Computing kpt #: 225 total cpu time spent up to now is 162.5 secs Computing kpt #: 226 total cpu time spent up to now is 163.5 secs Computing kpt #: 227 total cpu time spent up to now is 164.6 secs Computing kpt #: 228 total cpu time spent up to now is 165.8 secs Computing kpt #: 229 total cpu time spent up to now is 166.5 secs Computing kpt #: 230 total cpu time spent up to now is 167.6 secs Computing kpt #: 231 total cpu time spent up to now is 168.8 secs Computing kpt #: 232 total cpu time spent up to now is 169.9 secs Computing kpt #: 233 total cpu time spent up to now is 171.5 secs Computing kpt #: 234 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 173.2 secs Computing kpt #: 235 total cpu time spent up to now is 173.8 secs Computing kpt #: 236 total cpu time spent up to now is 174.5 secs Computing kpt #: 237 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 176.1 secs Computing kpt #: 238 total cpu time spent up to now is 177.3 secs Computing kpt #: 239 total cpu time spent up to now is 178.2 secs Computing kpt #: 240 total cpu time spent up to now is 178.8 secs Computing kpt #: 241 total cpu time spent up to now is 179.6 secs Computing kpt #: 242 total cpu time spent up to now is 180.3 secs Computing kpt #: 243 total cpu time spent up to now is 180.9 secs Computing kpt #: 244 total cpu time spent up to now is 181.6 secs Computing kpt #: 245 total cpu time spent up to now is 182.2 secs Computing kpt #: 246 total cpu time spent up to now is 182.8 secs Computing kpt #: 247 total cpu time spent up to now is 183.5 secs Computing kpt #: 248 total cpu time spent up to now is 184.1 secs Computing kpt #: 249 total cpu time spent up to now is 184.7 secs Computing kpt #: 250 total cpu time spent up to now is 185.3 secs Computing kpt #: 251 total cpu time spent up to now is 185.9 secs Computing kpt #: 252 total cpu time spent up to now is 186.6 secs Computing kpt #: 253 total cpu time spent up to now is 187.2 secs Computing kpt #: 254 total cpu time spent up to now is 187.8 secs Computing kpt #: 255 total cpu time spent up to now is 188.4 secs Computing kpt #: 256 total cpu time spent up to now is 189.0 secs Computing kpt #: 257 total cpu time spent up to now is 189.6 secs Computing kpt #: 258 total cpu time spent up to now is 190.2 secs Computing kpt #: 259 total cpu time spent up to now is 190.7 secs Computing kpt #: 260 total cpu time spent up to now is 191.4 secs Computing kpt #: 261 total cpu time spent up to now is 192.0 secs Computing kpt #: 262 total cpu time spent up to now is 192.6 secs Computing kpt #: 263 total cpu time spent up to now is 193.2 secs Computing kpt #: 264 total cpu time spent up to now is 193.9 secs Computing kpt #: 265 total cpu time spent up to now is 194.5 secs Computing kpt #: 266 total cpu time spent up to now is 195.1 secs Computing kpt #: 267 total cpu time spent up to now is 195.7 secs Computing kpt #: 268 total cpu time spent up to now is 196.3 secs Computing kpt #: 269 total cpu time spent up to now is 196.9 secs Computing kpt #: 270 total cpu time spent up to now is 197.5 secs Computing kpt #: 271 total cpu time spent up to now is 198.2 secs Computing kpt #: 272 total cpu time spent up to now is 198.8 secs Computing kpt #: 273 total cpu time spent up to now is 199.5 secs Computing kpt #: 274 total cpu time spent up to now is 200.1 secs Computing kpt #: 275 total cpu time spent up to now is 200.6 secs Computing kpt #: 276 total cpu time spent up to now is 201.1 secs Computing kpt #: 277 total cpu time spent up to now is 201.7 secs Computing kpt #: 278 total cpu time spent up to now is 202.3 secs Computing kpt #: 279 total cpu time spent up to now is 202.9 secs Computing kpt #: 280 total cpu time spent up to now is 203.5 secs Computing kpt #: 281 total cpu time spent up to now is 204.2 secs Computing kpt #: 282 total cpu time spent up to now is 204.8 secs Computing kpt #: 283 total cpu time spent up to now is 205.4 secs Computing kpt #: 284 total cpu time spent up to now is 206.0 secs Computing kpt #: 285 total cpu time spent up to now is 206.6 secs Computing kpt #: 286 total cpu time spent up to now is 207.2 secs Computing kpt #: 287 total cpu time spent up to now is 207.7 secs Computing kpt #: 288 total cpu time spent up to now is 208.3 secs Computing kpt #: 289 total cpu time spent up to now is 208.8 secs Computing kpt #: 290 total cpu time spent up to now is 209.4 secs Computing kpt #: 291 total cpu time spent up to now is 210.0 secs Computing kpt #: 292 total cpu time spent up to now is 210.6 secs Computing kpt #: 293 total cpu time spent up to now is 211.1 secs Computing kpt #: 294 total cpu time spent up to now is 211.7 secs Computing kpt #: 295 total cpu time spent up to now is 212.3 secs Computing kpt #: 296 total cpu time spent up to now is 212.9 secs Computing kpt #: 297 total cpu time spent up to now is 213.5 secs Computing kpt #: 298 total cpu time spent up to now is 214.1 secs Computing kpt #: 299 total cpu time spent up to now is 214.7 secs Computing kpt #: 300 total cpu time spent up to now is 215.3 secs Computing kpt #: 301 total cpu time spent up to now is 216.0 secs Computing kpt #: 302 total cpu time spent up to now is 216.6 secs Computing kpt #: 303 total cpu time spent up to now is 217.3 secs Computing kpt #: 304 total cpu time spent up to now is 218.0 secs Computing kpt #: 305 total cpu time spent up to now is 219.1 secs Computing kpt #: 306 total cpu time spent up to now is 219.9 secs Computing kpt #: 307 total cpu time spent up to now is 221.3 secs Computing kpt #: 308 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 223.1 secs Computing kpt #: 309 total cpu time spent up to now is 224.0 secs Computing kpt #: 310 total cpu time spent up to now is 224.7 secs Computing kpt #: 311 total cpu time spent up to now is 225.4 secs Computing kpt #: 312 total cpu time spent up to now is 226.1 secs Computing kpt #: 313 total cpu time spent up to now is 226.7 secs Computing kpt #: 314 total cpu time spent up to now is 227.4 secs Computing kpt #: 315 total cpu time spent up to now is 228.1 secs Computing kpt #: 316 total cpu time spent up to now is 228.7 secs Computing kpt #: 317 total cpu time spent up to now is 229.4 secs Computing kpt #: 318 total cpu time spent up to now is 230.0 secs Computing kpt #: 319 total cpu time spent up to now is 230.7 secs Computing kpt #: 320 total cpu time spent up to now is 231.3 secs Computing kpt #: 321 total cpu time spent up to now is 231.8 secs Computing kpt #: 322 total cpu time spent up to now is 232.4 secs Computing kpt #: 323 total cpu time spent up to now is 233.1 secs Computing kpt #: 324 total cpu time spent up to now is 233.8 secs Computing kpt #: 325 total cpu time spent up to now is 234.5 secs Computing kpt #: 326 total cpu time spent up to now is 235.2 secs Computing kpt #: 327 total cpu time spent up to now is 235.8 secs Computing kpt #: 328 total cpu time spent up to now is 236.5 secs Computing kpt #: 329 total cpu time spent up to now is 237.1 secs Computing kpt #: 330 total cpu time spent up to now is 237.8 secs Computing kpt #: 331 total cpu time spent up to now is 238.5 secs Computing kpt #: 332 total cpu time spent up to now is 239.1 secs Computing kpt #: 333 total cpu time spent up to now is 239.8 secs Computing kpt #: 334 total cpu time spent up to now is 240.4 secs Computing kpt #: 335 total cpu time spent up to now is 241.0 secs Computing kpt #: 336 total cpu time spent up to now is 241.6 secs Computing kpt #: 337 total cpu time spent up to now is 242.2 secs Computing kpt #: 338 total cpu time spent up to now is 242.8 secs Computing kpt #: 339 total cpu time spent up to now is 243.3 secs Computing kpt #: 340 total cpu time spent up to now is 243.8 secs Computing kpt #: 341 total cpu time spent up to now is 244.3 secs Computing kpt #: 342 total cpu time spent up to now is 244.8 secs Computing kpt #: 343 total cpu time spent up to now is 245.3 secs Computing kpt #: 344 total cpu time spent up to now is 245.8 secs Computing kpt #: 345 total cpu time spent up to now is 246.3 secs Computing kpt #: 346 total cpu time spent up to now is 246.8 secs Computing kpt #: 347 total cpu time spent up to now is 247.3 secs Computing kpt #: 348 total cpu time spent up to now is 247.8 secs Computing kpt #: 349 total cpu time spent up to now is 248.3 secs Computing kpt #: 350 total cpu time spent up to now is 248.8 secs Computing kpt #: 351 total cpu time spent up to now is 249.4 secs Computing kpt #: 352 total cpu time spent up to now is 250.0 secs Computing kpt #: 353 total cpu time spent up to now is 250.5 secs Computing kpt #: 354 total cpu time spent up to now is 251.1 secs Computing kpt #: 355 total cpu time spent up to now is 251.7 secs Computing kpt #: 356 total cpu time spent up to now is 252.3 secs Computing kpt #: 357 total cpu time spent up to now is 252.8 secs Computing kpt #: 358 total cpu time spent up to now is 253.4 secs Computing kpt #: 359 total cpu time spent up to now is 254.0 secs Computing kpt #: 360 total cpu time spent up to now is 254.6 secs Computing kpt #: 361 total cpu time spent up to now is 255.2 secs Computing kpt #: 362 total cpu time spent up to now is 255.7 secs Computing kpt #: 363 total cpu time spent up to now is 256.3 secs Computing kpt #: 364 total cpu time spent up to now is 256.8 secs Computing kpt #: 365 total cpu time spent up to now is 257.3 secs Computing kpt #: 366 total cpu time spent up to now is 257.9 secs Computing kpt #: 367 total cpu time spent up to now is 258.4 secs Computing kpt #: 368 total cpu time spent up to now is 258.9 secs Computing kpt #: 369 total cpu time spent up to now is 259.4 secs Computing kpt #: 370 total cpu time spent up to now is 260.0 secs Computing kpt #: 371 total cpu time spent up to now is 260.5 secs Computing kpt #: 372 total cpu time spent up to now is 261.0 secs Computing kpt #: 373 total cpu time spent up to now is 261.5 secs Computing kpt #: 374 total cpu time spent up to now is 262.0 secs Computing kpt #: 375 total cpu time spent up to now is 262.5 secs Computing kpt #: 376 total cpu time spent up to now is 263.0 secs Computing kpt #: 377 total cpu time spent up to now is 263.5 secs Computing kpt #: 378 total cpu time spent up to now is 264.0 secs Computing kpt #: 379 total cpu time spent up to now is 264.5 secs Computing kpt #: 380 total cpu time spent up to now is 265.0 secs Computing kpt #: 381 total cpu time spent up to now is 265.7 secs Computing kpt #: 382 total cpu time spent up to now is 266.3 secs Computing kpt #: 383 total cpu time spent up to now is 266.9 secs Computing kpt #: 384 total cpu time spent up to now is 267.5 secs Computing kpt #: 385 total cpu time spent up to now is 268.2 secs Computing kpt #: 386 total cpu time spent up to now is 268.8 secs Computing kpt #: 387 total cpu time spent up to now is 269.4 secs Computing kpt #: 388 total cpu time spent up to now is 270.0 secs Computing kpt #: 389 total cpu time spent up to now is 270.6 secs Computing kpt #: 390 total cpu time spent up to now is 271.3 secs Computing kpt #: 391 total cpu time spent up to now is 271.9 secs Computing kpt #: 392 total cpu time spent up to now is 272.5 secs Computing kpt #: 393 total cpu time spent up to now is 273.1 secs Computing kpt #: 394 total cpu time spent up to now is 273.7 secs Computing kpt #: 395 total cpu time spent up to now is 274.3 secs Computing kpt #: 396 total cpu time spent up to now is 274.9 secs Computing kpt #: 397 total cpu time spent up to now is 275.6 secs Computing kpt #: 398 total cpu time spent up to now is 276.2 secs Computing kpt #: 399 total cpu time spent up to now is 276.8 secs Computing kpt #: 400 total cpu time spent up to now is 277.4 secs Computing kpt #: 401 total cpu time spent up to now is 277.9 secs Computing kpt #: 402 total cpu time spent up to now is 278.5 secs Computing kpt #: 403 total cpu time spent up to now is 279.0 secs Computing kpt #: 404 total cpu time spent up to now is 279.5 secs Computing kpt #: 405 total cpu time spent up to now is 280.0 secs Computing kpt #: 406 total cpu time spent up to now is 280.6 secs Computing kpt #: 407 total cpu time spent up to now is 281.2 secs Computing kpt #: 408 total cpu time spent up to now is 281.8 secs Computing kpt #: 409 total cpu time spent up to now is 282.4 secs Computing kpt #: 410 total cpu time spent up to now is 283.0 secs Computing kpt #: 411 total cpu time spent up to now is 283.6 secs Computing kpt #: 412 total cpu time spent up to now is 284.2 secs Computing kpt #: 413 total cpu time spent up to now is 284.8 secs Computing kpt #: 414 total cpu time spent up to now is 285.3 secs Computing kpt #: 415 total cpu time spent up to now is 285.8 secs Computing kpt #: 416 total cpu time spent up to now is 286.3 secs Computing kpt #: 417 total cpu time spent up to now is 286.8 secs Computing kpt #: 418 total cpu time spent up to now is 287.3 secs Computing kpt #: 419 total cpu time spent up to now is 287.8 secs Computing kpt #: 420 total cpu time spent up to now is 288.3 secs ethr = 1.92E-08, avg # of iterations = 29.6 total cpu time spent up to now is 288.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5131 PWs) bands (ev): -12.9762 -12.9762 -12.0505 -12.0505 -8.9989 -8.9989 -8.7081 -8.7081 -8.3903 -8.3903 -8.2922 -8.2922 -8.2252 -8.2252 -7.8396 -7.8396 -7.6331 -7.6331 -7.5059 -7.5059 -7.4226 -7.4226 -7.2758 -7.2758 -7.2673 -7.2673 -6.1915 -6.1915 0.2592 0.2592 0.9440 0.9440 1.6617 1.6617 1.7936 1.7936 3.8303 3.8303 3.8907 3.8907 4.0847 4.0847 4.2300 4.2300 4.3500 4.3500 4.6630 4.6630 4.6867 4.6867 4.9021 4.9021 7.2270 7.2270 9.7005 9.7005 11.0714 11.0714 11.4081 11.4081 13.1548 13.1548 k = 0.0114-0.0000-0.0000 ( 5131 PWs) bands (ev): -12.9757 -12.9757 -12.0507 -12.0507 -8.9991 -8.9991 -8.7099 -8.7099 -8.3888 -8.3888 -8.2919 -8.2919 -8.2245 -8.2245 -7.8395 -7.8395 -7.6325 -7.6325 -7.5058 -7.5058 -7.4223 -7.4223 -7.2796 -7.2796 -7.2633 -7.2633 -6.1920 -6.1920 0.2591 0.2591 0.9450 0.9450 1.6618 1.6618 1.7926 1.7926 3.8295 3.8295 3.8842 3.8842 4.0838 4.0838 4.2294 4.2294 4.3493 4.3493 4.6545 4.6545 4.6924 4.6924 4.8984 4.8984 7.2339 7.2339 9.7032 9.7032 11.0750 11.0750 11.4141 11.4141 13.1497 13.1497 k = 0.0227-0.0000-0.0000 ( 5129 PWs) bands (ev): -12.9745 -12.9745 -12.0512 -12.0512 -8.9995 -8.9995 -8.7148 -8.7148 -8.3845 -8.3845 -8.2908 -8.2908 -8.2224 -8.2224 -7.8392 -7.8392 -7.6305 -7.6305 -7.5053 -7.5053 -7.4216 -7.4216 -7.2857 -7.2857 -7.2565 -7.2565 -6.1934 -6.1934 0.2587 0.2587 0.9479 0.9479 1.6621 1.6621 1.7896 1.7896 3.8272 3.8272 3.8652 3.8652 4.0807 4.0807 4.2274 4.2274 4.3472 4.3472 4.6371 4.6371 4.7015 4.7015 4.8876 4.8876 7.2543 7.2543 9.7112 9.7112 11.0857 11.0857 11.4319 11.4319 13.1345 13.1345 k = 0.0341-0.0000-0.0000 ( 5125 PWs) bands (ev): -12.9724 -12.9724 -12.0521 -12.0521 -9.0001 -9.0001 -8.7227 -8.7227 -8.3780 -8.3780 -8.2888 -8.2888 -8.2190 -8.2190 -7.8387 -7.8387 -7.6273 -7.6273 -7.5045 -7.5045 -7.4205 -7.4205 -7.2919 -7.2919 -7.2490 -7.2490 -6.1958 -6.1958 0.2582 0.2582 0.9528 0.9528 1.6623 1.6623 1.7850 1.7850 3.8226 3.8226 3.8349 3.8349 4.0749 4.0749 4.2236 4.2236 4.3440 4.3440 4.6152 4.6152 4.7101 4.7101 4.8701 4.8701 7.2877 7.2877 9.7241 9.7241 11.1032 11.1032 11.4613 11.4613 13.1102 13.1102 k = 0.0455-0.0000-0.0000 ( 5117 PWs) bands (ev): -12.9695 -12.9695 -12.0533 -12.0533 -9.0010 -9.0010 -8.7329 -8.7329 -8.3700 -8.3700 -8.2855 -8.2855 -8.2143 -8.2143 -7.8381 -7.8381 -7.6227 -7.6227 -7.5033 -7.5033 -7.4189 -7.4189 -7.2980 -7.2980 -7.2412 -7.2412 -6.1990 -6.1990 0.2574 0.2574 0.9596 0.9596 1.6617 1.6617 1.7795 1.7795 3.7911 3.7911 3.8191 3.8191 4.0656 4.0656 4.2171 4.2171 4.3400 4.3400 4.5901 4.5901 4.7178 4.7178 4.8471 4.8471 7.3330 7.3330 9.7416 9.7416 11.1274 11.1274 11.5020 11.5020 13.0775 13.0775 k = 0.0568-0.0000-0.0000 ( 5117 PWs) bands (ev): -12.9658 -12.9658 -12.0549 -12.0549 -9.0020 -9.0020 -8.7448 -8.7448 -8.3617 -8.3617 -8.2808 -8.2808 -8.2086 -8.2086 -7.8373 -7.8373 -7.6169 -7.6169 -7.5018 -7.5018 -7.4171 -7.4171 -7.3040 -7.3040 -7.2329 -7.2329 -6.2032 -6.2032 0.2564 0.2564 0.9683 0.9683 1.6594 1.6594 1.7741 1.7741 3.7393 3.7393 3.8120 3.8120 4.0522 4.0522 4.2068 4.2068 4.3358 4.3358 4.5626 4.5626 4.7248 4.7248 4.8196 4.8196 7.3891 7.3891 9.7631 9.7631 11.1578 11.1578 11.5533 11.5533 13.0370 13.0370 k = 0.0682-0.0000-0.0000 ( 5123 PWs) bands (ev): -12.9613 -12.9613 -12.0569 -12.0569 -9.0032 -9.0032 -8.7580 -8.7580 -8.3538 -8.3538 -8.2743 -8.2743 -8.2018 -8.2018 -7.8363 -7.8363 -7.6098 -7.6098 -7.5001 -7.5001 -7.4150 -7.4150 -7.3097 -7.3097 -7.2242 -7.2242 -6.2083 -6.2083 0.2551 0.2551 0.9790 0.9790 1.6545 1.6545 1.7701 1.7701 3.6783 3.6783 3.8036 3.8036 4.0341 4.0341 4.1912 4.1912 4.3318 4.3318 4.5340 4.5340 4.7315 4.7315 4.7892 4.7892 7.4546 7.4546 9.7878 9.7878 11.1940 11.1940 11.6145 11.6145 12.9893 12.9893 k = 0.0795-0.0000-0.0000 ( 5127 PWs) bands (ev): -12.9560 -12.9560 -12.0592 -12.0592 -9.0044 -9.0044 -8.7719 -8.7719 -8.3471 -8.3471 -8.2656 -8.2656 -8.1943 -8.1943 -7.8352 -7.8352 -7.6015 -7.6015 -7.4978 -7.4978 -7.4128 -7.4128 -7.3152 -7.3152 -7.2150 -7.2150 -6.2143 -6.2143 0.2534 0.2534 0.9915 0.9915 1.6458 1.6458 1.7685 1.7685 3.6092 3.6092 3.7936 3.7936 4.0110 4.0110 4.1688 4.1688 4.3285 4.3285 4.5055 4.5055 4.7380 4.7380 4.7573 4.7573 7.5282 7.5282 9.8148 9.8148 11.2354 11.2354 11.6849 11.6849 12.9353 12.9353 k = 0.0909-0.0000-0.0000 ( 5121 PWs) bands (ev): -12.9499 -12.9499 -12.0620 -12.0620 -9.0055 -9.0055 -8.7861 -8.7861 -8.3418 -8.3418 -8.2549 -8.2549 -8.1860 -8.1860 -7.8338 -7.8338 -7.5919 -7.5919 -7.4952 -7.4952 -7.4104 -7.4104 -7.3202 -7.3202 -7.2052 -7.2052 -6.2211 -6.2211 0.2514 0.2514 1.0059 1.0059 1.6331 1.6331 1.7699 1.7699 3.5333 3.5333 3.7820 3.7820 3.9824 3.9824 4.1383 4.1383 4.3259 4.3259 4.4784 4.4784 4.7254 4.7254 4.7446 4.7446 7.6086 7.6086 9.8432 9.8432 11.2815 11.2815 11.7635 11.7635 12.8758 12.8758 k = 0.1023-0.0000-0.0000 ( 5119 PWs) bands (ev): -12.9430 -12.9430 -12.0651 -12.0651 -9.0065 -9.0065 -8.8003 -8.8003 -8.3379 -8.3379 -8.2425 -8.2425 -8.1773 -8.1773 -7.8324 -7.8324 -7.5811 -7.5811 -7.4920 -7.4920 -7.4080 -7.4080 -7.3248 -7.3248 -7.1948 -7.1948 -6.2288 -6.2288 0.2490 0.2490 1.0221 1.0221 1.6166 1.6166 1.7741 1.7741 3.4516 3.4516 3.7688 3.7688 3.9481 3.9481 4.0994 4.0994 4.3234 4.3234 4.4538 4.4538 4.6952 4.6952 4.7512 4.7512 7.6946 7.6946 9.8720 9.8720 11.3317 11.3317 11.8490 11.8490 12.8119 12.8119 k = 0.1136-0.0000-0.0000 ( 5127 PWs) bands (ev): -12.9354 -12.9354 -12.0686 -12.0686 -9.0074 -9.0074 -8.8143 -8.8143 -8.3352 -8.3352 -8.2291 -8.2291 -8.1683 -8.1683 -7.8309 -7.8309 -7.5695 -7.5695 -7.4883 -7.4883 -7.4059 -7.4059 -7.3289 -7.3289 -7.1839 -7.1839 -6.2373 -6.2373 0.2461 0.2461 1.0401 1.0401 1.5971 1.5971 1.7805 1.7805 3.3651 3.3651 3.7538 3.7538 3.9079 3.9079 4.0526 4.0526 4.3199 4.3199 4.4327 4.4327 4.6680 4.6680 4.7579 4.7579 7.7850 7.7850 9.9001 9.9001 11.3855 11.3855 11.9400 11.9400 12.7452 12.7452 k = 0.1250-0.0000-0.0000 ( 5127 PWs) bands (ev): -12.9271 -12.9271 -12.0725 -12.0725 -9.0080 -9.0080 -8.8278 -8.8278 -8.3333 -8.3333 -8.2148 -8.2148 -8.1592 -8.1592 -7.8293 -7.8293 -7.5571 -7.5571 -7.4837 -7.4837 -7.4041 -7.4041 -7.3323 -7.3323 -7.1721 -7.1721 -6.2466 -6.2466 0.2428 0.2428 1.0598 1.0598 1.5753 1.5753 1.7883 1.7883 3.2750 3.2750 3.7369 3.7369 3.8617 3.8617 3.9990 3.9990 4.3136 4.3136 4.4164 4.4164 4.6446 4.6446 4.7648 4.7648 7.8788 7.8788 9.9265 9.9265 11.4424 11.4424 12.0341 12.0341 12.6780 12.6780 k = 0.1364-0.0000-0.0000 ( 5127 PWs) bands (ev): -12.9181 -12.9181 -12.0769 -12.0769 -9.0083 -9.0083 -8.8407 -8.8407 -8.3319 -8.3319 -8.2002 -8.2002 -8.1503 -8.1503 -7.8275 -7.8275 -7.5447 -7.5447 -7.4777 -7.4777 -7.4027 -7.4027 -7.3348 -7.3348 -7.1596 -7.1596 -6.2566 -6.2566 0.2389 0.2389 1.0813 1.0813 1.5521 1.5521 1.7969 1.7969 3.1823 3.1823 3.7181 3.7181 3.8099 3.8099 3.9397 3.9397 4.3026 4.3026 4.4063 4.4063 4.6255 4.6255 4.7718 4.7718 7.9751 7.9751 9.9500 9.9500 11.5019 11.5019 12.1271 12.1271 12.6145 12.6145 k = 0.1477-0.0000-0.0000 ( 5123 PWs) bands (ev): -12.9084 -12.9084 -12.0816 -12.0816 -9.0081 -9.0081 -8.8529 -8.8529 -8.3311 -8.3311 -8.1854 -8.1854 -8.1418 -8.1418 -7.8257 -7.8257 -7.5327 -7.5327 -7.4700 -7.4700 -7.4020 -7.4020 -7.3364 -7.3364 -7.1462 -7.1462 -6.2673 -6.2673 0.2344 0.2344 1.1044 1.1044 1.5281 1.5281 1.8053 1.8053 3.0882 3.0882 3.6970 3.6970 3.7530 3.7530 3.8764 3.8764 4.2864 4.2864 4.4026 4.4026 4.6106 4.6106 4.7789 4.7789 8.0730 8.0730 9.9699 9.9699 11.5636 11.5636 12.2092 12.2092 12.5647 12.5647 k = 0.1591-0.0000-0.0000 ( 5115 PWs) bands (ev): -12.8981 -12.8981 -12.0868 -12.0868 -9.0075 -9.0075 -8.8642 -8.8642 -8.3305 -8.3305 -8.1705 -8.1705 -8.1337 -8.1337 -7.8238 -7.8238 -7.5222 -7.5222 -7.4597 -7.4597 -7.4020 -7.4020 -7.3370 -7.3370 -7.1320 -7.1320 -6.2786 -6.2786 0.2294 0.2294 1.1290 1.1290 1.5037 1.5037 1.8130 1.8130 2.9937 2.9937 3.6713 3.6713 3.6936 3.6936 3.8103 3.8103 4.2660 4.2660 4.4041 4.4041 4.5994 4.5994 4.7861 4.7861 8.1717 8.1717 9.9851 9.9851 11.6274 11.6274 12.2560 12.2560 12.5530 12.5530 k = 0.1705-0.0000-0.0000 ( 5111 PWs) bands (ev): -12.8872 -12.8872 -12.0925 -12.0925 -9.0064 -9.0064 -8.8745 -8.8745 -8.3302 -8.3302 -8.1556 -8.1556 -8.1263 -8.1263 -7.8220 -7.8220 -7.5136 -7.5136 -7.4466 -7.4466 -7.4027 -7.4027 -7.3367 -7.3367 -7.1169 -7.1169 -6.2905 -6.2905 0.2238 0.2238 1.1551 1.1551 1.4796 1.4796 1.8188 1.8188 2.9001 2.9001 3.6212 3.6212 3.6511 3.6511 3.7438 3.7438 4.2432 4.2432 4.4091 4.4091 4.5915 4.5915 4.7933 4.7933 8.2705 8.2705 9.9949 9.9949 11.6930 11.6930 12.2456 12.2456 12.6015 12.6015 k = 0.1818-0.0000-0.0000 ( 5109 PWs) bands (ev): -12.8757 -12.8757 -12.0986 -12.0986 -9.0048 -9.0048 -8.8839 -8.8839 -8.3300 -8.3300 -8.1409 -8.1409 -8.1196 -8.1196 -7.8201 -7.8201 -7.5071 -7.5071 -7.4310 -7.4310 -7.4039 -7.4039 -7.3353 -7.3353 -7.1010 -7.1010 -6.3028 -6.3028 0.2175 0.2175 1.1824 1.1824 1.4563 1.4563 1.8217 1.8217 2.8086 2.8086 3.5537 3.5537 3.6159 3.6159 3.6811 3.6811 4.2191 4.2191 4.4166 4.4166 4.5862 4.5862 4.8004 4.8004 8.3688 8.3688 9.9989 9.9989 11.7599 11.7599 12.1978 12.1978 12.6907 12.6907 k = 0.1932-0.0000-0.0000 ( 5109 PWs) bands (ev): -12.8636 -12.8636 -12.1052 -12.1052 -9.0025 -9.0025 -8.8922 -8.8922 -8.3300 -8.3300 -8.1266 -8.1266 -8.1135 -8.1135 -7.8184 -7.8184 -7.5024 -7.5024 -7.4134 -7.4134 -7.4055 -7.4055 -7.3331 -7.3331 -7.0842 -7.0842 -6.3156 -6.3156 0.2106 0.2106 1.2106 1.2106 1.4343 1.4343 1.8204 1.8204 2.7208 2.7208 3.4830 3.4830 3.5667 3.5667 3.6309 3.6309 4.1945 4.1945 4.4258 4.4258 4.5829 4.5829 4.8074 4.8074 8.4658 8.4658 9.9968 9.9968 11.8274 11.8274 12.1377 12.1377 12.7965 12.7965 k = 0.2045-0.0000-0.0000 ( 5089 PWs) bands (ev): -12.8510 -12.8510 -12.1121 -12.1121 -8.9996 -8.9996 -8.8994 -8.8994 -8.3300 -8.3300 -8.1138 -8.1138 -8.1069 -8.1069 -7.8165 -7.8165 -7.4991 -7.4991 -7.4073 -7.4073 -7.3946 -7.3946 -7.3299 -7.3299 -7.0664 -7.0664 -6.3286 -6.3286 0.2032 0.2032 1.2392 1.2392 1.4145 1.4145 1.8132 1.8132 2.6384 2.6384 3.4110 3.4110 3.5035 3.5035 3.5934 3.5934 4.1700 4.1700 4.4363 4.4363 4.5811 4.5811 4.8142 4.8142 8.5608 8.5608 9.9883 9.9883 11.8923 11.8923 12.0783 12.0783 12.9091 12.9091 k = 0.2159-0.0000-0.0000 ( 5099 PWs) bands (ev): -12.8379 -12.8379 -12.1196 -12.1196 -8.9961 -8.9961 -8.9056 -8.9056 -8.3301 -8.3301 -8.1068 -8.1068 -8.0957 -8.0957 -7.8148 -7.8148 -7.4969 -7.4969 -7.4091 -7.4091 -7.3760 -7.3760 -7.3257 -7.3257 -7.0479 -7.0479 -6.3418 -6.3418 0.1953 0.1953 1.2667 1.2667 1.3985 1.3985 1.7984 1.7984 2.5629 2.5629 3.3384 3.3384 3.4353 3.4353 3.5601 3.5601 4.1457 4.1457 4.4477 4.4477 4.5803 4.5803 4.8206 4.8206 8.6533 8.6533 9.9738 9.9738 11.9358 11.9358 12.0428 12.0428 13.0243 13.0243 k = 0.2273-0.0000-0.0000 ( 5095 PWs) bands (ev): -12.8243 -12.8243 -12.1276 -12.1276 -8.9918 -8.9918 -8.9108 -8.9108 -8.3302 -8.3302 -8.1032 -8.1032 -8.0822 -8.0822 -7.8131 -7.8131 -7.4957 -7.4957 -7.4108 -7.4108 -7.3587 -7.3587 -7.3196 -7.3196 -7.0285 -7.0285 -6.3551 -6.3551 0.1870 0.1870 1.2895 1.2895 1.3899 1.3899 1.7741 1.7741 2.4959 2.4959 3.2663 3.2663 3.3664 3.3664 3.5273 3.5273 4.1221 4.1221 4.4601 4.4601 4.5803 4.5803 4.8267 4.8267 8.7424 8.7424 9.9534 9.9534 11.9130 11.9130 12.0784 12.0784 13.1404 13.1404 k = 0.2386-0.0000-0.0000 ( 5091 PWs) bands (ev): -12.8103 -12.8103 -12.1360 -12.1360 -8.9870 -8.9870 -8.9148 -8.9148 -8.3303 -8.3303 -8.1009 -8.1009 -8.0685 -8.0685 -7.8114 -7.8114 -7.4953 -7.4953 -7.4122 -7.4122 -7.3446 -7.3446 -7.3102 -7.3102 -7.0083 -7.0083 -6.3683 -6.3683 0.1783 0.1783 1.3011 1.3011 1.3955 1.3955 1.7393 1.7393 2.4383 2.4383 3.1955 3.1955 3.2988 3.2988 3.4938 3.4938 4.0993 4.0993 4.4730 4.4730 4.5807 4.5807 4.8323 4.8323 8.8275 8.8275 9.9277 9.9277 11.8631 11.8631 12.1469 12.1469 13.2561 13.2561 k = 0.2500-0.0000-0.0000 ( 5087 PWs) bands (ev): -12.7959 -12.7959 -12.1449 -12.1449 -8.9815 -8.9815 -8.9178 -8.9178 -8.3303 -8.3303 -8.0996 -8.0996 -8.0550 -8.0550 -7.8098 -7.8098 -7.4956 -7.4956 -7.4133 -7.4133 -7.3350 -7.3350 -7.2969 -7.2969 -6.9873 -6.9873 -6.3812 -6.3812 0.1695 0.1695 1.2996 1.2996 1.4169 1.4169 1.6936 1.6936 2.3898 2.3898 3.1268 3.1268 3.2334 3.2334 3.4593 3.4593 4.0775 4.0775 4.4866 4.4866 4.5813 4.5813 4.8373 4.8373 8.9079 8.9079 9.8973 9.8973 11.8131 11.8131 12.2226 12.2226 13.3709 13.3709 k = 0.2614-0.0000-0.0000 ( 5095 PWs) bands (ev): -12.7812 -12.7812 -12.1542 -12.1542 -8.9754 -8.9754 -8.9199 -8.9199 -8.3303 -8.3303 -8.0992 -8.0992 -8.0419 -8.0419 -7.8083 -7.8083 -7.4966 -7.4966 -7.4142 -7.4142 -7.3288 -7.3288 -7.2812 -7.2812 -6.9656 -6.9656 -6.3938 -6.3938 0.1606 0.1606 1.2914 1.2914 1.4480 1.4480 1.6380 1.6380 2.3491 2.3491 3.0610 3.0610 3.1712 3.1712 3.4236 3.4236 4.0570 4.0570 4.5006 4.5006 4.5817 4.5817 4.8418 4.8418 8.9829 8.9829 9.8629 9.8629 11.7682 11.7682 12.3011 12.3011 13.4841 13.4841 k = 0.2727-0.0000-0.0000 ( 5103 PWs) bands (ev): -12.7661 -12.7661 -12.1640 -12.1640 -8.9687 -8.9687 -8.9209 -8.9209 -8.3301 -8.3301 -8.0996 -8.0996 -8.0290 -8.0290 -7.8069 -7.8069 -7.4980 -7.4980 -7.4149 -7.4149 -7.3242 -7.3242 -7.2652 -7.2652 -6.9432 -6.9432 -6.4059 -6.4059 0.1518 0.1518 1.2811 1.2811 1.4837 1.4837 1.5744 1.5744 2.3135 2.3135 2.9990 2.9990 3.1127 3.1127 3.3867 3.3867 4.0381 4.0381 4.5149 4.5149 4.5817 4.5817 4.8456 4.8456 9.0518 9.0518 9.8252 9.8252 11.7302 11.7302 12.3812 12.3812 13.5955 13.5955 k = 0.2841-0.0000-0.0000 ( 5095 PWs) bands (ev): -12.7507 -12.7507 -12.1742 -12.1742 -8.9615 -8.9615 -8.9210 -8.9210 -8.3297 -8.3297 -8.1009 -8.1009 -8.0163 -8.0163 -7.8056 -7.8056 -7.4998 -7.4998 -7.4153 -7.4153 -7.3202 -7.3202 -7.2499 -7.2499 -6.9202 -6.9202 -6.4172 -6.4172 0.1434 0.1434 1.2705 1.2705 1.5024 1.5024 1.5249 1.5249 2.2803 2.2803 2.9416 2.9416 3.0586 3.0586 3.3487 3.3487 4.0211 4.0211 4.5296 4.5296 4.5812 4.5812 4.8487 4.8487 9.1139 9.1139 9.7851 9.7851 11.7005 11.7005 12.4622 12.4622 13.7046 13.7046 k = 0.2955-0.0000-0.0000 ( 5091 PWs) bands (ev): -12.7350 -12.7350 -12.1849 -12.1849 -8.9538 -8.9538 -8.9202 -8.9202 -8.3292 -8.3292 -8.1028 -8.1028 -8.0040 -8.0040 -7.8045 -7.8045 -7.5018 -7.5018 -7.4155 -7.4155 -7.3167 -7.3167 -7.2361 -7.2361 -6.8968 -6.8968 -6.4277 -6.4277 0.1355 0.1355 1.2602 1.2602 1.4308 1.4308 1.5639 1.5639 2.2470 2.2470 2.8894 2.8894 3.0095 3.0095 3.3094 3.3094 4.0061 4.0061 4.5445 4.5445 4.5798 4.5798 4.8510 4.8510 9.1686 9.1686 9.7433 9.7433 11.6798 11.6798 12.5435 12.5435 13.7597 13.7597 k = 0.3068-0.0000-0.0000 ( 5085 PWs) bands (ev): -12.7191 -12.7191 -12.1960 -12.1960 -8.9457 -8.9457 -8.9186 -8.9186 -8.3283 -8.3283 -8.1055 -8.1055 -7.9919 -7.9919 -7.8035 -7.8035 -7.5037 -7.5037 -7.4158 -7.4158 -7.3134 -7.3134 -7.2241 -7.2241 -6.8729 -6.8729 -6.4374 -6.4374 0.1283 0.1283 1.2489 1.2489 1.3576 1.3576 1.6058 1.6058 2.2115 2.2115 2.8424 2.8424 2.9657 2.9657 3.2691 3.2691 3.9937 3.9937 4.5595 4.5595 4.5775 4.5775 4.8527 4.8527 9.2156 9.2156 9.7006 9.7006 11.6688 11.6688 12.6244 12.6244 13.7663 13.7663 k = 0.3182-0.0000-0.0000 ( 5093 PWs) bands (ev): -12.7030 -12.7030 -12.2075 -12.2075 -8.9373 -8.9373 -8.9162 -8.9162 -8.3272 -8.3272 -8.1091 -8.1091 -7.9803 -7.9803 -7.8028 -7.8028 -7.5057 -7.5057 -7.4163 -7.4163 -7.3103 -7.3103 -7.2142 -7.2142 -6.8488 -6.8488 -6.4462 -6.4462 0.1220 0.1220 1.2289 1.2289 1.2931 1.2931 1.6491 1.6491 2.1727 2.1727 2.8007 2.8007 2.9275 2.9275 3.2276 3.2276 3.9841 3.9841 4.5727 4.5727 4.5758 4.5758 4.8535 4.8535 9.2546 9.2546 9.6576 9.6576 11.6680 11.6680 12.7041 12.7041 13.7721 13.7721 k = 0.3295-0.0000-0.0000 ( 5094 PWs) bands (ev): -12.6867 -12.6867 -12.2194 -12.2194 -8.9287 -8.9287 -8.9132 -8.9132 -8.3258 -8.3258 -8.1132 -8.1132 -7.9690 -7.9690 -7.8023 -7.8023 -7.5076 -7.5076 -7.4169 -7.4169 -7.3072 -7.3072 -7.2065 -7.2065 -6.8245 -6.8245 -6.4539 -6.4539 0.1169 0.1169 1.1774 1.1774 1.2617 1.2617 1.6934 1.6934 2.1303 2.1303 2.7639 2.7639 2.8947 2.8947 3.1852 3.1852 3.9775 3.9775 4.5686 4.5686 4.5900 4.5900 4.8536 4.8536 9.2855 9.2855 9.6150 9.6150 11.6774 11.6774 12.7819 12.7819 13.7775 13.7775 k = 0.3409-0.0000-0.0000 ( 5096 PWs) bands (ev): -12.6702 -12.6702 -12.2317 -12.2317 -8.9200 -8.9200 -8.9097 -8.9097 -8.3240 -8.3240 -8.1181 -8.1181 -7.9581 -7.9581 -7.8021 -7.8021 -7.5092 -7.5092 -7.4178 -7.4178 -7.3042 -7.3042 -7.2010 -7.2010 -6.8002 -6.8002 -6.4606 -6.4606 0.1131 0.1131 1.1064 1.1064 1.2521 1.2521 1.7384 1.7384 2.0845 2.0845 2.7316 2.7316 2.8670 2.8670 3.1418 3.1418 3.9743 3.9743 4.5620 4.5620 4.6051 4.6051 4.8530 4.8530 9.3087 9.3087 9.5735 9.5735 11.6970 11.6970 12.8563 12.8563 13.7827 13.7827 k = 0.3523-0.0000-0.0000 ( 5104 PWs) bands (ev): -12.6536 -12.6536 -12.2444 -12.2444 -8.9115 -8.9115 -8.9056 -8.9056 -8.3217 -8.3217 -8.1236 -8.1236 -7.9475 -7.9475 -7.8023 -7.8023 -7.5105 -7.5105 -7.4190 -7.4190 -7.3011 -7.3011 -7.1975 -7.1975 -6.7760 -6.7760 -6.4664 -6.4664 0.1109 0.1109 1.0324 1.0324 1.2485 1.2485 1.7837 1.7837 2.0364 2.0364 2.7034 2.7034 2.8435 2.8435 3.0976 3.0976 3.9746 3.9746 4.5535 4.5535 4.6201 4.6201 4.8516 4.8516 9.3245 9.3245 9.5337 9.5337 11.7265 11.7265 12.9257 12.9257 13.7880 13.7880 k = 0.3636-0.0000-0.0000 ( 5100 PWs) bands (ev): -12.6369 -12.6369 -12.2574 -12.2574 -8.9030 -8.9030 -8.9009 -8.9009 -8.3189 -8.3189 -8.1297 -8.1297 -7.9372 -7.9372 -7.8027 -7.8027 -7.5112 -7.5112 -7.4206 -7.4206 -7.2980 -7.2980 -7.1960 -7.1960 -6.7522 -6.7522 -6.4714 -6.4714 0.1105 0.1105 0.9592 0.9592 1.2479 1.2479 1.8282 1.8282 1.9879 1.9879 2.6792 2.6792 2.8232 2.8232 3.0527 3.0527 3.9787 3.9787 4.5431 4.5431 4.6349 4.6349 4.8496 4.8496 9.3336 9.3336 9.4960 9.4960 11.7652 11.7652 12.9880 12.9880 13.7938 13.7938 k = 0.3750-0.0000-0.0000 ( 5092 PWs) bands (ev): -12.6201 -12.6201 -12.2708 -12.2708 -8.8963 -8.8963 -8.8945 -8.8945 -8.3155 -8.3155 -8.1364 -8.1364 -7.9273 -7.9273 -7.8035 -7.8035 -7.5114 -7.5114 -7.4226 -7.4226 -7.2948 -7.2948 -7.1962 -7.1962 -6.7287 -6.7287 -6.4757 -6.4757 0.1120 0.1120 0.8877 0.8877 1.2496 1.2496 1.8652 1.8652 1.9465 1.9465 2.6587 2.6587 2.8049 2.8049 3.0072 3.0072 3.9865 3.9865 4.5305 4.5305 4.6496 4.6496 4.8470 4.8470 9.3367 9.3367 9.4610 9.4610 11.8124 11.8124 13.0403 13.0403 13.8003 13.8003 k = 0.3864-0.0000-0.0000 ( 5080 PWs) bands (ev): -12.6032 -12.6032 -12.2845 -12.2845 -8.8911 -8.8911 -8.8868 -8.8868 -8.3114 -8.3114 -8.1435 -8.1435 -7.9177 -7.9177 -7.8048 -7.8048 -7.5111 -7.5111 -7.4252 -7.4252 -7.2915 -7.2915 -7.1980 -7.1980 -6.7058 -6.7058 -6.4795 -6.4795 0.1156 0.1156 0.8186 0.8186 1.2535 1.2535 1.8584 1.8584 1.9490 1.9490 2.6420 2.6420 2.7877 2.7877 2.9613 2.9613 3.9982 3.9982 4.5158 4.5158 4.6639 4.6639 4.8439 4.8439 9.3348 9.3348 9.4290 9.4290 11.8673 11.8673 13.0793 13.0793 13.8077 13.8077 k = 0.3977-0.0000-0.0000 ( 5078 PWs) bands (ev): -12.5864 -12.5864 -12.2986 -12.2986 -8.8859 -8.8859 -8.8795 -8.8795 -8.3067 -8.3067 -8.1513 -8.1513 -7.9085 -7.9085 -7.8064 -7.8064 -7.5102 -7.5102 -7.4283 -7.4283 -7.2881 -7.2881 -7.2012 -7.2012 -6.6837 -6.6837 -6.4831 -6.4831 0.1215 0.1215 0.7522 0.7522 1.2596 1.2596 1.8145 1.8145 1.9896 1.9896 2.6291 2.6291 2.7705 2.7705 2.9153 2.9153 4.0134 4.0134 4.4988 4.4988 4.6779 4.6779 4.8401 4.8401 9.3287 9.3287 9.4003 9.4003 11.9290 11.9290 13.1017 13.1017 13.8163 13.8163 k = 0.4091-0.0000-0.0000 ( 5090 PWs) bands (ev): -12.5695 -12.5695 -12.3129 -12.3129 -8.8807 -8.8807 -8.8729 -8.8729 -8.3015 -8.3015 -8.1597 -8.1597 -7.8997 -7.8997 -7.8086 -7.8086 -7.5087 -7.5087 -7.4320 -7.4320 -7.2846 -7.2846 -7.2054 -7.2054 -6.6626 -6.6626 -6.4866 -6.4866 0.1299 0.1299 0.6888 0.6888 1.2680 1.2680 1.7653 1.7653 2.0370 2.0370 2.6197 2.6197 2.7525 2.7525 2.8698 2.8698 4.0320 4.0320 4.4795 4.4795 4.6915 4.6915 4.8359 4.8359 9.3196 9.3196 9.3752 9.3752 11.9964 11.9964 13.1054 13.1054 13.8263 13.8263 k = 0.4205-0.0000-0.0000 ( 5096 PWs) bands (ev): -12.5526 -12.5526 -12.3275 -12.3275 -8.8757 -8.8757 -8.8670 -8.8670 -8.2955 -8.2955 -8.1684 -8.1684 -7.8913 -7.8913 -7.8112 -7.8112 -7.5065 -7.5065 -7.4362 -7.4362 -7.2810 -7.2810 -7.2103 -7.2103 -6.6425 -6.6425 -6.4903 -6.4903 0.1409 0.1409 0.6285 0.6285 1.2787 1.2787 1.7160 1.7160 2.0861 2.0861 2.6137 2.6137 2.7323 2.7323 2.8259 2.8259 4.0538 4.0538 4.4580 4.4580 4.7047 4.7047 4.8311 4.8311 9.3086 9.3086 9.3534 9.3534 12.0688 12.0688 13.0899 13.0899 13.8380 13.8380 k = 0.4318-0.0000-0.0000 ( 5094 PWs) bands (ev): -12.5358 -12.5358 -12.3424 -12.3424 -8.8708 -8.8708 -8.8619 -8.8619 -8.2888 -8.2888 -8.1776 -8.1776 -7.8831 -7.8831 -7.8143 -7.8143 -7.5037 -7.5037 -7.4408 -7.4408 -7.2772 -7.2772 -7.2158 -7.2158 -6.6235 -6.6235 -6.4943 -6.4943 0.1547 0.1547 0.5715 0.5715 1.2919 1.2919 1.6681 1.6681 2.1362 2.1362 2.6109 2.6109 2.7078 2.7078 2.7858 2.7858 4.0783 4.0783 4.4344 4.4344 4.7175 4.7175 4.8258 4.8258 9.2971 9.2971 9.3345 9.3345 12.1453 12.1453 13.0567 13.0567 13.8519 13.8519 k = 0.4432-0.0000-0.0000 ( 5088 PWs) bands (ev): -12.5190 -12.5190 -12.3575 -12.3575 -8.8662 -8.8662 -8.8578 -8.8578 -8.2814 -8.2814 -8.1870 -8.1870 -7.8753 -7.8753 -7.8177 -7.8177 -7.5002 -7.5002 -7.4459 -7.4459 -7.2732 -7.2732 -7.2215 -7.2215 -6.6056 -6.6056 -6.4989 -6.4989 0.1714 0.1714 0.5179 0.5179 1.3078 1.3078 1.6219 1.6219 2.1867 2.1867 2.6106 2.6106 2.6767 2.6767 2.7523 2.7523 4.1051 4.1051 4.4088 4.4088 4.7297 4.7297 4.8199 4.8199 9.2864 9.2864 9.3182 9.3182 12.2251 12.2251 13.0088 13.0088 13.8681 13.8681 k = 0.4545-0.0000-0.0000 ( 5084 PWs) bands (ev): -12.5022 -12.5022 -12.3729 -12.3729 -8.8620 -8.8620 -8.8545 -8.8545 -8.2734 -8.2734 -8.1967 -8.1967 -7.8678 -7.8678 -7.8216 -7.8216 -7.4961 -7.4961 -7.4514 -7.4514 -7.2689 -7.2689 -7.2274 -7.2274 -6.5890 -6.5890 -6.5043 -6.5043 0.1910 0.1910 0.4677 0.4677 1.3263 1.3263 1.5781 1.5781 2.2375 2.2375 2.6098 2.6098 2.6414 2.6414 2.7261 2.7261 4.1339 4.1339 4.3814 4.3814 4.7414 4.7414 4.8135 4.8135 9.2776 9.2776 9.3040 9.3040 12.3072 12.3072 12.9493 12.9493 13.8869 13.8869 k = 0.4659-0.0000-0.0000 ( 5084 PWs) bands (ev): -12.4856 -12.4856 -12.3884 -12.3884 -8.8584 -8.8584 -8.8524 -8.8524 -8.2649 -8.2649 -8.2067 -8.2067 -7.8606 -7.8606 -7.8260 -7.8260 -7.4915 -7.4915 -7.4572 -7.4572 -7.2645 -7.2645 -7.2332 -7.2332 -6.5738 -6.5738 -6.5107 -6.5107 0.2138 0.2138 0.4210 0.4210 1.3476 1.3476 1.5367 1.5367 2.2885 2.2885 2.5847 2.5847 2.6278 2.6278 2.7049 2.7049 4.1641 4.1641 4.3525 4.3525 4.7525 4.7525 4.8066 4.8066 9.2712 9.2712 9.2919 9.2919 12.3911 12.3911 12.8810 12.8810 13.9085 13.9085 k = 0.4773-0.0000-0.0000 ( 5080 PWs) bands (ev): -12.4690 -12.4690 -12.4042 -12.4042 -8.8554 -8.8554 -8.8511 -8.8511 -8.2558 -8.2558 -8.2167 -8.2167 -7.8539 -7.8539 -7.8307 -7.8307 -7.4863 -7.4863 -7.4631 -7.4631 -7.2599 -7.2599 -7.2389 -7.2389 -6.5599 -6.5599 -6.5180 -6.5180 0.2399 0.2399 0.3778 0.3778 1.3718 1.3718 1.4980 1.4980 2.3396 2.3396 2.5395 2.5395 2.6338 2.6338 2.6867 2.6867 4.1954 4.1954 4.3223 4.3223 4.7630 4.7630 4.7991 4.7991 9.2677 9.2677 9.2819 9.2819 12.4759 12.4759 12.8062 12.8062 13.9328 13.9328 k = 0.4886-0.0000-0.0000 ( 5080 PWs) bands (ev): -12.4526 -12.4526 -12.4202 -12.4202 -8.8530 -8.8530 -8.8509 -8.8509 -8.2464 -8.2464 -8.2267 -8.2267 -7.8475 -7.8475 -7.8360 -7.8360 -7.4808 -7.4808 -7.4691 -7.4691 -7.2550 -7.2550 -7.2445 -7.2445 -6.5475 -6.5475 -6.5265 -6.5265 0.2692 0.2692 0.3382 0.3382 1.3990 1.3990 1.4621 1.4621 2.3904 2.3904 2.4909 2.4909 2.6439 2.6439 2.6706 2.6706 4.2273 4.2273 4.2911 4.2911 4.7729 4.7729 4.7910 4.7910 9.2671 9.2671 9.2743 9.2743 12.5607 12.5607 12.7270 12.7270 13.9599 13.9599 k = 0.5000-0.0000-0.0000 ( 5076 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8515 -8.8515 -8.8515 -8.8515 -8.2366 -8.2366 -8.2366 -8.2366 -7.8415 -7.8415 -7.8415 -7.8415 -7.4751 -7.4751 -7.4751 -7.4751 -7.2499 -7.2499 -7.2499 -7.2499 -6.5363 -6.5363 -6.5363 -6.5363 0.3020 0.3020 0.3020 0.3020 1.4291 1.4291 1.4291 1.4291 2.4410 2.4410 2.4410 2.4410 2.6563 2.6563 2.6563 2.6563 4.2593 4.2593 4.2593 4.2593 4.7823 4.7823 4.7823 4.7823 9.2693 9.2693 9.2693 9.2693 12.6448 12.6448 12.6448 12.6448 13.9899 13.9899 k = 0.5000-0.0000-0.0000 ( 5076 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8515 -8.8515 -8.8515 -8.8515 -8.2366 -8.2366 -8.2366 -8.2366 -7.8415 -7.8415 -7.8415 -7.8415 -7.4751 -7.4751 -7.4751 -7.4751 -7.2499 -7.2499 -7.2499 -7.2499 -6.5363 -6.5363 -6.5363 -6.5363 0.3020 0.3020 0.3020 0.3020 1.4291 1.4291 1.4291 1.4291 2.4410 2.4410 2.4410 2.4410 2.6563 2.6563 2.6563 2.6563 4.2593 4.2593 4.2593 4.2593 4.7823 4.7823 4.7823 4.7823 9.2693 9.2693 9.2693 9.2693 12.6448 12.6448 12.6448 12.6448 13.9899 13.9899 k = 0.5000 0.0114-0.0000 ( 5078 PWs) bands (ev): -12.4365 -12.4365 -12.4356 -12.4356 -8.8516 -8.8516 -8.8512 -8.8512 -8.2426 -8.2426 -8.2306 -8.2306 -7.8431 -7.8431 -7.8400 -7.8400 -7.4794 -7.4794 -7.4707 -7.4707 -7.2506 -7.2506 -7.2490 -7.2490 -6.5384 -6.5384 -6.5344 -6.5344 0.3000 0.3000 0.3004 0.3004 1.4180 1.4180 1.4295 1.4295 2.4458 2.4458 2.4514 2.4514 2.6537 2.6537 2.6588 2.6588 4.2575 4.2575 4.2614 4.2614 4.7787 4.7787 4.7821 4.7821 9.2695 9.2695 9.2698 9.2698 12.6419 12.6419 12.6458 12.6458 13.9712 13.9713 k = 0.5000 0.0229-0.0000 ( 5076 PWs) bands (ev): -12.4362 -12.4362 -12.4344 -12.4344 -8.8514 -8.8514 -8.8507 -8.8507 -8.2485 -8.2485 -8.2246 -8.2246 -7.8447 -7.8447 -7.8385 -7.8385 -7.4838 -7.4838 -7.4664 -7.4664 -7.2513 -7.2513 -7.2480 -7.2480 -6.5407 -6.5407 -6.5326 -6.5326 0.2942 0.2942 0.2951 0.2951 1.3975 1.3975 1.4195 1.4195 2.4659 2.4659 2.4752 2.4752 2.6510 2.6510 2.6622 2.6622 4.2560 4.2560 4.2637 4.2637 4.7713 4.7713 4.7782 4.7782 9.2703 9.2703 9.2709 9.2709 12.6367 12.6367 12.6446 12.6446 13.9337 13.9337 k = 0.5000 0.0343-0.0000 ( 5084 PWs) bands (ev): -12.4353 -12.4353 -12.4327 -12.4327 -8.8510 -8.8510 -8.8499 -8.8499 -8.2543 -8.2543 -8.2186 -8.2186 -7.8463 -7.8463 -7.8371 -7.8371 -7.4882 -7.4882 -7.4623 -7.4623 -7.2518 -7.2518 -7.2469 -7.2469 -6.5431 -6.5431 -6.5311 -6.5311 0.2846 0.2846 0.2861 0.2861 1.3696 1.3696 1.4005 1.4005 2.4996 2.4996 2.5084 2.5084 2.6482 2.6482 2.6683 2.6683 4.2547 4.2547 4.2665 4.2665 4.7602 4.7602 4.7707 4.7707 9.2717 9.2717 9.2727 9.2727 12.6285 12.6285 12.6408 12.6408 13.8842 13.8842 k = 0.5000 0.0457-0.0000 ( 5088 PWs) bands (ev): -12.4339 -12.4339 -12.4305 -12.4305 -8.8504 -8.8504 -8.8489 -8.8489 -8.2599 -8.2599 -8.2126 -8.2126 -7.8479 -7.8479 -7.8358 -7.8358 -7.4924 -7.4924 -7.4583 -7.4583 -7.2523 -7.2523 -7.2456 -7.2456 -6.5457 -6.5457 -6.5298 -6.5298 0.2710 0.2710 0.2731 0.2731 1.3371 1.3371 1.3750 1.3750 2.5437 2.5437 2.5441 2.5441 2.6467 2.6467 2.6817 2.6817 4.2536 4.2536 4.2695 4.2695 4.7455 4.7455 4.7598 4.7598 9.2737 9.2737 9.2751 9.2751 12.6163 12.6163 12.6332 12.6332 13.8297 13.8297 k = 0.5000 0.0572-0.0000 ( 5100 PWs) bands (ev): -12.4321 -12.4321 -12.4278 -12.4278 -8.8495 -8.8495 -8.8477 -8.8477 -8.2654 -8.2654 -8.2066 -8.2066 -7.8496 -7.8496 -7.8347 -7.8347 -7.4966 -7.4966 -7.4545 -7.4545 -7.2528 -7.2528 -7.2443 -7.2443 -6.5484 -6.5484 -6.5287 -6.5287 0.2529 0.2529 0.2560 0.2560 1.3025 1.3025 1.3456 1.3456 2.5722 2.5722 2.5885 2.5885 2.6533 2.6533 2.7101 2.7101 4.2524 4.2524 4.2729 4.2729 4.7274 4.7274 4.7457 4.7457 9.2763 9.2763 9.2782 9.2782 12.5985 12.5985 12.6203 12.6203 13.7756 13.7756 k = 0.5000 0.0686-0.0000 ( 5096 PWs) bands (ev): -12.4297 -12.4297 -12.4246 -12.4246 -8.8485 -8.8485 -8.8463 -8.8463 -8.2706 -8.2706 -8.2007 -8.2007 -7.8512 -7.8512 -7.8335 -7.8335 -7.5004 -7.5004 -7.4508 -7.4508 -7.2532 -7.2532 -7.2428 -7.2428 -6.5511 -6.5511 -6.5278 -6.5278 0.2302 0.2302 0.2345 0.2345 1.2680 1.2680 1.3146 1.3146 2.5864 2.5864 2.6086 2.6086 2.6915 2.6915 2.7577 2.7577 4.2512 4.2512 4.2766 4.2766 4.7059 4.7059 4.7288 4.7288 9.2795 9.2795 9.2818 9.2818 12.5738 12.5738 12.6007 12.6007 13.7264 13.7264 k = 0.5000 0.0800-0.0000 ( 5096 PWs) bands (ev): -12.4268 -12.4268 -12.4210 -12.4210 -8.8472 -8.8472 -8.8446 -8.8446 -8.2755 -8.2755 -8.1949 -8.1949 -7.8528 -7.8528 -7.8324 -7.8324 -7.5041 -7.5041 -7.4473 -7.4473 -7.2536 -7.2536 -7.2411 -7.2411 -6.5540 -6.5540 -6.5271 -6.5271 0.2027 0.2027 0.2084 0.2084 1.2353 1.2353 1.2842 1.2842 2.5900 2.5900 2.6074 2.6074 2.7559 2.7559 2.8198 2.8198 4.2497 4.2497 4.2806 4.2806 4.6815 4.6815 4.7093 4.7093 9.2832 9.2832 9.2860 9.2860 12.5407 12.5407 12.5727 12.5727 13.6854 13.6854 k = 0.5000 0.0915-0.0000 ( 5096 PWs) bands (ev): -12.4235 -12.4235 -12.4169 -12.4169 -8.8457 -8.8457 -8.8427 -8.8427 -8.2802 -8.2802 -8.1892 -8.1892 -7.8544 -7.8544 -7.8315 -7.8315 -7.5074 -7.5074 -7.4440 -7.4440 -7.2540 -7.2540 -7.2392 -7.2392 -6.5570 -6.5570 -6.5267 -6.5267 0.1704 0.1704 0.1776 0.1776 1.2060 1.2060 1.2559 1.2559 2.5876 2.5876 2.6004 2.6004 2.8295 2.8295 2.8904 2.8904 4.2478 4.2478 4.2848 4.2848 4.6544 4.6544 4.6879 4.6879 9.2873 9.2873 9.2907 9.2907 12.4984 12.4984 12.5351 12.5351 13.6548 13.6548 k = 0.5000 0.1029-0.0000 ( 5100 PWs) bands (ev): -12.4198 -12.4198 -12.4124 -12.4124 -8.8440 -8.8440 -8.8407 -8.8407 -8.2846 -8.2846 -8.1838 -8.1838 -7.8560 -7.8560 -7.8306 -7.8306 -7.5105 -7.5105 -7.4410 -7.4410 -7.2544 -7.2544 -7.2373 -7.2373 -6.5601 -6.5601 -6.5267 -6.5267 0.1332 0.1332 0.1423 0.1423 1.1809 1.1809 1.2310 1.2310 2.5816 2.5816 2.5909 2.5909 2.9075 2.9075 2.9659 2.9659 4.2452 4.2452 4.2892 4.2892 4.6250 4.6250 4.6649 4.6649 9.2919 9.2919 9.2959 9.2959 12.4467 12.4467 12.4875 12.4875 13.6355 13.6355 k = 0.5000 0.1143-0.0000 ( 5096 PWs) bands (ev): -12.4156 -12.4156 -12.4076 -12.4076 -8.8422 -8.8422 -8.8384 -8.8384 -8.2887 -8.2887 -8.1786 -8.1786 -7.8575 -7.8575 -7.8299 -7.8299 -7.5131 -7.5131 -7.4382 -7.4382 -7.2548 -7.2548 -7.2352 -7.2352 -6.5632 -6.5632 -6.5268 -6.5268 0.0916 0.0916 0.1024 0.1024 1.1605 1.1605 1.2101 1.2101 2.5731 2.5731 2.5798 2.5798 2.9882 2.9882 3.0444 3.0444 4.2416 4.2416 4.2935 4.2935 4.5937 4.5937 4.6411 4.6411 9.2968 9.2968 9.3016 9.3016 12.3861 12.3861 12.4303 12.4303 13.6276 13.6276 k = 0.5000 0.1258-0.0000 ( 5080 PWs) bands (ev): -12.4110 -12.4110 -12.4024 -12.4024 -8.8401 -8.8401 -8.8359 -8.8359 -8.2923 -8.2923 -8.1735 -8.1735 -7.8589 -7.8589 -7.8293 -7.8293 -7.5152 -7.5152 -7.4355 -7.4355 -7.2553 -7.2553 -7.2331 -7.2331 -6.5663 -6.5663 -6.5272 -6.5272 0.0458 0.0458 0.0585 0.0585 1.1450 1.1450 1.1938 1.1938 2.5627 2.5627 2.5672 2.5672 3.0706 3.0706 3.1245 3.1245 4.2366 4.2366 4.2975 4.2975 4.5612 4.5612 4.6170 4.6170 9.3022 9.3022 9.3077 9.3077 12.3176 12.3176 12.3644 12.3644 13.6301 13.6301 k = 0.5000 0.1372-0.0000 ( 5084 PWs) bands (ev): -12.4061 -12.4061 -12.3969 -12.3969 -8.8380 -8.8380 -8.8334 -8.8334 -8.2956 -8.2956 -8.1687 -8.1687 -7.8604 -7.8604 -7.8290 -7.8290 -7.5170 -7.5170 -7.4331 -7.4331 -7.2559 -7.2559 -7.2310 -7.2310 -6.5696 -6.5696 -6.5280 -6.5280 -0.0034 -0.0034 0.0109 0.0109 1.1345 1.1345 1.1821 1.1821 2.5507 2.5507 2.5533 2.5533 3.1538 3.1538 3.2054 3.2054 4.2296 4.2296 4.3007 4.3007 4.5281 4.5281 4.5936 4.5936 9.3079 9.3079 9.3143 9.3143 12.2425 12.2425 12.2913 12.2913 13.6415 13.6415 k = 0.5000 0.1486-0.0000 ( 5088 PWs) bands (ev): -12.4009 -12.4009 -12.3911 -12.3911 -8.8356 -8.8356 -8.8306 -8.8306 -8.2985 -8.2985 -8.1643 -8.1643 -7.8619 -7.8619 -7.8288 -7.8288 -7.5182 -7.5182 -7.4309 -7.4309 -7.2566 -7.2566 -7.2289 -7.2289 -6.5729 -6.5729 -6.5290 -6.5290 -0.0556 -0.0556 -0.0397 -0.0397 1.1287 1.1287 1.1750 1.1750 2.5372 2.5372 2.5382 2.5382 3.2372 3.2372 3.2864 3.2864 4.2203 4.2203 4.3024 4.3024 4.4958 4.4958 4.5717 4.5717 9.3139 9.3139 9.3212 9.3212 12.1623 12.1623 12.2125 12.2125 13.6599 13.6599 k = 0.5000 0.1601-0.0000 ( 5092 PWs) bands (ev): -12.3953 -12.3953 -12.3851 -12.3851 -8.8332 -8.8332 -8.8278 -8.8278 -8.3010 -8.3010 -8.1602 -8.1602 -7.8633 -7.8633 -7.8288 -7.8288 -7.5190 -7.5190 -7.4290 -7.4290 -7.2574 -7.2574 -7.2268 -7.2268 -6.5762 -6.5762 -6.5304 -6.5304 -0.1101 -0.1101 -0.0928 -0.0928 1.1273 1.1273 1.1722 1.1722 2.5219 2.5219 2.5222 2.5222 3.3202 3.3202 3.3669 3.3669 4.2080 4.2080 4.3011 4.3011 4.4659 4.4659 4.5520 4.5520 9.3202 9.3202 9.3284 9.3284 12.0784 12.0784 12.1296 12.1296 13.6837 13.6837 k = 0.5000 0.1715-0.0000 ( 5088 PWs) bands (ev): -12.3895 -12.3895 -12.3788 -12.3788 -8.8306 -8.8306 -8.8248 -8.8248 -8.3030 -8.3030 -8.1564 -8.1564 -7.8646 -7.8646 -7.8289 -7.8289 -7.5191 -7.5191 -7.4271 -7.4271 -7.2582 -7.2582 -7.2248 -7.2248 -6.5795 -6.5795 -6.5321 -6.5321 -0.1660 -0.1660 -0.1477 -0.1477 1.1300 1.1300 1.1735 1.1735 2.5043 2.5043 2.5060 2.5060 3.4023 3.4023 3.4462 3.4462 4.1923 4.1923 4.2945 4.2945 4.4413 4.4413 4.5354 4.5354 9.3268 9.3268 9.3360 9.3360 11.9919 11.9919 12.0439 12.0439 13.7109 13.7110 k = 0.5000 0.1829-0.0000 ( 5092 PWs) bands (ev): -12.3835 -12.3835 -12.3724 -12.3724 -8.8279 -8.8279 -8.8218 -8.8218 -8.3045 -8.3045 -8.1530 -8.1530 -7.8659 -7.8659 -7.8293 -7.8293 -7.5187 -7.5187 -7.4255 -7.4255 -7.2593 -7.2593 -7.2229 -7.2229 -6.5829 -6.5829 -6.5342 -6.5342 -0.2230 -0.2230 -0.2038 -0.2038 1.1363 1.1363 1.1785 1.1785 2.4855 2.4855 2.4885 2.4885 3.4831 3.4831 3.5239 3.5239 4.1732 4.1732 4.2801 4.2801 4.4248 4.4248 4.5224 4.5224 9.3337 9.3337 9.3439 9.3439 11.9040 11.9040 11.9565 11.9565 13.7402 13.7402 k = 0.5000 0.1944-0.0000 ( 5080 PWs) bands (ev): -12.3772 -12.3772 -12.3659 -12.3659 -8.8252 -8.8252 -8.8186 -8.8186 -8.3055 -8.3055 -8.1499 -8.1499 -7.8670 -7.8670 -7.8298 -7.8298 -7.5175 -7.5175 -7.4239 -7.4239 -7.2603 -7.2603 -7.2211 -7.2211 -6.5861 -6.5861 -6.5364 -6.5364 -0.2803 -0.2803 -0.2605 -0.2605 1.1460 1.1460 1.1870 1.1870 2.4656 2.4656 2.4697 2.4697 3.5621 3.5621 3.5994 3.5994 4.1508 4.1508 4.2575 4.2575 4.4173 4.4173 4.5132 4.5132 9.3409 9.3409 9.3521 9.3521 11.8155 11.8155 11.8684 11.8684 13.7698 13.7698 k = 0.5000 0.2058-0.0000 ( 5076 PWs) bands (ev): -12.3708 -12.3708 -12.3593 -12.3593 -8.8223 -8.8223 -8.8154 -8.8154 -8.3060 -8.3060 -8.1473 -8.1473 -7.8681 -7.8681 -7.8305 -7.8305 -7.5158 -7.5158 -7.4225 -7.4225 -7.2615 -7.2615 -7.2195 -7.2195 -6.5894 -6.5894 -6.5390 -6.5390 -0.3375 -0.3375 -0.3174 -0.3174 1.1587 1.1587 1.1985 1.1985 2.4445 2.4445 2.4498 2.4498 3.6388 3.6388 3.6719 3.6719 4.1255 4.1255 4.2290 4.2290 4.4173 4.4173 4.5078 4.5078 9.3482 9.3482 9.3605 9.3605 11.7272 11.7272 11.7802 11.7802 13.7984 13.7984 k = 0.5000 0.2172-0.0000 ( 5072 PWs) bands (ev): -12.3643 -12.3643 -12.3526 -12.3526 -8.8195 -8.8195 -8.8122 -8.8122 -8.3060 -8.3060 -8.1452 -8.1452 -7.8691 -7.8691 -7.8314 -7.8314 -7.5134 -7.5134 -7.4212 -7.4212 -7.2628 -7.2628 -7.2181 -7.2181 -6.5926 -6.5926 -6.5420 -6.5420 -0.3941 -0.3941 -0.3739 -0.3739 1.1741 1.1741 1.2128 1.2128 2.4223 2.4223 2.4287 2.4287 3.7127 3.7127 3.7406 3.7406 4.0981 4.0981 4.1978 4.1978 4.4224 4.4224 4.5060 4.5060 9.3559 9.3559 9.3692 9.3692 11.6397 11.6397 11.6928 11.6928 13.8245 13.8245 k = 0.5000 0.2287-0.0000 ( 5072 PWs) bands (ev): -12.3577 -12.3577 -12.3460 -12.3460 -8.8165 -8.8165 -8.8090 -8.8090 -8.3055 -8.3055 -8.1436 -8.1436 -7.8701 -7.8701 -7.8325 -7.8325 -7.5105 -7.5105 -7.4200 -7.4200 -7.2643 -7.2643 -7.2170 -7.2170 -6.5957 -6.5957 -6.5451 -6.5451 -0.4497 -0.4497 -0.4296 -0.4296 1.1919 1.1919 1.2297 1.2297 2.3990 2.3990 2.4064 2.4064 3.7828 3.7828 3.8039 3.8039 4.0696 4.0696 4.1669 4.1669 4.4310 4.4310 4.5074 4.5074 9.3637 9.3637 9.3781 9.3781 11.5536 11.5536 11.6065 11.6065 13.8466 13.8466 k = 0.5000 0.2401-0.0000 ( 5072 PWs) bands (ev): -12.3511 -12.3511 -12.3394 -12.3394 -8.8136 -8.8136 -8.8059 -8.8059 -8.3044 -8.3044 -8.1425 -8.1425 -7.8710 -7.8710 -7.8338 -7.8338 -7.5070 -7.5070 -7.4189 -7.4189 -7.2658 -7.2658 -7.2162 -7.2162 -6.5988 -6.5988 -6.5486 -6.5486 -0.5039 -0.5039 -0.4841 -0.4841 1.2118 1.2118 1.2488 1.2488 2.3746 2.3746 2.3831 2.3831 3.8478 3.8478 3.8593 3.8593 4.0418 4.0418 4.1395 4.1395 4.4425 4.4425 4.5120 4.5120 9.3718 9.3718 9.3873 9.3873 11.4693 11.4693 11.5219 11.5219 13.8635 13.8635 k = 0.5000 0.2515-0.0000 ( 5080 PWs) bands (ev): -12.3446 -12.3446 -12.3329 -12.3329 -8.8107 -8.8107 -8.8028 -8.8028 -8.3028 -8.3028 -8.1420 -8.1420 -7.8718 -7.8718 -7.8353 -7.8353 -7.5029 -7.5029 -7.4179 -7.4179 -7.2675 -7.2675 -7.2159 -7.2159 -6.6017 -6.6017 -6.5523 -6.5523 -0.5565 -0.5565 -0.5372 -0.5372 1.2338 1.2338 1.2699 1.2699 2.3491 2.3491 2.3586 2.3586 3.9020 3.9020 3.9027 3.9027 4.0195 4.0195 4.1208 4.1208 4.4564 4.4564 4.5194 4.5194 9.3802 9.3802 9.3966 9.3966 11.3871 11.3871 11.4393 11.4393 13.8738 13.8738 k = 0.5000 0.2630-0.0000 ( 5084 PWs) bands (ev): -12.3380 -12.3380 -12.3265 -12.3265 -8.8077 -8.8077 -8.7997 -8.7997 -8.3007 -8.3007 -8.1419 -8.1419 -7.8726 -7.8726 -7.8369 -7.8369 -7.4982 -7.4982 -7.4169 -7.4169 -7.2692 -7.2692 -7.2158 -7.2158 -6.6045 -6.6045 -6.5561 -6.5561 -0.6072 -0.6072 -0.5885 -0.5885 1.2576 1.2576 1.2930 1.2930 2.3227 2.3227 2.3332 2.3332 3.9246 3.9246 3.9295 3.9295 4.0211 4.0211 4.1182 4.1182 4.4728 4.4728 4.5295 4.5295 9.3887 9.3887 9.4060 9.4060 11.3076 11.3076 11.3591 11.3591 13.8768 13.8768 k = 0.5000 0.2744-0.0000 ( 5080 PWs) bands (ev): -12.3316 -12.3316 -12.3204 -12.3204 -8.8048 -8.8048 -8.7968 -8.7968 -8.2979 -8.2979 -8.1424 -8.1424 -7.8731 -7.8731 -7.8386 -7.8386 -7.4931 -7.4931 -7.4159 -7.4159 -7.2709 -7.2709 -7.2161 -7.2161 -6.6071 -6.6071 -6.5602 -6.5602 -0.6556 -0.6556 -0.6377 -0.6377 1.2829 1.2829 1.3176 1.3176 2.2952 2.2952 2.3067 2.3067 3.9177 3.9177 3.9241 3.9241 4.0569 4.0569 4.1344 4.1344 4.4917 4.4917 4.5423 4.5423 9.3975 9.3975 9.4156 9.4156 11.2309 11.2309 11.2815 11.2815 13.8722 13.8722 k = 0.5000 0.2858-0.0000 ( 5084 PWs) bands (ev): -12.3253 -12.3253 -12.3144 -12.3144 -8.8020 -8.8020 -8.7939 -8.7939 -8.2947 -8.2947 -8.1434 -8.1434 -7.8737 -7.8737 -7.8406 -7.8406 -7.4875 -7.4875 -7.4150 -7.4150 -7.2726 -7.2726 -7.2169 -7.2169 -6.6096 -6.6096 -6.5643 -6.5643 -0.7018 -0.7018 -0.6847 -0.6847 1.3098 1.3098 1.3438 1.3438 2.2669 2.2669 2.2794 2.2794 3.8926 3.8926 3.9078 3.9078 4.1016 4.1016 4.1622 4.1622 4.5131 4.5131 4.5578 4.5578 9.4065 9.4065 9.4252 9.4252 11.1574 11.1574 11.2070 11.2070 13.8605 13.8605 k = 0.5000 0.2973-0.0000 ( 5080 PWs) bands (ev): -12.3192 -12.3192 -12.3087 -12.3087 -8.7992 -8.7992 -8.7912 -8.7912 -8.2909 -8.2909 -8.1449 -8.1449 -7.8741 -7.8741 -7.8425 -7.8425 -7.4815 -7.4815 -7.4141 -7.4141 -7.2742 -7.2742 -7.2180 -7.2180 -6.6119 -6.6119 -6.5686 -6.5686 -0.7453 -0.7453 -0.7292 -0.7292 1.3379 1.3379 1.3713 1.3713 2.2376 2.2376 2.2511 2.2511 3.8651 3.8651 3.8842 3.8842 4.1444 4.1444 4.1929 4.1929 4.5369 4.5369 4.5757 4.5757 9.4156 9.4156 9.4349 9.4349 11.0874 11.0874 11.1357 11.1357 13.8428 13.8429 k = 0.5000 0.3087-0.0000 ( 5090 PWs) bands (ev): -12.3133 -12.3133 -12.3033 -12.3033 -8.7965 -8.7965 -8.7887 -8.7887 -8.2867 -8.2867 -8.1471 -8.1471 -7.8743 -7.8743 -7.8445 -7.8445 -7.4753 -7.4753 -7.4133 -7.4133 -7.2758 -7.2758 -7.2197 -7.2197 -6.6140 -6.6140 -6.5730 -6.5730 -0.7861 -0.7861 -0.7711 -0.7711 1.3672 1.3672 1.4000 1.4000 2.2076 2.2076 2.2220 2.2220 3.8377 3.8377 3.8580 3.8580 4.1830 4.1830 4.2223 4.2223 4.5629 4.5629 4.5960 4.5960 9.4248 9.4248 9.4445 9.4445 11.0211 11.0211 11.0679 11.0679 13.8207 13.8207 k = 0.5000 0.3201-0.0000 ( 5102 PWs) bands (ev): -12.3077 -12.3077 -12.2982 -12.2982 -8.7939 -8.7939 -8.7864 -8.7864 -8.2820 -8.2820 -8.1499 -8.1499 -7.8745 -7.8745 -7.8467 -7.8467 -7.4689 -7.4689 -7.4125 -7.4125 -7.2772 -7.2772 -7.2219 -7.2219 -6.6158 -6.6158 -6.5774 -6.5774 -0.8241 -0.8241 -0.8101 -0.8101 1.3976 1.3976 1.4297 1.4297 2.1768 2.1768 2.1922 2.1922 3.8113 3.8113 3.8314 3.8314 4.2166 4.2166 4.2484 4.2484 4.5905 4.5905 4.6181 4.6181 9.4342 9.4342 9.4539 9.4539 10.9589 10.9589 11.0039 11.0039 13.7956 13.7956 k = 0.5000 0.3316-0.0000 ( 5098 PWs) bands (ev): -12.3024 -12.3024 -12.2935 -12.2935 -8.7914 -8.7914 -8.7843 -8.7843 -8.2767 -8.2767 -8.1531 -8.1531 -7.8745 -7.8745 -7.8487 -7.8487 -7.4623 -7.4623 -7.4117 -7.4117 -7.2784 -7.2784 -7.2244 -7.2244 -6.6173 -6.6173 -6.5817 -6.5817 -0.8590 -0.8590 -0.8463 -0.8463 1.4288 1.4288 1.4603 1.4603 2.1453 2.1453 2.1616 2.1616 3.7865 3.7865 3.8056 3.8056 4.2454 4.2454 4.2709 4.2709 4.6190 4.6190 4.6415 4.6415 9.4435 9.4435 9.4631 9.4631 10.9010 10.9010 10.9438 10.9438 13.7692 13.7692 k = 0.5000 0.3430-0.0000 ( 5106 PWs) bands (ev): -12.2974 -12.2974 -12.2892 -12.2892 -8.7891 -8.7891 -8.7824 -8.7824 -8.2711 -8.2711 -8.1568 -8.1568 -7.8745 -7.8745 -7.8509 -7.8509 -7.4558 -7.4558 -7.4110 -7.4110 -7.2793 -7.2793 -7.2275 -7.2275 -6.6187 -6.6187 -6.5861 -6.5861 -0.8909 -0.8909 -0.8793 -0.8793 1.4608 1.4608 1.4916 1.4916 2.1133 2.1133 2.1304 2.1304 3.7635 3.7635 3.7812 3.7812 4.2695 4.2695 4.2898 4.2898 4.6474 4.6474 4.6656 4.6656 9.4528 9.4528 9.4720 9.4720 10.8477 10.8477 10.8880 10.8880 13.7426 13.7427 k = 0.5000 0.3544-0.0000 ( 5094 PWs) bands (ev): -12.2928 -12.2928 -12.2853 -12.2853 -8.7869 -8.7869 -8.7806 -8.7806 -8.2650 -8.2650 -8.1610 -8.1610 -7.8742 -7.8742 -7.8530 -7.8530 -7.4492 -7.4492 -7.4103 -7.4103 -7.2798 -7.2798 -7.2308 -7.2308 -6.6196 -6.6196 -6.5902 -6.5902 -0.9196 -0.9196 -0.9092 -0.9092 1.4934 1.4934 1.5236 1.5236 2.0808 2.0808 2.0988 2.0988 3.7425 3.7425 3.7586 3.7586 4.2896 4.2896 4.3055 4.3055 4.6750 4.6750 4.6894 4.6894 9.4619 9.4619 9.4804 9.4804 10.7994 10.7994 10.8366 10.8366 13.7170 13.7170 k = 0.5000 0.3659-0.0000 ( 5092 PWs) bands (ev): -12.2885 -12.2885 -12.2819 -12.2819 -8.7848 -8.7848 -8.7792 -8.7792 -8.2587 -8.2587 -8.1657 -8.1657 -7.8738 -7.8738 -7.8551 -7.8551 -7.4430 -7.4430 -7.4098 -7.4098 -7.2799 -7.2799 -7.2345 -7.2345 -6.6202 -6.6202 -6.5941 -6.5941 -0.9450 -0.9450 -0.9359 -0.9359 1.5265 1.5265 1.5559 1.5559 2.0480 2.0480 2.0667 2.0667 3.7238 3.7238 3.7381 3.7381 4.3062 4.3062 4.3185 4.3185 4.7010 4.7010 4.7122 4.7122 9.4707 9.4707 9.4881 9.4881 10.7561 10.7561 10.7900 10.7900 13.6930 13.6931 k = 0.5000 0.3773-0.0000 ( 5094 PWs) bands (ev): -12.2847 -12.2847 -12.2789 -12.2789 -8.7829 -8.7829 -8.7779 -8.7779 -8.2521 -8.2521 -8.1710 -8.1710 -7.8734 -7.8734 -7.8571 -7.8571 -7.4371 -7.4371 -7.4095 -7.4095 -7.2795 -7.2795 -7.2387 -7.2387 -6.6205 -6.6205 -6.5979 -6.5979 -0.9671 -0.9671 -0.9592 -0.9592 1.5599 1.5599 1.5883 1.5883 2.0151 2.0151 2.0344 2.0344 3.7075 3.7075 3.7198 3.7198 4.3196 4.3196 4.3291 4.3291 4.7247 4.7247 4.7334 4.7334 9.4791 9.4791 9.4950 9.4950 10.7183 10.7183 10.7485 10.7485 13.6714 13.6715 k = 0.5000 0.3887-0.0000 ( 5094 PWs) bands (ev): -12.2814 -12.2814 -12.2765 -12.2765 -8.7812 -8.7812 -8.7770 -8.7770 -8.2452 -8.2452 -8.1766 -8.1766 -7.8727 -7.8727 -7.8591 -7.8591 -7.4316 -7.4316 -7.4093 -7.4093 -7.2786 -7.2786 -7.2430 -7.2430 -6.6205 -6.6205 -6.6015 -6.6015 -0.9857 -0.9857 -0.9792 -0.9792 1.5932 1.5932 1.6205 1.6205 1.9824 1.9824 2.0021 2.0021 3.6936 3.6936 3.7040 3.7040 4.3304 4.3304 4.3375 4.3375 4.7456 4.7456 4.7522 4.7522 9.4869 9.4869 9.5009 9.5009 10.6862 10.6862 10.7122 10.7122 13.6526 13.6526 k = 0.5000 0.4002-0.0000 ( 5108 PWs) bands (ev): -12.2786 -12.2786 -12.2746 -12.2746 -8.7798 -8.7798 -8.7763 -8.7763 -8.2382 -8.2382 -8.1826 -8.1826 -7.8721 -7.8721 -7.8611 -7.8611 -7.4268 -7.4268 -7.4095 -7.4095 -7.2772 -7.2772 -7.2476 -7.2476 -6.6202 -6.6202 -6.6049 -6.6049 -1.0009 -1.0009 -0.9957 -0.9957 1.6262 1.6262 1.6519 1.6519 1.9505 1.9505 1.9702 1.9702 3.6824 3.6824 3.6907 3.6907 4.3388 4.3388 4.3441 4.3441 4.7633 4.7633 4.7681 4.7681 9.4940 9.4940 9.5057 9.5057 10.6601 10.6601 10.6815 10.6815 13.6369 13.6369 k = 0.5000 0.4116-0.0000 ( 5108 PWs) bands (ev): -12.2762 -12.2762 -12.2732 -12.2732 -8.7785 -8.7785 -8.7758 -8.7758 -8.2311 -8.2311 -8.1889 -8.1889 -7.8711 -7.8711 -7.8629 -7.8629 -7.4225 -7.4225 -7.4098 -7.4098 -7.2750 -7.2750 -7.2522 -7.2522 -6.6195 -6.6195 -6.6080 -6.6080 -1.0127 -1.0127 -1.0087 -1.0087 1.6581 1.6581 1.6816 1.6816 1.9203 1.9203 1.9392 1.9392 3.6738 3.6738 3.6801 3.6801 4.3453 4.3453 4.3489 4.3489 4.7775 4.7775 4.7808 4.7808 9.5001 9.5001 9.5092 9.5092 10.6403 10.6403 10.6567 10.6567 13.6246 13.6250 k = 0.5000 0.4230-0.0000 ( 5116 PWs) bands (ev): -12.2743 -12.2743 -12.2723 -12.2723 -8.7774 -8.7774 -8.7757 -8.7757 -8.2239 -8.2239 -8.1956 -8.1956 -7.8701 -7.8701 -7.8646 -7.8646 -7.4189 -7.4189 -7.4107 -7.4107 -7.2723 -7.2723 -7.2568 -7.2568 -6.6185 -6.6185 -6.6108 -6.6108 -1.0209 -1.0209 -1.0183 -1.0183 1.6877 1.6877 1.7072 1.7072 1.8941 1.8941 1.9106 1.9106 3.6679 3.6679 3.6721 3.6721 4.3499 4.3499 4.3522 4.3522 4.7879 4.7879 4.7900 4.7900 9.5051 9.5051 9.5113 9.5113 10.6267 10.6267 10.6379 10.6379 13.6159 13.6163 k = 0.5000 0.4345-0.0000 ( 5112 PWs) bands (ev): -12.2730 -12.2730 -12.2720 -12.2720 -8.7766 -8.7766 -8.7757 -8.7757 -8.2166 -8.2166 -8.2024 -8.2024 -7.8689 -7.8689 -7.8662 -7.8662 -7.4159 -7.4159 -7.4119 -7.4119 -7.2691 -7.2691 -7.2612 -7.2612 -6.6171 -6.6171 -6.6132 -6.6132 -1.0256 -1.0256 -1.0243 -1.0243 1.7123 1.7123 1.7244 1.7244 1.8762 1.8762 1.8868 1.8868 3.6648 3.6648 3.6669 3.6669 4.3528 4.3528 4.3539 4.3539 4.7944 4.7944 4.7954 4.7954 9.5088 9.5088 9.5120 9.5120 10.6197 10.6197 10.6254 10.6254 13.6111 13.6112 k = 0.5000 0.4459-0.0000 ( 5108 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7761 -8.7761 -8.7761 -8.7761 -8.2095 -8.2095 -8.2095 -8.2095 -7.8676 -7.8676 -7.8676 -7.8676 -7.4135 -7.4135 -7.4135 -7.4135 -7.2653 -7.2653 -7.2653 -7.2653 -6.6153 -6.6153 -6.6153 -6.6153 -1.0267 -1.0267 -1.0267 -1.0267 1.7265 1.7265 1.7265 1.7265 1.8734 1.8734 1.8734 1.8734 3.6645 3.6645 3.6645 3.6645 4.3541 4.3541 4.3541 4.3541 4.7969 4.7969 4.7969 4.7969 9.5111 9.5111 9.5111 9.5111 10.6193 10.6193 10.6193 10.6193 13.6100 13.6100 k = 0.5000 0.4459-0.0000 ( 5108 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7761 -8.7761 -8.7761 -8.7761 -8.2095 -8.2095 -8.2095 -8.2095 -7.8676 -7.8676 -7.8676 -7.8676 -7.4135 -7.4135 -7.4135 -7.4135 -7.2653 -7.2653 -7.2653 -7.2653 -6.6153 -6.6153 -6.6153 -6.6153 -1.0267 -1.0267 -1.0267 -1.0267 1.7265 1.7265 1.7265 1.7265 1.8734 1.8734 1.8734 1.8734 3.6645 3.6645 3.6645 3.6645 4.3541 4.3541 4.3541 4.3541 4.7969 4.7969 4.7969 4.7969 9.5111 9.5111 9.5111 9.5111 10.6193 10.6193 10.6193 10.6193 13.6100 13.6100 k = 0.4886 0.4459-0.0000 ( 5112 PWs) bands (ev): -12.2727 -12.2727 -12.2720 -12.2720 -8.7773 -8.7773 -8.7759 -8.7759 -8.2106 -8.2106 -8.2077 -8.2077 -7.8734 -7.8734 -7.8621 -7.8621 -7.4148 -7.4148 -7.4121 -7.4121 -7.2666 -7.2666 -7.2638 -7.2638 -6.6212 -6.6212 -6.6115 -6.6115 -1.0253 -1.0253 -1.0245 -1.0245 1.7206 1.7206 1.7357 1.7357 1.8668 1.8668 1.8812 1.8812 3.6638 3.6638 3.6647 3.6647 4.3490 4.3490 4.3567 4.3567 4.7946 4.7946 4.7978 4.7978 9.5091 9.5091 9.5165 9.5165 10.6214 10.6214 10.6231 10.6231 13.6077 13.6078 k = 0.4773 0.4459-0.0000 ( 5104 PWs) bands (ev): -12.2733 -12.2733 -12.2719 -12.2719 -8.7797 -8.7797 -8.7770 -8.7770 -8.2110 -8.2110 -8.2053 -8.2053 -7.8795 -7.8795 -7.8568 -7.8568 -7.4157 -7.4157 -7.4105 -7.4105 -7.2677 -7.2677 -7.2621 -7.2621 -6.6292 -6.6292 -6.6098 -6.6098 -1.0205 -1.0205 -1.0189 -1.0189 1.7177 1.7177 1.7479 1.7479 1.8617 1.8617 1.8905 1.8905 3.6627 3.6627 3.6645 3.6645 4.3415 4.3415 4.3567 4.3567 4.7912 4.7912 4.7975 4.7975 9.5103 9.5103 9.5251 9.5251 10.6294 10.6294 10.6328 10.6328 13.6013 13.6014 k = 0.4659 0.4459-0.0000 ( 5096 PWs) bands (ev): -12.2741 -12.2741 -12.2721 -12.2721 -8.7831 -8.7831 -8.7791 -8.7791 -8.2107 -8.2107 -8.2022 -8.2022 -7.8858 -7.8858 -7.8519 -7.8519 -7.4162 -7.4162 -7.4087 -7.4087 -7.2685 -7.2685 -7.2604 -7.2604 -6.6392 -6.6392 -6.6101 -6.6101 -1.0122 -1.0122 -1.0099 -1.0099 1.7174 1.7174 1.7623 1.7623 1.8589 1.8589 1.9016 1.9016 3.6613 3.6613 3.6639 3.6639 4.3317 4.3317 4.3543 4.3543 4.7865 4.7865 4.7957 4.7957 9.5149 9.5149 9.5370 9.5370 10.6431 10.6431 10.6483 10.6483 13.5908 13.5916 k = 0.4545 0.4459-0.0000 ( 5096 PWs) bands (ev): -12.2751 -12.2751 -12.2724 -12.2724 -8.7876 -8.7876 -8.7824 -8.7824 -8.2100 -8.2100 -8.1985 -8.1985 -7.8926 -7.8926 -7.8474 -7.8474 -7.4164 -7.4164 -7.4069 -7.4069 -7.2690 -7.2690 -7.2586 -7.2586 -6.6512 -6.6512 -6.6125 -6.6125 -1.0005 -1.0005 -0.9974 -0.9974 1.7191 1.7191 1.7766 1.7766 1.8605 1.8605 1.9152 1.9152 3.6593 3.6593 3.6629 3.6629 4.3196 4.3196 4.3493 4.3493 4.7806 4.7806 4.7926 4.7926 9.5227 9.5227 9.5521 9.5521 10.6625 10.6625 10.6694 10.6694 13.5770 13.5775 k = 0.4432 0.4459-0.0000 ( 5090 PWs) bands (ev): -12.2763 -12.2763 -12.2729 -12.2729 -8.7929 -8.7929 -8.7866 -8.7866 -8.2087 -8.2087 -8.1943 -8.1943 -7.8995 -7.8995 -7.8431 -7.8431 -7.4162 -7.4162 -7.4051 -7.4051 -7.2692 -7.2692 -7.2568 -7.2568 -6.6652 -6.6652 -6.6169 -6.6169 -0.9854 -0.9854 -0.9816 -0.9816 1.7221 1.7221 1.7869 1.7869 1.8707 1.8707 1.9319 1.9319 3.6570 3.6570 3.6615 3.6615 4.3054 4.3054 4.3417 4.3417 4.7737 4.7737 4.7881 4.7881 9.5337 9.5337 9.5702 9.5702 10.6873 10.6873 10.6960 10.6960 13.5598 13.5600 k = 0.4318 0.4459-0.0000 ( 5072 PWs) bands (ev): -12.2777 -12.2777 -12.2736 -12.2736 -8.7990 -8.7990 -8.7916 -8.7916 -8.2069 -8.2069 -8.1896 -8.1896 -7.9067 -7.9067 -7.8391 -7.8391 -7.4155 -7.4155 -7.4034 -7.4034 -7.2689 -7.2689 -7.2550 -7.2550 -6.6809 -6.6809 -6.6231 -6.6231 -0.9669 -0.9669 -0.9626 -0.9626 1.7256 1.7256 1.7904 1.7904 1.8922 1.8922 1.9525 1.9525 3.6541 3.6541 3.6597 3.6597 4.2892 4.2892 4.3318 4.3318 4.7657 4.7657 4.7821 4.7821 9.5478 9.5478 9.5913 9.5913 10.7173 10.7173 10.7278 10.7278 13.5404 13.5414 k = 0.4205 0.4459-0.0000 ( 5084 PWs) bands (ev): -12.2792 -12.2792 -12.2746 -12.2746 -8.8058 -8.8058 -8.7975 -8.7975 -8.2049 -8.2049 -8.1846 -8.1846 -7.9144 -7.9144 -7.8355 -7.8355 -7.4147 -7.4147 -7.4021 -7.4021 -7.2683 -7.2683 -7.2533 -7.2533 -6.6985 -6.6985 -6.6313 -6.6313 -0.9452 -0.9452 -0.9403 -0.9403 1.7290 1.7290 1.7883 1.7883 1.9237 1.9237 1.9776 1.9776 3.6508 3.6508 3.6575 3.6575 4.2711 4.2711 4.3195 4.3195 4.7566 4.7566 4.7746 4.7746 9.5649 9.5649 9.6152 9.6152 10.7521 10.7521 10.7645 10.7645 13.5191 13.5208 k = 0.4091 0.4459-0.0000 ( 5084 PWs) bands (ev): -12.2809 -12.2809 -12.2757 -12.2757 -8.8130 -8.8130 -8.8040 -8.8040 -8.2025 -8.2025 -8.1793 -8.1793 -7.9222 -7.9222 -7.8323 -7.8323 -7.4135 -7.4135 -7.4010 -7.4010 -7.2671 -7.2671 -7.2517 -7.2517 -6.7177 -6.7177 -6.6412 -6.6412 -0.9203 -0.9203 -0.9150 -0.9150 1.7318 1.7318 1.7830 1.7830 1.9628 1.9628 2.0076 2.0076 3.6470 3.6470 3.6549 3.6549 4.2513 4.2513 4.3051 4.3051 4.7465 4.7465 4.7657 4.7657 9.5847 9.5847 9.6417 9.6417 10.7914 10.7914 10.8057 10.8057 13.4967 13.4985 k = 0.3977 0.4459-0.0000 ( 5084 PWs) bands (ev): -12.2828 -12.2828 -12.2771 -12.2771 -8.8206 -8.8206 -8.8109 -8.8109 -8.2000 -8.2000 -8.1737 -8.1737 -7.9304 -7.9304 -7.8293 -7.8293 -7.4119 -7.4119 -7.4003 -7.4003 -7.2655 -7.2655 -7.2502 -7.2502 -6.7383 -6.7383 -6.6528 -6.6528 -0.8923 -0.8923 -0.8867 -0.8867 1.7338 1.7338 1.7761 1.7761 2.0079 2.0079 2.0427 2.0427 3.6427 3.6427 3.6518 3.6518 4.2300 4.2300 4.2885 4.2885 4.7353 4.7353 4.7553 4.7553 9.6073 9.6073 9.6707 9.6707 10.8347 10.8347 10.8509 10.8509 13.4737 13.4737 k = 0.3864 0.4459-0.0000 ( 5080 PWs) bands (ev): -12.2849 -12.2849 -12.2786 -12.2786 -8.8284 -8.8284 -8.8182 -8.8182 -8.1974 -8.1974 -8.1679 -8.1679 -7.9388 -7.9388 -7.8267 -7.8267 -7.4101 -7.4101 -7.4001 -7.4001 -7.2633 -7.2633 -7.2488 -7.2488 -6.7602 -6.7602 -6.6658 -6.6658 -0.8614 -0.8614 -0.8556 -0.8556 1.7350 1.7350 1.7682 1.7682 2.0583 2.0583 2.0830 2.0830 3.6378 3.6378 3.6483 3.6483 4.2073 4.2073 4.2701 4.2701 4.7232 4.7232 4.7434 4.7434 9.6322 9.6322 9.7018 9.7018 10.8816 10.8816 10.8997 10.8997 13.4510 13.4510 k = 0.3750 0.4459-0.0000 ( 5100 PWs) bands (ev): -12.2871 -12.2871 -12.2804 -12.2804 -8.8363 -8.8363 -8.8257 -8.8257 -8.1948 -8.1948 -8.1622 -8.1622 -7.9476 -7.9476 -7.8245 -7.8245 -7.4082 -7.4082 -7.4004 -7.4004 -7.2608 -7.2608 -7.2479 -7.2479 -6.7834 -6.7834 -6.6804 -6.6804 -0.8277 -0.8277 -0.8219 -0.8219 1.7353 1.7353 1.7598 1.7598 2.1135 2.1135 2.1283 2.1283 3.6324 3.6324 3.6444 3.6444 4.1835 4.1835 4.2500 4.2500 4.7100 4.7100 4.7301 4.7301 9.6592 9.6592 9.7347 9.7347 10.9316 10.9316 10.9516 10.9516 13.4291 13.4292 k = 0.3636 0.4459-0.0000 ( 5100 PWs) bands (ev): -12.2895 -12.2895 -12.2823 -12.2823 -8.8440 -8.8440 -8.8333 -8.8333 -8.1922 -8.1922 -8.1564 -8.1564 -7.9565 -7.9565 -7.8226 -7.8226 -7.4059 -7.4059 -7.4012 -7.4012 -7.2578 -7.2578 -7.2471 -7.2471 -6.8074 -6.8074 -6.6962 -6.6962 -0.7913 -0.7913 -0.7856 -0.7856 1.7349 1.7349 1.7513 1.7513 2.1732 2.1732 2.1783 2.1783 3.6263 3.6263 3.6399 3.6399 4.1588 4.1588 4.2283 4.2283 4.6959 4.6959 4.7153 4.7153 9.6880 9.6880 9.7693 9.7693 10.9839 10.9839 11.0059 11.0059 13.4089 13.4089 k = 0.3523 0.4459-0.0000 ( 5104 PWs) bands (ev): -12.2921 -12.2921 -12.2844 -12.2844 -8.8516 -8.8516 -8.8408 -8.8408 -8.1896 -8.1896 -8.1508 -8.1508 -7.9656 -7.9656 -7.8211 -7.8211 -7.4034 -7.4034 -7.4024 -7.4024 -7.2544 -7.2544 -7.2469 -7.2469 -6.8322 -6.8322 -6.7131 -6.7131 -0.7524 -0.7524 -0.7470 -0.7470 1.7342 1.7342 1.7428 1.7428 2.2327 2.2327 2.2371 2.2371 3.6195 3.6195 3.6350 3.6350 4.1333 4.1333 4.2054 4.2054 4.6808 4.6808 4.6991 4.6991 9.7182 9.7182 9.8049 9.8049 11.0381 11.0381 11.0620 11.0620 13.3909 13.3909 k = 0.3409 0.4459-0.0000 ( 5110 PWs) bands (ev): -12.2948 -12.2948 -12.2867 -12.2867 -8.8588 -8.8588 -8.8482 -8.8482 -8.1873 -8.1873 -8.1454 -8.1454 -7.9749 -7.9749 -7.8199 -7.8199 -7.4041 -7.4041 -7.4009 -7.4009 -7.2508 -7.2508 -7.2473 -7.2473 -6.8574 -6.8574 -6.7310 -6.7310 -0.7113 -0.7113 -0.7063 -0.7063 1.7334 1.7334 1.7347 1.7347 2.2913 2.2913 2.3049 2.3049 3.6120 3.6120 3.6296 3.6296 4.1072 4.1072 4.1814 4.1814 4.6649 4.6649 4.6815 4.6815 9.7495 9.7495 9.8414 9.8414 11.0934 11.0934 11.1192 11.1192 13.3759 13.3759 k = 0.3295 0.4459-0.0000 ( 5104 PWs) bands (ev): -12.2976 -12.2976 -12.2892 -12.2892 -8.8655 -8.8655 -8.8552 -8.8552 -8.1850 -8.1850 -8.1402 -8.1402 -7.9842 -7.9842 -7.8190 -7.8190 -7.4061 -7.4061 -7.3982 -7.3982 -7.2484 -7.2484 -7.2469 -7.2469 -6.8825 -6.8825 -6.7496 -6.7496 -0.6681 -0.6681 -0.6636 -0.6636 1.7269 1.7269 1.7326 1.7326 2.3535 2.3535 2.3764 2.3764 3.6037 3.6037 3.6236 3.6236 4.0809 4.0809 4.1566 4.1566 4.6481 4.6481 4.6626 4.6626 9.7814 9.7814 9.8781 9.8781 11.1490 11.1490 11.1766 11.1766 13.3646 13.3646 k = 0.3182 0.4459-0.0000 ( 5100 PWs) bands (ev): -12.3006 -12.3006 -12.2919 -12.2919 -8.8716 -8.8716 -8.8618 -8.8618 -8.1831 -8.1831 -8.1356 -8.1356 -7.9934 -7.9934 -7.8184 -7.8184 -7.4086 -7.4086 -7.3955 -7.3955 -7.2505 -7.2505 -7.2429 -7.2429 -6.9075 -6.9075 -6.7690 -6.7690 -0.6230 -0.6230 -0.6193 -0.6193 1.7199 1.7199 1.7322 1.7322 2.4191 2.4191 2.4512 2.4512 3.5946 3.5946 3.6170 3.6170 4.0546 4.0546 4.1313 4.1313 4.6305 4.6305 4.6423 4.6423 9.8133 9.8133 9.9145 9.9145 11.2042 11.2042 11.2335 11.2335 13.3577 13.3577 k = 0.3068 0.4459-0.0000 ( 5100 PWs) bands (ev): -12.3037 -12.3037 -12.2948 -12.2948 -8.8771 -8.8771 -8.8679 -8.8679 -8.1814 -8.1814 -8.1317 -8.1317 -8.0025 -8.0025 -7.8182 -7.8182 -7.4115 -7.4115 -7.3928 -7.3928 -7.2538 -7.2538 -7.2390 -7.2390 -6.9317 -6.9317 -6.7888 -6.7888 -0.5763 -0.5763 -0.5735 -0.5735 1.7138 1.7138 1.7324 1.7324 2.4875 2.4875 2.5291 2.5291 3.5846 3.5846 3.6097 3.6097 4.0284 4.0284 4.1057 4.1057 4.6123 4.6123 4.6209 4.6209 9.8448 9.8448 9.9502 9.9502 11.2580 11.2580 11.2890 11.2890 13.3559 13.3559 k = 0.2955 0.4459-0.0000 ( 5108 PWs) bands (ev): -12.3069 -12.3069 -12.2978 -12.2978 -8.8819 -8.8819 -8.8735 -8.8735 -8.1801 -8.1801 -8.1287 -8.1287 -8.0111 -8.0111 -7.8183 -7.8183 -7.4148 -7.4148 -7.3902 -7.3902 -7.2586 -7.2586 -7.2352 -7.2352 -6.9549 -6.9549 -6.8090 -6.8090 -0.5282 -0.5282 -0.5266 -0.5266 1.7088 1.7088 1.7334 1.7334 2.5584 2.5584 2.6096 2.6096 3.5736 3.5736 3.6018 3.6018 4.0027 4.0027 4.0800 4.0800 4.5935 4.5935 4.5983 4.5983 9.8753 9.8753 9.9845 9.9845 11.3097 11.3097 11.3421 11.3421 13.3601 13.3601 k = 0.2841 0.4459-0.0000 ( 5108 PWs) bands (ev): -12.3102 -12.3102 -12.3009 -12.3009 -8.8858 -8.8858 -8.8783 -8.8783 -8.1792 -8.1792 -8.1269 -8.1269 -8.0190 -8.0190 -7.8188 -7.8188 -7.4183 -7.4183 -7.3877 -7.3877 -7.2653 -7.2653 -7.2315 -7.2315 -6.9765 -6.9765 -6.8293 -6.8293 -0.4791 -0.4791 -0.4787 -0.4787 1.7051 1.7051 1.7356 1.7356 2.6311 2.6311 2.6925 2.6925 3.5616 3.5616 3.5930 3.5930 3.9776 3.9776 4.0546 4.0546 4.5745 4.5745 4.5746 4.5746 9.9042 9.9042 10.0169 10.0169 11.3583 11.3583 11.3919 11.3919 13.3708 13.3708 k = 0.2727 0.4459-0.0000 ( 5104 PWs) bands (ev): -12.3135 -12.3135 -12.3042 -12.3042 -8.8889 -8.8889 -8.8825 -8.8825 -8.1786 -8.1786 -8.1268 -8.1268 -8.0257 -8.0257 -7.8197 -7.8197 -7.4222 -7.4222 -7.3853 -7.3853 -7.2739 -7.2739 -7.2282 -7.2282 -6.9959 -6.9959 -6.8494 -6.8494 -0.4303 -0.4303 -0.4292 -0.4292 1.7030 1.7030 1.7392 1.7392 2.7051 2.7051 2.7772 2.7772 3.5487 3.5487 3.5835 3.5835 3.9534 3.9534 4.0297 4.0297 4.5501 4.5501 4.5553 4.5553 9.9309 9.9309 10.0466 10.0466 11.4031 11.4031 11.4376 11.4376 13.3887 13.3887 k = 0.2614 0.4459-0.0000 ( 5108 PWs) bands (ev): -12.3170 -12.3170 -12.3076 -12.3076 -8.8910 -8.8910 -8.8858 -8.8858 -8.1785 -8.1785 -8.1288 -8.1288 -8.0309 -8.0309 -7.8210 -7.8210 -7.4263 -7.4263 -7.3832 -7.3832 -7.2847 -7.2847 -7.2253 -7.2253 -7.0130 -7.0130 -6.8693 -6.8693 -0.3816 -0.3816 -0.3789 -0.3789 1.7027 1.7027 1.7444 1.7444 2.7797 2.7797 2.8631 2.8631 3.5350 3.5350 3.5730 3.5730 3.9302 3.9302 4.0057 4.0057 4.5249 4.5249 4.5364 4.5364 9.9549 9.9549 10.0732 10.0732 11.4434 11.4434 11.4785 11.4785 13.4144 13.4144 k = 0.2500 0.4459-0.0000 ( 5100 PWs) bands (ev): -12.3205 -12.3205 -12.3111 -12.3111 -8.8921 -8.8921 -8.8883 -8.8883 -8.1789 -8.1789 -8.1330 -8.1330 -8.0343 -8.0343 -7.8226 -7.8226 -7.4307 -7.4307 -7.3816 -7.3816 -7.2975 -7.2975 -7.2228 -7.2228 -7.0273 -7.0273 -6.8887 -6.8887 -0.3329 -0.3329 -0.3285 -0.3285 1.7045 1.7045 1.7514 1.7514 2.8541 2.8541 2.9493 2.9493 3.5208 3.5208 3.5617 3.5617 3.9082 3.9082 3.9828 3.9828 4.4993 4.4993 4.5181 4.5181 9.9755 9.9755 10.0959 10.0959 11.4785 11.4785 11.5139 11.5139 13.4481 13.4481 k = 0.2386 0.4459-0.0000 ( 5100 PWs) bands (ev): -12.3240 -12.3240 -12.3147 -12.3147 -8.8922 -8.8922 -8.8898 -8.8898 -8.1798 -8.1798 -8.1395 -8.1395 -8.0360 -8.0360 -7.8248 -7.8248 -7.4355 -7.4355 -7.3808 -7.3808 -7.3118 -7.3118 -7.2210 -7.2210 -7.0390 -7.0390 -6.9075 -6.9075 -0.2846 -0.2846 -0.2784 -0.2784 1.7087 1.7087 1.7606 1.7606 2.9273 2.9273 3.0347 3.0347 3.5067 3.5067 3.5494 3.5494 3.8876 3.8876 3.9614 3.9614 4.4734 4.4734 4.5008 4.5008 9.9922 9.9922 10.1142 10.1142 11.5082 11.5082 11.5433 11.5433 13.4900 13.4900 k = 0.2273 0.4459-0.0000 ( 5098 PWs) bands (ev): -12.3276 -12.3276 -12.3184 -12.3184 -8.8912 -8.8912 -8.8905 -8.8905 -8.1813 -8.1813 -8.1480 -8.1480 -8.0360 -8.0360 -7.8274 -7.8274 -7.4404 -7.4404 -7.3817 -7.3817 -7.3263 -7.3263 -7.2199 -7.2199 -7.0482 -7.0482 -6.9253 -6.9253 -0.2369 -0.2369 -0.2289 -0.2289 1.7154 1.7154 1.7721 1.7721 2.9981 2.9981 3.1171 3.1171 3.4943 3.4943 3.5364 3.5364 3.8683 3.8683 3.9417 3.9417 4.4479 4.4479 4.4851 4.4851 10.0045 10.0045 10.1276 10.1276 11.5322 11.5322 11.5667 11.5667 13.5400 13.5435 k = 0.2159 0.4459-0.0000 ( 5092 PWs) bands (ev): -12.3312 -12.3312 -12.3221 -12.3221 -8.8903 -8.8903 -8.8893 -8.8893 -8.1834 -8.1834 -8.1582 -8.1582 -8.0348 -8.0348 -7.8305 -7.8305 -7.4456 -7.4456 -7.3862 -7.3862 -7.3388 -7.3388 -7.2196 -7.2196 -7.0551 -7.0551 -6.9421 -6.9421 -0.1902 -0.1902 -0.1803 -0.1803 1.7249 1.7249 1.7861 1.7861 3.0651 3.0651 3.1926 3.1926 3.4866 3.4866 3.5230 3.5230 3.8505 3.8505 3.9240 3.9240 4.4231 4.4231 4.4718 4.4718 10.0121 10.0121 10.1356 10.1356 11.5505 11.5505 11.5840 11.5840 13.5978 13.5991 k = 0.2045 0.4459-0.0000 ( 5096 PWs) bands (ev): -12.3347 -12.3347 -12.3258 -12.3258 -8.8891 -8.8891 -8.8863 -8.8863 -8.1862 -8.1862 -8.1698 -8.1698 -8.0328 -8.0328 -7.8342 -7.8342 -7.4512 -7.4512 -7.3962 -7.3962 -7.3468 -7.3468 -7.2202 -7.2202 -7.0602 -7.0602 -6.9577 -6.9577 -0.1449 -0.1449 -0.1332 -0.1332 1.7375 1.7375 1.8029 1.8029 3.1263 3.1263 3.2535 3.2535 3.4906 3.4906 3.5097 3.5097 3.8340 3.8340 3.9085 3.9085 4.3998 4.3998 4.4616 4.4616 10.0147 10.0147 10.1380 10.1380 11.5634 11.5634 11.5956 11.5956 13.6628 13.6632 k = 0.1932 0.4459-0.0000 ( 5088 PWs) bands (ev): -12.3382 -12.3382 -12.3296 -12.3296 -8.8869 -8.8869 -8.8823 -8.8823 -8.1896 -8.1896 -8.1823 -8.1823 -8.0300 -8.0300 -7.8384 -7.8384 -7.4569 -7.4569 -7.4112 -7.4112 -7.3500 -7.3500 -7.2217 -7.2217 -7.0636 -7.0636 -6.9719 -6.9719 -0.1012 -0.1012 -0.0877 -0.0877 1.7534 1.7534 1.8225 1.8225 3.1793 3.1793 3.2889 3.2889 3.4978 3.4978 3.5158 3.5158 3.8189 3.8189 3.8954 3.8954 4.3790 4.3790 4.4554 4.4554 10.0120 10.0120 10.1344 10.1344 11.5712 11.5712 11.6017 11.6017 13.7344 13.7344 k = 0.1818 0.4459-0.0000 ( 5080 PWs) bands (ev): -12.3416 -12.3416 -12.3333 -12.3333 -8.8839 -8.8839 -8.8774 -8.8774 -8.1955 -8.1955 -8.1937 -8.1937 -8.0268 -8.0268 -7.8432 -7.8432 -7.4628 -7.4628 -7.4287 -7.4287 -7.3505 -7.3505 -7.2241 -7.2241 -7.0658 -7.0658 -6.9846 -6.9846 -0.0593 -0.0593 -0.0442 -0.0442 1.7726 1.7726 1.8450 1.8450 3.2209 3.2209 3.2967 3.2967 3.4891 3.4891 3.5629 3.5629 3.8051 3.8051 3.8848 3.8848 4.3620 4.3620 4.4544 4.4544 10.0041 10.0041 10.1249 10.1249 11.5744 11.5744 11.6031 11.6031 13.8115 13.8116 k = 0.1705 0.4459-0.0000 ( 5084 PWs) bands (ev): -12.3449 -12.3449 -12.3369 -12.3369 -8.8800 -8.8800 -8.8716 -8.8716 -8.2093 -8.2093 -8.1988 -8.1988 -8.0233 -8.0233 -7.8487 -7.8487 -7.4691 -7.4691 -7.4471 -7.4471 -7.3496 -7.3496 -7.2274 -7.2274 -7.0671 -7.0671 -6.9959 -6.9959 -0.0196 -0.0196 -0.0031 -0.0031 1.7954 1.7954 1.8706 1.8706 3.2477 3.2477 3.2865 3.2865 3.4861 3.4861 3.6200 3.6200 3.7929 3.7929 3.8764 3.8764 4.3505 4.3505 4.4592 4.4592 9.9910 9.9910 10.1095 10.1095 11.5737 11.5737 11.6002 11.6002 13.8931 13.8931 k = 0.1591 0.4459-0.0000 ( 5088 PWs) bands (ev): -12.3482 -12.3482 -12.3405 -12.3405 -8.8753 -8.8753 -8.8650 -8.8650 -8.2233 -8.2233 -8.2046 -8.2046 -8.0197 -8.0197 -7.8549 -7.8549 -7.4755 -7.4755 -7.4652 -7.4652 -7.3482 -7.3482 -7.2316 -7.2316 -7.0677 -7.0677 -7.0057 -7.0057 0.0178 0.0178 0.0354 0.0354 1.8218 1.8218 1.8991 1.8991 3.2575 3.2575 3.2669 3.2669 3.4899 3.4899 3.6752 3.6752 3.7831 3.7831 3.8700 3.8700 4.3466 4.3466 4.4709 4.4709 9.9730 9.9730 10.0885 10.0885 11.5696 11.5696 11.5940 11.5940 13.9780 13.9782 k = 0.1477 0.4459-0.0000 ( 5084 PWs) bands (ev): -12.3513 -12.3513 -12.3440 -12.3440 -8.8698 -8.8698 -8.8577 -8.8577 -8.2373 -8.2373 -8.2113 -8.2113 -8.0159 -8.0159 -7.8615 -7.8615 -7.4822 -7.4822 -7.4821 -7.4821 -7.3463 -7.3463 -7.2364 -7.2364 -7.0677 -7.0677 -7.0140 -7.0140 0.0527 0.0527 0.0711 0.0711 1.8518 1.8518 1.9306 1.9306 3.2421 3.2421 3.2518 3.2518 3.4992 3.4992 3.7176 3.7176 3.7797 3.7797 3.8649 3.8649 4.3528 4.3528 4.4895 4.4895 9.9506 9.9506 10.0622 10.0622 11.5628 11.5628 11.5850 11.5850 14.0645 14.0646 k = 0.1364 0.4459-0.0000 ( 5092 PWs) bands (ev): -12.3542 -12.3542 -12.3474 -12.3474 -8.8636 -8.8636 -8.8498 -8.8498 -8.2513 -8.2513 -8.2188 -8.2188 -8.0120 -8.0120 -7.8688 -7.8688 -7.4979 -7.4979 -7.4889 -7.4889 -7.3442 -7.3442 -7.2419 -7.2419 -7.0673 -7.0673 -7.0211 -7.0211 0.0849 0.0849 0.1038 0.1038 1.8852 1.8852 1.9649 1.9649 3.2140 3.2140 3.2343 3.2343 3.5106 3.5106 3.7330 3.7330 3.7928 3.7928 3.8606 3.8606 4.3707 4.3707 4.5151 4.5151 9.9244 9.9244 10.0314 10.0314 11.5539 11.5539 11.5739 11.5739 14.1502 14.1502 k = 0.1250 0.4459-0.0000 ( 5096 PWs) bands (ev): -12.3570 -12.3570 -12.3506 -12.3506 -8.8567 -8.8567 -8.8415 -8.8415 -8.2650 -8.2650 -8.2273 -8.2273 -8.0081 -8.0081 -7.8765 -7.8765 -7.5120 -7.5120 -7.4959 -7.4959 -7.3420 -7.3420 -7.2478 -7.2478 -7.0665 -7.0665 -7.0269 -7.0269 0.1145 0.1145 0.1335 0.1335 1.9220 1.9220 2.0016 2.0016 3.1836 3.1836 3.2085 3.2085 3.5216 3.5216 3.7288 3.7288 3.8133 3.8133 3.8565 3.8565 4.4008 4.4008 4.5466 4.5466 9.8951 9.8951 9.9967 9.9967 11.5436 11.5436 11.5615 11.5615 14.2306 14.2310 k = 0.1136 0.4459-0.0000 ( 5088 PWs) bands (ev): -12.3596 -12.3596 -12.3537 -12.3537 -8.8493 -8.8493 -8.8329 -8.8329 -8.2782 -8.2782 -8.2364 -8.2364 -8.0040 -8.0040 -7.8844 -7.8844 -7.5242 -7.5242 -7.5028 -7.5028 -7.3395 -7.3395 -7.2539 -7.2539 -7.0655 -7.0655 -7.0317 -7.0317 0.1414 0.1414 0.1601 0.1601 1.9617 1.9617 2.0406 2.0406 3.1514 3.1514 3.1770 3.1770 3.5309 3.5309 3.7191 3.7191 3.8277 3.8277 3.8523 3.8523 4.4415 4.4415 4.5829 4.5829 9.8636 9.8636 9.9590 9.9590 11.5324 11.5324 11.5482 11.5482 14.2845 14.2850 k = 0.1023 0.4459-0.0000 ( 5088 PWs) bands (ev): -12.3619 -12.3619 -12.3565 -12.3565 -8.8416 -8.8416 -8.8243 -8.8243 -8.2906 -8.2906 -8.2464 -8.2464 -8.0000 -8.0000 -7.8926 -7.8926 -7.5347 -7.5347 -7.5097 -7.5097 -7.3370 -7.3370 -7.2601 -7.2601 -7.0644 -7.0644 -7.0356 -7.0356 0.1655 0.1655 0.1835 0.1835 2.0041 2.0041 2.0813 2.0813 3.1177 3.1177 3.1414 3.1414 3.5384 3.5384 3.7077 3.7077 3.8347 3.8347 3.8479 3.8479 4.4898 4.4898 4.6222 4.6222 9.8309 9.8309 9.9193 9.9193 11.5208 11.5208 11.5347 11.5347 14.2788 14.2788 k = 0.0909 0.4459-0.0000 ( 5062 PWs) bands (ev): -12.3640 -12.3640 -12.3592 -12.3592 -8.8335 -8.8335 -8.8157 -8.8157 -8.3020 -8.3020 -8.2568 -8.2568 -7.9957 -7.9957 -7.9008 -7.9008 -7.5432 -7.5432 -7.5164 -7.5164 -7.3342 -7.3342 -7.2662 -7.2662 -7.0631 -7.0631 -7.0388 -7.0388 0.1870 0.1870 0.2040 0.2040 2.0486 2.0486 2.1232 2.1232 3.0828 3.0828 3.1031 3.1031 3.5444 3.5444 3.6951 3.6951 3.8362 3.8362 3.8432 3.8432 4.5423 4.5423 4.6626 4.6626 9.7981 9.7981 9.8788 9.8788 11.5093 11.5093 11.5214 11.5214 14.2560 14.2560 k = 0.0795 0.4459-0.0000 ( 5058 PWs) bands (ev): -12.3659 -12.3659 -12.3616 -12.3616 -8.8253 -8.8253 -8.8076 -8.8076 -8.3123 -8.3123 -8.2677 -8.2677 -7.9915 -7.9915 -7.9090 -7.9090 -7.5501 -7.5501 -7.5231 -7.5231 -7.3314 -7.3314 -7.2723 -7.2723 -7.0618 -7.0618 -7.0415 -7.0415 0.2058 0.2058 0.2215 0.2215 2.0946 2.0946 2.1655 2.1655 3.0473 3.0473 3.0629 3.0629 3.5494 3.5494 3.6819 3.6819 3.8344 3.8344 3.8385 3.8385 4.5958 4.5958 4.7022 4.7022 9.7662 9.7662 9.8386 9.8386 11.4984 11.4984 11.5087 11.5087 14.2261 14.2261 k = 0.0682 0.4459-0.0000 ( 5058 PWs) bands (ev): -12.3675 -12.3675 -12.3638 -12.3638 -8.8172 -8.8172 -8.8002 -8.8002 -8.3211 -8.3211 -8.2788 -8.2788 -7.9872 -7.9872 -7.9170 -7.9170 -7.5554 -7.5554 -7.5296 -7.5296 -7.3285 -7.3285 -7.2782 -7.2782 -7.0605 -7.0605 -7.0437 -7.0437 0.2221 0.2221 0.2361 0.2361 2.1412 2.1412 2.2074 2.2074 3.0115 3.0115 3.0221 3.0221 3.5540 3.5540 3.6682 3.6682 3.8310 3.8310 3.8339 3.8339 4.6477 4.6477 4.7394 4.7394 9.7365 9.7365 9.7999 9.7999 11.4882 11.4882 11.4969 11.4969 14.1949 14.1949 k = 0.0568 0.4459-0.0000 ( 5062 PWs) bands (ev): -12.3689 -12.3689 -12.3658 -12.3658 -8.8095 -8.8095 -8.7937 -8.7937 -8.3283 -8.3283 -8.2899 -8.2899 -7.9829 -7.9829 -7.9248 -7.9248 -7.5591 -7.5591 -7.5357 -7.5357 -7.3255 -7.3255 -7.2838 -7.2838 -7.0592 -7.0592 -7.0457 -7.0457 0.2360 0.2360 0.2480 0.2480 2.1875 2.1875 2.2475 2.2475 2.9761 2.9761 2.9818 2.9818 3.5586 3.5586 3.6543 3.6543 3.8271 3.8271 3.8295 3.8295 4.6960 4.6960 4.7726 4.7726 9.7100 9.7100 9.7638 9.7638 11.4793 11.4793 11.4864 11.4864 14.1655 14.1656 k = 0.0455 0.4459-0.0000 ( 5066 PWs) bands (ev): -12.3699 -12.3699 -12.3674 -12.3674 -8.8022 -8.8022 -8.7885 -8.7885 -8.3335 -8.3335 -8.3006 -8.3006 -7.9783 -7.9783 -7.9322 -7.9322 -7.5614 -7.5614 -7.5415 -7.5415 -7.3224 -7.3224 -7.2892 -7.2892 -7.0579 -7.0579 -7.0474 -7.0474 0.2474 0.2474 0.2573 0.2573 2.2320 2.2320 2.2842 2.2842 2.9423 2.9423 2.9436 2.9436 3.5637 3.5637 3.6406 3.6406 3.8235 3.8235 3.8257 3.8257 4.7390 4.7390 4.8003 4.8003 9.6877 9.6877 9.7315 9.7315 11.4718 11.4718 11.4774 11.4774 14.1401 14.1402 k = 0.0341 0.4459-0.0000 ( 5068 PWs) bands (ev): -12.3707 -12.3707 -12.3688 -12.3688 -8.7957 -8.7957 -8.7847 -8.7847 -8.3366 -8.3366 -8.3105 -8.3105 -7.9736 -7.9736 -7.9392 -7.9392 -7.5624 -7.5624 -7.5467 -7.5467 -7.3191 -7.3191 -7.2943 -7.2943 -7.0567 -7.0567 -7.0489 -7.0489 0.2565 0.2565 0.2641 0.2641 2.2729 2.2729 2.3154 2.3154 2.9098 2.9098 2.9115 2.9115 3.5694 3.5694 3.6274 3.6274 3.8206 3.8206 3.8224 3.8224 4.7754 4.7754 4.8214 4.8214 9.6707 9.6707 9.7039 9.7039 11.4659 11.4659 11.4701 11.4701 14.1196 14.1199 k = 0.0227 0.4459-0.0000 ( 5056 PWs) bands (ev): -12.3712 -12.3712 -12.3699 -12.3699 -8.7902 -8.7902 -8.7825 -8.7825 -8.3374 -8.3374 -8.3193 -8.3193 -7.9686 -7.9686 -7.9458 -7.9458 -7.5621 -7.5621 -7.5513 -7.5513 -7.3155 -7.3155 -7.2990 -7.2990 -7.0553 -7.0553 -7.0503 -7.0503 0.2634 0.2634 0.2685 0.2685 2.3080 2.3080 2.3384 2.3384 2.8830 2.8830 2.8859 2.8859 3.5762 3.5762 3.6150 3.6150 3.8186 3.8186 3.8199 3.8199 4.8043 4.8043 4.8349 4.8349 9.6596 9.6596 9.6819 9.6819 11.4618 11.4618 11.4645 11.4645 14.1049 14.1051 k = 0.0114 0.4459-0.0000 ( 5062 PWs) bands (ev): -12.3713 -12.3713 -12.3707 -12.3707 -8.7859 -8.7859 -8.7820 -8.7820 -8.3360 -8.3360 -8.3267 -8.3267 -7.9634 -7.9634 -7.9520 -7.9520 -7.5608 -7.5608 -7.5553 -7.5553 -7.3118 -7.3118 -7.3036 -7.3036 -7.0541 -7.0541 -7.0516 -7.0516 0.2680 0.2680 0.2706 0.2706 2.3343 2.3343 2.3502 2.3502 2.8660 2.8660 2.8682 2.8682 3.5841 3.5841 3.6035 3.6035 3.8175 3.8175 3.8182 3.8182 4.8249 4.8249 4.8403 4.8403 9.6549 9.6549 9.6662 9.6662 11.4595 11.4595 11.4609 11.4609 14.0967 14.0974 k = 0.0000 0.4459-0.0000 ( 5070 PWs) bands (ev): -12.3711 -12.3711 -12.3711 -12.3711 -8.7831 -8.7831 -8.7831 -8.7831 -8.3324 -8.3324 -8.3324 -8.3324 -7.9579 -7.9579 -7.9579 -7.9579 -7.5586 -7.5586 -7.5586 -7.5586 -7.3078 -7.3078 -7.3078 -7.3078 -7.0529 -7.0529 -7.0529 -7.0529 0.2704 0.2704 0.2704 0.2704 2.3489 2.3489 2.3489 2.3489 2.8610 2.8610 2.8610 2.8610 3.5932 3.5932 3.5932 3.5932 3.8174 3.8174 3.8174 3.8174 4.8370 4.8370 4.8370 4.8370 9.6571 9.6571 9.6571 9.6571 11.4592 11.4592 11.4592 11.4592 14.0939 14.0939 k = 0.0000 0.4459-0.0000 ( 5070 PWs) bands (ev): -12.3711 -12.3711 -12.3711 -12.3711 -8.7831 -8.7831 -8.7831 -8.7831 -8.3324 -8.3324 -8.3324 -8.3324 -7.9579 -7.9579 -7.9579 -7.9579 -7.5586 -7.5586 -7.5586 -7.5586 -7.3078 -7.3078 -7.3078 -7.3078 -7.0529 -7.0529 -7.0529 -7.0529 0.2704 0.2704 0.2704 0.2704 2.3489 2.3489 2.3489 2.3489 2.8610 2.8610 2.8610 2.8610 3.5932 3.5932 3.5932 3.5932 3.8174 3.8174 3.8174 3.8174 4.8370 4.8370 4.8370 4.8370 9.6571 9.6571 9.6571 9.6571 11.4592 11.4592 11.4592 11.4592 14.0939 14.0939 k = 0.0000 0.4345-0.0000 ( 5066 PWs) bands (ev): -12.3909 -12.3909 -12.3519 -12.3519 -8.7896 -8.7896 -8.7769 -8.7769 -8.3350 -8.3350 -8.3298 -8.3298 -7.9712 -7.9712 -7.9448 -7.9448 -7.5610 -7.5610 -7.5561 -7.5561 -7.3125 -7.3125 -7.3034 -7.3034 -7.0742 -7.0742 -7.0304 -7.0304 0.2389 0.2389 0.3042 0.3042 2.3021 2.3021 2.3963 2.3963 2.8172 2.8172 2.9049 2.9049 3.5599 3.5599 3.6272 3.6272 3.7901 3.7901 3.8463 3.8463 4.8325 4.8325 4.8412 4.8412 9.6206 9.6206 9.6908 9.6908 11.4199 11.4199 11.5003 11.5003 14.0879 14.0880 k = 0.0000 0.4230-0.0000 ( 5062 PWs) bands (ev): -12.4110 -12.4110 -12.3331 -12.3331 -8.7963 -8.7963 -8.7709 -8.7709 -8.3375 -8.3375 -8.3272 -8.3272 -7.9847 -7.9847 -7.9320 -7.9320 -7.5635 -7.5635 -7.5537 -7.5537 -7.3173 -7.3173 -7.2992 -7.2992 -7.0944 -7.0944 -7.0068 -7.0068 0.2096 0.2096 0.3402 0.3402 2.2558 2.2558 2.4441 2.4441 2.7737 2.7737 2.9488 2.9488 3.5274 3.5274 3.6616 3.6616 3.7649 3.7649 3.8768 3.8768 4.8278 4.8278 4.8452 4.8452 9.5813 9.5813 9.7218 9.7218 11.3826 11.3826 11.5426 11.5426 14.0773 14.0773 k = 0.0000 0.4116-0.0000 ( 5060 PWs) bands (ev): -12.4316 -12.4316 -12.3149 -12.3149 -8.8031 -8.8031 -8.7651 -8.7651 -8.3401 -8.3401 -8.3246 -8.3246 -7.9982 -7.9982 -7.9196 -7.9196 -7.5660 -7.5660 -7.5514 -7.5514 -7.3224 -7.3224 -7.2954 -7.2954 -7.1133 -7.1133 -6.9823 -6.9823 0.1826 0.1826 0.3785 0.3785 2.2098 2.2098 2.4923 2.4923 2.7311 2.7311 2.9926 2.9926 3.4957 3.4957 3.6962 3.6962 3.7423 3.7423 3.9084 3.9084 4.8228 4.8228 4.8489 4.8489 9.5389 9.5389 9.7502 9.7502 11.3476 11.3476 11.5858 11.5858 14.0623 14.0623 k = 0.0000 0.4002-0.0000 ( 5062 PWs) bands (ev): -12.4524 -12.4524 -12.2973 -12.2973 -8.8101 -8.8101 -8.7596 -8.7596 -8.3427 -8.3427 -8.3219 -8.3219 -8.0118 -8.0118 -7.9077 -7.9077 -7.5686 -7.5686 -7.5491 -7.5491 -7.3277 -7.3277 -7.2921 -7.2921 -7.1308 -7.1308 -6.9570 -6.9570 0.1580 0.1580 0.4189 0.4189 2.1642 2.1642 2.5395 2.5395 2.6904 2.6904 3.0362 3.0362 3.4651 3.4651 3.7180 3.7180 3.7350 3.7350 3.9410 3.9410 4.8176 4.8176 4.8523 4.8523 9.4935 9.4935 9.7761 9.7761 11.3153 11.3153 11.6294 11.6294 14.0432 14.0432 k = 0.0000 0.3887-0.0000 ( 5056 PWs) bands (ev): -12.4736 -12.4736 -12.2802 -12.2802 -8.8173 -8.8173 -8.7544 -8.7544 -8.3451 -8.3451 -8.3193 -8.3193 -8.0254 -8.0254 -7.8962 -7.8962 -7.5713 -7.5713 -7.5468 -7.5468 -7.3331 -7.3331 -7.2892 -7.2892 -7.1466 -7.1466 -6.9308 -6.9308 0.1356 0.1356 0.4614 0.4614 2.1189 2.1189 2.5796 2.5796 2.6582 2.6582 3.0795 3.0795 3.4356 3.4356 3.7021 3.7021 3.7684 3.7684 3.9743 3.9743 4.8122 4.8122 4.8555 4.8555 9.4449 9.4449 9.7995 9.7995 11.2858 11.2858 11.6729 11.6729 14.0202 14.0202 k = 0.0000 0.3773-0.0000 ( 5060 PWs) bands (ev): -12.4950 -12.4950 -12.2638 -12.2638 -8.8246 -8.8246 -8.7494 -8.7494 -8.3476 -8.3476 -8.3167 -8.3167 -8.0389 -8.0389 -7.8853 -7.8853 -7.5740 -7.5740 -7.5446 -7.5446 -7.3387 -7.3387 -7.2871 -7.2871 -7.1608 -7.1608 -6.9039 -6.9039 0.1155 0.1155 0.5059 0.5059 2.0738 2.0738 2.5794 2.5794 2.6676 2.6676 3.1225 3.1225 3.4072 3.4072 3.6873 3.6873 3.8036 3.8036 4.0081 4.0081 4.8066 4.8066 4.8584 4.8584 9.3932 9.3932 9.8207 9.8207 11.2594 11.2594 11.7158 11.7158 13.9938 13.9938 k = 0.0000 0.3659-0.0000 ( 5066 PWs) bands (ev): -12.5165 -12.5165 -12.2480 -12.2480 -8.8320 -8.8320 -8.7448 -8.7448 -8.3500 -8.3500 -8.3142 -8.3142 -8.0521 -8.0521 -7.8750 -7.8750 -7.5767 -7.5767 -7.5424 -7.5424 -7.3444 -7.3444 -7.2857 -7.2857 -7.1732 -7.1732 -6.8765 -6.8765 0.0976 0.0976 0.5523 0.5523 2.0288 2.0288 2.5454 2.5454 2.7124 2.7124 3.1650 3.1650 3.3803 3.3803 3.6754 3.6754 3.8387 3.8387 4.0422 4.0422 4.8009 4.8009 4.8611 4.8611 9.3384 9.3384 9.8396 9.8396 11.2363 11.2363 11.7574 11.7574 13.9645 13.9645 k = 0.0000 0.3544-0.0000 ( 5062 PWs) bands (ev): -12.5382 -12.5382 -12.2329 -12.2329 -8.8395 -8.8395 -8.7404 -8.7404 -8.3524 -8.3524 -8.3116 -8.3116 -8.0652 -8.0652 -7.8654 -7.8654 -7.5795 -7.5795 -7.5403 -7.5403 -7.3501 -7.3501 -7.2852 -7.2852 -7.1835 -7.1835 -6.8483 -6.8483 0.0819 0.0819 0.6005 0.6005 1.9839 1.9839 2.5058 2.5058 2.7643 2.7643 3.2070 3.2070 3.3548 3.3548 3.6666 3.6666 3.8736 3.8736 4.0764 4.0764 4.7950 4.7950 4.8635 4.8635 9.2804 9.2804 9.8563 9.8563 11.2164 11.2164 11.7970 11.7970 13.9329 13.9329 k = 0.0000 0.3430-0.0000 ( 5061 PWs) bands (ev): -12.5600 -12.5600 -12.2185 -12.2185 -8.8471 -8.8471 -8.7362 -8.7362 -8.3548 -8.3548 -8.3092 -8.3092 -8.0780 -8.0780 -7.8565 -7.8565 -7.5824 -7.5824 -7.5382 -7.5382 -7.3560 -7.3560 -7.2856 -7.2856 -7.1919 -7.1919 -6.8196 -6.8196 0.0684 0.0684 0.6504 0.6504 1.9391 1.9391 2.4653 2.4653 2.8186 2.8186 3.2483 3.2483 3.3311 3.3311 3.6612 3.6612 3.9080 3.9080 4.1104 4.1104 4.7889 4.7889 4.8657 4.8657 9.2193 9.2193 9.8708 9.8708 11.1999 11.1999 11.8340 11.8340 13.8999 13.8999 k = 0.0000 0.3316-0.0000 ( 5075 PWs) bands (ev): -12.5817 -12.5817 -12.2048 -12.2048 -8.8547 -8.8547 -8.7324 -8.7324 -8.3571 -8.3571 -8.3068 -8.3068 -8.0905 -8.0905 -7.8485 -7.8485 -7.5853 -7.5853 -7.5363 -7.5363 -7.3619 -7.3619 -7.2871 -7.2871 -7.1983 -7.1983 -6.7906 -6.7906 0.0571 0.0571 0.7017 0.7017 1.8943 1.8943 2.4249 2.4249 2.8741 2.8741 3.2890 3.2890 3.3096 3.3096 3.6591 3.6591 3.9418 3.9418 4.1440 4.1440 4.7828 4.7828 4.8677 4.8677 9.1553 9.1553 9.8832 9.8832 11.1867 11.1867 11.8676 11.8676 13.8661 13.8661 k = 0.0000 0.3201-0.0000 ( 5067 PWs) bands (ev): -12.6034 -12.6034 -12.1917 -12.1917 -8.8624 -8.8624 -8.7289 -8.7289 -8.3594 -8.3594 -8.3044 -8.3044 -8.1025 -8.1025 -7.8411 -7.8411 -7.5882 -7.5882 -7.5344 -7.5344 -7.3677 -7.3677 -7.2893 -7.2893 -7.2029 -7.2029 -6.7610 -6.7610 0.0478 0.0478 0.7543 0.7543 1.8497 1.8497 2.3850 2.3850 2.9302 2.9302 3.2902 3.2902 3.3294 3.3294 3.6604 3.6604 3.9749 3.9749 4.1770 4.1770 4.7766 4.7766 4.8695 4.8695 9.0883 9.0883 9.8935 9.8935 11.1770 11.1770 11.8969 11.8969 13.8327 13.8327 k = 0.0000 0.3087-0.0000 ( 5077 PWs) bands (ev): -12.6250 -12.6250 -12.1793 -12.1793 -8.8700 -8.8700 -8.7257 -8.7257 -8.3616 -8.3616 -8.3022 -8.3022 -8.1142 -8.1142 -7.8346 -7.8346 -7.5912 -7.5912 -7.5326 -7.5326 -7.3733 -7.3733 -7.2922 -7.2922 -7.2062 -7.2062 -6.7313 -6.7313 0.0406 0.0406 0.8081 0.8081 1.8051 1.8051 2.3457 2.3457 2.9859 2.9859 3.2748 3.2748 3.3687 3.3687 3.6651 3.6651 4.0072 4.0072 4.2091 4.2091 4.7703 4.7703 4.8711 4.8711 9.0186 9.0186 9.9018 9.9018 11.1705 11.1705 11.9210 11.9210 13.8007 13.8007 k = 0.0000 0.2973-0.0000 ( 5081 PWs) bands (ev): -12.6464 -12.6464 -12.1677 -12.1677 -8.8776 -8.8776 -8.7227 -8.7227 -8.3637 -8.3637 -8.3000 -8.3000 -8.1254 -8.1254 -7.8290 -7.8290 -7.5941 -7.5941 -7.5308 -7.5308 -7.3787 -7.3787 -7.2955 -7.2955 -7.2083 -7.2083 -6.7015 -6.7015 0.0354 0.0354 0.8626 0.8626 1.7607 1.7607 2.3072 2.3072 3.0397 3.0397 3.2646 3.2646 3.4073 3.4073 3.6730 3.6730 4.0385 4.0385 4.2402 4.2402 4.7640 4.7640 4.8725 4.8725 8.9463 8.9463 9.9080 9.9080 11.1673 11.1673 11.9390 11.9390 13.7712 13.7712 k = 0.0000 0.2858-0.0000 ( 5081 PWs) bands (ev): -12.6676 -12.6676 -12.1567 -12.1567 -8.8852 -8.8852 -8.7200 -8.7200 -8.3657 -8.3657 -8.2979 -8.2979 -8.1361 -8.1361 -7.8241 -7.8241 -7.5970 -7.5970 -7.5292 -7.5292 -7.3837 -7.3837 -7.2989 -7.2989 -7.2095 -7.2095 -6.6716 -6.6716 0.0321 0.0321 0.9178 0.9178 1.7164 1.7164 2.2695 2.2695 3.0879 3.0879 3.2632 3.2632 3.4452 3.4452 3.6841 3.6841 4.0689 4.0689 4.2700 4.2700 4.7578 4.7578 4.8738 4.8738 8.8716 8.8716 9.9122 9.9122 11.1671 11.1671 11.9501 11.9501 13.7448 13.7448 k = 0.0000 0.2744-0.0000 ( 5083 PWs) bands (ev): -12.6885 -12.6885 -12.1464 -12.1464 -8.8927 -8.8927 -8.7176 -8.7176 -8.3677 -8.3677 -8.2959 -8.2959 -8.1463 -8.1463 -7.8200 -7.8200 -7.5998 -7.5998 -7.5276 -7.5276 -7.3884 -7.3884 -7.3023 -7.3023 -7.2102 -7.2102 -6.6416 -6.6416 0.0307 0.0307 0.9733 0.9733 1.6724 1.6724 2.2327 2.2327 3.1243 3.1243 3.2771 3.2771 3.4824 3.4824 3.6982 3.6982 4.0982 4.0982 4.2983 4.2983 4.7515 4.7515 4.8750 4.8750 8.7947 8.7947 9.9144 9.9144 11.1699 11.1699 11.9535 11.9535 13.7135 13.7135 k = 0.0000 0.2630-0.0000 ( 5083 PWs) bands (ev): -12.7090 -12.7090 -12.1367 -12.1367 -8.9001 -8.9001 -8.7155 -8.7155 -8.3696 -8.3696 -8.2939 -8.2939 -8.1559 -8.1559 -7.8168 -7.8168 -7.6026 -7.6026 -7.5261 -7.5261 -7.3925 -7.3925 -7.3055 -7.3055 -7.2107 -7.2107 -6.6118 -6.6118 0.0311 0.0311 1.0287 1.0287 1.6287 1.6287 2.1969 2.1969 3.1445 3.1445 3.3104 3.3104 3.5190 3.5190 3.7151 3.7151 4.1263 4.1263 4.3248 4.3248 4.7454 4.7454 4.8760 4.8760 8.7158 8.7158 9.9146 9.9146 11.1754 11.1754 11.9488 11.9488 13.6698 13.6698 k = 0.0000 0.2515-0.0000 ( 5091 PWs) bands (ev): -12.7292 -12.7292 -12.1277 -12.1277 -8.9074 -8.9074 -8.7136 -8.7136 -8.3715 -8.3715 -8.2921 -8.2921 -8.1650 -8.1650 -7.8144 -7.8144 -7.6054 -7.6054 -7.5247 -7.5247 -7.3963 -7.3963 -7.3085 -7.3085 -7.2111 -7.2111 -6.5822 -6.5822 0.0333 0.0333 1.0837 1.0837 1.5853 1.5853 2.1622 2.1622 3.1533 3.1533 3.3583 3.3583 3.5553 3.5553 3.7346 3.7346 4.1532 4.1532 4.3495 4.3495 4.7394 4.7394 4.8769 4.8769 8.6351 8.6351 9.9130 9.9130 11.1834 11.1834 11.9357 11.9357 13.6240 13.6240 k = 0.0000 0.2401-0.0000 ( 5091 PWs) bands (ev): -12.7488 -12.7488 -12.1194 -12.1194 -8.9145 -8.9145 -8.7120 -8.7120 -8.3732 -8.3732 -8.2905 -8.2905 -8.1734 -8.1734 -7.8127 -7.8127 -7.6080 -7.6080 -7.5234 -7.5234 -7.3995 -7.3995 -7.3111 -7.3111 -7.2115 -7.2115 -6.5529 -6.5529 0.0371 0.0371 1.1379 1.1379 1.5423 1.5423 2.1287 2.1287 3.1578 3.1578 3.4133 3.4133 3.5917 3.5917 3.7566 3.7566 4.1789 4.1789 4.3720 4.3720 4.7336 4.7336 4.8778 4.8778 8.5529 8.5529 9.9095 9.9095 11.1938 11.1938 11.9142 11.9142 13.5775 13.5775 k = 0.0000 0.2287-0.0000 ( 5099 PWs) bands (ev): -12.7680 -12.7680 -12.1117 -12.1117 -8.9215 -8.9215 -8.7106 -8.7106 -8.3749 -8.3749 -8.2890 -8.2890 -8.1811 -8.1811 -7.8118 -7.8118 -7.6105 -7.6105 -7.5222 -7.5222 -7.4023 -7.4023 -7.3133 -7.3133 -7.2121 -7.2121 -6.5242 -6.5242 0.0425 0.0425 1.1910 1.1910 1.5000 1.5000 2.0964 2.0964 3.1624 3.1624 3.4704 3.4704 3.6288 3.6288 3.7807 3.7807 4.2032 4.2032 4.3924 4.3924 4.7279 4.7279 4.8785 4.8785 8.4696 8.4696 9.9043 9.9043 11.2060 11.2060 11.8848 11.8848 13.5306 13.5306 k = 0.0000 0.2172-0.0000 ( 5107 PWs) bands (ev): -12.7866 -12.7866 -12.1045 -12.1045 -8.9283 -8.9283 -8.7094 -8.7094 -8.3765 -8.3765 -8.2878 -8.2878 -8.1882 -8.1882 -7.8115 -7.8115 -7.6129 -7.6129 -7.5212 -7.5212 -7.4047 -7.4047 -7.3151 -7.3151 -7.2128 -7.2128 -6.4960 -6.4960 0.0494 0.0494 1.2424 1.2424 1.4582 1.4582 2.0653 2.0653 3.1690 3.1690 3.5264 3.5264 3.6679 3.6679 3.8066 3.8066 4.2260 4.2260 4.4104 4.4104 4.7225 4.7225 4.8792 4.8792 8.3853 8.3853 9.8974 9.8974 11.2200 11.2200 11.8481 11.8481 13.4838 13.4838 k = 0.0000 0.2058-0.0000 ( 5107 PWs) bands (ev): -12.8046 -12.8046 -12.0979 -12.0979 -8.9349 -8.9349 -8.7085 -8.7085 -8.3780 -8.3780 -8.2868 -8.2868 -8.1946 -8.1946 -7.8118 -7.8118 -7.6151 -7.6151 -7.5201 -7.5201 -7.4066 -7.4066 -7.3164 -7.3164 -7.2137 -7.2137 -6.4684 -6.4684 0.0577 0.0577 1.2917 1.2917 1.4174 1.4174 2.0356 2.0356 3.1788 3.1788 3.5785 3.5785 3.7107 3.7107 3.8342 3.8342 4.2473 4.2473 4.4261 4.4261 4.7173 4.7173 4.8799 4.8799 8.3004 8.3004 9.8889 9.8889 11.2353 11.2353 11.8053 11.8053 13.4375 13.4375 k = 0.0000 0.1944-0.0000 ( 5107 PWs) bands (ev): -12.8219 -12.8219 -12.0919 -12.0919 -8.9412 -8.9412 -8.7077 -8.7077 -8.3794 -8.3794 -8.2859 -8.2859 -8.2004 -8.2004 -7.8125 -7.8125 -7.6172 -7.6172 -7.5190 -7.5190 -7.4082 -7.4082 -7.3173 -7.3173 -7.2148 -7.2148 -6.4416 -6.4416 0.0673 0.0673 1.3369 1.3369 1.3790 1.3790 2.0073 2.0073 3.1922 3.1922 3.6243 3.6243 3.7587 3.7587 3.8630 3.8630 4.2668 4.2668 4.4395 4.4395 4.7125 4.7125 4.8805 4.8805 8.2153 8.2153 9.8791 9.8791 11.2515 11.2515 11.7572 11.7572 13.3921 13.3921 k = 0.0000 0.1829-0.0000 ( 5115 PWs) bands (ev): -12.8385 -12.8385 -12.0864 -12.0864 -8.9474 -8.9474 -8.7072 -8.7072 -8.3807 -8.3807 -8.2854 -8.2854 -8.2054 -8.2054 -7.8138 -7.8138 -7.6191 -7.6191 -7.5181 -7.5181 -7.4096 -7.4096 -7.3177 -7.3177 -7.2164 -7.2164 -6.4157 -6.4157 0.0781 0.0781 1.3340 1.3340 1.3868 1.3868 1.9805 1.9805 3.2098 3.2098 3.6632 3.6632 3.8119 3.8119 3.8928 3.8928 4.2845 4.2845 4.4507 4.4507 4.7080 4.7080 4.8812 4.8812 8.1302 8.1302 9.8680 9.8680 11.2682 11.2682 11.7053 11.7053 13.3482 13.3482 k = 0.0000 0.1715-0.0000 ( 5115 PWs) bands (ev): -12.8543 -12.8543 -12.0814 -12.0814 -8.9532 -8.9532 -8.7067 -8.7067 -8.3819 -8.3819 -8.2851 -8.2851 -8.2097 -8.2097 -7.8154 -7.8154 -7.6209 -7.6209 -7.5171 -7.5171 -7.4108 -7.4108 -7.3176 -7.3176 -7.2181 -7.2181 -6.3908 -6.3908 0.0899 0.0899 1.2968 1.2968 1.4270 1.4270 1.9553 1.9553 3.2317 3.2317 3.6961 3.6961 3.8689 3.8689 3.9231 3.9231 4.2998 4.2998 4.4601 4.4601 4.7038 4.7038 4.8818 4.8818 8.0457 8.0457 9.8558 9.8558 11.2850 11.2850 11.6506 11.6506 13.3064 13.3064 k = 0.0000 0.1601-0.0000 ( 5115 PWs) bands (ev): -12.8693 -12.8693 -12.0769 -12.0769 -8.9588 -8.9588 -8.7065 -8.7065 -8.3831 -8.3831 -8.2850 -8.2850 -8.2133 -8.2133 -7.8172 -7.8172 -7.6226 -7.6226 -7.5161 -7.5161 -7.4120 -7.4120 -7.3170 -7.3170 -7.2201 -7.2201 -6.3669 -6.3669 0.1027 0.1027 1.2595 1.2595 1.4649 1.4649 1.9316 1.9316 3.2580 3.2580 3.7245 3.7245 3.9275 3.9275 3.9538 3.9538 4.3125 4.3125 4.4681 4.4681 4.7001 4.7001 4.8824 4.8824 7.9621 7.9621 9.8427 9.8427 11.3012 11.3012 11.5946 11.5946 13.2672 13.2672 k = 0.0000 0.1486-0.0000 ( 5119 PWs) bands (ev): -12.8834 -12.8834 -12.0728 -12.0728 -8.9641 -8.9641 -8.7063 -8.7063 -8.3841 -8.3841 -8.2852 -8.2852 -8.2163 -8.2163 -7.8193 -7.8193 -7.6241 -7.6241 -7.5152 -7.5152 -7.4130 -7.4130 -7.3160 -7.3160 -7.2224 -7.2224 -6.3442 -6.3442 0.1163 0.1163 1.2232 1.2232 1.4995 1.4995 1.9097 1.9097 3.2888 3.2888 3.7495 3.7495 3.9842 3.9842 3.9862 3.9862 4.3217 4.3217 4.4757 4.4757 4.6968 4.6968 4.8831 4.8831 7.8800 7.8800 9.8290 9.8290 11.3163 11.3163 11.5385 11.5385 13.2312 13.2312 k = 0.0000 0.1372-0.0000 ( 5119 PWs) bands (ev): -12.8967 -12.8967 -12.0692 -12.0692 -8.9690 -8.9690 -8.7063 -8.7063 -8.3851 -8.3851 -8.2855 -8.2855 -8.2188 -8.2188 -7.8214 -7.8214 -7.6255 -7.6255 -7.5142 -7.5142 -7.4140 -7.4140 -7.3145 -7.3145 -7.2249 -7.2249 -6.3228 -6.3228 0.1305 0.1305 1.1882 1.1882 1.5306 1.5306 1.8896 1.8896 3.3238 3.3238 3.7716 3.7716 4.0146 4.0146 4.0429 4.0429 4.3268 4.3268 4.4837 4.4837 4.6939 4.6939 4.8839 4.8839 7.7998 7.7998 9.8148 9.8148 11.3291 11.3291 11.4840 11.4840 13.1992 13.1992 k = 0.0000 0.1258-0.0000 ( 5111 PWs) bands (ev): -12.9091 -12.9091 -12.0659 -12.0659 -8.9736 -8.9736 -8.7063 -8.7063 -8.3859 -8.3859 -8.2860 -8.2860 -8.2206 -8.2206 -7.8236 -7.8236 -7.6266 -7.6266 -7.5131 -7.5131 -7.4149 -7.4149 -7.3125 -7.3125 -7.2277 -7.2277 -6.3027 -6.3027 0.1451 0.1451 1.1545 1.1545 1.5579 1.5579 1.8714 1.8714 3.3628 3.3628 3.7914 3.7914 4.0440 4.0440 4.0967 4.0967 4.3269 4.3269 4.4933 4.4933 4.6916 4.6916 4.8848 4.8848 7.7220 7.7220 9.8005 9.8005 11.3370 11.3370 11.4344 11.4344 13.1716 13.1716 k = 0.0000 0.1143-0.0000 ( 5113 PWs) bands (ev): -12.9204 -12.9204 -12.0630 -12.0630 -8.9779 -8.9779 -8.7065 -8.7065 -8.3866 -8.3866 -8.2867 -8.2867 -8.2220 -8.2220 -7.8260 -7.8260 -7.6278 -7.6278 -7.5122 -7.5122 -7.4158 -7.4158 -7.3101 -7.3101 -7.2308 -7.2308 -6.2842 -6.2842 0.1599 0.1599 1.1225 1.1225 1.5816 1.5816 1.8550 1.8550 3.4054 3.4054 3.8092 3.8092 4.0723 4.0723 4.1462 4.1462 4.3218 4.3218 4.5054 4.5054 4.6897 4.6897 4.8858 4.8858 7.6473 7.6473 9.7863 9.7863 11.3304 11.3304 11.3998 11.3998 13.1490 13.1490 k = 0.0000 0.1029-0.0000 ( 5113 PWs) bands (ev): -12.9308 -12.9308 -12.0605 -12.0605 -8.9818 -8.9818 -8.7067 -8.7067 -8.3874 -8.3874 -8.2875 -8.2875 -8.2231 -8.2231 -7.8282 -7.8282 -7.6288 -7.6288 -7.5112 -7.5112 -7.4168 -7.4168 -7.3073 -7.3073 -7.2341 -7.2341 -6.2671 -6.2671 0.1748 0.1748 1.0922 1.0922 1.6017 1.6017 1.8408 1.8408 3.4512 3.4512 3.8250 3.8250 4.0991 4.0991 4.1900 4.1900 4.3115 4.3115 4.5205 4.5205 4.6882 4.6882 4.8870 4.8870 7.5764 7.5764 9.7723 9.7723 11.2994 11.2994 11.3906 11.3906 13.1318 13.1318 k = 0.0000 0.0915-0.0000 ( 5121 PWs) bands (ev): -12.9402 -12.9402 -12.0583 -12.0583 -8.9853 -8.9853 -8.7069 -8.7069 -8.3880 -8.3880 -8.2884 -8.2884 -8.2238 -8.2238 -7.8304 -7.8304 -7.6297 -7.6297 -7.5103 -7.5103 -7.4178 -7.4178 -7.3043 -7.3043 -7.2377 -7.2377 -6.2517 -6.2517 0.1893 0.1893 1.0640 1.0640 1.6183 1.6183 1.8286 1.8286 3.4994 3.4994 3.8390 3.8390 4.1241 4.1241 4.2261 4.2261 4.2974 4.2974 4.5386 4.5386 4.6872 4.6872 4.8884 4.8884 7.5099 7.5099 9.7590 9.7590 11.2585 11.2585 11.3930 11.3930 13.1200 13.1200 k = 0.0000 0.0800-0.0000 ( 5133 PWs) bands (ev): -12.9486 -12.9486 -12.0564 -12.0564 -8.9885 -8.9885 -8.7071 -8.7071 -8.3885 -8.3885 -8.2892 -8.2892 -8.2244 -8.2244 -7.8325 -7.8325 -7.6305 -7.6305 -7.5095 -7.5095 -7.4188 -7.4188 -7.3010 -7.3010 -7.2415 -7.2415 -6.2379 -6.2379 0.2034 0.2034 1.0380 1.0380 1.6315 1.6315 1.8185 1.8185 3.5496 3.5496 3.8512 3.8512 4.1470 4.1470 4.2472 4.2472 4.2870 4.2870 4.5591 4.5591 4.6866 4.6866 4.8901 4.8901 7.4485 7.4485 9.7465 9.7465 11.2180 11.2180 11.3973 11.3973 13.1137 13.1137 k = 0.0000 0.0686-0.0000 ( 5133 PWs) bands (ev): -12.9558 -12.9558 -12.0548 -12.0548 -8.9912 -8.9912 -8.7073 -8.7073 -8.3890 -8.3890 -8.2899 -8.2899 -8.2247 -8.2247 -7.8343 -7.8343 -7.6312 -7.6312 -7.5086 -7.5086 -7.4196 -7.4196 -7.2974 -7.2974 -7.2454 -7.2454 -6.2258 -6.2258 0.2165 0.2165 1.0146 1.0146 1.6418 1.6418 1.8104 1.8104 3.6007 3.6007 3.8618 3.8618 4.1673 4.1673 4.2371 4.2371 4.2975 4.2975 4.5809 4.5809 4.6863 4.6863 4.8920 4.8920 7.3931 7.3931 9.7351 9.7351 11.1810 11.1810 11.4011 11.4011 13.1126 13.1126 k = 0.0000 0.0572-0.0000 ( 5131 PWs) bands (ev): -12.9620 -12.9620 -12.0535 -12.0535 -8.9936 -8.9936 -8.7076 -8.7076 -8.3894 -8.3894 -8.2906 -8.2906 -8.2249 -8.2249 -7.8359 -7.8359 -7.6317 -7.6317 -7.5078 -7.5078 -7.4204 -7.4204 -7.2935 -7.2935 -7.2494 -7.2494 -6.2154 -6.2154 0.2285 0.2285 0.9940 0.9940 1.6493 1.6493 1.8043 1.8043 3.6519 3.6519 3.8707 3.8707 4.1835 4.1835 4.2129 4.2129 4.3142 4.3142 4.6026 4.6026 4.6862 4.6862 4.8941 4.8941 7.3445 7.3445 9.7250 9.7250 11.1485 11.1485 11.4040 11.4040 13.1162 13.1162 k = 0.0000 0.0457-0.0000 ( 5135 PWs) bands (ev): -12.9671 -12.9671 -12.0524 -12.0524 -8.9955 -8.9955 -8.7078 -8.7078 -8.3897 -8.3897 -8.2912 -8.2912 -8.2251 -8.2251 -7.8372 -7.8372 -7.6322 -7.6322 -7.5072 -7.5072 -7.4212 -7.4212 -7.2896 -7.2896 -7.2535 -7.2535 -6.2069 -6.2069 0.2389 0.2389 0.9766 0.9766 1.6546 1.6546 1.7999 1.7999 3.7019 3.7019 3.8779 3.8779 4.1763 4.1763 4.2046 4.2046 4.3279 4.3279 4.6226 4.6226 4.6863 4.6863 4.8964 4.8964 7.3034 7.3034 9.7164 9.7164 11.1213 11.1213 11.4059 11.4059 13.1235 13.1235 k = 0.0000 0.0343-0.0000 ( 5135 PWs) bands (ev): -12.9711 -12.9711 -12.0516 -12.0516 -8.9970 -8.9970 -8.7079 -8.7079 -8.3899 -8.3899 -8.2916 -8.2916 -8.2251 -8.2251 -7.8383 -7.8383 -7.6326 -7.6326 -7.5067 -7.5067 -7.4217 -7.4217 -7.2855 -7.2855 -7.2577 -7.2577 -6.2003 -6.2003 0.2475 0.2475 0.9626 0.9626 1.6581 1.6581 1.7969 1.7969 3.7488 3.7488 3.8835 3.8835 4.1463 4.1463 4.2148 4.2148 4.3380 4.3380 4.6395 4.6395 4.6865 4.6865 4.8985 4.8985 7.2705 7.2705 9.7096 9.7096 11.0997 11.0997 11.4071 11.4071 13.1333 13.1333 k = 0.0000 0.0229-0.0000 ( 5137 PWs) bands (ev): -12.9739 -12.9739 -12.0510 -12.0510 -8.9981 -8.9981 -8.7080 -8.7080 -8.3901 -8.3901 -8.2920 -8.2920 -8.2252 -8.2252 -7.8391 -7.8391 -7.6329 -7.6329 -7.5063 -7.5063 -7.4222 -7.4222 -7.2814 -7.2814 -7.2618 -7.2618 -6.1954 -6.1954 0.2539 0.2539 0.9523 0.9523 1.6602 1.6602 1.7950 1.7950 3.7896 3.7896 3.8875 3.8875 4.1166 4.1166 4.2231 4.2231 4.3449 4.3449 4.6523 4.6523 4.6866 4.6866 4.9004 4.9004 7.2465 7.2465 9.7046 9.7046 11.0841 11.0841 11.4077 11.4077 13.1435 13.1435 k = 0.0000 0.0114-0.0000 ( 5135 PWs) bands (ev): -12.9756 -12.9756 -12.0506 -12.0506 -8.9987 -8.9987 -8.7081 -8.7081 -8.3902 -8.3902 -8.2922 -8.2922 -8.2252 -8.2252 -7.8395 -7.8395 -7.6331 -7.6331 -7.5060 -7.5060 -7.4225 -7.4225 -7.2777 -7.2777 -7.2654 -7.2654 -6.1925 -6.1925 0.2578 0.2578 0.9461 0.9461 1.6613 1.6613 1.7939 1.7939 3.8191 3.8191 3.8899 3.8899 4.0937 4.0937 4.2283 4.2283 4.3488 4.3488 4.6603 4.6603 4.6867 4.6867 4.9016 4.9016 7.2319 7.2319 9.7016 9.7016 11.0746 11.0746 11.4080 11.4080 13.1516 13.1516 k = 0.0000 0.0000 0.0000 ( 5131 PWs) bands (ev): -12.9762 -12.9762 -12.0505 -12.0505 -8.9989 -8.9989 -8.7081 -8.7081 -8.3903 -8.3903 -8.2922 -8.2922 -8.2252 -8.2252 -7.8396 -7.8396 -7.6331 -7.6331 -7.5059 -7.5059 -7.4226 -7.4226 -7.2758 -7.2758 -7.2673 -7.2673 -6.1915 -6.1915 0.2592 0.2592 0.9440 0.9440 1.6617 1.6617 1.7936 1.7936 3.8303 3.8303 3.8907 3.8907 4.0847 4.0847 4.2300 4.2300 4.3500 4.3500 4.6630 4.6630 4.6867 4.6867 4.9021 4.9021 7.2270 7.2270 9.7005 9.7005 11.0714 11.0714 11.4081 11.4081 13.1548 13.1548 k = 0.0000 0.0000 0.0000 ( 5131 PWs) bands (ev): -12.9762 -12.9762 -12.0505 -12.0505 -8.9989 -8.9989 -8.7081 -8.7081 -8.3903 -8.3903 -8.2922 -8.2922 -8.2252 -8.2252 -7.8396 -7.8396 -7.6331 -7.6331 -7.5059 -7.5059 -7.4226 -7.4226 -7.2758 -7.2758 -7.2673 -7.2673 -6.1915 -6.1915 0.2592 0.2592 0.9440 0.9440 1.6617 1.6617 1.7936 1.7936 3.8303 3.8303 3.8907 3.8907 4.0847 4.0847 4.2300 4.2300 4.3500 4.3500 4.6630 4.6630 4.6867 4.6867 4.9021 4.9021 7.2270 7.2270 9.7005 9.7005 11.0714 11.0714 11.4081 11.4081 13.1548 13.1548 k = 0.0000 0.0000 0.0110 ( 5137 PWs) bands (ev): -12.9762 -12.9762 -12.0505 -12.0505 -8.9986 -8.9986 -8.7088 -8.7088 -8.3903 -8.3903 -8.2923 -8.2923 -8.2249 -8.2249 -7.8397 -7.8397 -7.6331 -7.6331 -7.5059 -7.5059 -7.4226 -7.4226 -7.2758 -7.2758 -7.2672 -7.2672 -6.1916 -6.1916 0.2573 0.2573 0.9440 0.9440 1.6646 1.6646 1.7948 1.7948 3.8298 3.8298 3.8898 3.8898 4.0847 4.0847 4.2304 4.2304 4.3478 4.3478 4.6601 4.6601 4.6878 4.6878 4.9023 4.9023 7.2319 7.2319 9.6981 9.6981 11.0701 11.0701 11.4088 11.4088 13.1365 13.1365 k = 0.0000 0.0000 0.0220 ( 5135 PWs) bands (ev): -12.9762 -12.9762 -12.0505 -12.0505 -8.9974 -8.9974 -8.7109 -8.7109 -8.3902 -8.3902 -8.2925 -8.2925 -8.2241 -8.2241 -7.8397 -7.8397 -7.6329 -7.6329 -7.5060 -7.5060 -7.4225 -7.4225 -7.2759 -7.2759 -7.2667 -7.2667 -6.1918 -6.1918 0.2516 0.2516 0.9441 0.9441 1.6728 1.6728 1.7988 1.7988 3.8282 3.8282 3.8872 3.8872 4.0847 4.0847 4.2316 4.2316 4.3412 4.3412 4.6528 4.6528 4.6899 4.6899 4.9031 4.9031 7.2466 7.2466 9.6908 9.6908 11.0663 11.0663 11.4110 11.4110 13.0952 13.0952 k = 0.0000 0.0000 0.0330 ( 5129 PWs) bands (ev): -12.9761 -12.9761 -12.0505 -12.0505 -8.9956 -8.9956 -8.7143 -8.7143 -8.3902 -8.3902 -8.2928 -8.2928 -8.2226 -8.2226 -7.8398 -7.8398 -7.6327 -7.6327 -7.5060 -7.5060 -7.4224 -7.4224 -7.2759 -7.2759 -7.2657 -7.2657 -6.1922 -6.1922 0.2426 0.2426 0.9443 0.9443 1.6853 1.6853 1.8063 1.8063 3.8257 3.8257 3.8830 3.8830 4.0846 4.0846 4.2332 4.2332 4.3299 4.3299 4.6428 4.6428 4.6918 4.6918 4.9044 4.9044 7.2706 7.2706 9.6788 9.6788 11.0602 11.0602 11.4143 11.4143 13.0459 13.0459 k = 0.0000 0.0000 0.0439 ( 5129 PWs) bands (ev): -12.9761 -12.9761 -12.0506 -12.0506 -8.9930 -8.9930 -8.7190 -8.7190 -8.3902 -8.3902 -8.2931 -8.2931 -8.2208 -8.2208 -7.8399 -7.8399 -7.6324 -7.6324 -7.5060 -7.5060 -7.4224 -7.4224 -7.2759 -7.2759 -7.2646 -7.2646 -6.1927 -6.1927 0.2305 0.2305 0.9445 0.9445 1.6997 1.6997 1.8190 1.8190 3.8221 3.8221 3.8774 3.8774 4.0844 4.0844 4.2343 4.2343 4.3145 4.3145 4.6315 4.6315 4.6932 4.6932 4.9065 4.9065 7.3032 7.3032 9.6619 9.6619 11.0522 11.0522 11.4188 11.4188 12.9947 12.9947 k = 0.0000 0.0000 0.0549 ( 5119 PWs) bands (ev): -12.9761 -12.9761 -12.0506 -12.0506 -8.9896 -8.9896 -8.7248 -8.7248 -8.3901 -8.3901 -8.2934 -8.2934 -8.2186 -8.2186 -7.8400 -7.8400 -7.6320 -7.6320 -7.5059 -7.5059 -7.4223 -7.4223 -7.2759 -7.2759 -7.2631 -7.2631 -6.1932 -6.1932 0.2160 0.2160 0.9447 0.9447 1.7137 1.7137 1.8388 1.8388 3.8173 3.8173 3.8707 3.8707 4.0839 4.0839 4.2330 4.2330 4.2964 4.2964 4.6201 4.6201 4.6941 4.6941 4.9093 4.9093 7.3436 7.3436 9.6404 9.6404 11.0428 11.0428 11.4242 11.4242 12.9439 12.9439 k = 0.0000 0.0000 0.0659 ( 5115 PWs) bands (ev): -12.9761 -12.9761 -12.0506 -12.0506 -8.9856 -8.9856 -8.7318 -8.7318 -8.3900 -8.3900 -8.2938 -8.2938 -8.2161 -8.2161 -7.8402 -7.8402 -7.6316 -7.6316 -7.5060 -7.5060 -7.4222 -7.4222 -7.2759 -7.2759 -7.2614 -7.2614 -6.1939 -6.1939 0.1996 0.1996 0.9450 0.9450 1.7252 1.7252 1.8668 1.8668 3.8113 3.8113 3.8631 3.8631 4.0830 4.0830 4.2242 4.2242 4.2807 4.2807 4.6095 4.6095 4.6945 4.6945 4.9129 4.9129 7.3907 7.3907 9.6143 9.6143 11.0324 11.0324 11.4302 11.4302 12.8949 12.8949 k = 0.0000 0.0000 0.0769 ( 5115 PWs) bands (ev): -12.9761 -12.9761 -12.0506 -12.0506 -8.9809 -8.9809 -8.7397 -8.7397 -8.3900 -8.3900 -8.2942 -8.2942 -8.2134 -8.2134 -7.8403 -7.8403 -7.6312 -7.6312 -7.5060 -7.5060 -7.4222 -7.4222 -7.2759 -7.2759 -7.2596 -7.2596 -6.1946 -6.1946 0.1820 0.1820 0.9453 0.9453 1.7337 1.7337 1.9026 1.9026 3.8040 3.8040 3.8549 3.8549 4.0813 4.0813 4.2025 4.2025 4.2736 4.2736 4.6004 4.6004 4.6945 4.6945 4.9171 4.9171 7.4435 7.4435 9.5839 9.5839 11.0217 11.0217 11.4366 11.4366 12.8483 12.8483 k = 0.0000 0.0000 0.0879 ( 5123 PWs) bands (ev): -12.9761 -12.9761 -12.0506 -12.0506 -8.9755 -8.9755 -8.7485 -8.7485 -8.3901 -8.3901 -8.2946 -8.2946 -8.2106 -8.2106 -7.8405 -7.8405 -7.6308 -7.6308 -7.5060 -7.5060 -7.4221 -7.4221 -7.2760 -7.2760 -7.2576 -7.2576 -6.1955 -6.1955 0.1637 0.1637 0.9457 0.9457 1.7399 1.7399 1.9448 1.9448 3.7951 3.7951 3.8463 3.8463 4.0778 4.0778 4.1715 4.1715 4.2731 4.2731 4.5930 4.5930 4.6943 4.6943 4.9218 4.9218 7.5008 7.5008 9.5496 9.5496 11.0109 11.0109 11.4433 11.4433 12.8046 12.8046 k = 0.0000 0.0000 0.0989 ( 5123 PWs) bands (ev): -12.9760 -12.9760 -12.0507 -12.0507 -8.9694 -8.9694 -8.7581 -8.7581 -8.3901 -8.3901 -8.2950 -8.2950 -8.2078 -8.2078 -7.8407 -7.8407 -7.6304 -7.6304 -7.5061 -7.5061 -7.4221 -7.4221 -7.2760 -7.2760 -7.2556 -7.2556 -6.1964 -6.1964 0.1453 0.1453 0.9461 0.9461 1.7443 1.7443 1.9917 1.9917 3.7841 3.7841 3.8376 3.8376 4.0700 4.0700 4.1394 4.1394 4.2752 4.2752 4.5875 4.5875 4.6940 4.6940 4.9269 4.9269 7.5614 7.5614 9.5117 9.5117 11.0005 11.0005 11.4499 11.4499 12.7642 12.7642 k = 0.0000 0.0000 0.1099 ( 5109 PWs) bands (ev): -12.9760 -12.9760 -12.0507 -12.0507 -8.9627 -8.9627 -8.7682 -8.7682 -8.3900 -8.3900 -8.2952 -8.2952 -8.2051 -8.2051 -7.8408 -7.8408 -7.6298 -7.6298 -7.5059 -7.5059 -7.4219 -7.4219 -7.2759 -7.2759 -7.2534 -7.2534 -6.1972 -6.1972 0.1273 0.1273 0.9464 0.9464 1.7477 1.7477 2.0417 2.0417 3.7705 3.7705 3.8289 3.8289 4.0521 4.0521 4.1156 4.1156 4.2782 4.2782 4.5837 4.5837 4.6935 4.6935 4.9321 4.9321 7.6241 7.6241 9.4710 9.4710 10.9909 10.9909 11.4565 11.4565 12.7273 12.7273 k = 0.0000 0.0000 0.1209 ( 5107 PWs) bands (ev): -12.9760 -12.9760 -12.0507 -12.0507 -8.9554 -8.9554 -8.7789 -8.7789 -8.3899 -8.3899 -8.2955 -8.2955 -8.2024 -8.2024 -7.8410 -7.8410 -7.6294 -7.6294 -7.5060 -7.5060 -7.4219 -7.4219 -7.2759 -7.2759 -7.2513 -7.2513 -6.1980 -6.1980 0.1101 0.1101 0.9468 0.9468 1.7503 1.7503 2.0933 2.0933 3.7534 3.7534 3.8204 3.8204 4.0231 4.0231 4.1041 4.1041 4.2814 4.2814 4.5813 4.5813 4.6929 4.6929 4.9373 4.9373 7.6876 7.6876 9.4280 9.4280 10.9821 10.9821 11.4627 11.4627 12.6940 12.6940 k = 0.0000 0.0000 0.1318 ( 5101 PWs) bands (ev): -12.9759 -12.9759 -12.0507 -12.0507 -8.9475 -8.9475 -8.7900 -8.7900 -8.3899 -8.3899 -8.2958 -8.2958 -8.2000 -8.2000 -7.8411 -7.8411 -7.6289 -7.6289 -7.5060 -7.5060 -7.4218 -7.4218 -7.2759 -7.2759 -7.2492 -7.2492 -6.1988 -6.1988 0.0941 0.0941 0.9471 0.9471 1.7523 1.7523 2.1452 2.1452 3.7321 3.7321 3.8124 3.8124 3.9912 3.9912 4.0992 4.0992 4.2844 4.2844 4.5801 4.5801 4.6923 4.6923 4.9423 4.9423 7.7505 7.7505 9.3840 9.3840 10.9744 10.9744 11.4684 11.4684 12.6646 12.6646 k = 0.0000 0.0000 0.1428 ( 5105 PWs) bands (ev): -12.9759 -12.9759 -12.0507 -12.0507 -8.9392 -8.9392 -8.8013 -8.8013 -8.3899 -8.3899 -8.2961 -8.2961 -8.1977 -8.1977 -7.8413 -7.8413 -7.6285 -7.6285 -7.5060 -7.5060 -7.4218 -7.4218 -7.2759 -7.2759 -7.2473 -7.2473 -6.1996 -6.1996 0.0796 0.0796 0.9475 0.9475 1.7540 1.7540 2.1957 2.1957 3.7065 3.7065 3.8051 3.8051 3.9625 3.9625 4.0968 4.0968 4.2871 4.2871 4.5796 4.5796 4.6916 4.6916 4.9469 4.9469 7.8112 7.8112 9.3400 9.3400 10.9677 10.9677 11.4735 11.4735 12.6390 12.6390 k = 0.0000 0.0000 0.1538 ( 5109 PWs) bands (ev): -12.9759 -12.9759 -12.0507 -12.0507 -8.9304 -8.9304 -8.8127 -8.8127 -8.3899 -8.3899 -8.2963 -8.2963 -8.1958 -8.1958 -7.8414 -7.8414 -7.6282 -7.6282 -7.5061 -7.5061 -7.4217 -7.4217 -7.2760 -7.2760 -7.2456 -7.2456 -6.2003 -6.2003 0.0669 0.0669 0.9478 0.9478 1.7553 1.7553 2.2434 2.2434 3.6777 3.6777 3.7987 3.7987 3.9393 3.9393 4.0954 4.0954 4.2894 4.2894 4.5797 4.5797 4.6910 4.6910 4.9511 4.9511 7.8680 7.8680 9.2976 9.2976 10.9622 10.9622 11.4779 11.4779 12.6174 12.6174 k = 0.0000 0.0000 0.1648 ( 5108 PWs) bands (ev): -12.9759 -12.9759 -12.0507 -12.0507 -8.9213 -8.9213 -8.8240 -8.8240 -8.3898 -8.3898 -8.2966 -8.2966 -8.1941 -8.1941 -7.8416 -7.8416 -7.6279 -7.6279 -7.5062 -7.5062 -7.4217 -7.4217 -7.2760 -7.2760 -7.2440 -7.2440 -6.2009 -6.2009 0.0563 0.0563 0.9480 0.9480 1.7563 1.7563 2.2864 2.2864 3.6479 3.6479 3.7933 3.7933 3.9219 3.9219 4.0945 4.0945 4.2913 4.2913 4.5802 4.5802 4.6904 4.6904 4.9547 4.9547 7.9190 7.9190 9.2586 9.2586 10.9577 10.9577 11.4816 11.4816 12.5998 12.5998 k = 0.0000 0.0000 0.1758 ( 5108 PWs) bands (ev): -12.9759 -12.9759 -12.0508 -12.0508 -8.9120 -8.9120 -8.8350 -8.8350 -8.3898 -8.3898 -8.2967 -8.2967 -8.1928 -8.1928 -7.8417 -7.8417 -7.6276 -7.6276 -7.5062 -7.5062 -7.4217 -7.4217 -7.2760 -7.2760 -7.2428 -7.2428 -6.2014 -6.2014 0.0478 0.0478 0.9482 0.9482 1.7571 1.7571 2.3228 2.3228 3.6202 3.6202 3.7891 3.7891 3.9095 3.9095 4.0940 4.0940 4.2928 4.2928 4.5807 4.5807 4.6900 4.6900 4.9576 4.9576 7.9621 7.9621 9.2249 9.2249 10.9544 10.9544 11.4846 11.4846 12.5860 12.5860 k = 0.0000 0.0000 0.1868 ( 5118 PWs) bands (ev): -12.9759 -12.9759 -12.0508 -12.0508 -8.9032 -8.9032 -8.8451 -8.8451 -8.3899 -8.3899 -8.2969 -8.2969 -8.1919 -8.1919 -7.8418 -7.8418 -7.6275 -7.6275 -7.5063 -7.5063 -7.4217 -7.4217 -7.2761 -7.2761 -7.2420 -7.2420 -6.2018 -6.2018 0.0416 0.0416 0.9484 0.9484 1.7577 1.7577 2.3506 2.3506 3.5977 3.5977 3.7860 3.7860 3.9013 3.9013 4.0936 4.0936 4.2938 4.2938 4.5812 4.5812 4.6896 4.6896 4.9597 4.9597 7.9950 7.9950 9.1987 9.1987 10.9520 10.9520 11.4867 11.4867 12.5763 12.5763 k = 0.0000 0.0000 0.1978 ( 5122 PWs) bands (ev): -12.9759 -12.9759 -12.0508 -12.0508 -8.8958 -8.8958 -8.8533 -8.8533 -8.3899 -8.3899 -8.2969 -8.2969 -8.1913 -8.1913 -7.8418 -7.8418 -7.6275 -7.6275 -7.5063 -7.5063 -7.4217 -7.4217 -7.2761 -7.2761 -7.2415 -7.2415 -6.2020 -6.2020 0.0379 0.0379 0.9484 0.9484 1.7580 1.7580 2.3682 2.3682 3.5830 3.5830 3.7842 3.7842 3.8967 3.8967 4.0934 4.0934 4.2944 4.2944 4.5816 4.5816 4.6894 4.6894 4.9610 4.9610 8.0158 8.0158 9.1820 9.1820 10.9506 10.9506 11.4879 11.4879 12.5704 12.5704 k = 0.0000 0.0000 0.2088 ( 5128 PWs) bands (ev): -12.9759 -12.9759 -12.0508 -12.0508 -8.8926 -8.8926 -8.8568 -8.8568 -8.3900 -8.3900 -8.2970 -8.2970 -8.1912 -8.1912 -7.8419 -7.8419 -7.6275 -7.6275 -7.5063 -7.5063 -7.4217 -7.4217 -7.2761 -7.2761 -7.2414 -7.2414 -6.2021 -6.2021 0.0367 0.0367 0.9485 0.9485 1.7581 1.7581 2.3742 2.3742 3.5779 3.5779 3.7835 3.7835 3.8952 3.8952 4.0934 4.0934 4.2946 4.2946 4.5817 4.5817 4.6893 4.6893 4.9614 4.9614 8.0229 8.0229 9.1763 9.1763 10.9501 10.9501 11.4883 11.4883 12.5685 12.5685 k = 0.0000 0.0000 0.2088 ( 5128 PWs) bands (ev): -12.9759 -12.9759 -12.0508 -12.0508 -8.8926 -8.8926 -8.8568 -8.8568 -8.3900 -8.3900 -8.2970 -8.2970 -8.1912 -8.1912 -7.8419 -7.8419 -7.6275 -7.6275 -7.5063 -7.5063 -7.4217 -7.4217 -7.2761 -7.2761 -7.2414 -7.2414 -6.2021 -6.2021 0.0367 0.0367 0.9485 0.9485 1.7581 1.7581 2.3742 2.3742 3.5779 3.5779 3.7835 3.7835 3.8952 3.8952 4.0934 4.0934 4.2946 4.2946 4.5817 4.5817 4.6893 4.6893 4.9614 4.9614 8.0229 8.0229 9.1763 9.1763 10.9501 10.9501 11.4883 11.4883 12.5685 12.5685 k = 0.0114-0.0000 0.2088 ( 5118 PWs) bands (ev): -12.9754 -12.9754 -12.0509 -12.0509 -8.8935 -8.8935 -8.8570 -8.8570 -8.3890 -8.3890 -8.2967 -8.2967 -8.1905 -8.1905 -7.8417 -7.8417 -7.6269 -7.6269 -7.5061 -7.5061 -7.4214 -7.4214 -7.2776 -7.2776 -7.2395 -7.2395 -6.2025 -6.2025 0.0371 0.0371 0.9494 0.9494 1.7559 1.7559 2.3729 2.3729 3.5783 3.5783 3.7830 3.7830 3.8912 3.8912 4.0931 4.0931 4.2944 4.2944 4.5806 4.5806 4.6870 4.6870 4.9571 4.9571 8.0262 8.0262 9.1812 9.1812 10.9538 10.9538 11.4941 11.4941 12.5692 12.5692 k = 0.0227-0.0000 0.2088 ( 5116 PWs) bands (ev): -12.9742 -12.9742 -12.0515 -12.0515 -8.8962 -8.8962 -8.8576 -8.8576 -8.3863 -8.3863 -8.2960 -8.2960 -8.1888 -8.1888 -7.8412 -7.8412 -7.6252 -7.6252 -7.5056 -7.5056 -7.4207 -7.4207 -7.2815 -7.2815 -7.2348 -7.2348 -6.2037 -6.2037 0.0385 0.0385 0.9524 0.9524 1.7491 1.7491 2.3690 2.3690 3.5792 3.5792 3.7812 3.7812 3.8798 3.8798 4.0919 4.0919 4.2937 4.2937 4.5772 4.5772 4.6804 4.6804 4.9446 4.9446 8.0361 8.0361 9.1958 9.1958 10.9648 10.9648 11.5112 11.5112 12.5713 12.5713 k = 0.0341-0.0000 0.2088 ( 5116 PWs) bands (ev): -12.9721 -12.9721 -12.0523 -12.0523 -8.9004 -8.9004 -8.8588 -8.8588 -8.3819 -8.3819 -8.2947 -8.2947 -8.1859 -8.1859 -7.8405 -7.8405 -7.6226 -7.6226 -7.5047 -7.5047 -7.4196 -7.4196 -7.2867 -7.2867 -7.2282 -7.2282 -6.2058 -6.2058 0.0408 0.0408 0.9572 0.9572 1.7381 1.7381 2.3625 2.3625 3.5802 3.5802 3.7778 3.7778 3.8626 3.8626 4.0888 4.0888 4.2926 4.2926 4.5707 4.5707 4.6700 4.6700 4.9246 4.9246 8.0524 8.0524 9.2198 9.2198 10.9830 10.9830 11.5394 11.5394 12.5747 12.5747 k = 0.0455-0.0000 0.2088 ( 5124 PWs) bands (ev): -12.9692 -12.9692 -12.0536 -12.0536 -8.9060 -8.9060 -8.8604 -8.8604 -8.3764 -8.3764 -8.2927 -8.2927 -8.1820 -8.1820 -7.8396 -7.8396 -7.6189 -7.6189 -7.5034 -7.5034 -7.4182 -7.4182 -7.2925 -7.2925 -7.2205 -7.2205 -6.2088 -6.2088 0.0440 0.0440 0.9640 0.9640 1.7229 1.7229 2.3531 2.3531 3.5805 3.5805 3.7720 3.7720 3.8424 3.8424 4.0824 4.0824 4.2913 4.2913 4.5600 4.5600 4.6565 4.6565 4.8987 4.8987 8.0746 8.0746 9.2525 9.2525 11.0083 11.0083 11.5782 11.5782 12.5793 12.5793 k = 0.0568-0.0000 0.2088 ( 5120 PWs) bands (ev): -12.9655 -12.9655 -12.0552 -12.0552 -8.9126 -8.9126 -8.8625 -8.8625 -8.3698 -8.3698 -8.2898 -8.2898 -8.1772 -8.1772 -7.8383 -7.8383 -7.6140 -7.6140 -7.5017 -7.5017 -7.4164 -7.4164 -7.2984 -7.2984 -7.2120 -7.2120 -6.2125 -6.2125 0.0481 0.0481 0.9727 0.9727 1.7038 1.7038 2.3408 2.3408 3.5788 3.5788 3.7623 3.7623 3.8231 3.8231 4.0717 4.0717 4.2902 4.2902 4.5436 4.5436 4.6408 4.6408 4.8692 4.8692 8.1024 8.1024 9.2932 9.2932 11.0402 11.0402 11.6268 11.6268 12.5848 12.5848 k = 0.0682-0.0000 0.2088 ( 5112 PWs) bands (ev): -12.9610 -12.9610 -12.0571 -12.0571 -8.9200 -8.9200 -8.8651 -8.8651 -8.3629 -8.3629 -8.2858 -8.2858 -8.1715 -8.1715 -7.8367 -7.8367 -7.6081 -7.6081 -7.4996 -7.4996 -7.4142 -7.4142 -7.3042 -7.3042 -7.2026 -7.2026 -6.2170 -6.2170 0.0530 0.0530 0.9832 0.9832 1.6811 1.6811 2.3254 2.3254 3.5730 3.5730 3.7476 3.7476 3.8084 3.8084 4.0553 4.0553 4.2893 4.2893 4.5198 4.5198 4.6235 4.6235 4.8391 4.8391 8.1351 8.1351 9.3409 9.3409 11.0787 11.0787 11.6845 11.6845 12.5910 12.5910 k = 0.0795-0.0000 0.2088 ( 5112 PWs) bands (ev): -12.9557 -12.9557 -12.0594 -12.0594 -8.9279 -8.9279 -8.8680 -8.8680 -8.3562 -8.3562 -8.2805 -8.2805 -8.1652 -8.1652 -7.8350 -7.8350 -7.6013 -7.6013 -7.4970 -7.4970 -7.4119 -7.4119 -7.3099 -7.3099 -7.1926 -7.1926 -6.2224 -6.2224 0.0587 0.0587 0.9957 0.9957 1.6554 1.6554 2.3066 2.3066 3.5605 3.5605 3.7303 3.7303 3.7993 3.7993 4.0326 4.0326 4.2890 4.2890 4.4870 4.4870 4.6049 4.6049 4.8115 4.8115 8.1721 8.1721 9.3946 9.3946 11.1231 11.1231 11.7502 11.7502 12.5975 12.5975 k = 0.0909-0.0000 0.2088 ( 5104 PWs) bands (ev): -12.9496 -12.9496 -12.0621 -12.0621 -8.9362 -8.9362 -8.8711 -8.8711 -8.3500 -8.3500 -8.2734 -8.2734 -8.1584 -8.1584 -7.8332 -7.8332 -7.5933 -7.5933 -7.4940 -7.4940 -7.4094 -7.4094 -7.3154 -7.3154 -7.1819 -7.1819 -6.2286 -6.2286 0.0652 0.0652 1.0100 1.0100 1.6269 1.6269 2.2841 2.2841 3.5391 3.5391 3.7145 3.7145 3.7942 3.7942 4.0028 4.0028 4.2894 4.2894 4.4443 4.4443 4.5854 4.5854 4.7891 4.7891 8.2126 8.2126 9.4533 9.4533 11.1730 11.1730 11.8226 11.8226 12.6039 12.6039 k = 0.1023-0.0000 0.2088 ( 5104 PWs) bands (ev): -12.9428 -12.9428 -12.0652 -12.0652 -8.9445 -8.9445 -8.8744 -8.8744 -8.3448 -8.3448 -8.2646 -8.2646 -8.1512 -8.1512 -7.8312 -7.8312 -7.5845 -7.5845 -7.4904 -7.4904 -7.4069 -7.4069 -7.3206 -7.3206 -7.1705 -7.1705 -6.2357 -6.2357 0.0723 0.0723 1.0261 1.0261 1.5961 1.5961 2.2578 2.2578 3.5089 3.5089 3.7017 3.7017 3.7918 3.7918 3.9659 3.9659 4.2908 4.2908 4.3918 4.3918 4.5660 4.5660 4.7729 4.7729 8.2559 8.2559 9.5158 9.5158 11.2281 11.2281 11.9005 11.9005 12.6098 12.6098 k = 0.1136-0.0000 0.2088 ( 5108 PWs) bands (ev): -12.9352 -12.9352 -12.0687 -12.0687 -8.9528 -8.9528 -8.8778 -8.8778 -8.3408 -8.3408 -8.2542 -8.2542 -8.1439 -8.1439 -7.8292 -7.8292 -7.5750 -7.5750 -7.4863 -7.4863 -7.4045 -7.4045 -7.3254 -7.3254 -7.1584 -7.1584 -6.2434 -6.2434 0.0801 0.0801 1.0439 1.0439 1.5635 1.5635 2.2273 2.2273 3.4718 3.4718 3.6905 3.6905 3.7915 3.7915 3.9220 3.9220 4.2931 4.2931 4.3308 4.3308 4.5478 4.5478 4.7624 4.7624 8.3012 8.3012 9.5809 9.5809 11.2876 11.2876 11.9826 11.9826 12.6147 12.6147 k = 0.1250-0.0000 0.2088 ( 5108 PWs) bands (ev): -12.9269 -12.9269 -12.0727 -12.0727 -8.9607 -8.9607 -8.8810 -8.8810 -8.3377 -8.3377 -8.2424 -8.2424 -8.1364 -8.1364 -7.8271 -7.8271 -7.5649 -7.5649 -7.4812 -7.4812 -7.4025 -7.4025 -7.3295 -7.3295 -7.1454 -7.1454 -6.2519 -6.2519 0.0884 0.0884 1.0635 1.0635 1.5297 1.5297 2.1924 2.1924 3.4301 3.4301 3.6788 3.6788 3.7922 3.7922 3.8719 3.8719 4.2638 4.2638 4.2965 4.2965 4.5316 4.5316 4.7565 4.7565 8.3477 8.3477 9.6476 9.6476 11.3510 11.3510 12.0672 12.0672 12.6185 12.6185 k = 0.1364-0.0000 0.2088 ( 5098 PWs) bands (ev): -12.9179 -12.9179 -12.0770 -12.0770 -8.9683 -8.9683 -8.8840 -8.8840 -8.3354 -8.3354 -8.2297 -8.2297 -8.1290 -8.1290 -7.8249 -7.8249 -7.5546 -7.5546 -7.4752 -7.4752 -7.4009 -7.4009 -7.3329 -7.3329 -7.1315 -7.1315 -6.2610 -6.2610 0.0973 0.0973 1.0847 1.0847 1.4952 1.4952 2.1531 2.1531 3.3858 3.3858 3.6647 3.6647 3.7906 3.7906 3.8182 3.8182 4.1942 4.1942 4.3009 4.3009 4.5178 4.5178 4.7540 4.7540 8.3947 8.3947 9.7147 9.7147 11.4177 11.4177 12.1528 12.1528 12.6210 12.6210 k = 0.1477-0.0000 0.2088 ( 5090 PWs) bands (ev): -12.9082 -12.9082 -12.0817 -12.0817 -8.9752 -8.9752 -8.8867 -8.8867 -8.3337 -8.3337 -8.2163 -8.2163 -8.1216 -8.1216 -7.8227 -7.8227 -7.5443 -7.5443 -7.4678 -7.4678 -7.3998 -7.3998 -7.3354 -7.3354 -7.1167 -7.1167 -6.2709 -6.2709 0.1064 0.1064 1.1074 1.1074 1.4605 1.4605 2.1093 2.1093 3.3403 3.3403 3.6465 3.6465 3.7533 3.7533 3.7927 3.7927 4.1268 4.1268 4.3063 4.3063 4.5065 4.5065 4.7538 4.7538 8.4413 8.4413 9.7811 9.7811 11.4870 11.4870 12.2379 12.2379 12.6225 12.6225 k = 0.1591-0.0000 0.2088 ( 5090 PWs) bands (ev): -12.8979 -12.8979 -12.0869 -12.0869 -8.9815 -8.9815 -8.8891 -8.8891 -8.3327 -8.3327 -8.2028 -8.2028 -8.1144 -8.1144 -7.8205 -7.8205 -7.5348 -7.5348 -7.4590 -7.4590 -7.3996 -7.3996 -7.3369 -7.3369 -7.1011 -7.1011 -6.2815 -6.2815 0.1159 0.1159 1.1315 1.1315 1.4263 1.4263 2.0609 2.0609 3.2943 3.2943 3.6207 3.6207 3.6949 3.6949 3.7787 3.7787 4.0683 4.0683 4.3127 4.3127 4.4977 4.4977 4.7555 4.7555 8.4868 8.4868 9.8457 9.8457 11.5582 11.5582 12.3207 12.3207 12.6240 12.6240 k = 0.1705-0.0000 0.2088 ( 5098 PWs) bands (ev): -12.8870 -12.8870 -12.0926 -12.0926 -8.9871 -8.9871 -8.8911 -8.8911 -8.3320 -8.3320 -8.1894 -8.1894 -8.1073 -8.1073 -7.8185 -7.8185 -7.5264 -7.5264 -7.4484 -7.4484 -7.4001 -7.4001 -7.3374 -7.3374 -7.0845 -7.0845 -6.2927 -6.2927 0.1254 0.1254 1.1566 1.1566 1.3932 1.3932 2.0083 2.0083 3.2481 3.2481 3.5792 3.5792 3.6440 3.6440 3.7493 3.7493 4.0270 4.0270 4.3201 4.3201 4.4912 4.4912 4.7584 4.7584 8.5307 8.5307 9.9074 9.9074 11.6307 11.6307 12.3988 12.3988 12.6275 12.6275 k = 0.1818-0.0000 0.2088 ( 5098 PWs) bands (ev): -12.8755 -12.8755 -12.0986 -12.0986 -8.9919 -8.9919 -8.8925 -8.8925 -8.3316 -8.3316 -8.1764 -8.1764 -8.1001 -8.1001 -7.8164 -7.8164 -7.5193 -7.5193 -7.4363 -7.4363 -7.4010 -7.4010 -7.3368 -7.3368 -7.0670 -7.0670 -6.3044 -6.3044 0.1349 0.1349 1.1821 1.1821 1.3625 1.3625 1.9516 1.9516 3.2018 3.2018 3.5187 3.5187 3.6036 3.6036 3.7026 3.7026 4.0067 4.0067 4.3284 4.3284 4.4870 4.4870 4.7623 4.7623 8.5724 8.5724 9.9651 9.9651 11.7036 11.7036 12.4678 12.4678 12.6375 12.6375 k = 0.1932-0.0000 0.2088 ( 5102 PWs) bands (ev): -12.8634 -12.8634 -12.1052 -12.1052 -8.9958 -8.9958 -8.8934 -8.8934 -8.3313 -8.3313 -8.1641 -8.1641 -8.0928 -8.0928 -7.8144 -7.8144 -7.5134 -7.5134 -7.4234 -7.4234 -7.4014 -7.4014 -7.3355 -7.3355 -7.0487 -7.0487 -6.3165 -6.3165 0.1443 0.1443 1.2063 1.2063 1.3362 1.3362 1.8912 1.8912 3.1552 3.1552 3.4488 3.4488 3.5602 3.5602 3.6480 3.6480 4.0034 4.0034 4.3375 4.3375 4.4850 4.4850 4.7670 4.7670 8.6113 8.6113 10.0178 10.0178 11.7762 11.7762 12.5196 12.5196 12.6628 12.6628 k = 0.2045-0.0000 0.2088 ( 5102 PWs) bands (ev): -12.8508 -12.8508 -12.1122 -12.1122 -8.9988 -8.9988 -8.8936 -8.8936 -8.3312 -8.3312 -8.1529 -8.1529 -8.0852 -8.0852 -7.8125 -7.8125 -7.5089 -7.5089 -7.4138 -7.4138 -7.3976 -7.3976 -7.3334 -7.3334 -7.0295 -7.0295 -6.3291 -6.3291 0.1533 0.1533 1.2246 1.2246 1.3193 1.3193 1.8276 1.8276 3.1076 3.1076 3.3756 3.3756 3.5016 3.5016 3.5998 3.5998 4.0107 4.0107 4.3474 4.3474 4.4850 4.4850 4.7722 4.7722 8.6471 8.6471 10.0643 10.0643 11.8478 11.8478 12.5488 12.5488 12.7096 12.7096 k = 0.2159-0.0000 0.2088 ( 5102 PWs) bands (ev): -12.8378 -12.8378 -12.1197 -12.1197 -9.0009 -9.0009 -8.8933 -8.8933 -8.3312 -8.3312 -8.1432 -8.1432 -8.0770 -8.0770 -7.8106 -7.8106 -7.5055 -7.5055 -7.4120 -7.4120 -7.3852 -7.3852 -7.3308 -7.3308 -7.0096 -7.0096 -6.3419 -6.3419 0.1619 0.1619 1.2280 1.2280 1.3212 1.3212 1.7613 1.7613 3.0583 3.0583 3.3018 3.3018 3.4285 3.4285 3.5609 3.5609 4.0240 4.0240 4.3579 4.3579 4.4870 4.4870 4.7778 4.7778 8.6794 8.6794 10.1039 10.1039 11.9176 11.9176 12.5637 12.5637 12.7706 12.7706 k = 0.2273-0.0000 0.2088 ( 5096 PWs) bands (ev): -12.8242 -12.8242 -12.1276 -12.1276 -9.0019 -9.0019 -8.8924 -8.8924 -8.3312 -8.3312 -8.1350 -8.1350 -8.0680 -8.0680 -7.8087 -7.8087 -7.5030 -7.5030 -7.4131 -7.4131 -7.3695 -7.3695 -7.3274 -7.3274 -6.9888 -6.9888 -6.3548 -6.3548 0.1699 0.1699 1.2168 1.2168 1.3419 1.3419 1.6928 1.6928 3.0063 3.0063 3.2288 3.2288 3.3486 3.3486 3.5261 3.5261 4.0411 4.0411 4.3690 4.3690 4.4910 4.4910 4.7838 4.7838 8.7082 8.7082 10.1355 10.1355 11.9849 11.9849 12.5741 12.5741 12.8372 12.8372 k = 0.2386-0.0000 0.2088 ( 5100 PWs) bands (ev): -12.8102 -12.8102 -12.1360 -12.1360 -9.0020 -9.0020 -8.8908 -8.8908 -8.3312 -8.3312 -8.1288 -8.1288 -8.0583 -8.0583 -7.8070 -7.8070 -7.5016 -7.5016 -7.4148 -7.4148 -7.3537 -7.3537 -7.3232 -7.3232 -6.9675 -6.9675 -6.3678 -6.3678 0.1772 0.1772 1.2009 1.2009 1.3717 1.3717 1.6226 1.6226 2.9505 2.9505 3.1574 3.1574 3.2677 3.2677 3.4922 3.4922 4.0605 4.0605 4.3804 4.3804 4.4969 4.4969 4.7899 4.7899 8.7332 8.7332 10.1585 10.1585 12.0491 12.0491 12.5848 12.5848 12.9056 12.9056 k = 0.2500-0.0000 0.2088 ( 5096 PWs) bands (ev): -12.7958 -12.7958 -12.1449 -12.1449 -9.0012 -9.0012 -8.8886 -8.8886 -8.3312 -8.3312 -8.1241 -8.1241 -8.0478 -8.0478 -7.8053 -7.8053 -7.5009 -7.5009 -7.4163 -7.4163 -7.3398 -7.3398 -7.3168 -7.3168 -6.9456 -6.9456 -6.3809 -6.3809 0.1836 0.1836 1.1854 1.1854 1.4059 1.4059 1.5515 1.5515 2.8903 2.8903 3.0874 3.0874 3.1891 3.1891 3.4578 3.4578 4.0814 4.0814 4.3923 4.3923 4.5045 4.5045 4.7962 4.7962 8.7547 8.7547 10.1723 10.1723 12.1099 12.1099 12.5978 12.5978 12.9746 12.9746 k = 0.2614-0.0000 0.2088 ( 5096 PWs) bands (ev): -12.7811 -12.7811 -12.1542 -12.1542 -8.9994 -8.9994 -8.8859 -8.8859 -8.3310 -8.3310 -8.1210 -8.1210 -8.0369 -8.0369 -7.8038 -7.8038 -7.5010 -7.5010 -7.4175 -7.4175 -7.3302 -7.3302 -7.3064 -7.3064 -6.9233 -6.9233 -6.3937 -6.3937 0.1890 0.1890 1.1722 1.1722 1.4417 1.4417 1.4807 1.4807 2.8256 2.8256 3.0178 3.0178 3.1158 3.1158 3.4224 3.4224 4.1034 4.1034 4.4044 4.4044 4.5138 4.5138 4.8025 4.8025 8.7727 8.7727 10.1766 10.1766 12.1672 12.1672 12.6139 12.6139 13.0439 13.0439 k = 0.2727-0.0000 0.2088 ( 5096 PWs) bands (ev): -12.7660 -12.7660 -12.1640 -12.1640 -8.9967 -8.9967 -8.8827 -8.8827 -8.3308 -8.3308 -8.1193 -8.1193 -8.0256 -8.0256 -7.8024 -7.8024 -7.5016 -7.5016 -7.4185 -7.4185 -7.3242 -7.3242 -7.2929 -7.2929 -6.9007 -6.9007 -6.4062 -6.4062 0.1936 0.1936 1.1620 1.1620 1.4072 1.4072 1.4823 1.4823 2.7570 2.7570 2.9469 2.9469 3.0496 3.0496 3.3859 3.3859 4.1262 4.1262 4.4166 4.4166 4.5247 4.5247 4.8088 4.8088 8.7876 8.7876 10.1713 10.1713 12.2210 12.2210 12.6336 12.6336 13.1136 13.1136 k = 0.2841-0.0000 0.2088 ( 5102 PWs) bands (ev): -12.7506 -12.7506 -12.1742 -12.1742 -8.9931 -8.9931 -8.8790 -8.8790 -8.3304 -8.3304 -8.1188 -8.1188 -8.0143 -8.0143 -7.8012 -7.8012 -7.5027 -7.5027 -7.4194 -7.4194 -7.3200 -7.3200 -7.2787 -7.2787 -6.8779 -6.8779 -6.4183 -6.4183 0.1972 0.1972 1.1548 1.1548 1.3368 1.3368 1.5221 1.5221 2.6856 2.6856 2.8746 2.8746 2.9905 2.9905 3.3481 3.3481 4.1494 4.1494 4.4288 4.4288 4.5369 4.5369 4.8150 4.8150 8.7996 8.7996 10.1565 10.1565 12.2718 12.2718 12.6569 12.6569 13.1837 13.1837 k = 0.2955-0.0000 0.2088 ( 5110 PWs) bands (ev): -12.7349 -12.7349 -12.1849 -12.1849 -8.9887 -8.9887 -8.8749 -8.8749 -8.3298 -8.3298 -8.1193 -8.1193 -8.0029 -8.0029 -7.8002 -7.8002 -7.5041 -7.5041 -7.4200 -7.4200 -7.3165 -7.3165 -7.2651 -7.2651 -6.8549 -6.8549 -6.4299 -6.4299 0.2000 0.2000 1.1496 1.1496 1.2684 1.2684 1.5636 1.5636 2.6127 2.6127 2.8021 2.8021 2.9369 2.9369 3.3090 3.3090 4.1730 4.1730 4.4410 4.4410 4.5504 4.5504 4.8211 4.8211 8.8093 8.8093 10.1328 10.1328 12.3202 12.3202 12.6834 12.6834 13.2546 13.2546 k = 0.3068-0.0000 0.2088 ( 5112 PWs) bands (ev): -12.7190 -12.7190 -12.1960 -12.1960 -8.9835 -8.9835 -8.8705 -8.8705 -8.3290 -8.3290 -8.1207 -8.1207 -7.9917 -7.9917 -7.7993 -7.7993 -7.5057 -7.5057 -7.4205 -7.4205 -7.3132 -7.3132 -7.2525 -7.2525 -6.8319 -6.8319 -6.4407 -6.4407 0.2020 0.2020 1.1411 1.1411 1.2082 1.2082 1.6062 1.6062 2.5392 2.5392 2.7308 2.7308 2.8870 2.8870 3.2687 3.2687 4.1967 4.1967 4.4530 4.4530 4.5649 4.5649 4.8269 4.8269 8.8171 8.8171 10.1008 10.1008 12.3668 12.3668 12.7127 12.7127 13.3262 13.3262 k = 0.3182-0.0000 0.2088 ( 5108 PWs) bands (ev): -12.7029 -12.7029 -12.2075 -12.2075 -8.9776 -8.9776 -8.8659 -8.8659 -8.3277 -8.3277 -8.1230 -8.1230 -7.9805 -7.9805 -7.7987 -7.7987 -7.5073 -7.5073 -7.4209 -7.4209 -7.3100 -7.3100 -7.2414 -7.2414 -6.8090 -6.8090 -6.4506 -6.4506 0.2036 0.2036 1.1058 1.1058 1.1798 1.1798 1.6499 1.6499 2.4660 2.4660 2.6619 2.6619 2.8395 2.8395 3.2272 3.2272 4.2204 4.2204 4.4647 4.4647 4.5803 4.5803 4.8325 4.8325 8.8236 8.8236 10.0612 10.0612 12.4121 12.4121 12.7443 12.7443 13.3987 13.3987 k = 0.3295-0.0000 0.2088 ( 5104 PWs) bands (ev): -12.6866 -12.6866 -12.2194 -12.2194 -8.9710 -8.9710 -8.8612 -8.8612 -8.3261 -8.3261 -8.1260 -8.1260 -7.9697 -7.9697 -7.7983 -7.7983 -7.5088 -7.5088 -7.4215 -7.4215 -7.3069 -7.3069 -7.2320 -7.2320 -6.7863 -6.7863 -6.4596 -6.4596 0.2049 0.2049 1.0466 1.0466 1.1806 1.1806 1.6946 1.6946 2.3938 2.3938 2.5964 2.5964 2.7934 2.7934 3.1846 3.1846 4.2440 4.2440 4.4760 4.4760 4.5964 4.5964 4.8377 4.8377 8.8293 8.8293 10.0152 10.0152 12.4567 12.4567 12.7775 12.7775 13.4721 13.4721 k = 0.3409-0.0000 0.2088 ( 5104 PWs) bands (ev): -12.6701 -12.6701 -12.2317 -12.2317 -8.9639 -8.9639 -8.8565 -8.8565 -8.3240 -8.3240 -8.1297 -8.1297 -7.9591 -7.9591 -7.7984 -7.7984 -7.5100 -7.5100 -7.4222 -7.4222 -7.3039 -7.3039 -7.2243 -7.2243 -6.7640 -6.7640 -6.4678 -6.4678 0.2061 0.2061 0.9838 0.9838 1.1901 1.1901 1.7401 1.7401 2.3230 2.3230 2.5347 2.5347 2.7482 2.7482 3.1409 3.1409 4.2674 4.2674 4.4867 4.4867 4.6131 4.6131 4.8425 4.8425 8.8347 8.8347 9.9636 9.9636 12.5009 12.5009 12.8115 12.8115 13.5461 13.5461 k = 0.3523-0.0000 0.2088 ( 5098 PWs) bands (ev): -12.6535 -12.6535 -12.2444 -12.2444 -8.9562 -8.9562 -8.8520 -8.8520 -8.3214 -8.3214 -8.1341 -8.1341 -7.9488 -7.9488 -7.7987 -7.7987 -7.5108 -7.5108 -7.4232 -7.4232 -7.3008 -7.3008 -7.2185 -7.2185 -6.7421 -6.7421 -6.4749 -6.4749 0.2076 0.2076 0.9217 0.9217 1.2041 1.2041 1.7862 1.7862 2.2541 2.2541 2.4775 2.4775 2.7038 2.7038 3.0962 3.0962 4.2904 4.2904 4.4968 4.4968 4.6301 4.6301 4.8467 4.8467 8.8405 8.8405 9.9075 9.9075 12.5449 12.5449 12.8457 12.8457 13.6208 13.6208 k = 0.3636-0.0000 0.2088 ( 5102 PWs) bands (ev): -12.6368 -12.6368 -12.2574 -12.2574 -8.9482 -8.9482 -8.8477 -8.8477 -8.3183 -8.3183 -8.1391 -8.1391 -7.9388 -7.9388 -7.7995 -7.7995 -7.5113 -7.5113 -7.4245 -7.4245 -7.2977 -7.2977 -7.2145 -7.2145 -6.7208 -6.7208 -6.4811 -6.4811 0.2096 0.2096 0.8615 0.8615 1.2213 1.2213 1.8326 1.8326 2.1877 2.1877 2.4251 2.4251 2.6599 2.6599 3.0505 3.0505 4.3130 4.3130 4.5060 4.5060 4.6473 4.6473 4.8504 4.8504 8.8472 8.8472 9.8479 9.8479 12.5886 12.5886 12.8793 12.8793 13.6956 13.6956 k = 0.3750-0.0000 0.2088 ( 5106 PWs) bands (ev): -12.6201 -12.6201 -12.2708 -12.2708 -8.9398 -8.9398 -8.8439 -8.8439 -8.3147 -8.3147 -8.1447 -8.1447 -7.9292 -7.9292 -7.8006 -7.8006 -7.5112 -7.5112 -7.4263 -7.4263 -7.2946 -7.2946 -7.2122 -7.2122 -6.7002 -6.7002 -6.4866 -6.4866 0.2123 0.2123 0.8036 0.8036 1.2412 1.2412 1.8787 1.8787 2.1245 2.1245 2.3780 2.3780 2.6167 2.6167 3.0039 3.0039 4.3350 4.3350 4.5142 4.5142 4.6646 4.6646 4.8535 4.8535 8.8553 8.8553 9.7857 9.7857 12.6321 12.6321 12.9114 12.9114 13.7701 13.7701 k = 0.3864-0.0000 0.2088 ( 5106 PWs) bands (ev): -12.6032 -12.6032 -12.2846 -12.2846 -8.9311 -8.9311 -8.8405 -8.8405 -8.3103 -8.3103 -8.1509 -8.1509 -7.9198 -7.9198 -7.8022 -7.8022 -7.5106 -7.5106 -7.4284 -7.4284 -7.2913 -7.2913 -7.2115 -7.2115 -6.6803 -6.6803 -6.4914 -6.4914 0.2161 0.2161 0.7482 0.7482 1.2633 1.2633 1.9219 1.9219 2.0673 2.0673 2.3363 2.3363 2.5741 2.5741 2.9565 2.9565 4.3564 4.3564 4.5213 4.5213 4.6818 4.6818 4.8558 4.8558 8.8652 8.8652 9.7219 9.7219 12.6752 12.6752 12.9415 12.9415 13.8432 13.8432 k = 0.3977-0.0000 0.2088 ( 5098 PWs) bands (ev): -12.5863 -12.5863 -12.2986 -12.2986 -8.9222 -8.9222 -8.8378 -8.8378 -8.3053 -8.3053 -8.1577 -8.1577 -7.9107 -7.9107 -7.8042 -7.8042 -7.5094 -7.5094 -7.4310 -7.4310 -7.2879 -7.2879 -7.2122 -7.2122 -6.6613 -6.6613 -6.4955 -6.4955 0.2211 0.2211 0.6955 0.6955 1.2875 1.2875 1.9475 1.9475 2.0306 2.0306 2.3004 2.3004 2.5323 2.5323 2.9084 2.9084 4.3770 4.3770 4.5271 4.5271 4.6989 4.6989 4.8573 4.8573 8.8774 8.8774 9.6572 9.6572 12.7175 12.7175 12.9688 12.9688 13.9123 13.9123 k = 0.4091-0.0000 0.2088 ( 5094 PWs) bands (ev): -12.5695 -12.5695 -12.3129 -12.3129 -8.9133 -8.9133 -8.8358 -8.8358 -8.2997 -8.2997 -8.1649 -8.1649 -7.9019 -7.9019 -7.8067 -7.8067 -7.5075 -7.5075 -7.4341 -7.4341 -7.2843 -7.2843 -7.2142 -7.2142 -6.6433 -6.6433 -6.4993 -6.4993 0.2275 0.2275 0.6456 0.6456 1.3133 1.3133 1.9211 1.9211 2.0490 2.0490 2.2706 2.2706 2.4916 2.4916 2.8596 2.8596 4.3967 4.3967 4.5317 4.5317 4.7155 4.7155 4.8578 4.8578 8.8924 8.8924 9.5924 9.5924 12.7589 12.7589 12.9925 12.9925 13.9710 13.9710 k = 0.4205-0.0000 0.2088 ( 5090 PWs) bands (ev): -12.5526 -12.5526 -12.3275 -12.3275 -8.9045 -8.9045 -8.8346 -8.8346 -8.2934 -8.2934 -8.1726 -8.1726 -7.8934 -7.8934 -7.8097 -7.8097 -7.5050 -7.5050 -7.4377 -7.4377 -7.2807 -7.2807 -7.2172 -7.2172 -6.6263 -6.6263 -6.5030 -6.5030 0.2356 0.2356 0.5987 0.5987 1.3406 1.3406 1.8731 1.8731 2.0919 2.0919 2.2471 2.2471 2.4522 2.4522 2.8101 2.8101 4.4154 4.4154 4.5347 4.5347 4.7317 4.7317 4.8574 4.8574 8.9103 8.9103 9.5282 9.5282 12.7990 12.7990 13.0122 13.0122 14.0068 14.0069 k = 0.4318-0.0000 0.2088 ( 5092 PWs) bands (ev): -12.5357 -12.5357 -12.3424 -12.3424 -8.8958 -8.8958 -8.8343 -8.8343 -8.2864 -8.2864 -8.1807 -8.1807 -7.8853 -7.8853 -7.8132 -7.8132 -7.5018 -7.5018 -7.4418 -7.4418 -7.2768 -7.2768 -7.2210 -7.2210 -6.6105 -6.6105 -6.5067 -6.5067 0.2456 0.2456 0.5546 0.5546 1.3692 1.3692 1.8233 1.8233 2.1385 2.1385 2.2307 2.2307 2.4144 2.4144 2.7602 2.7602 4.4331 4.4331 4.5363 4.5363 4.7473 4.7473 4.8560 4.8560 8.9315 8.9315 9.4651 9.4651 12.8374 12.8374 13.0274 13.0274 14.0202 14.0202 k = 0.4432-0.0000 0.2088 ( 5088 PWs) bands (ev): -12.5190 -12.5190 -12.3575 -12.3575 -8.8873 -8.8873 -8.8349 -8.8349 -8.2789 -8.2789 -8.1892 -8.1892 -7.8774 -7.8774 -7.8171 -7.8171 -7.4981 -7.4981 -7.4463 -7.4463 -7.2729 -7.2729 -7.2253 -7.2253 -6.5958 -6.5958 -6.5106 -6.5106 0.2575 0.2575 0.5135 0.5135 1.3989 1.3989 1.7750 1.7750 2.1816 2.1816 2.2253 2.2253 2.3787 2.3787 2.7097 2.7097 4.4496 4.4496 4.5363 4.5363 4.7622 4.7622 4.8534 4.8534 8.9562 8.9562 9.4037 9.4037 12.8739 12.8739 13.0376 13.0376 14.0245 14.0245 k = 0.4545-0.0000 0.2088 ( 5098 PWs) bands (ev): -12.5022 -12.5022 -12.3729 -12.3729 -8.8792 -8.8792 -8.8365 -8.8365 -8.2709 -8.2709 -8.1981 -8.1981 -7.8699 -7.8699 -7.8215 -7.8215 -7.4940 -7.4940 -7.4513 -7.4513 -7.2688 -7.2688 -7.2301 -7.2301 -6.5822 -6.5822 -6.5150 -6.5150 0.2716 0.2716 0.4754 0.4754 1.4297 1.4297 1.7288 1.7288 2.2003 2.2003 2.2505 2.2505 2.3459 2.3459 2.6589 2.6589 4.4649 4.4649 4.5347 4.5347 4.7762 4.7762 4.8496 4.8496 8.9846 8.9846 9.3444 9.3444 12.9078 12.9078 13.0426 13.0426 14.0259 14.0259 k = 0.4659-0.0000 0.2088 ( 5100 PWs) bands (ev): -12.4856 -12.4856 -12.3885 -12.3885 -8.8714 -8.8714 -8.8390 -8.8390 -8.2624 -8.2624 -8.2072 -8.2072 -7.8627 -7.8627 -7.8263 -7.8263 -7.4893 -7.4893 -7.4565 -7.4565 -7.2645 -7.2645 -7.2352 -7.2352 -6.5699 -6.5699 -6.5200 -6.5200 0.2880 0.2880 0.4403 0.4403 1.4617 1.4617 1.6848 1.6848 2.2046 2.2046 2.2903 2.2903 2.3219 2.3219 2.6078 2.6078 4.4788 4.4788 4.5315 4.5315 4.7894 4.7894 4.8447 4.8447 9.0168 9.0168 9.2877 9.2877 12.9390 12.9390 13.0424 13.0424 14.0268 14.0268 k = 0.4773-0.0000 0.2088 ( 5096 PWs) bands (ev): -12.4690 -12.4690 -12.4042 -12.4042 -8.8642 -8.8642 -8.8424 -8.8424 -8.2536 -8.2536 -8.2165 -8.2165 -7.8557 -7.8557 -7.8314 -7.8314 -7.4842 -7.4842 -7.4620 -7.4620 -7.2599 -7.2599 -7.2402 -7.2402 -6.5588 -6.5588 -6.5258 -6.5258 0.3068 0.3068 0.4080 0.4080 1.4949 1.4949 1.6430 1.6430 2.2113 2.2113 2.2815 2.2815 2.3531 2.3531 2.5565 2.5565 4.4914 4.4914 4.5266 4.5266 4.8015 4.8015 4.8385 4.8385 9.0528 9.0528 9.2340 9.2340 12.9668 12.9668 13.0369 13.0369 14.0285 14.0286 k = 0.4886-0.0000 0.2088 ( 5088 PWs) bands (ev): -12.4526 -12.4526 -12.4202 -12.4202 -8.8576 -8.8576 -8.8466 -8.8466 -8.2445 -8.2445 -8.2258 -8.2258 -7.8491 -7.8491 -7.8369 -7.8369 -7.4788 -7.4788 -7.4676 -7.4676 -7.2551 -7.2551 -7.2452 -7.2452 -6.5488 -6.5488 -6.5324 -6.5324 0.3280 0.3280 0.3786 0.3786 1.5295 1.5295 1.6034 1.6034 2.2227 2.2227 2.2586 2.2586 2.4027 2.4027 2.5051 2.5051 4.5025 4.5025 4.5202 4.5202 4.8125 4.8125 4.8310 4.8310 9.0926 9.0926 9.1834 9.1834 12.9909 12.9909 13.0263 13.0263 14.0315 14.0317 k = 0.5000-0.0000 0.2088 ( 5092 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8518 -8.8518 -8.8518 -8.8518 -8.2352 -8.2352 -8.2352 -8.2352 -7.8428 -7.8428 -7.8428 -7.8428 -7.4733 -7.4733 -7.4733 -7.4733 -7.2503 -7.2503 -7.2503 -7.2503 -6.5401 -6.5401 -6.5401 -6.5401 0.3520 0.3520 0.3520 0.3520 1.5656 1.5656 1.5656 1.5656 2.2386 2.2386 2.2386 2.2386 2.4537 2.4537 2.4537 2.4537 4.5121 4.5121 4.5121 4.5121 4.8224 4.8224 4.8224 4.8224 9.1362 9.1362 9.1362 9.1362 13.0109 13.0109 13.0109 13.0109 14.0362 14.0362 k = 0.5000-0.0000 0.2088 ( 5092 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8518 -8.8518 -8.8518 -8.8518 -8.2352 -8.2352 -8.2352 -8.2352 -7.8428 -7.8428 -7.8428 -7.8428 -7.4733 -7.4733 -7.4733 -7.4733 -7.2503 -7.2503 -7.2503 -7.2503 -6.5401 -6.5401 -6.5401 -6.5401 0.3520 0.3520 0.3520 0.3520 1.5656 1.5656 1.5656 1.5656 2.2386 2.2386 2.2386 2.2386 2.4537 2.4537 2.4537 2.4537 4.5121 4.5121 4.5121 4.5121 4.8224 4.8224 4.8224 4.8224 9.1362 9.1362 9.1362 9.1362 13.0109 13.0109 13.0109 13.0109 14.0362 14.0362 k = 0.5000 0.0114 0.2088 ( 5088 PWs) bands (ev): -12.4365 -12.4365 -12.4356 -12.4356 -8.8518 -8.8518 -8.8514 -8.8514 -8.2412 -8.2412 -8.2291 -8.2291 -7.8443 -7.8443 -7.8413 -7.8413 -7.4777 -7.4777 -7.4689 -7.4689 -7.2511 -7.2511 -7.2493 -7.2493 -6.5421 -6.5421 -6.5382 -6.5382 0.3493 0.3493 0.3500 0.3500 1.5543 1.5543 1.5670 1.5670 2.2341 2.2341 2.2400 2.2400 2.4538 2.4538 2.4729 2.4729 4.5085 4.5085 4.5145 4.5145 4.8178 4.8178 4.8239 4.8239 9.1357 9.1357 9.1371 9.1371 13.0115 13.0115 13.0137 13.0137 14.0142 14.0165 k = 0.5000 0.0229 0.2088 ( 5088 PWs) bands (ev): -12.4362 -12.4362 -12.4344 -12.4344 -8.8517 -8.8517 -8.8509 -8.8509 -8.2472 -8.2472 -8.2230 -8.2230 -7.8459 -7.8459 -7.8398 -7.8398 -7.4821 -7.4821 -7.4646 -7.4646 -7.2517 -7.2517 -7.2482 -7.2482 -6.5443 -6.5443 -6.5365 -6.5365 0.3420 0.3420 0.3434 0.3434 1.5342 1.5342 1.5585 1.5585 2.2284 2.2284 2.2375 2.2375 2.4738 2.4738 2.5084 2.5084 4.5037 4.5037 4.5157 4.5157 4.8102 4.8102 4.8224 4.8224 9.1356 9.1356 9.1385 9.1385 13.0156 13.0156 13.0199 13.0199 13.9678 13.9679 k = 0.5000 0.0343 0.2088 ( 5084 PWs) bands (ev): -12.4353 -12.4353 -12.4327 -12.4327 -8.8513 -8.8513 -8.8501 -8.8501 -8.2530 -8.2530 -8.2168 -8.2168 -7.8475 -7.8475 -7.8384 -7.8384 -7.4864 -7.4864 -7.4604 -7.4604 -7.2523 -7.2523 -7.2470 -7.2470 -6.5467 -6.5467 -6.5349 -6.5349 0.3298 0.3298 0.3321 0.3321 1.5077 1.5077 1.5418 1.5418 2.2231 2.2231 2.2326 2.2326 2.5109 2.5109 2.5564 2.5564 4.4976 4.4976 4.5157 4.5157 4.7997 4.7997 4.8181 4.8181 9.1359 9.1359 9.1402 9.1402 13.0230 13.0230 13.0291 13.0291 13.9013 13.9013 k = 0.5000 0.0457 0.2088 ( 5084 PWs) bands (ev): -12.4339 -12.4339 -12.4305 -12.4305 -8.8507 -8.8507 -8.8491 -8.8491 -8.2586 -8.2586 -8.2107 -8.2107 -7.8490 -7.8490 -7.8371 -7.8371 -7.4906 -7.4906 -7.4564 -7.4564 -7.2528 -7.2528 -7.2457 -7.2457 -6.5492 -6.5492 -6.5337 -6.5337 0.3128 0.3128 0.3161 0.3161 1.4773 1.4773 1.5190 1.5190 2.2187 2.2187 2.2267 2.2267 2.5613 2.5613 2.6139 2.6139 4.4900 4.4900 4.5144 4.5144 4.7863 4.7863 4.8112 4.8112 9.1367 9.1367 9.1424 9.1424 13.0332 13.0332 13.0410 13.0410 13.8190 13.8190 k = 0.5000 0.0572 0.2088 ( 5084 PWs) bands (ev): -12.4321 -12.4321 -12.4278 -12.4278 -8.8499 -8.8499 -8.8479 -8.8479 -8.2641 -8.2641 -8.2046 -8.2046 -7.8506 -7.8506 -7.8358 -7.8358 -7.4947 -7.4947 -7.4525 -7.4525 -7.2532 -7.2532 -7.2441 -7.2441 -6.5518 -6.5518 -6.5326 -6.5326 0.2908 0.2908 0.2953 0.2953 1.4452 1.4452 1.4927 1.4927 2.2151 2.2151 2.2209 2.2209 2.6217 2.6217 2.6788 2.6788 4.4809 4.4809 4.5119 4.5119 4.7705 4.7705 4.8019 4.8019 9.1378 9.1378 9.1450 9.1450 13.0459 13.0459 13.0547 13.0547 13.7252 13.7252 k = 0.5000 0.0686 0.2088 ( 5080 PWs) bands (ev): -12.4297 -12.4297 -12.4246 -12.4246 -8.8488 -8.8488 -8.8464 -8.8464 -8.2694 -8.2694 -8.1986 -8.1986 -7.8522 -7.8522 -7.8347 -7.8347 -7.4987 -7.4987 -7.4488 -7.4488 -7.2536 -7.2536 -7.2424 -7.2424 -6.5545 -6.5545 -6.5317 -6.5317 0.2638 0.2638 0.2696 0.2696 1.4137 1.4137 1.4652 1.4652 2.2121 2.2121 2.2153 2.2153 2.6893 2.6893 2.7490 2.7490 4.4702 4.4702 4.5078 4.5078 4.7524 4.7524 4.7906 4.7906 9.1394 9.1394 9.1480 9.1480 13.0604 13.0604 13.0696 13.0696 13.6233 13.6233 k = 0.5000 0.0800 0.2088 ( 5076 PWs) bands (ev): -12.4268 -12.4268 -12.4209 -12.4209 -8.8475 -8.8475 -8.8447 -8.8447 -8.2744 -8.2744 -8.1928 -8.1928 -7.8537 -7.8537 -7.8335 -7.8335 -7.5024 -7.5024 -7.4454 -7.4454 -7.2540 -7.2540 -7.2406 -7.2406 -6.5573 -6.5573 -6.5311 -6.5311 0.2318 0.2318 0.2391 0.2391 1.3841 1.3841 1.4382 1.4382 2.2095 2.2095 2.2101 2.2101 2.7622 2.7622 2.8233 2.8233 4.4578 4.4578 4.5021 4.5021 4.7327 4.7327 4.7777 4.7777 9.1413 9.1413 9.1514 9.1514 13.0759 13.0759 13.0841 13.0841 13.5167 13.5167 k = 0.5000 0.0915 0.2088 ( 5076 PWs) bands (ev): -12.4235 -12.4235 -12.4169 -12.4169 -8.8461 -8.8461 -8.8428 -8.8428 -8.2791 -8.2791 -8.1871 -8.1871 -7.8553 -7.8553 -7.8326 -7.8326 -7.5058 -7.5058 -7.4421 -7.4421 -7.2543 -7.2543 -7.2387 -7.2387 -6.5603 -6.5603 -6.5307 -6.5307 0.1949 0.1949 0.2039 0.2039 1.3577 1.3577 1.4132 1.4132 2.2051 2.2051 2.2071 2.2071 2.8390 2.8390 2.9005 2.9005 4.4434 4.4434 4.4942 4.4942 4.7119 4.7119 4.7635 4.7635 9.1436 9.1436 9.1552 9.1552 13.0914 13.0914 13.0960 13.0960 13.4089 13.4089 k = 0.5000 0.1029 0.2088 ( 5068 PWs) bands (ev): -12.4198 -12.4198 -12.4124 -12.4124 -8.8444 -8.8444 -8.8407 -8.8407 -8.2835 -8.2835 -8.1815 -8.1815 -7.8568 -7.8568 -7.8317 -7.8317 -7.5089 -7.5089 -7.4391 -7.4391 -7.2547 -7.2547 -7.2366 -7.2366 -6.5632 -6.5632 -6.5305 -6.5305 0.1536 0.1536 0.1643 0.1643 1.3350 1.3350 1.3912 1.3912 2.2001 2.2001 2.2048 2.2048 2.9184 2.9184 2.9796 2.9796 4.4270 4.4270 4.4839 4.4839 4.6907 4.6907 4.7485 4.7485 9.1463 9.1463 9.1593 9.1593 13.0996 13.0996 13.1053 13.1053 13.3066 13.3066 k = 0.5000 0.1143 0.2088 ( 5080 PWs) bands (ev): -12.4156 -12.4156 -12.4076 -12.4076 -8.8426 -8.8426 -8.8385 -8.8385 -8.2878 -8.2878 -8.1764 -8.1764 -7.8583 -7.8583 -7.8311 -7.8311 -7.5117 -7.5117 -7.4364 -7.4364 -7.2552 -7.2552 -7.2345 -7.2345 -6.5663 -6.5663 -6.5308 -6.5308 0.1081 0.1081 0.1205 0.1205 1.3165 1.3165 1.3727 1.3727 2.1952 2.1952 2.2023 2.2023 2.9995 2.9995 3.0598 3.0598 4.4086 4.4086 4.4706 4.4706 4.6700 4.6700 4.7331 4.7331 9.1494 9.1494 9.1639 9.1639 13.0755 13.0755 13.1116 13.1116 13.2294 13.2294 k = 0.5000 0.1258 0.2088 ( 5084 PWs) bands (ev): -12.4111 -12.4111 -12.4024 -12.4024 -8.8406 -8.8406 -8.8360 -8.8360 -8.2915 -8.2915 -8.1713 -8.1713 -7.8598 -7.8598 -7.8305 -7.8305 -7.5140 -7.5140 -7.4338 -7.4338 -7.2557 -7.2557 -7.2323 -7.2323 -6.5694 -6.5694 -6.5312 -6.5312 0.0590 0.0590 0.0731 0.0731 1.3023 1.3023 1.3580 1.3580 2.1901 2.1901 2.1996 2.1996 3.0816 3.0816 3.1406 3.1406 4.3880 4.3880 4.4538 4.4538 4.6507 4.6507 4.7177 4.7177 9.1529 9.1529 9.1688 9.1688 13.0008 13.0008 13.0727 13.0727 13.1720 13.1720 k = 0.5000 0.1372 0.2088 ( 5084 PWs) bands (ev): -12.4061 -12.4061 -12.3969 -12.3969 -8.8384 -8.8384 -8.8334 -8.8334 -8.2949 -8.2949 -8.1665 -8.1665 -7.8613 -7.8613 -7.8301 -7.8301 -7.5159 -7.5159 -7.4315 -7.4315 -7.2563 -7.2563 -7.2301 -7.2301 -6.5726 -6.5726 -6.5320 -6.5320 0.0070 0.0070 0.0226 0.0226 1.2922 1.2922 1.3472 1.3472 2.1848 2.1848 2.1966 2.1966 3.1641 3.1641 3.2213 3.2213 4.3654 4.3654 4.4331 4.4331 4.6334 4.6334 4.7026 4.7026 9.1568 9.1568 9.1741 9.1741 12.8983 12.8983 12.9717 12.9717 13.1687 13.1687 k = 0.5000 0.1486 0.2088 ( 5092 PWs) bands (ev): -12.4009 -12.4009 -12.3911 -12.3911 -8.8361 -8.8361 -8.8307 -8.8307 -8.2979 -8.2979 -8.1621 -8.1621 -7.8627 -7.8627 -7.8299 -7.8299 -7.5172 -7.5172 -7.4295 -7.4295 -7.2570 -7.2570 -7.2279 -7.2279 -6.5758 -6.5758 -6.5330 -6.5330 -0.0475 -0.0475 -0.0305 -0.0305 1.2861 1.2861 1.3403 1.3403 2.1792 2.1792 2.1933 2.1933 3.2463 3.2463 3.3014 3.3014 4.3410 4.3410 4.4086 4.4086 4.6186 4.6186 4.6882 4.6882 9.1610 9.1610 9.1797 9.1797 12.7884 12.7884 12.8593 12.8593 13.1758 13.1758 k = 0.5000 0.1601 0.2088 ( 5088 PWs) bands (ev): -12.3953 -12.3953 -12.3851 -12.3851 -8.8337 -8.8337 -8.8278 -8.8278 -8.3004 -8.3004 -8.1579 -8.1579 -7.8640 -7.8640 -7.8298 -7.8298 -7.5180 -7.5180 -7.4275 -7.4275 -7.2578 -7.2578 -7.2256 -7.2256 -6.5791 -6.5791 -6.5344 -6.5344 -0.1037 -0.1037 -0.0856 -0.0856 1.2836 1.2836 1.3369 1.3369 2.1732 2.1732 2.1895 2.1895 3.3278 3.3278 3.3803 3.3803 4.3149 4.3149 4.3805 4.3805 4.6063 4.6063 4.6745 4.6745 9.1657 9.1657 9.1858 9.1858 12.6770 12.6770 12.7459 12.7459 13.1831 13.1831 k = 0.5000 0.1715 0.2088 ( 5092 PWs) bands (ev): -12.3895 -12.3895 -12.3789 -12.3789 -8.8311 -8.8311 -8.8248 -8.8248 -8.3025 -8.3025 -8.1542 -8.1542 -7.8653 -7.8653 -7.8298 -7.8298 -7.5183 -7.5183 -7.4258 -7.4258 -7.2586 -7.2586 -7.2235 -7.2235 -6.5823 -6.5823 -6.5360 -6.5360 -0.1611 -0.1611 -0.1420 -0.1420 1.2845 1.2845 1.3370 1.3370 2.1667 2.1667 2.1852 2.1852 3.4082 3.4082 3.4576 3.4576 4.2876 4.2876 4.3493 4.3493 4.5964 4.5964 4.6618 4.6618 9.1707 9.1707 9.1922 9.1922 12.5662 12.5662 12.6336 12.6336 13.1891 13.1891 k = 0.5000 0.1829 0.2088 ( 5092 PWs) bands (ev): -12.3835 -12.3835 -12.3725 -12.3725 -8.8285 -8.8285 -8.8218 -8.8218 -8.3041 -8.3041 -8.1509 -8.1509 -7.8666 -7.8666 -7.8301 -7.8301 -7.5179 -7.5179 -7.4243 -7.4243 -7.2596 -7.2596 -7.2214 -7.2214 -6.5856 -6.5856 -6.5380 -6.5380 -0.2191 -0.2191 -0.1994 -0.1994 1.2885 1.2885 1.3401 1.3401 2.1597 2.1597 2.1804 2.1804 3.4869 3.4869 3.5326 3.5326 4.2595 4.2595 4.3159 4.3159 4.5886 4.5886 4.6501 4.6501 9.1762 9.1762 9.1989 9.1989 12.4571 12.4571 12.5231 12.5231 13.1934 13.1934 k = 0.5000 0.1944 0.2088 ( 5100 PWs) bands (ev): -12.3772 -12.3772 -12.3659 -12.3659 -8.8257 -8.8257 -8.8187 -8.8187 -8.3053 -8.3053 -8.1479 -8.1479 -7.8678 -7.8678 -7.8307 -7.8307 -7.5169 -7.5169 -7.4229 -7.4229 -7.2607 -7.2607 -7.2196 -7.2196 -6.5888 -6.5888 -6.5403 -6.5403 -0.2772 -0.2772 -0.2571 -0.2571 1.2953 1.2953 1.3461 1.3461 2.1521 2.1521 2.1749 2.1749 3.5637 3.5637 3.6047 3.6047 4.2313 4.2313 4.2807 4.2807 4.5827 4.5827 4.6396 4.6396 9.1820 9.1820 9.2060 9.2060 12.3501 12.3501 12.4149 12.4149 13.1962 13.1962 k = 0.5000 0.2058 0.2088 ( 5100 PWs) bands (ev): -12.3709 -12.3709 -12.3593 -12.3593 -8.8229 -8.8229 -8.8155 -8.8155 -8.3058 -8.3058 -8.1454 -8.1454 -7.8689 -7.8689 -7.8313 -7.8313 -7.5153 -7.5153 -7.4215 -7.4215 -7.2619 -7.2619 -7.2179 -7.2179 -6.5920 -6.5920 -6.5429 -6.5429 -0.3349 -0.3349 -0.3146 -0.3146 1.3044 1.3044 1.3546 1.3546 2.1440 2.1440 2.1688 2.1688 3.6381 3.6381 3.6731 3.6731 4.2037 4.2037 4.2445 4.2445 4.5784 4.5784 4.6303 4.6303 9.1883 9.1883 9.2135 9.2135 12.2457 12.2457 12.3093 12.3093 13.1976 13.1976 k = 0.5000 0.2172 0.2088 ( 5100 PWs) bands (ev): -12.3644 -12.3644 -12.3527 -12.3527 -8.8200 -8.8200 -8.8123 -8.8123 -8.3059 -8.3059 -8.1434 -8.1434 -7.8699 -7.8699 -7.8322 -7.8322 -7.5131 -7.5131 -7.4203 -7.4203 -7.2632 -7.2632 -7.2165 -7.2165 -6.5951 -6.5951 -6.5457 -6.5457 -0.3919 -0.3919 -0.3716 -0.3716 1.3158 1.3158 1.3654 1.3654 2.1352 2.1352 2.1620 2.1620 3.7097 3.7097 3.7364 3.7364 4.1779 4.1779 4.2077 4.2077 4.5758 4.5758 4.6224 4.6224 9.1951 9.1951 9.2213 9.2213 12.1442 12.1442 12.2066 12.2066 13.1981 13.1981 k = 0.5000 0.2287 0.2088 ( 5100 PWs) bands (ev): -12.3578 -12.3578 -12.3460 -12.3460 -8.8171 -8.8171 -8.8091 -8.8091 -8.3054 -8.3054 -8.1418 -8.1418 -7.8708 -7.8708 -7.8333 -7.8333 -7.5102 -7.5102 -7.4192 -7.4192 -7.2646 -7.2646 -7.2154 -7.2154 -6.5981 -6.5981 -6.5488 -6.5488 -0.4478 -0.4478 -0.4277 -0.4277 1.3292 1.3292 1.3782 1.3782 2.1257 2.1257 2.1544 2.1544 3.7780 3.7780 3.7931 3.7931 4.1556 4.1556 4.1708 4.1708 4.5749 4.5749 4.6160 4.6160 9.2022 9.2022 9.2294 9.2294 12.0459 12.0459 12.1071 12.1071 13.1980 13.1980 k = 0.5000 0.2401 0.2088 ( 5100 PWs) bands (ev): -12.3512 -12.3512 -12.3395 -12.3395 -8.8142 -8.8142 -8.8059 -8.8059 -8.3044 -8.3044 -8.1407 -8.1407 -7.8717 -7.8717 -7.8345 -7.8345 -7.5068 -7.5068 -7.4181 -7.4181 -7.2661 -7.2661 -7.2146 -7.2146 -6.6011 -6.6011 -6.5522 -6.5522 -0.5022 -0.5022 -0.4825 -0.4825 1.3443 1.3443 1.3928 1.3928 2.1155 2.1155 2.1460 2.1460 3.8402 3.8402 3.8425 3.8425 4.1344 4.1344 4.1394 4.1394 4.5756 4.5756 4.6113 4.6113 9.2098 9.2098 9.2379 9.2379 11.9510 11.9510 12.0109 12.0109 13.1978 13.1978 k = 0.5000 0.2515 0.2088 ( 5096 PWs) bands (ev): -12.3446 -12.3446 -12.3329 -12.3329 -8.8112 -8.8112 -8.8028 -8.8028 -8.3028 -8.3028 -8.1402 -8.1402 -7.8724 -7.8724 -7.8358 -7.8358 -7.5027 -7.5027 -7.4171 -7.4171 -7.2677 -7.2677 -7.2141 -7.2141 -6.6039 -6.6039 -6.5557 -6.5557 -0.5549 -0.5549 -0.5357 -0.5357 1.3609 1.3609 1.4090 1.4090 2.1046 2.1046 2.1369 2.1369 3.8739 3.8739 3.9025 3.9025 4.0989 4.0989 4.1331 4.1331 4.5782 4.5782 4.6085 4.6085 9.2179 9.2179 9.2466 9.2466 11.8598 11.8598 11.9182 11.9182 13.1979 13.1979 k = 0.5000 0.2630 0.2088 ( 5088 PWs) bands (ev): -12.3381 -12.3381 -12.3266 -12.3266 -8.8083 -8.8083 -8.7997 -8.7997 -8.3006 -8.3006 -8.1401 -8.1401 -7.8730 -7.8730 -7.8374 -7.8374 -7.4981 -7.4981 -7.4162 -7.4162 -7.2692 -7.2692 -7.2140 -7.2140 -6.6066 -6.6066 -6.5594 -6.5594 -0.6056 -0.6056 -0.5870 -0.5870 1.3788 1.3788 1.4266 1.4266 2.0929 2.0929 2.1269 2.1269 3.8912 3.8912 3.9565 3.9565 4.0658 4.0658 4.1396 4.1396 4.5828 4.5828 4.6078 4.6078 9.2263 9.2263 9.2556 9.2556 11.7723 11.7723 11.8292 11.8292 13.1986 13.1986 k = 0.5000 0.2744 0.2088 ( 5096 PWs) bands (ev): -12.3316 -12.3316 -12.3204 -12.3204 -8.8054 -8.8054 -8.7968 -8.7968 -8.2979 -8.2979 -8.1407 -8.1407 -7.8736 -7.8736 -7.8391 -7.8391 -7.4930 -7.4930 -7.4153 -7.4153 -7.2709 -7.2709 -7.2144 -7.2144 -6.6092 -6.6092 -6.5634 -6.5634 -0.6541 -0.6541 -0.6363 -0.6363 1.3979 1.3979 1.4455 1.4455 2.0805 2.0805 2.1160 2.1160 3.8927 3.8927 3.9949 3.9949 4.0447 4.0447 4.1577 4.1577 4.5896 4.5896 4.6096 4.6096 9.2351 9.2351 9.2647 9.2647 11.6888 11.6888 11.7440 11.7440 13.1987 13.1987 k = 0.5000 0.2858 0.2088 ( 5096 PWs) bands (ev): -12.3253 -12.3253 -12.3144 -12.3144 -8.8025 -8.8025 -8.7940 -8.7940 -8.2947 -8.2947 -8.1418 -8.1418 -7.8740 -7.8740 -7.8409 -7.8409 -7.4875 -7.4875 -7.4144 -7.4144 -7.2726 -7.2726 -7.2151 -7.2151 -6.6116 -6.6116 -6.5675 -6.5675 -0.7002 -0.7002 -0.6833 -0.6833 1.4180 1.4180 1.4653 1.4653 2.0673 2.0673 2.1043 2.1043 3.8834 3.8834 3.9844 3.9844 4.0685 4.0685 4.1823 4.1823 4.5988 4.5988 4.6142 4.6142 9.2443 9.2443 9.2740 9.2740 11.6095 11.6095 11.6628 11.6628 13.2004 13.2004 k = 0.5000 0.2973 0.2088 ( 5096 PWs) bands (ev): -12.3192 -12.3192 -12.3087 -12.3087 -8.7998 -8.7998 -8.7913 -8.7913 -8.2909 -8.2909 -8.1434 -8.1434 -7.8744 -7.8744 -7.8427 -7.8427 -7.4815 -7.4815 -7.4135 -7.4135 -7.2742 -7.2742 -7.2163 -7.2163 -6.6138 -6.6138 -6.5717 -6.5717 -0.7437 -0.7437 -0.7278 -0.7278 1.4390 1.4390 1.4860 1.4860 2.0535 2.0535 2.0917 2.0917 3.8681 3.8681 3.9561 3.9561 4.1063 4.1063 4.2085 4.2085 4.6103 4.6103 4.6218 4.6218 9.2537 9.2537 9.2833 9.2833 11.5346 11.5346 11.5858 11.5858 13.2039 13.2039 k = 0.5000 0.3087 0.2088 ( 5096 PWs) bands (ev): -12.3133 -12.3133 -12.3033 -12.3033 -8.7971 -8.7971 -8.7888 -8.7888 -8.2867 -8.2867 -8.1457 -8.1457 -7.8746 -7.8746 -7.8447 -7.8447 -7.4753 -7.4753 -7.4128 -7.4128 -7.2756 -7.2756 -7.2180 -7.2180 -6.6157 -6.6157 -6.5759 -6.5759 -0.7845 -0.7845 -0.7696 -0.7696 1.4606 1.4606 1.5074 1.5074 2.0390 2.0390 2.0783 2.0783 3.8501 3.8501 3.9269 3.9269 4.1411 4.1411 4.2330 4.2330 4.6241 4.6241 4.6324 4.6324 9.2634 9.2634 9.2927 9.2927 11.4642 11.4642 11.5131 11.5131 13.2095 13.2095 k = 0.5000 0.3201 0.2088 ( 5096 PWs) bands (ev): -12.3077 -12.3077 -12.2982 -12.2982 -8.7945 -8.7945 -8.7865 -8.7865 -8.2819 -8.2819 -8.1484 -8.1484 -7.8747 -7.8747 -7.8467 -7.8467 -7.4689 -7.4689 -7.4120 -7.4120 -7.2770 -7.2770 -7.2201 -7.2201 -6.6175 -6.6175 -6.5801 -6.5801 -0.8224 -0.8224 -0.8086 -0.8086 1.4829 1.4829 1.5292 1.5292 2.0238 2.0238 2.0641 2.0641 3.8313 3.8313 3.8988 3.8988 4.1713 4.1713 4.2540 4.2540 4.6399 4.6399 4.6458 4.6458 9.2733 9.2733 9.3018 9.3018 11.3986 11.3986 11.4450 11.4450 13.2173 13.2173 k = 0.5000 0.3316 0.2088 ( 5092 PWs) bands (ev): -12.3024 -12.3024 -12.2935 -12.2935 -8.7919 -8.7919 -8.7843 -8.7843 -8.2767 -8.2767 -8.1517 -8.1517 -7.8747 -7.8747 -7.8488 -7.8488 -7.4623 -7.4623 -7.4113 -7.4113 -7.2781 -7.2781 -7.2227 -7.2227 -6.6190 -6.6190 -6.5843 -6.5843 -0.8573 -0.8573 -0.8447 -0.8447 1.5055 1.5055 1.5514 1.5514 2.0082 2.0082 2.0491 2.0491 3.8128 3.8128 3.8723 3.8723 4.1969 4.1969 4.2710 4.2710 4.6573 4.6573 4.6615 4.6615 9.2832 9.2832 9.3108 9.3108 11.3380 11.3380 11.3815 11.3815 13.2274 13.2274 k = 0.5000 0.3430 0.2088 ( 5096 PWs) bands (ev): -12.2974 -12.2974 -12.2892 -12.2892 -8.7896 -8.7896 -8.7824 -8.7824 -8.2711 -8.2711 -8.1556 -8.1556 -7.8746 -7.8746 -7.8509 -7.8509 -7.4558 -7.4558 -7.4106 -7.4106 -7.2789 -7.2789 -7.2257 -7.2257 -6.6202 -6.6202 -6.5885 -6.5885 -0.8891 -0.8891 -0.8777 -0.8777 1.5283 1.5283 1.5737 1.5737 1.9921 1.9921 2.0333 2.0333 3.7953 3.7953 3.8477 3.8477 4.2182 4.2182 4.2840 4.2840 4.6756 4.6756 4.6788 4.6788 9.2931 9.2931 9.3193 9.3193 11.2825 11.2825 11.3230 11.3230 13.2399 13.2399 k = 0.5000 0.3544 0.2088 ( 5096 PWs) bands (ev): -12.2928 -12.2928 -12.2853 -12.2853 -8.7873 -8.7873 -8.7808 -8.7808 -8.2650 -8.2650 -8.1599 -8.1599 -7.8743 -7.8743 -7.8530 -7.8530 -7.4493 -7.4493 -7.4100 -7.4100 -7.2794 -7.2794 -7.2292 -7.2292 -6.6212 -6.6212 -6.5926 -6.5926 -0.9178 -0.9178 -0.9075 -0.9075 1.5512 1.5512 1.5957 1.5957 1.9757 1.9757 2.0170 2.0170 3.7792 3.7792 3.8251 3.8251 4.2357 4.2357 4.2935 4.2935 4.6941 4.6941 4.6967 4.6967 9.3027 9.3027 9.3273 9.3273 11.2324 11.2324 11.2695 11.2695 13.2546 13.2546 k = 0.5000 0.3659 0.2088 ( 5108 PWs) bands (ev): -12.2885 -12.2885 -12.2819 -12.2819 -8.7853 -8.7853 -8.7793 -8.7793 -8.2587 -8.2587 -8.1648 -8.1648 -7.8740 -7.8740 -7.8551 -7.8551 -7.4431 -7.4431 -7.4096 -7.4096 -7.2796 -7.2796 -7.2332 -7.2332 -6.6218 -6.6218 -6.5965 -6.5965 -0.9431 -0.9431 -0.9341 -0.9341 1.5739 1.5739 1.6173 1.6173 1.9594 1.9594 2.0002 2.0002 3.7649 3.7649 3.8046 3.8046 4.2501 4.2501 4.3001 4.3001 4.7122 4.7122 4.7144 4.7144 9.3121 9.3121 9.3346 9.3346 11.1880 11.1880 11.2213 11.2213 13.2714 13.2714 k = 0.5000 0.3773 0.2088 ( 5108 PWs) bands (ev): -12.2847 -12.2847 -12.2789 -12.2789 -8.7834 -8.7834 -8.7781 -8.7781 -8.2521 -8.2521 -8.1701 -8.1701 -7.8734 -7.8734 -7.8571 -7.8571 -7.4372 -7.4372 -7.4093 -7.4093 -7.2791 -7.2791 -7.2373 -7.2373 -6.6221 -6.6221 -6.6002 -6.6002 -0.9651 -0.9651 -0.9574 -0.9574 1.5964 1.5964 1.6381 1.6381 1.9433 1.9433 1.9830 1.9830 3.7526 3.7526 3.7863 3.7863 4.2619 4.2619 4.3043 4.3043 4.7293 4.7293 4.7312 4.7312 9.3209 9.3209 9.3410 9.3410 11.1493 11.1493 11.1786 11.1786 13.2900 13.2900 k = 0.5000 0.3887 0.2088 ( 5096 PWs) bands (ev): -12.2814 -12.2814 -12.2765 -12.2765 -8.7817 -8.7817 -8.7772 -8.7772 -8.2451 -8.2451 -8.1757 -8.1757 -7.8727 -7.8727 -7.8590 -7.8590 -7.4317 -7.4317 -7.4090 -7.4090 -7.2781 -7.2781 -7.2417 -7.2417 -6.6221 -6.6221 -6.6037 -6.6037 -0.9838 -0.9838 -0.9773 -0.9773 1.6181 1.6181 1.6573 1.6573 1.9281 1.9281 1.9658 1.9658 3.7423 3.7423 3.7702 3.7702 4.2716 4.2716 4.3065 4.3065 4.7447 4.7447 4.7463 4.7463 9.3291 9.3291 9.3465 9.3465 11.1166 11.1166 11.1416 11.1416 13.3097 13.3097 k = 0.5000 0.4002 0.2088 ( 5100 PWs) bands (ev): -12.2785 -12.2785 -12.2745 -12.2745 -8.7802 -8.7802 -8.7765 -8.7765 -8.2380 -8.2380 -8.1819 -8.1819 -7.8719 -7.8719 -7.8609 -7.8609 -7.4268 -7.4268 -7.4091 -7.4091 -7.2765 -7.2765 -7.2463 -7.2463 -6.6218 -6.6218 -6.6069 -6.6069 -0.9990 -0.9990 -0.9938 -0.9938 1.6389 1.6389 1.6744 1.6744 1.9144 1.9144 1.9488 1.9488 3.7343 3.7343 3.7566 3.7566 4.2795 4.2795 4.3073 4.3073 4.7579 4.7579 4.7593 4.7593 9.3365 9.3365 9.3508 9.3508 11.0901 11.0901 11.1104 11.1104 13.3297 13.3297 k = 0.5000 0.4116 0.2088 ( 5092 PWs) bands (ev): -12.2762 -12.2762 -12.2731 -12.2731 -8.7789 -8.7789 -8.7761 -8.7761 -8.2308 -8.2308 -8.1882 -8.1882 -7.8710 -7.8710 -7.8626 -7.8626 -7.4225 -7.4225 -7.4095 -7.4095 -7.2742 -7.2742 -7.2509 -7.2509 -6.6211 -6.6211 -6.6099 -6.6099 -1.0107 -1.0107 -1.0068 -1.0068 1.6580 1.6580 1.6881 1.6881 1.9033 1.9033 1.9326 1.9326 3.7286 3.7286 3.7453 3.7453 4.2862 4.2862 4.3068 4.3068 4.7686 4.7686 4.7697 4.7697 9.3429 9.3429 9.3539 9.3539 11.0699 11.0699 11.0854 11.0854 13.3487 13.3487 k = 0.5000 0.4230 0.2088 ( 5092 PWs) bands (ev): -12.2743 -12.2743 -12.2723 -12.2723 -8.7778 -8.7778 -8.7759 -8.7759 -8.2235 -8.2235 -8.1950 -8.1950 -7.8699 -7.8699 -7.8643 -7.8643 -7.4188 -7.4188 -7.4104 -7.4104 -7.2714 -7.2714 -7.2555 -7.2555 -6.6200 -6.6200 -6.6125 -6.6125 -1.0189 -1.0189 -1.0163 -1.0163 1.6749 1.6749 1.6972 1.6972 1.8961 1.8961 1.9179 1.9179 3.7253 3.7253 3.7364 3.7364 4.2917 4.2917 4.3054 4.3054 4.7765 4.7765 4.7773 4.7773 9.3481 9.3481 9.3556 9.3556 11.0562 11.0562 11.0666 11.0666 13.3650 13.3650 k = 0.5000 0.4345 0.2088 ( 5088 PWs) bands (ev): -12.2730 -12.2730 -12.2720 -12.2720 -8.7769 -8.7769 -8.7760 -8.7760 -8.2162 -8.2162 -8.2019 -8.2019 -7.8687 -7.8687 -7.8659 -7.8659 -7.4158 -7.4158 -7.4116 -7.4116 -7.2680 -7.2680 -7.2600 -7.2600 -6.6187 -6.6187 -6.6149 -6.6149 -1.0235 -1.0235 -1.0223 -1.0223 1.6885 1.6885 1.7005 1.7005 1.8939 1.8939 1.9057 1.9057 3.7244 3.7244 3.7299 3.7299 4.2963 4.2963 4.3031 4.3031 4.7814 4.7814 4.7818 4.7818 9.3521 9.3521 9.3558 9.3558 11.0490 11.0490 11.0542 11.0542 13.3764 13.3764 k = 0.5000 0.4459 0.2088 ( 5088 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7763 -8.7763 -8.7763 -8.7763 -8.2090 -8.2090 -8.2090 -8.2090 -7.8673 -7.8673 -7.8673 -7.8673 -7.4134 -7.4134 -7.4134 -7.4134 -7.2642 -7.2642 -7.2642 -7.2642 -6.6170 -6.6170 -6.6170 -6.6170 -1.0247 -1.0247 -1.0247 -1.0247 1.6974 1.6974 1.6974 1.6974 1.8973 1.8973 1.8973 1.8973 3.7259 3.7259 3.7259 3.7259 4.3001 4.3001 4.3001 4.3001 4.7832 4.7832 4.7832 4.7832 9.3547 9.3547 9.3547 9.3547 11.0483 11.0483 11.0483 11.0483 13.3812 13.3812 k = 0.5000 0.4459 0.2088 ( 5088 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7763 -8.7763 -8.7763 -8.7763 -8.2090 -8.2090 -8.2090 -8.2090 -7.8673 -7.8673 -7.8673 -7.8673 -7.4134 -7.4134 -7.4134 -7.4134 -7.2642 -7.2642 -7.2642 -7.2642 -6.6170 -6.6170 -6.6170 -6.6170 -1.0247 -1.0247 -1.0247 -1.0247 1.6974 1.6974 1.6974 1.6974 1.8973 1.8973 1.8973 1.8973 3.7259 3.7259 3.7259 3.7259 4.3001 4.3001 4.3001 4.3001 4.7832 4.7832 4.7832 4.7832 9.3547 9.3547 9.3547 9.3547 11.0483 11.0483 11.0483 11.0483 13.3812 13.3812 k = 0.4886 0.4459 0.2088 ( 5092 PWs) bands (ev): -12.2727 -12.2727 -12.2720 -12.2720 -8.7776 -8.7776 -8.7762 -8.7762 -8.2101 -8.2101 -8.2073 -8.2073 -7.8732 -7.8732 -7.8618 -7.8618 -7.4146 -7.4146 -7.4120 -7.4120 -7.2655 -7.2655 -7.2627 -7.2627 -6.6228 -6.6228 -6.6131 -6.6131 -1.0233 -1.0233 -1.0225 -1.0225 1.6926 1.6926 1.7054 1.7054 1.8919 1.8919 1.9046 1.9046 3.7221 3.7221 3.7246 3.7246 4.2954 4.2954 4.3063 4.3063 4.7812 4.7812 4.7846 4.7846 9.3525 9.3525 9.3611 9.3611 11.0497 11.0497 11.0509 11.0509 13.3612 13.3612 k = 0.4773 0.4459 0.2088 ( 5104 PWs) bands (ev): -12.2733 -12.2733 -12.2719 -12.2719 -8.7800 -8.7800 -8.7773 -8.7773 -8.2106 -8.2106 -8.2049 -8.2049 -7.8793 -7.8793 -7.8567 -7.8567 -7.4156 -7.4156 -7.4105 -7.4105 -7.2666 -7.2666 -7.2612 -7.2612 -6.6309 -6.6309 -6.6115 -6.6115 -1.0185 -1.0185 -1.0169 -1.0169 1.6910 1.6910 1.7165 1.7165 1.8886 1.8886 1.9138 1.9138 3.7132 3.7132 3.7181 3.7181 4.2921 4.2921 4.3136 4.3136 4.7787 4.7787 4.7853 4.7853 9.3546 9.3546 9.3717 9.3717 11.0551 11.0551 11.0575 11.0575 13.3182 13.3182 k = 0.4659 0.4459 0.2088 ( 5104 PWs) bands (ev): -12.2741 -12.2741 -12.2721 -12.2721 -8.7835 -8.7835 -8.7794 -8.7794 -8.2104 -8.2104 -8.2019 -8.2019 -7.8857 -7.8857 -7.8518 -7.8518 -7.4161 -7.4161 -7.4088 -7.4088 -7.2675 -7.2675 -7.2595 -7.2595 -6.6410 -6.6410 -6.6119 -6.6119 -1.0103 -1.0103 -1.0079 -1.0079 1.6923 1.6923 1.7301 1.7301 1.8878 1.8878 1.9253 1.9253 3.6997 3.6997 3.7064 3.7064 4.2904 4.2904 4.3218 4.3218 4.7757 4.7757 4.7853 4.7853 9.3610 9.3610 9.3866 9.3866 11.0643 11.0643 11.0680 11.0680 13.2627 13.2627 k = 0.4545 0.4459 0.2088 ( 5100 PWs) bands (ev): -12.2751 -12.2751 -12.2724 -12.2724 -8.7879 -8.7879 -8.7827 -8.7827 -8.2097 -8.2097 -8.1983 -8.1983 -7.8923 -7.8923 -7.8472 -7.8472 -7.4163 -7.4163 -7.4070 -7.4070 -7.2680 -7.2680 -7.2577 -7.2577 -6.6530 -6.6530 -6.6142 -6.6142 -0.9986 -0.9986 -0.9955 -0.9955 1.6962 1.6962 1.7453 1.7453 1.8906 1.8906 1.9394 1.9394 3.6819 3.6819 3.6901 3.6901 4.2900 4.2900 4.3305 4.3305 4.7720 4.7720 4.7844 4.7844 9.3716 9.3716 9.4056 9.4056 11.0772 11.0772 11.0821 11.0821 13.2017 13.2017 k = 0.4432 0.4459 0.2088 ( 5108 PWs) bands (ev): -12.2763 -12.2763 -12.2729 -12.2729 -8.7932 -8.7932 -8.7869 -8.7869 -8.2085 -8.2085 -8.1942 -8.1942 -7.8994 -7.8994 -7.8430 -7.8430 -7.4162 -7.4162 -7.4053 -7.4053 -7.2681 -7.2681 -7.2559 -7.2559 -6.6670 -6.6670 -6.6187 -6.6187 -0.9835 -0.9835 -0.9798 -0.9798 1.7020 1.7020 1.7603 1.7603 1.8986 1.8986 1.9565 1.9565 3.6604 3.6604 3.6694 3.6694 4.2908 4.2908 4.3393 4.3393 4.7678 4.7678 4.7825 4.7825 9.3863 9.3863 9.4287 9.4287 11.0933 11.0933 11.0995 11.0995 13.1393 13.1393 k = 0.4318 0.4459 0.2088 ( 5104 PWs) bands (ev): -12.2777 -12.2777 -12.2737 -12.2737 -8.7993 -8.7993 -8.7919 -8.7919 -8.2068 -8.2068 -8.1895 -8.1895 -7.9066 -7.9066 -7.8390 -7.8390 -7.4157 -7.4157 -7.4038 -7.4038 -7.2678 -7.2678 -7.2541 -7.2541 -6.6828 -6.6828 -6.6249 -6.6249 -0.9650 -0.9650 -0.9608 -0.9608 1.7092 1.7092 1.7731 1.7731 1.9137 1.9137 1.9772 1.9772 3.6355 3.6355 3.6449 3.6449 4.2923 4.2923 4.3479 4.3479 4.7629 4.7629 4.7796 4.7796 9.4052 9.4052 9.4557 9.4557 11.1122 11.1122 11.1198 11.1198 13.0782 13.0782 k = 0.4205 0.4459 0.2088 ( 5100 PWs) bands (ev): -12.2792 -12.2792 -12.2746 -12.2746 -8.8060 -8.8060 -8.7977 -8.7977 -8.2047 -8.2047 -8.1845 -8.1845 -7.9142 -7.9142 -7.8354 -7.8354 -7.4148 -7.4148 -7.4024 -7.4024 -7.2671 -7.2671 -7.2523 -7.2523 -6.7003 -6.7003 -6.6331 -6.6331 -0.9434 -0.9434 -0.9386 -0.9386 1.7174 1.7174 1.7823 1.7823 1.9375 1.9375 2.0021 2.0021 3.6078 3.6078 3.6172 3.6172 4.2943 4.2943 4.3560 4.3560 4.7573 4.7573 4.7753 4.7753 9.4280 9.4280 9.4865 9.4865 11.1334 11.1334 11.1424 11.1424 13.0199 13.0199 k = 0.4091 0.4459 0.2088 ( 5104 PWs) bands (ev): -12.2809 -12.2809 -12.2757 -12.2757 -8.8132 -8.8132 -8.8041 -8.8041 -8.2024 -8.2024 -8.1792 -8.1792 -7.9221 -7.9221 -7.8322 -7.8322 -7.4136 -7.4136 -7.4015 -7.4015 -7.2659 -7.2659 -7.2507 -7.2507 -6.7195 -6.7195 -6.6430 -6.6430 -0.9186 -0.9186 -0.9134 -0.9134 1.7258 1.7258 1.7877 1.7877 1.9699 1.9699 2.0315 2.0315 3.5776 3.5776 3.5867 3.5867 4.2966 4.2966 4.3633 4.3633 4.7508 4.7508 4.7697 4.7697 9.4547 9.4547 9.5210 9.5210 11.1562 11.1562 11.1667 11.1667 12.9660 12.9660 k = 0.3977 0.4459 0.2088 ( 5096 PWs) bands (ev): -12.2828 -12.2828 -12.2771 -12.2771 -8.8208 -8.8208 -8.8110 -8.8110 -8.1999 -8.1999 -8.1736 -8.1736 -7.9302 -7.9302 -7.8293 -7.8293 -7.4121 -7.4121 -7.4008 -7.4008 -7.2642 -7.2642 -7.2491 -7.2491 -6.7401 -6.7401 -6.6545 -6.6545 -0.8907 -0.8907 -0.8852 -0.8852 1.7343 1.7343 1.7903 1.7903 2.0100 2.0100 2.0657 2.0657 3.5455 3.5455 3.5539 3.5539 4.2989 4.2989 4.3696 4.3696 4.7434 4.7434 4.7625 4.7625 9.4850 9.4850 9.5589 9.5589 11.1798 11.1798 11.1920 11.1920 12.9174 12.9174 k = 0.3864 0.4459 0.2088 ( 5096 PWs) bands (ev): -12.2849 -12.2849 -12.2786 -12.2786 -8.8285 -8.8285 -8.8183 -8.8183 -8.1972 -8.1972 -8.1679 -8.1679 -7.9386 -7.9386 -7.8267 -7.8267 -7.4103 -7.4103 -7.4006 -7.4006 -7.2620 -7.2620 -7.2477 -7.2477 -6.7621 -6.7621 -6.6676 -6.6676 -0.8599 -0.8599 -0.8542 -0.8542 1.7426 1.7426 1.7909 1.7909 2.0567 2.0567 2.1050 2.1050 3.5118 3.5118 3.5194 3.5194 4.3009 4.3009 4.3747 4.3747 4.7350 4.7350 4.7538 4.7538 9.5187 9.5187 9.6000 9.6000 11.2034 11.2034 11.2172 11.2172 12.8755 12.8755 k = 0.3750 0.4459 0.2088 ( 5096 PWs) bands (ev): -12.2871 -12.2871 -12.2803 -12.2803 -8.8363 -8.8363 -8.8258 -8.8258 -8.1946 -8.1946 -8.1621 -8.1621 -7.9473 -7.9473 -7.8245 -7.8245 -7.4082 -7.4082 -7.4009 -7.4009 -7.2593 -7.2593 -7.2466 -7.2466 -6.7852 -6.7852 -6.6821 -6.6821 -0.8263 -0.8263 -0.8206 -0.8206 1.7506 1.7506 1.7905 1.7905 2.1091 2.1091 2.1492 2.1492 3.4768 3.4768 3.4836 3.4836 4.3025 4.3025 4.3784 4.3784 4.7257 4.7257 4.7433 4.7433 9.5556 9.5556 9.6441 9.6441 11.2260 11.2260 11.2415 11.2415 12.8414 12.8414 k = 0.3636 0.4459 0.2088 ( 5092 PWs) bands (ev): -12.2895 -12.2895 -12.2823 -12.2823 -8.8441 -8.8441 -8.8333 -8.8333 -8.1919 -8.1919 -8.1564 -8.1564 -7.9562 -7.9562 -7.8225 -7.8225 -7.4059 -7.4059 -7.4015 -7.4015 -7.2563 -7.2563 -7.2459 -7.2459 -6.8092 -6.8092 -6.6979 -6.6979 -0.7900 -0.7900 -0.7844 -0.7844 1.7583 1.7583 1.7897 1.7897 2.1664 2.1664 2.1983 2.1983 3.4408 3.4408 3.4468 3.4468 4.3035 4.3035 4.3807 4.3807 4.7153 4.7153 4.7311 4.7311 9.5953 9.5953 9.6906 9.6906 11.2466 11.2466 11.2639 11.2639 12.8162 12.8162 k = 0.3523 0.4459 0.2088 ( 5088 PWs) bands (ev): -12.2921 -12.2921 -12.2844 -12.2844 -8.8516 -8.8516 -8.8408 -8.8408 -8.1893 -8.1893 -8.1507 -8.1507 -7.9653 -7.9653 -7.8209 -7.8209 -7.4035 -7.4035 -7.4027 -7.4027 -7.2528 -7.2528 -7.2455 -7.2455 -6.8340 -6.8340 -6.7148 -6.7148 -0.7513 -0.7513 -0.7460 -0.7460 1.7659 1.7659 1.7888 1.7888 2.2283 2.2283 2.2519 2.2519 3.4042 3.4042 3.4095 3.4095 4.3039 4.3039 4.3814 4.3814 4.7040 4.7040 4.7171 4.7171 9.6374 9.6374 9.7392 9.7392 11.2644 11.2644 11.2834 11.2834 12.8009 12.8009 k = 0.3409 0.4459 0.2088 ( 5084 PWs) bands (ev): -12.2948 -12.2948 -12.2867 -12.2867 -8.8587 -8.8587 -8.8481 -8.8481 -8.1869 -8.1869 -8.1453 -8.1453 -7.9745 -7.9745 -7.8197 -7.8197 -7.4044 -7.4044 -7.4010 -7.4010 -7.2491 -7.2491 -7.2458 -7.2458 -6.8591 -6.8591 -6.7327 -6.7327 -0.7103 -0.7103 -0.7054 -0.7054 1.7735 1.7735 1.7881 1.7881 2.2941 2.2941 2.3099 2.3099 3.3673 3.3673 3.3720 3.3720 4.3033 4.3033 4.3802 4.3802 4.6919 4.6919 4.7013 4.7013 9.6814 9.6814 9.7894 9.7894 11.2784 11.2784 11.2992 11.2992 12.7966 12.7966 k = 0.3295 0.4459 0.2088 ( 5088 PWs) bands (ev): -12.2976 -12.2976 -12.2892 -12.2892 -8.8655 -8.8655 -8.8552 -8.8552 -8.1847 -8.1847 -8.1403 -8.1403 -7.9838 -7.9838 -7.8188 -7.8188 -7.4064 -7.4064 -7.3984 -7.3984 -7.2469 -7.2469 -7.2453 -7.2453 -6.8844 -6.8844 -6.7514 -6.7514 -0.6672 -0.6672 -0.6629 -0.6629 1.7813 1.7813 1.7878 1.7878 2.3635 2.3635 2.3718 2.3718 3.3303 3.3303 3.3348 3.3348 4.3018 4.3018 4.3769 4.3769 4.6792 4.6792 4.6839 4.6839 9.7268 9.7268 9.8406 9.8406 11.2883 11.2883 11.3108 11.3108 12.8037 12.8037 k = 0.3182 0.4459 0.2088 ( 5092 PWs) bands (ev): -12.3006 -12.3006 -12.2919 -12.2919 -8.8716 -8.8716 -8.8618 -8.8618 -8.1828 -8.1828 -8.1357 -8.1357 -7.9930 -7.9930 -7.8183 -7.8183 -7.4090 -7.4090 -7.3958 -7.3958 -7.2489 -7.2489 -7.2413 -7.2413 -6.9093 -6.9093 -6.7708 -6.7708 -0.6223 -0.6223 -0.6188 -0.6188 1.7883 1.7883 1.7895 1.7895 2.4359 2.4359 2.4372 2.4372 3.2935 3.2935 3.2982 3.2982 4.2991 4.2991 4.3714 4.3714 4.6649 4.6649 4.6662 4.6662 9.7729 9.7729 9.8921 9.8921 11.2939 11.2939 11.3180 11.3180 12.8227 12.8227 k = 0.3068 0.4459 0.2088 ( 5092 PWs) bands (ev): -12.3037 -12.3037 -12.2948 -12.2948 -8.8771 -8.8771 -8.8679 -8.8679 -8.1812 -8.1812 -8.1319 -8.1319 -8.0020 -8.0020 -7.8181 -7.8181 -7.4119 -7.4119 -7.3931 -7.3931 -7.2522 -7.2522 -7.2373 -7.2373 -6.9335 -6.9335 -6.7906 -6.7906 -0.5758 -0.5758 -0.5732 -0.5732 1.7897 1.7897 1.7985 1.7985 2.5056 2.5056 2.5108 2.5108 3.2573 3.2573 3.2627 3.2627 4.2951 4.2951 4.3632 4.3632 4.6446 4.6446 4.6532 4.6532 9.8189 9.8189 9.9429 9.9429 11.2955 11.2955 11.3212 11.3212 12.8534 12.8534 k = 0.2955 0.4459 0.2088 ( 5088 PWs) bands (ev): -12.3069 -12.3069 -12.2978 -12.2978 -8.8818 -8.8818 -8.8734 -8.8734 -8.1798 -8.1798 -8.1290 -8.1290 -8.0106 -8.0106 -7.8183 -7.8183 -7.4151 -7.4151 -7.3906 -7.3906 -7.2570 -7.2570 -7.2335 -7.2335 -6.9565 -6.9565 -6.8107 -6.8107 -0.5280 -0.5280 -0.5265 -0.5265 1.7923 1.7923 1.8084 1.8084 2.5764 2.5764 2.5873 2.5873 3.2220 3.2220 3.2291 3.2291 4.2894 4.2894 4.3521 4.3521 4.6232 4.6232 4.6407 4.6407 9.8639 9.8639 9.9923 9.9923 11.2937 11.2937 11.3210 11.3210 12.8957 12.8957 k = 0.2841 0.4459 0.2088 ( 5084 PWs) bands (ev): -12.3102 -12.3102 -12.3009 -12.3009 -8.8857 -8.8857 -8.8782 -8.8782 -8.1789 -8.1789 -8.1273 -8.1273 -8.0183 -8.0183 -7.8187 -7.8187 -7.4186 -7.4186 -7.3882 -7.3882 -7.2636 -7.2636 -7.2298 -7.2298 -6.9780 -6.9780 -6.8310 -6.8310 -0.4790 -0.4790 -0.4788 -0.4788 1.7962 1.7962 1.8194 1.8194 2.6489 2.6489 2.6641 2.6641 3.1882 3.1882 3.1986 3.1986 4.2818 4.2818 4.3378 4.3378 4.6012 4.6012 4.6291 4.6291 9.9070 9.9070 10.0389 10.0389 11.2896 11.2896 11.3187 11.3187 12.9486 12.9486 k = 0.2727 0.4459 0.2088 ( 5084 PWs) bands (ev): -12.3135 -12.3135 -12.3042 -12.3042 -8.8887 -8.8887 -8.8823 -8.8823 -8.1784 -8.1784 -8.1273 -8.1273 -8.0250 -8.0250 -7.8196 -7.8196 -7.4225 -7.4225 -7.3859 -7.3859 -7.2723 -7.2723 -7.2264 -7.2264 -6.9973 -6.9973 -6.8511 -6.8511 -0.4306 -0.4306 -0.4294 -0.4294 1.8016 1.8016 1.8317 1.8317 2.7217 2.7217 2.7389 2.7389 3.1567 3.1567 3.1731 3.1731 4.2720 4.2720 4.3200 4.3200 4.5790 4.5790 4.6189 4.6189 9.9470 9.9470 10.0817 10.0817 11.2845 11.2845 11.3155 11.3155 13.0115 13.0115 k = 0.2614 0.4459 0.2088 ( 5092 PWs) bands (ev): -12.3170 -12.3170 -12.3076 -12.3076 -8.8908 -8.8908 -8.8856 -8.8856 -8.1783 -8.1783 -8.1294 -8.1294 -8.0302 -8.0302 -7.8209 -7.8209 -7.4267 -7.4267 -7.3840 -7.3840 -7.2832 -7.2832 -7.2236 -7.2236 -7.0142 -7.0142 -6.8710 -6.8710 -0.3820 -0.3820 -0.3792 -0.3792 1.8089 1.8089 1.8457 1.8457 2.7928 2.7928 2.8076 2.8076 3.1293 3.1293 3.1566 3.1566 4.2593 4.2593 4.2988 4.2988 4.5571 4.5571 4.6102 4.6102 9.9828 9.9828 10.1192 10.1192 11.2797 11.2797 11.3131 11.3131 13.0832 13.0832 k = 0.2500 0.4459 0.2088 ( 5092 PWs) bands (ev): -12.3205 -12.3205 -12.3111 -12.3111 -8.8919 -8.8919 -8.8881 -8.8881 -8.1787 -8.1787 -8.1337 -8.1337 -8.0337 -8.0337 -7.8226 -7.8226 -7.4311 -7.4311 -7.3826 -7.3826 -7.2960 -7.2960 -7.2212 -7.2212 -7.0283 -7.0283 -6.8904 -6.8904 -0.3335 -0.3335 -0.3290 -0.3290 1.8181 1.8181 1.8615 1.8615 2.8579 2.8579 2.8623 2.8623 3.1099 3.1099 3.1567 3.1567 4.2435 4.2435 4.2742 4.2742 4.5363 4.5363 4.6034 4.6034 10.0131 10.0131 10.1502 10.1502 11.2767 11.2767 11.3130 11.3130 13.1628 13.1628 k = 0.2386 0.4459 0.2088 ( 5092 PWs) bands (ev): -12.3241 -12.3241 -12.3147 -12.3147 -8.8919 -8.8919 -8.8897 -8.8897 -8.1797 -8.1797 -8.1402 -8.1402 -8.0353 -8.0353 -7.8248 -7.8248 -7.4358 -7.4358 -7.3820 -7.3820 -7.3103 -7.3103 -7.2195 -7.2195 -7.0398 -7.0398 -6.9091 -6.9091 -0.2852 -0.2852 -0.2790 -0.2790 1.8296 1.8296 1.8793 1.8793 2.8934 2.8934 2.9071 2.9071 3.1077 3.1077 3.1825 3.1825 4.2242 4.2242 4.2465 4.2465 4.5172 4.5172 4.5985 4.5985 10.0369 10.0369 10.1733 10.1733 11.2768 11.2768 11.3165 11.3165 13.2493 13.2493 k = 0.2273 0.4459 0.2088 ( 5084 PWs) bands (ev): -12.3276 -12.3276 -12.3184 -12.3184 -8.8910 -8.8910 -8.8903 -8.8903 -8.1811 -8.1811 -8.1487 -8.1487 -8.0354 -8.0354 -7.8274 -7.8274 -7.4406 -7.4406 -7.3831 -7.3831 -7.3249 -7.3249 -7.2184 -7.2184 -7.0487 -7.0487 -6.9269 -6.9269 -0.2375 -0.2375 -0.2295 -0.2295 1.8436 1.8436 1.8994 1.8994 2.8999 2.8999 2.9279 2.9279 3.1345 3.1345 3.2347 3.2347 4.2010 4.2010 4.2162 4.2162 4.5003 4.5003 4.5957 4.5957 10.0532 10.0532 10.1877 10.1877 11.2810 11.2810 11.3248 11.3248 13.3416 13.3416 k = 0.2159 0.4459 0.2088 ( 5080 PWs) bands (ev): -12.3312 -12.3312 -12.3221 -12.3221 -8.8900 -8.8900 -8.8890 -8.8890 -8.1831 -8.1831 -8.1589 -8.1589 -8.0343 -8.0343 -7.8306 -7.8306 -7.4458 -7.4458 -7.3876 -7.3876 -7.3375 -7.3375 -7.2182 -7.2182 -7.0554 -7.0554 -6.9436 -6.9436 -0.1908 -0.1908 -0.1809 -0.1809 1.8603 1.8603 1.9219 1.9219 2.8902 2.8902 2.9233 2.9233 3.1866 3.1866 3.3040 3.3040 4.1743 4.1743 4.1839 4.1839 4.4860 4.4860 4.5949 4.5949 10.0613 10.0613 10.1928 10.1928 11.2900 11.2900 11.3382 11.3382 13.4388 13.4388 k = 0.2045 0.4459 0.2088 ( 5084 PWs) bands (ev): -12.3347 -12.3347 -12.3258 -12.3258 -8.8888 -8.8888 -8.8860 -8.8860 -8.1859 -8.1859 -8.1704 -8.1704 -8.0323 -8.0323 -7.8343 -7.8343 -7.4513 -7.4513 -7.3975 -7.3975 -7.3458 -7.3458 -7.2189 -7.2189 -7.0602 -7.0602 -6.9591 -6.9591 -0.1453 -0.1453 -0.1336 -0.1336 1.8799 1.8799 1.9469 1.9469 2.8725 2.8725 2.9065 2.9065 3.2494 3.2494 3.3813 3.3813 4.1444 4.1444 4.1505 4.1505 4.4745 4.4745 4.5963 4.5963 10.0610 10.0610 10.1884 10.1884 11.3038 11.3038 11.3568 11.3568 13.5398 13.5398 k = 0.1932 0.4459 0.2088 ( 5088 PWs) bands (ev): -12.3382 -12.3382 -12.3296 -12.3296 -8.8867 -8.8867 -8.8820 -8.8820 -8.1894 -8.1894 -8.1830 -8.1830 -8.0297 -8.0297 -7.8387 -7.8387 -7.4570 -7.4570 -7.4123 -7.4123 -7.3495 -7.3495 -7.2206 -7.2206 -7.0635 -7.0635 -6.9732 -6.9732 -0.1014 -0.1014 -0.0879 -0.0879 1.9026 1.9026 1.9746 1.9746 2.8514 2.8514 2.8855 2.8855 3.3135 3.3135 3.4606 3.4606 4.1125 4.1125 4.1174 4.1174 4.4659 4.4659 4.5997 4.5997 10.0525 10.0525 10.1750 10.1750 11.3223 11.3223 11.3799 11.3799 13.6436 13.6436 k = 0.1818 0.4459 0.2088 ( 5088 PWs) bands (ev): -12.3416 -12.3416 -12.3333 -12.3333 -8.8837 -8.8837 -8.8771 -8.8771 -8.1962 -8.1962 -8.1936 -8.1936 -8.0266 -8.0266 -7.8435 -7.8435 -7.4630 -7.4630 -7.4297 -7.4297 -7.3504 -7.3504 -7.2232 -7.2232 -7.0656 -7.0656 -6.9857 -6.9857 -0.0591 -0.0591 -0.0442 -0.0442 1.9285 1.9285 2.0051 2.0051 2.8292 2.8292 2.8634 2.8634 3.3738 3.3738 3.5376 3.5376 4.0805 4.0805 4.0861 4.0861 4.4601 4.4601 4.6055 4.6055 10.0363 10.0363 10.1534 10.1534 11.3447 11.3447 11.4065 11.4065 13.7489 13.7489 k = 0.1705 0.4459 0.2088 ( 5088 PWs) bands (ev): -12.3450 -12.3450 -12.3369 -12.3369 -8.8798 -8.8798 -8.8713 -8.8713 -8.2099 -8.2099 -8.1985 -8.1985 -8.0232 -8.0232 -7.8491 -7.8491 -7.4692 -7.4692 -7.4480 -7.4480 -7.3497 -7.3497 -7.2267 -7.2267 -7.0667 -7.0667 -6.9968 -6.9968 -0.0189 -0.0189 -0.0026 -0.0026 1.9578 1.9578 2.0384 2.0384 2.8069 2.8069 2.8416 2.8416 3.4260 3.4260 3.6072 3.6072 4.0519 4.0519 4.0591 4.0591 4.4574 4.4574 4.6136 4.6136 10.0132 10.0132 10.1247 10.1247 11.3700 11.3700 11.4353 11.4353 13.8538 13.8538 k = 0.1591 0.4459 0.2088 ( 5100 PWs) bands (ev): -12.3482 -12.3482 -12.3405 -12.3405 -8.8751 -8.8751 -8.8647 -8.8647 -8.2239 -8.2239 -8.2044 -8.2044 -8.0196 -8.0196 -7.8553 -7.8553 -7.4756 -7.4756 -7.4660 -7.4660 -7.3485 -7.3485 -7.2311 -7.2311 -7.0671 -7.0671 -7.0064 -7.0064 0.0191 0.0191 0.0365 0.0365 1.9906 1.9906 2.0745 2.0745 2.7852 2.7852 2.8208 2.8208 3.4661 3.4661 3.6621 3.6621 4.0327 4.0327 4.0392 4.0392 4.4579 4.4579 4.6243 4.6243 9.9843 9.9843 10.0899 10.0899 11.3972 11.3972 11.4651 11.4651 13.9546 13.9546 k = 0.1477 0.4459 0.2088 ( 5096 PWs) bands (ev): -12.3513 -12.3513 -12.3440 -12.3440 -8.8696 -8.8696 -8.8574 -8.8574 -8.2380 -8.2380 -8.2111 -8.2111 -8.0159 -8.0159 -7.8621 -7.8621 -7.4830 -7.4830 -7.4822 -7.4822 -7.3467 -7.3467 -7.2362 -7.2362 -7.0669 -7.0669 -7.0144 -7.0144 0.0547 0.0547 0.0730 0.0730 2.0267 2.0267 2.1131 2.1131 2.7646 2.7646 2.8017 2.8017 3.4901 3.4901 3.6928 3.6928 4.0295 4.0295 4.0310 4.0310 4.4623 4.4623 4.6378 4.6378 9.9507 9.9507 10.0503 10.0503 11.4251 11.4251 11.4945 11.4945 14.0428 14.0428 k = 0.1364 0.4459 0.2088 ( 5088 PWs) bands (ev): -12.3542 -12.3542 -12.3474 -12.3474 -8.8633 -8.8633 -8.8494 -8.8494 -8.2519 -8.2519 -8.2186 -8.2186 -8.0120 -8.0120 -7.8693 -7.8693 -7.4985 -7.4985 -7.4890 -7.4890 -7.3447 -7.3447 -7.2418 -7.2418 -7.0664 -7.0664 -7.0212 -7.0212 0.0878 0.0878 0.1066 0.1066 2.0662 2.0662 2.1541 2.1541 2.7454 2.7454 2.7845 2.7845 3.4958 3.4958 3.6937 3.6937 4.0314 4.0314 4.0511 4.0511 4.4714 4.4714 4.6541 4.6541 9.9135 9.9135 10.0071 10.0071 11.4527 11.4527 11.5223 11.5223 14.0950 14.0956 k = 0.1250 0.4459 0.2088 ( 5092 PWs) bands (ev): -12.3570 -12.3570 -12.3506 -12.3506 -8.8564 -8.8564 -8.8411 -8.8411 -8.2656 -8.2656 -8.2270 -8.2270 -8.0082 -8.0082 -7.8771 -7.8771 -7.5125 -7.5125 -7.4959 -7.4959 -7.3425 -7.3425 -7.2479 -7.2479 -7.0655 -7.0655 -7.0268 -7.0268 0.1184 0.1184 0.1373 0.1373 2.1088 2.1088 2.1971 2.1971 2.7279 2.7279 2.7697 2.7697 3.4835 3.4835 3.6696 3.6696 4.0442 4.0442 4.0861 4.0861 4.4865 4.4865 4.6732 4.6732 9.8739 9.8739 9.9614 9.9614 11.4791 11.4791 11.5477 11.5477 14.0552 14.0553 k = 0.1136 0.4459 0.2088 ( 5092 PWs) bands (ev): -12.3596 -12.3596 -12.3537 -12.3537 -8.8491 -8.8491 -8.8325 -8.8325 -8.2788 -8.2788 -8.2363 -8.2363 -8.0042 -8.0042 -7.8852 -7.8852 -7.5248 -7.5248 -7.5028 -7.5028 -7.3402 -7.3402 -7.2542 -7.2542 -7.0645 -7.0645 -7.0314 -7.0314 0.1463 0.1463 0.1649 0.1649 2.1543 2.1543 2.2416 2.2416 2.7123 2.7123 2.7577 2.7577 3.4560 3.4560 3.6296 3.6296 4.0644 4.0644 4.1254 4.1254 4.5085 4.5085 4.6948 4.6948 9.8332 9.8332 9.9142 9.9142 11.5035 11.5035 11.5700 11.5700 13.9955 13.9955 k = 0.1023 0.4459 0.2088 ( 5108 PWs) bands (ev): -12.3619 -12.3619 -12.3565 -12.3565 -8.8413 -8.8413 -8.8238 -8.8238 -8.2913 -8.2913 -8.2463 -8.2463 -8.0003 -8.0003 -7.8935 -7.8935 -7.5353 -7.5353 -7.5098 -7.5098 -7.3378 -7.3378 -7.2607 -7.2607 -7.0634 -7.0634 -7.0353 -7.0353 0.1715 0.1715 0.1895 0.1895 2.2022 2.2022 2.2866 2.2866 2.6990 2.6990 2.7493 2.7493 3.4169 3.4169 3.5802 3.5802 4.0885 4.0885 4.1612 4.1612 4.5383 4.5383 4.7185 4.7185 9.7923 9.7923 9.8667 9.8667 11.5256 11.5256 11.5887 11.5887 13.9423 13.9423 k = 0.0909 0.4459 0.2088 ( 5100 PWs) bands (ev): -12.3641 -12.3641 -12.3592 -12.3592 -8.8332 -8.8332 -8.8153 -8.8153 -8.3028 -8.3028 -8.2568 -8.2568 -7.9962 -7.9962 -7.9018 -7.9018 -7.5439 -7.5439 -7.5166 -7.5166 -7.3351 -7.3351 -7.2670 -7.2670 -7.0621 -7.0621 -7.0383 -7.0383 0.1941 0.1941 0.2111 0.2111 2.2518 2.2518 2.3313 2.3313 2.6884 2.6884 2.7453 2.7453 3.3697 3.3697 3.5251 3.5251 4.1134 4.1134 4.1898 4.1898 4.5750 4.5750 4.7436 4.7436 9.7525 9.7525 9.8200 9.8200 11.5451 11.5451 11.6037 11.6037 13.8972 13.8972 k = 0.0795 0.4459 0.2088 ( 5096 PWs) bands (ev): -12.3659 -12.3659 -12.3617 -12.3617 -8.8250 -8.8250 -8.8071 -8.8071 -8.3131 -8.3131 -8.2678 -8.2678 -7.9920 -7.9920 -7.9100 -7.9100 -7.5507 -7.5507 -7.5233 -7.5233 -7.3324 -7.3324 -7.2731 -7.2731 -7.0607 -7.0607 -7.0408 -7.0408 0.2140 0.2140 0.2297 0.2297 2.3021 2.3021 2.3739 2.3739 2.6811 2.6811 2.7468 2.7468 3.3168 3.3168 3.4664 3.4664 4.1370 4.1370 4.2107 4.2107 4.6167 4.6167 4.7688 4.7688 9.7147 9.7147 9.7750 9.7750 11.5619 11.5619 11.6151 11.6151 13.8603 13.8603 k = 0.0682 0.4459 0.2088 ( 5092 PWs) bands (ev): -12.3676 -12.3676 -12.3638 -12.3638 -8.8169 -8.8169 -8.7997 -8.7997 -8.3219 -8.3219 -8.2790 -8.2790 -7.9878 -7.9878 -7.9180 -7.9180 -7.5559 -7.5559 -7.5298 -7.5298 -7.3295 -7.3295 -7.2790 -7.2790 -7.0593 -7.0593 -7.0430 -7.0430 0.2313 0.2313 0.2454 0.2454 2.3517 2.3517 2.4126 2.4126 2.6784 2.6784 2.7554 2.7554 3.2602 3.2602 3.4054 3.4054 4.1584 4.1584 4.2250 4.2250 4.6604 4.6604 4.7930 4.7930 9.6802 9.6802 9.7327 9.7327 11.5762 11.5762 11.6231 11.6231 13.8310 13.8310 k = 0.0568 0.4459 0.2088 ( 5096 PWs) bands (ev): -12.3689 -12.3689 -12.3658 -12.3658 -8.8091 -8.8091 -8.7932 -8.7932 -8.3291 -8.3291 -8.2901 -8.2901 -7.9835 -7.9835 -7.9258 -7.9258 -7.5596 -7.5596 -7.5360 -7.5360 -7.3265 -7.3265 -7.2848 -7.2848 -7.0580 -7.0580 -7.0448 -7.0448 0.2461 0.2461 0.2582 0.2582 2.3984 2.3984 2.4454 2.4454 2.6818 2.6818 2.7721 2.7721 3.2016 3.2016 3.3431 3.3431 4.1771 4.1771 4.2340 4.2340 4.7036 4.7036 4.8148 4.8148 9.6497 9.6497 9.6943 9.6943 11.5881 11.5881 11.6281 11.6281 13.8087 13.8087 k = 0.0455 0.4459 0.2088 ( 5088 PWs) bands (ev): -12.3700 -12.3700 -12.3674 -12.3674 -8.8018 -8.8018 -8.7879 -8.7879 -8.3342 -8.3342 -8.3008 -8.3008 -7.9789 -7.9789 -7.9331 -7.9331 -7.5618 -7.5618 -7.5417 -7.5417 -7.3233 -7.3233 -7.2901 -7.2901 -7.0566 -7.0566 -7.0464 -7.0464 0.2583 0.2583 0.2684 0.2684 2.4390 2.4390 2.4710 2.4710 2.6940 2.6940 2.7971 2.7971 3.1429 3.1429 3.2802 3.2802 4.1930 4.1930 4.2390 4.2390 4.7437 4.7437 4.8328 4.8328 9.6243 9.6243 9.6605 9.6605 11.5981 11.5981 11.6306 11.6306 13.7927 13.7927 k = 0.0341 0.4459 0.2088 ( 5084 PWs) bands (ev): -12.3707 -12.3707 -12.3688 -12.3688 -8.7952 -8.7952 -8.7841 -8.7841 -8.3372 -8.3372 -8.3108 -8.3108 -7.9742 -7.9742 -7.9401 -7.9401 -7.5627 -7.5627 -7.5469 -7.5469 -7.3200 -7.3200 -7.2952 -7.2952 -7.0553 -7.0553 -7.0478 -7.0478 0.2681 0.2681 0.2758 0.2758 2.4704 2.4704 2.4891 2.4891 2.7172 2.7172 2.8280 2.8280 3.0873 3.0873 3.2177 3.2177 4.2063 4.2063 4.2408 4.2408 4.7791 4.7791 4.8458 4.8458 9.6047 9.6047 9.6322 9.6322 11.6063 11.6063 11.6310 11.6310 13.7822 13.7822 k = 0.0227 0.4459 0.2088 ( 5084 PWs) bands (ev): -12.3712 -12.3712 -12.3699 -12.3699 -8.7897 -8.7897 -8.7819 -8.7819 -8.3380 -8.3380 -8.3197 -8.3197 -7.9693 -7.9693 -7.9467 -7.9467 -7.5625 -7.5625 -7.5515 -7.5515 -7.3165 -7.3165 -7.3001 -7.3001 -7.0541 -7.0541 -7.0491 -7.0491 0.2755 0.2755 0.2807 0.2807 2.4913 2.4913 2.5007 2.5007 2.7516 2.7516 2.8567 2.8567 3.0422 3.0422 3.1569 3.1569 4.2173 4.2173 4.2402 4.2402 4.8084 4.8084 4.8527 4.8527 9.5916 9.5916 9.6101 9.6101 11.6132 11.6132 11.6298 11.6298 13.7766 13.7766 k = 0.0114 0.4459 0.2088 ( 5080 PWs) bands (ev): -12.3713 -12.3713 -12.3707 -12.3707 -8.7854 -8.7854 -8.7814 -8.7814 -8.3365 -8.3365 -8.3271 -8.3271 -7.9642 -7.9642 -7.9529 -7.9529 -7.5611 -7.5611 -7.5555 -7.5555 -7.3127 -7.3127 -7.3046 -7.3046 -7.0528 -7.0528 -7.0503 -7.0503 0.2804 0.2804 0.2830 0.2830 2.5030 2.5030 2.5066 2.5066 2.7937 2.7937 2.8634 2.8634 3.0265 3.0265 3.0999 3.0999 4.2260 4.2260 4.2375 4.2375 4.8307 4.8307 4.8528 4.8528 9.5854 9.5854 9.5947 9.5947 11.6189 11.6189 11.6272 11.6272 13.7753 13.7753 k = 0.0000 0.4459 0.2088 ( 5068 PWs) bands (ev): -12.3711 -12.3711 -12.3711 -12.3711 -8.7826 -8.7826 -8.7826 -8.7826 -8.3328 -8.3328 -8.3328 -8.3328 -7.9586 -7.9586 -7.9586 -7.9586 -7.5587 -7.5587 -7.5587 -7.5587 -7.3087 -7.3087 -7.3087 -7.3087 -7.0515 -7.0515 -7.0515 -7.0515 0.2829 0.2829 0.2829 0.2829 2.5075 2.5075 2.5075 2.5075 2.8361 2.8361 2.8361 2.8361 3.0518 3.0518 3.0518 3.0518 4.2327 4.2327 4.2327 4.2327 4.8455 4.8455 4.8455 4.8455 9.5864 9.5864 9.5864 9.5864 11.6235 11.6235 11.6235 11.6235 13.7781 13.7781 k = 0.0000 0.4459 0.2088 ( 5068 PWs) bands (ev): -12.3711 -12.3711 -12.3711 -12.3711 -8.7826 -8.7826 -8.7826 -8.7826 -8.3328 -8.3328 -8.3328 -8.3328 -7.9586 -7.9586 -7.9586 -7.9586 -7.5587 -7.5587 -7.5587 -7.5587 -7.3087 -7.3087 -7.3087 -7.3087 -7.0515 -7.0515 -7.0515 -7.0515 0.2829 0.2829 0.2829 0.2829 2.5075 2.5075 2.5075 2.5075 2.8361 2.8361 2.8361 2.8361 3.0518 3.0518 3.0518 3.0518 4.2327 4.2327 4.2327 4.2327 4.8455 4.8455 4.8455 4.8455 9.5864 9.5864 9.5864 9.5864 11.6235 11.6235 11.6235 11.6235 13.7781 13.7781 k = 0.0000 0.4345 0.2088 ( 5072 PWs) bands (ev): -12.3909 -12.3909 -12.3519 -12.3519 -8.7837 -8.7837 -8.7817 -8.7817 -8.3358 -8.3358 -8.3298 -8.3298 -7.9722 -7.9722 -7.9453 -7.9453 -7.5612 -7.5612 -7.5562 -7.5562 -7.3137 -7.3137 -7.3039 -7.3039 -7.0728 -7.0728 -7.0292 -7.0292 0.2429 0.2429 0.3255 0.3255 2.4756 2.4756 2.5352 2.5352 2.7979 2.7979 2.8709 2.8709 3.0325 3.0325 3.0811 3.0811 4.2291 4.2291 4.2366 4.2366 4.8399 4.8399 4.8509 4.8509 9.5653 9.5653 9.6047 9.6047 11.5903 11.5903 11.6596 11.6596 13.7551 13.7551 k = 0.0000 0.4230 0.2088 ( 5072 PWs) bands (ev): -12.4110 -12.4110 -12.3331 -12.3331 -8.7851 -8.7851 -8.7812 -8.7812 -8.3387 -8.3387 -8.3268 -8.3268 -7.9859 -7.9859 -7.9321 -7.9321 -7.5637 -7.5637 -7.5538 -7.5538 -7.3188 -7.3188 -7.2994 -7.2994 -7.0929 -7.0929 -7.0059 -7.0059 0.2053 0.2053 0.3705 0.3705 2.4392 2.4392 2.5596 2.5596 2.7583 2.7583 2.8981 2.8981 3.0275 3.0275 3.1174 3.1174 4.2257 4.2257 4.2406 4.2406 4.8342 4.8342 4.8560 4.8560 9.5413 9.5413 9.6202 9.6202 11.5599 11.5599 11.6983 11.6983 13.7274 13.7274 k = 0.0000 0.4116 0.2088 ( 5062 PWs) bands (ev): -12.4315 -12.4315 -12.3149 -12.3149 -8.7868 -8.7868 -8.7810 -8.7810 -8.3416 -8.3416 -8.3238 -8.3238 -7.9996 -7.9996 -7.9193 -7.9193 -7.5664 -7.5664 -7.5514 -7.5514 -7.3241 -7.3241 -7.2949 -7.2949 -7.1116 -7.1116 -6.9816 -6.9816 0.1702 0.1702 0.4179 0.4179 2.3982 2.3982 2.5812 2.5812 2.7183 2.7183 2.9142 2.9142 3.0404 3.0404 3.1591 3.1591 4.2226 4.2226 4.2449 4.2449 4.8282 4.8282 4.8609 4.8609 9.5146 9.5146 9.6328 9.6328 11.5324 11.5324 11.7396 11.7396 13.6957 13.6957 k = 0.0000 0.4002 0.2088 ( 5076 PWs) bands (ev): -12.4524 -12.4524 -12.2973 -12.2973 -8.7888 -8.7888 -8.7811 -8.7811 -8.3445 -8.3445 -8.3209 -8.3209 -8.0133 -8.0133 -7.9070 -7.9070 -7.5691 -7.5691 -7.5492 -7.5492 -7.3295 -7.3295 -7.2910 -7.2910 -7.1291 -7.1291 -6.9566 -6.9566 0.1375 0.1375 0.4678 0.4678 2.3530 2.3530 2.6006 2.6006 2.6788 2.6788 2.9221 2.9221 3.0680 3.0680 3.2046 3.2046 4.2198 4.2198 4.2492 4.2492 4.8221 4.8221 4.8656 4.8656 9.4851 9.4851 9.6426 9.6426 11.5078 11.5078 11.7831 11.7831 13.6606 13.6606 k = 0.0000 0.3887 0.2088 ( 5072 PWs) bands (ev): -12.4735 -12.4735 -12.2803 -12.2803 -8.7909 -8.7909 -8.7815 -8.7815 -8.3473 -8.3473 -8.3179 -8.3179 -8.0268 -8.0268 -7.8951 -7.8951 -7.5718 -7.5718 -7.5469 -7.5469 -7.3350 -7.3350 -7.2874 -7.2874 -7.1451 -7.1451 -6.9306 -6.9306 0.1073 0.1073 0.5200 0.5200 2.3043 2.3043 2.6134 2.6134 2.6449 2.6449 2.9282 2.9282 3.1031 3.1031 3.2530 3.2530 4.2176 4.2176 4.2538 4.2538 4.8158 4.8158 4.8700 4.8700 9.4530 9.4530 9.6497 9.6497 11.4861 11.4861 11.8284 11.8284 13.6225 13.6225 k = 0.0000 0.3773 0.2088 ( 5084 PWs) bands (ev): -12.4949 -12.4949 -12.2639 -12.2639 -8.7934 -8.7934 -8.7822 -8.7822 -8.3500 -8.3500 -8.3150 -8.3150 -8.0403 -8.0403 -7.8839 -7.8839 -7.5745 -7.5745 -7.5447 -7.5447 -7.3407 -7.3407 -7.2844 -7.2844 -7.1595 -7.1595 -6.9041 -6.9041 0.0796 0.0796 0.5746 0.5746 2.2526 2.2526 2.5902 2.5902 2.6469 2.6469 2.9362 2.9362 3.1414 3.1414 3.3035 3.3035 4.2158 4.2158 4.2585 4.2585 4.8095 4.8095 4.8741 4.8741 9.4183 9.4183 9.6540 9.6540 11.4672 11.4672 11.8753 11.8753 13.5821 13.5821 k = 0.0000 0.3659 0.2088 ( 5086 PWs) bands (ev): -12.5164 -12.5164 -12.2481 -12.2481 -8.7960 -8.7960 -8.7833 -8.7833 -8.3527 -8.3527 -8.3121 -8.3121 -8.0534 -8.0534 -7.8733 -7.8733 -7.5773 -7.5773 -7.5425 -7.5425 -7.3464 -7.3464 -7.2819 -7.2819 -7.1721 -7.1721 -6.8769 -6.8769 0.0542 0.0542 0.6315 0.6315 2.1989 2.1989 2.5514 2.5514 2.6648 2.6648 2.9475 2.9475 3.1807 3.1807 3.3551 3.3551 4.2147 4.2147 4.2634 4.2634 4.8030 4.8030 4.8781 4.8781 9.3811 9.3811 9.6558 9.6558 11.4510 11.4510 11.9229 11.9229 13.5397 13.5397 k = 0.0000 0.3544 0.2088 ( 5094 PWs) bands (ev): -12.5381 -12.5381 -12.2330 -12.2330 -8.7988 -8.7988 -8.7846 -8.7846 -8.3553 -8.3553 -8.3093 -8.3093 -8.0663 -8.0663 -7.8634 -7.8634 -7.5801 -7.5801 -7.5405 -7.5405 -7.3522 -7.3522 -7.2803 -7.2803 -7.1830 -7.1830 -6.8491 -6.8491 0.0311 0.0311 0.6905 0.6905 2.1436 2.1436 2.5114 2.5114 2.6848 2.6848 2.9621 2.9621 3.2203 3.2203 3.4073 3.4073 4.2143 4.2143 4.2685 4.2685 4.7965 4.7965 4.8817 4.8817 9.3415 9.3415 9.6550 9.6550 11.4374 11.4374 11.9707 11.9707 13.4959 13.4959 k = 0.0000 0.3430 0.2088 ( 5088 PWs) bands (ev): -12.5598 -12.5598 -12.2186 -12.2186 -8.8018 -8.8018 -8.7863 -8.7863 -8.3577 -8.3577 -8.3065 -8.3065 -8.0786 -8.0786 -7.8542 -7.8542 -7.5829 -7.5829 -7.5384 -7.5384 -7.3579 -7.3579 -7.2796 -7.2796 -7.1917 -7.1917 -6.8207 -6.8207 0.0104 0.0104 0.7517 0.7517 2.0873 2.0873 2.4712 2.4712 2.7061 2.7061 2.9801 2.9801 3.2595 3.2595 3.4594 3.4594 4.2147 4.2147 4.2739 4.2739 4.7900 4.7900 4.8851 4.8851 9.2996 9.2996 9.6517 9.6517 11.4264 11.4264 12.0176 12.0176 13.4510 13.4510 k = 0.0000 0.3316 0.2088 ( 5090 PWs) bands (ev): -12.5816 -12.5816 -12.2049 -12.2049 -8.8049 -8.8049 -8.7882 -8.7882 -8.3602 -8.3602 -8.3037 -8.3037 -8.0906 -8.0906 -7.8458 -7.8458 -7.5857 -7.5857 -7.5363 -7.5363 -7.3637 -7.3637 -7.2799 -7.2799 -7.1984 -7.1984 -6.7921 -6.7921 -0.0080 -0.0080 0.8149 0.8149 2.0305 2.0305 2.4313 2.4313 2.7287 2.7287 3.0010 3.0010 3.2981 3.2981 3.5109 3.5109 4.2160 4.2160 4.2796 4.2796 4.7835 4.7835 4.8883 4.8883 9.2555 9.2555 9.6461 9.6461 11.4178 11.4178 12.0624 12.0624 13.4055 13.4055 k = 0.0000 0.3201 0.2088 ( 5086 PWs) bands (ev): -12.6032 -12.6032 -12.1918 -12.1918 -8.8082 -8.8082 -8.7905 -8.7905 -8.3624 -8.3624 -8.3011 -8.3011 -8.1021 -8.1021 -7.8383 -7.8383 -7.5885 -7.5885 -7.5343 -7.5343 -7.3692 -7.3692 -7.2812 -7.2812 -7.2032 -7.2032 -6.7630 -6.7630 -0.0242 -0.0242 0.8800 0.8800 1.9735 1.9735 2.3919 2.3919 2.7525 2.7525 3.0245 3.0245 3.3360 3.3360 3.5615 3.5615 4.2184 4.2184 4.2857 4.2857 4.7770 4.7770 4.8913 4.8913 9.2094 9.2094 9.6383 9.6383 11.4115 11.4115 12.1036 12.1036 13.3597 13.3597 k = 0.0000 0.3087 0.2088 ( 5090 PWs) bands (ev): -12.6248 -12.6248 -12.1794 -12.1794 -8.8116 -8.8116 -8.7929 -8.7929 -8.3647 -8.3647 -8.2986 -8.2986 -8.1131 -8.1131 -7.8316 -7.8316 -7.5913 -7.5913 -7.5325 -7.5325 -7.3747 -7.3747 -7.2834 -7.2834 -7.2063 -7.2063 -6.7337 -6.7337 -0.0383 -0.0383 0.9469 0.9469 1.9166 1.9166 2.3530 2.3530 2.7775 2.7775 3.0503 3.0503 3.3731 3.3731 3.6106 3.6106 4.2218 4.2218 4.2922 4.2922 4.7706 4.7706 4.8941 4.8941 9.1613 9.1613 9.6283 9.6283 11.4073 11.4073 12.1391 12.1391 13.3138 13.3138 k = 0.0000 0.2973 0.2088 ( 5094 PWs) bands (ev): -12.6462 -12.6462 -12.1678 -12.1678 -8.8151 -8.8151 -8.7957 -8.7957 -8.3669 -8.3669 -8.2962 -8.2962 -8.1234 -8.1234 -7.8259 -7.8259 -7.5941 -7.5941 -7.5307 -7.5307 -7.3799 -7.3799 -7.2861 -7.2861 -7.2081 -7.2081 -6.7042 -6.7042 -0.0502 -0.0502 1.0154 1.0154 1.8601 1.8601 2.3147 2.3147 2.8038 2.8038 3.0780 3.0780 3.4092 3.4092 3.6581 3.6581 4.2265 4.2265 4.2993 4.2993 4.7643 4.7643 4.8966 4.8966 9.1114 9.1114 9.6164 9.6164 11.4051 11.4051 12.1669 12.1669 13.2683 13.2683 k = 0.0000 0.2858 0.2088 ( 5102 PWs) bands (ev): -12.6674 -12.6674 -12.1568 -12.1568 -8.8187 -8.8187 -8.7986 -8.7986 -8.3690 -8.3690 -8.2940 -8.2940 -8.1332 -8.1332 -7.8211 -7.8211 -7.5968 -7.5968 -7.5290 -7.5290 -7.3848 -7.3848 -7.2893 -7.2893 -7.2089 -7.2089 -6.6747 -6.6747 -0.0600 -0.0600 1.0853 1.0853 1.8041 1.8041 2.2772 2.2772 2.8313 2.8313 3.1072 3.1072 3.4443 3.4443 3.7036 3.7036 4.2323 4.2323 4.3068 4.3068 4.7581 4.7581 4.8990 4.8990 9.0599 9.0599 9.6027 9.6027 11.4047 11.4047 12.1845 12.1845 13.2233 13.2233 k = 0.0000 0.2744 0.2088 ( 5112 PWs) bands (ev): -12.6883 -12.6883 -12.1465 -12.1465 -8.8225 -8.8225 -8.8017 -8.8017 -8.3709 -8.3709 -8.2920 -8.2920 -8.1423 -8.1423 -7.8171 -7.8171 -7.5994 -7.5994 -7.5274 -7.5274 -7.3893 -7.3893 -7.2924 -7.2924 -7.2091 -7.2091 -6.6452 -6.6452 -0.0679 -0.0679 1.1564 1.1564 1.7489 1.7489 2.2406 2.2406 2.8600 2.8600 3.1377 3.1377 3.4783 3.4783 3.7470 3.7470 4.2393 4.2393 4.3150 4.3150 4.7521 4.7521 4.9013 4.9013 9.0070 9.0070 9.5872 9.5872 11.4060 11.4060 12.1896 12.1896 13.1790 13.1790 k = 0.0000 0.2630 0.2088 ( 5118 PWs) bands (ev): -12.7088 -12.7088 -12.1369 -12.1369 -8.8262 -8.8262 -8.8049 -8.8049 -8.3728 -8.3728 -8.2902 -8.2902 -8.1507 -8.1507 -7.8140 -7.8140 -7.6020 -7.6020 -7.5259 -7.5259 -7.3934 -7.3934 -7.2954 -7.2954 -7.2089 -7.2089 -6.6159 -6.6159 -0.0739 -0.0739 1.2285 1.2285 1.6946 1.6946 2.2050 2.2050 2.8898 2.8898 3.1690 3.1690 3.5111 3.5111 3.7882 3.7882 4.2474 4.2474 4.3238 4.3238 4.7463 4.7463 4.9034 4.9034 8.9528 8.9528 9.5702 9.5702 11.4088 11.4088 12.1807 12.1807 13.1358 13.1358 k = 0.0000 0.2515 0.2088 ( 5118 PWs) bands (ev): -12.7289 -12.7289 -12.1279 -12.1279 -8.8301 -8.8301 -8.8083 -8.8083 -8.3745 -8.3745 -8.2886 -8.2886 -8.1583 -8.1583 -7.8117 -7.8117 -7.6044 -7.6044 -7.5244 -7.5244 -7.3970 -7.3970 -7.2982 -7.2982 -7.2085 -7.2085 -6.5868 -6.5868 -0.0780 -0.0780 1.3014 1.3014 1.6414 1.6414 2.1703 2.1703 2.9207 2.9207 3.2009 3.2009 3.5428 3.5428 3.8271 3.8271 4.2565 4.2565 4.3333 4.3333 4.7407 4.7407 4.9055 4.9055 8.8976 8.8976 9.5518 9.5518 11.4129 11.4129 12.1572 12.1572 13.0936 13.0936 k = 0.0000 0.2401 0.2088 ( 5120 PWs) bands (ev): -12.7486 -12.7486 -12.1196 -12.1196 -8.8340 -8.8340 -8.8117 -8.8117 -8.3761 -8.3761 -8.2872 -8.2872 -8.1651 -8.1651 -7.8103 -7.8103 -7.6067 -7.6067 -7.5231 -7.5231 -7.4001 -7.4001 -7.3006 -7.3006 -7.2081 -7.2081 -6.5581 -6.5581 -0.0804 -0.0804 1.3745 1.3745 1.5894 1.5894 2.1368 2.1368 2.9525 2.9525 3.2330 3.2330 3.5732 3.5732 3.8639 3.8639 4.2664 4.2664 4.3434 4.3434 4.7354 4.7354 4.9075 4.9075 8.8415 8.8415 9.5321 9.5321 11.4181 11.4181 12.1197 12.1197 13.0527 13.0527 k = 0.0000 0.2287 0.2088 ( 5116 PWs) bands (ev): -12.7678 -12.7678 -12.1118 -12.1118 -8.8379 -8.8379 -8.8152 -8.8152 -8.3777 -8.3777 -8.2862 -8.2862 -8.1712 -8.1712 -7.8094 -7.8094 -7.6089 -7.6089 -7.5218 -7.5218 -7.4028 -7.4028 -7.3027 -7.3027 -7.2077 -7.2077 -6.5296 -6.5296 -0.0812 -0.0812 1.4472 1.4472 1.5394 1.5394 2.1045 2.1045 2.9853 2.9853 3.2650 3.2650 3.6025 3.6025 3.8986 3.8986 4.2768 4.2768 4.3542 4.3542 4.7303 4.7303 4.9094 4.9094 8.7849 8.7849 9.5114 9.5114 11.4242 11.4242 12.0699 12.0699 13.0132 13.0132 k = 0.0000 0.2172 0.2088 ( 5112 PWs) bands (ev): -12.7864 -12.7864 -12.1047 -12.1047 -8.8419 -8.8419 -8.8187 -8.8187 -8.3791 -8.3791 -8.2854 -8.2854 -8.1765 -8.1765 -7.8093 -7.8093 -7.6109 -7.6109 -7.5207 -7.5207 -7.4051 -7.4051 -7.3043 -7.3043 -7.2075 -7.2075 -6.5017 -6.5017 -0.0804 -0.0804 1.4845 1.4845 1.5258 1.5258 2.0736 2.0736 3.0189 3.0189 3.2965 3.2965 3.6304 3.6304 3.9314 3.9314 4.2874 4.2874 4.3656 4.3656 4.7255 4.7255 4.9113 4.9113 8.7280 8.7280 9.4899 9.4899 11.4308 11.4308 12.0099 12.0099 12.9752 12.9752 k = 0.0000 0.2058 0.2088 ( 5116 PWs) bands (ev): -12.8043 -12.8043 -12.0981 -12.0981 -8.8458 -8.8458 -8.8221 -8.8221 -8.3804 -8.3804 -8.2850 -8.2850 -8.1810 -8.1810 -7.8099 -7.8099 -7.6128 -7.6128 -7.5196 -7.5196 -7.4071 -7.4071 -7.3055 -7.3055 -7.2076 -7.2076 -6.4746 -6.4746 -0.0781 -0.0781 1.4393 1.4393 1.5956 1.5956 2.0441 2.0441 3.0534 3.0534 3.3273 3.3273 3.6571 3.6571 3.9626 3.9626 4.2977 4.2977 4.3775 4.3775 4.7211 4.7211 4.9133 4.9133 8.6710 8.6710 9.4676 9.4676 11.4376 11.4376 11.9422 11.9422 12.9386 12.9386 k = 0.0000 0.1944 0.2088 ( 5116 PWs) bands (ev): -12.8216 -12.8216 -12.0921 -12.0921 -8.8498 -8.8498 -8.8255 -8.8255 -8.3816 -8.3816 -8.2849 -8.2849 -8.1847 -8.1847 -7.8109 -7.8109 -7.6145 -7.6145 -7.5185 -7.5185 -7.4087 -7.4087 -7.3063 -7.3063 -7.2079 -7.2079 -6.4482 -6.4482 -0.0745 -0.0745 1.3931 1.3931 1.6665 1.6665 2.0163 2.0163 3.0888 3.0888 3.3571 3.3571 3.6825 3.6825 3.9923 3.9923 4.3073 4.3073 4.3899 4.3899 4.7170 4.7170 4.9153 4.9153 8.6144 8.6144 9.4448 9.4448 11.4444 11.4444 11.8693 11.8693 12.9035 12.9035 k = 0.0000 0.1829 0.2088 ( 5106 PWs) bands (ev): -12.8382 -12.8382 -12.0866 -12.0866 -8.8537 -8.8537 -8.8288 -8.8288 -8.3826 -8.3826 -8.2851 -8.2851 -8.1876 -8.1876 -7.8125 -7.8125 -7.6160 -7.6160 -7.5175 -7.5175 -7.4101 -7.4101 -7.3066 -7.3066 -7.2085 -7.2085 -6.4227 -6.4227 -0.0697 -0.0697 1.3483 1.3483 1.7355 1.7355 1.9906 1.9906 3.1251 3.1251 3.3857 3.3857 3.7065 3.7065 4.0208 4.0208 4.3157 4.3157 4.4029 4.4029 4.7132 4.7132 4.9175 4.9175 8.5584 8.5584 9.4217 9.4217 11.4505 11.4505 11.7933 11.7933 12.8700 12.8700 k = 0.0000 0.1715 0.2088 ( 5100 PWs) bands (ev): -12.8540 -12.8540 -12.0816 -12.0816 -8.8576 -8.8576 -8.8320 -8.8320 -8.3836 -8.3836 -8.2855 -8.2855 -8.1899 -8.1899 -7.8143 -7.8143 -7.6174 -7.6174 -7.5165 -7.5165 -7.4112 -7.4112 -7.3064 -7.3064 -7.2094 -7.2094 -6.3981 -6.3981 -0.0638 -0.0638 1.3052 1.3052 1.8008 1.8008 1.9684 1.9684 3.1624 3.1624 3.4129 3.4129 3.7292 3.7292 4.0482 4.0482 4.3223 4.3223 4.4163 4.4163 4.7097 4.7097 4.9197 4.9197 8.5033 8.5033 9.3984 9.3984 11.4551 11.4551 11.7168 11.7168 12.8380 12.8380 k = 0.0000 0.1601 0.2088 ( 5104 PWs) bands (ev): -12.8690 -12.8690 -12.0771 -12.0771 -8.8615 -8.8615 -8.8350 -8.8350 -8.3845 -8.3845 -8.2862 -8.2862 -8.1916 -8.1916 -7.8165 -7.8165 -7.6187 -7.6187 -7.5156 -7.5156 -7.4123 -7.4123 -7.3058 -7.3058 -7.2106 -7.2106 -6.3746 -6.3746 -0.0569 -0.0569 1.2639 1.2639 1.8566 1.8566 1.9549 1.9549 3.2008 3.2008 3.4384 3.4384 3.7505 3.7505 4.0746 4.0746 4.3264 4.3264 4.4303 4.4303 4.7066 4.7066 4.9222 4.9222 8.4496 8.4496 9.3753 9.3753 11.4565 11.4565 11.6425 11.6425 12.8075 12.8075 k = 0.0000 0.1486 0.2088 ( 5116 PWs) bands (ev): -12.8832 -12.8832 -12.0730 -12.0730 -8.8652 -8.8652 -8.8379 -8.8379 -8.3854 -8.3854 -8.2872 -8.2872 -8.1929 -8.1929 -7.8190 -7.8190 -7.6201 -7.6201 -7.5147 -7.5147 -7.4134 -7.4134 -7.3049 -7.3049 -7.2122 -7.2122 -6.3523 -6.3523 -0.0493 -0.0493 1.2244 1.2244 1.8823 1.8823 1.9703 1.9703 3.2402 3.2402 3.4624 3.4624 3.7704 3.7704 4.1002 4.1002 4.3276 4.3276 4.4448 4.4448 4.7038 4.7038 4.9248 4.9248 8.3975 8.3975 9.3525 9.3525 11.4497 11.4497 11.5766 11.5766 12.7785 12.7785 k = 0.0000 0.1372 0.2088 ( 5116 PWs) bands (ev): -12.8964 -12.8964 -12.0694 -12.0694 -8.8688 -8.8688 -8.8406 -8.8406 -8.3862 -8.3862 -8.2882 -8.2882 -8.1936 -8.1936 -7.8215 -7.8215 -7.6212 -7.6212 -7.5138 -7.5138 -7.4143 -7.4143 -7.3034 -7.3034 -7.2139 -7.2139 -6.3312 -6.3312 -0.0411 -0.0411 1.1871 1.1871 1.8754 1.8754 2.0166 2.0166 3.2808 3.2808 3.4847 3.4847 3.7889 3.7889 4.1248 4.1248 4.3253 4.3253 4.4597 4.4597 4.7013 4.7013 4.9277 4.9277 8.3475 8.3475 9.3302 9.3302 11.4224 11.4224 11.5322 11.5322 12.7509 12.7509 k = 0.0000 0.1258 0.2088 ( 5106 PWs) bands (ev): -12.9088 -12.9088 -12.0661 -12.0661 -8.8722 -8.8722 -8.8431 -8.8431 -8.3867 -8.3867 -8.2892 -8.2892 -8.1939 -8.1939 -7.8240 -7.8240 -7.6221 -7.6221 -7.5128 -7.5128 -7.4151 -7.4151 -7.3016 -7.3016 -7.2160 -7.2160 -6.3115 -6.3115 -0.0323 -0.0323 1.1519 1.1519 1.8601 1.8601 2.0692 2.0692 3.3225 3.3225 3.5055 3.5055 3.8060 3.8060 4.1483 4.1483 4.3193 4.3193 4.4749 4.4749 4.6991 4.6991 4.9308 4.9308 8.2999 8.2999 9.3086 9.3086 11.3703 11.3703 11.5144 11.5144 12.7248 12.7248 k = 0.0000 0.1143 0.2088 ( 5112 PWs) bands (ev): -12.9202 -12.9202 -12.0632 -12.0632 -8.8755 -8.8755 -8.8454 -8.8454 -8.3874 -8.3874 -8.2903 -8.2903 -8.1940 -8.1940 -7.8266 -7.8266 -7.6231 -7.6231 -7.5119 -7.5119 -7.4160 -7.4160 -7.2995 -7.2995 -7.2183 -7.2183 -6.2932 -6.2932 -0.0234 -0.0234 1.1189 1.1189 1.8438 1.8438 2.1202 2.1202 3.3650 3.3650 3.5249 3.5249 3.8215 3.8215 4.1708 4.1708 4.3094 4.3094 4.4901 4.4901 4.6972 4.6972 4.9341 4.9341 8.2551 8.2551 9.2880 9.2880 11.3087 11.3087 11.5087 11.5087 12.7002 12.7002 k = 0.0000 0.1029 0.2088 ( 5116 PWs) bands (ev): -12.9305 -12.9305 -12.0607 -12.0607 -8.8785 -8.8785 -8.8476 -8.8476 -8.3879 -8.3879 -8.2914 -8.2914 -8.1939 -8.1939 -7.8292 -7.8292 -7.6239 -7.6239 -7.5110 -7.5110 -7.4169 -7.4169 -7.2971 -7.2971 -7.2209 -7.2209 -6.2763 -6.2763 -0.0143 -0.0143 1.0884 1.0884 1.8282 1.8282 2.1677 2.1677 3.4077 3.4077 3.5436 3.5436 3.8356 3.8356 4.1918 4.1918 4.2956 4.2956 4.5050 4.5050 4.6956 4.6956 4.9376 4.9376 8.2134 8.2134 9.2686 9.2686 11.2471 11.2471 11.5063 11.5063 12.6772 12.6772 k = 0.0000 0.0915 0.2088 ( 5112 PWs) bands (ev): -12.9399 -12.9399 -12.0585 -12.0585 -8.8813 -8.8813 -8.8495 -8.8495 -8.3883 -8.3883 -8.2925 -8.2925 -8.1936 -8.1936 -7.8315 -7.8315 -7.6246 -7.6246 -7.5102 -7.5102 -7.4177 -7.4177 -7.2943 -7.2943 -7.2235 -7.2235 -6.2611 -6.2611 -0.0054 -0.0054 1.0605 1.0605 1.8139 1.8139 2.2108 2.2108 3.4496 3.4496 3.5625 3.5625 3.8481 3.8481 4.2112 4.2112 4.2781 4.2781 4.5193 4.5193 4.6943 4.6943 4.9413 4.9413 8.1751 8.1751 9.2505 9.2505 11.1888 11.1888 11.5045 11.5045 12.6559 12.6559 k = 0.0000 0.0800 0.2088 ( 5108 PWs) bands (ev): -12.9482 -12.9482 -12.0566 -12.0566 -8.8839 -8.8839 -8.8511 -8.8511 -8.3887 -8.3887 -8.2934 -8.2934 -8.1932 -8.1932 -7.8337 -7.8337 -7.6253 -7.6253 -7.5094 -7.5094 -7.4185 -7.4185 -7.2915 -7.2915 -7.2263 -7.2263 -6.2474 -6.2474 0.0032 0.0032 1.0352 1.0352 1.8011 1.8011 2.2491 2.2491 3.4883 3.4883 3.5836 3.5836 3.8592 3.8592 4.2278 4.2278 4.2581 4.2581 4.5327 4.5327 4.6931 4.6931 4.9450 4.9450 8.1406 8.1406 9.2340 9.2340 11.1354 11.1354 11.5025 11.5025 12.6365 12.6365 k = 0.0000 0.0686 0.2088 ( 5104 PWs) bands (ev): -12.9555 -12.9555 -12.0550 -12.0550 -8.8861 -8.8861 -8.8526 -8.8526 -8.3890 -8.3890 -8.2943 -8.2943 -8.1927 -8.1927 -7.8357 -7.8357 -7.6258 -7.6258 -7.5086 -7.5086 -7.4192 -7.4192 -7.2885 -7.2885 -7.2291 -7.2291 -6.2355 -6.2355 0.0112 0.0112 1.0129 1.0129 1.7898 1.7898 2.2824 2.2824 3.5201 3.5201 3.6100 3.6100 3.8687 3.8687 4.2269 4.2269 4.2503 4.2503 4.5449 4.5449 4.6921 4.6921 4.9486 4.9486 8.1101 8.1101 9.2193 9.2193 11.0879 11.0879 11.5001 11.5001 12.6191 12.6191 k = 0.0000 0.0572 0.2088 ( 5110 PWs) bands (ev): -12.9617 -12.9617 -12.0537 -12.0537 -8.8881 -8.8881 -8.8539 -8.8539 -8.3893 -8.3893 -8.2951 -8.2951 -8.1923 -8.1923 -7.8375 -7.8375 -7.6263 -7.6263 -7.5080 -7.5080 -7.4199 -7.4199 -7.2855 -7.2855 -7.2321 -7.2321 -6.2253 -6.2253 0.0185 0.0185 0.9937 0.9937 1.7802 1.7802 2.3105 2.3105 3.5428 3.5428 3.6433 3.6433 3.8768 3.8768 4.2019 4.2019 4.2620 4.2620 4.5557 4.5557 4.6913 4.6913 4.9521 4.9521 8.0839 8.0839 9.2065 9.2065 11.0467 11.0467 11.4974 11.4974 12.6041 12.6041 k = 0.0000 0.0457 0.2088 ( 5112 PWs) bands (ev): -12.9668 -12.9668 -12.0526 -12.0526 -8.8897 -8.8897 -8.8549 -8.8549 -8.3895 -8.3895 -8.2957 -8.2957 -8.1919 -8.1919 -7.8390 -7.8390 -7.6267 -7.6267 -7.5074 -7.5074 -7.4205 -7.4205 -7.2827 -7.2827 -7.2348 -7.2348 -6.2170 -6.2170 0.0247 0.0247 0.9776 0.9776 1.7723 1.7723 2.3335 2.3335 3.5577 3.5577 3.6810 3.6810 3.8834 3.8834 4.1735 4.1735 4.2733 4.2733 4.5648 4.5648 4.6906 4.6906 4.9552 4.9552 8.0622 8.0622 9.1958 9.1958 11.0124 11.0124 11.4946 11.4946 12.5915 12.5915 k = 0.0000 0.0343 0.2088 ( 5120 PWs) bands (ev): -12.9707 -12.9707 -12.0518 -12.0518 -8.8909 -8.8909 -8.8558 -8.8558 -8.3897 -8.3897 -8.2963 -8.2963 -8.1916 -8.1916 -7.8403 -7.8403 -7.6270 -7.6270 -7.5069 -7.5069 -7.4210 -7.4210 -7.2801 -7.2801 -7.2374 -7.2374 -6.2105 -6.2105 0.0298 0.0298 0.9650 0.9650 1.7661 1.7661 2.3514 2.3514 3.5673 3.5673 3.7187 3.7187 3.8885 3.8885 4.1449 4.1449 4.2825 4.2825 4.5721 4.5721 4.6901 4.6901 4.9578 4.9578 8.0451 8.0451 9.1874 9.1874 10.9853 10.9853 11.4921 11.4921 12.5815 12.5815 k = 0.0000 0.0229 0.2088 ( 5120 PWs) bands (ev): -12.9736 -12.9736 -12.0512 -12.0512 -8.8918 -8.8918 -8.8564 -8.8564 -8.3898 -8.3898 -8.2966 -8.2966 -8.1914 -8.1914 -7.8411 -7.8411 -7.6273 -7.6273 -7.5066 -7.5066 -7.4214 -7.4214 -7.2780 -7.2780 -7.2395 -7.2395 -6.2058 -6.2058 0.0336 0.0336 0.9558 0.9558 1.7617 1.7617 2.3641 2.3641 3.5734 3.5734 3.7517 3.7517 3.8922 3.8922 4.1191 4.1191 4.2892 4.2892 4.5774 4.5774 4.6896 4.6896 4.9597 4.9597 8.0328 8.0328 9.1812 9.1812 10.9658 10.9658 11.4901 11.4901 12.5742 12.5742 k = 0.0000 0.0114 0.2088 ( 5120 PWs) bands (ev): -12.9753 -12.9753 -12.0509 -12.0509 -8.8924 -8.8924 -8.8567 -8.8567 -8.3899 -8.3899 -8.2969 -8.2969 -8.1912 -8.1912 -7.8417 -7.8417 -7.6274 -7.6274 -7.5064 -7.5064 -7.4216 -7.4216 -7.2766 -7.2766 -7.2408 -7.2408 -6.2030 -6.2030 0.0359 0.0359 0.9503 0.9503 1.7590 1.7590 2.3717 2.3717 3.5768 3.5768 3.7750 3.7750 3.8944 3.8944 4.1004 4.1004 4.2932 4.2932 4.5806 4.5806 4.6894 4.6894 4.9610 4.9610 8.0253 8.0253 9.1775 9.1775 10.9541 10.9541 11.4888 11.4888 12.5699 12.5699 k = 0.0000 0.0000 0.2088 ( 5128 PWs) bands (ev): -12.9759 -12.9759 -12.0508 -12.0508 -8.8926 -8.8926 -8.8568 -8.8568 -8.3900 -8.3900 -8.2970 -8.2970 -8.1912 -8.1912 -7.8419 -7.8419 -7.6275 -7.6275 -7.5063 -7.5063 -7.4217 -7.4217 -7.2761 -7.2761 -7.2414 -7.2414 -6.2021 -6.2021 0.0367 0.0367 0.9485 0.9485 1.7581 1.7581 2.3742 2.3742 3.5779 3.5779 3.7835 3.7835 3.8952 3.8952 4.0934 4.0934 4.2946 4.2946 4.5817 4.5817 4.6893 4.6893 4.9614 4.9614 8.0229 8.0229 9.1763 9.1763 10.9501 10.9501 11.4883 11.4883 12.5685 12.5685 k = 0.0000 0.4459-0.0000 ( 5070 PWs) bands (ev): -12.3711 -12.3711 -12.3711 -12.3711 -8.7831 -8.7831 -8.7831 -8.7831 -8.3324 -8.3324 -8.3324 -8.3324 -7.9579 -7.9579 -7.9579 -7.9579 -7.5586 -7.5586 -7.5586 -7.5586 -7.3078 -7.3078 -7.3078 -7.3078 -7.0529 -7.0529 -7.0529 -7.0529 0.2704 0.2704 0.2704 0.2704 2.3489 2.3489 2.3489 2.3489 2.8610 2.8610 2.8610 2.8610 3.5932 3.5932 3.5932 3.5932 3.8174 3.8174 3.8174 3.8174 4.8370 4.8370 4.8370 4.8370 9.6571 9.6571 9.6571 9.6571 11.4592 11.4592 11.4592 11.4592 14.0939 14.0939 k = 0.0000 0.4459 0.0110 ( 5066 PWs) bands (ev): -12.3711 -12.3711 -12.3711 -12.3711 -8.7831 -8.7831 -8.7831 -8.7831 -8.3324 -8.3324 -8.3324 -8.3324 -7.9579 -7.9579 -7.9579 -7.9579 -7.5585 -7.5585 -7.5585 -7.5585 -7.3078 -7.3078 -7.3078 -7.3078 -7.0529 -7.0529 -7.0529 -7.0529 0.2705 0.2705 0.2705 0.2705 2.3497 2.3497 2.3497 2.3497 2.8609 2.8609 2.8609 2.8609 3.5840 3.5840 3.5840 3.5840 3.8259 3.8259 3.8259 3.8259 4.8370 4.8370 4.8370 4.8370 9.6566 9.6566 9.6566 9.6566 11.4603 11.4603 11.4603 11.4603 14.0917 14.0917 k = 0.0000 0.4459 0.0220 ( 5072 PWs) bands (ev): -12.3711 -12.3711 -12.3711 -12.3711 -8.7831 -8.7831 -8.7831 -8.7831 -8.3324 -8.3324 -8.3324 -8.3324 -7.9580 -7.9580 -7.9580 -7.9580 -7.5586 -7.5586 -7.5586 -7.5586 -7.3079 -7.3079 -7.3079 -7.3079 -7.0529 -7.0529 -7.0529 -7.0529 0.2707 0.2707 0.2707 0.2707 2.3519 2.3519 2.3519 2.3519 2.8608 2.8608 2.8608 2.8608 3.5599 3.5599 3.5599 3.5599 3.8481 3.8481 3.8481 3.8481 4.8372 4.8372 4.8372 4.8372 9.6551 9.6551 9.6551 9.6551 11.4635 11.4635 11.4635 11.4635 14.0851 14.0851 k = 0.0000 0.4459 0.0330 ( 5076 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7831 -8.7831 -8.7831 -8.7831 -8.3325 -8.3325 -8.3325 -8.3325 -7.9580 -7.9580 -7.9580 -7.9580 -7.5586 -7.5586 -7.5586 -7.5586 -7.3079 -7.3079 -7.3079 -7.3079 -7.0529 -7.0529 -7.0529 -7.0529 0.2711 0.2711 0.2711 0.2711 2.3556 2.3556 2.3556 2.3556 2.8606 2.8606 2.8606 2.8606 3.5268 3.5268 3.5268 3.5268 3.8780 3.8780 3.8780 3.8780 4.8374 4.8374 4.8374 4.8374 9.6527 9.6527 9.6527 9.6527 11.4687 11.4687 11.4687 11.4687 14.0744 14.0744 k = 0.0000 0.4459 0.0439 ( 5088 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7831 -8.7831 -8.7831 -8.7831 -8.3326 -8.3326 -8.3326 -8.3326 -7.9581 -7.9581 -7.9581 -7.9581 -7.5587 -7.5587 -7.5587 -7.5587 -7.3080 -7.3080 -7.3080 -7.3080 -7.0528 -7.0528 -7.0528 -7.0528 0.2717 0.2717 0.2717 0.2717 2.3607 2.3607 2.3607 2.3607 2.8602 2.8602 2.8602 2.8602 3.4889 3.4889 3.4889 3.4889 3.9115 3.9115 3.9115 3.9115 4.8377 4.8377 4.8377 4.8377 9.6494 9.6494 9.6494 9.6494 11.4759 11.4759 11.4759 11.4759 14.0598 14.0598 k = 0.0000 0.4459 0.0549 ( 5078 PWs) bands (ev): -12.3711 -12.3711 -12.3711 -12.3711 -8.7831 -8.7831 -8.7831 -8.7831 -8.3325 -8.3325 -8.3325 -8.3325 -7.9581 -7.9581 -7.9581 -7.9581 -7.5586 -7.5586 -7.5586 -7.5586 -7.3080 -7.3080 -7.3080 -7.3080 -7.0527 -7.0527 -7.0527 -7.0527 0.2724 0.2724 0.2724 0.2724 2.3672 2.3672 2.3672 2.3672 2.8598 2.8598 2.8598 2.8598 3.4486 3.4486 3.4486 3.4486 3.9463 3.9463 3.9463 3.9463 4.8381 4.8381 4.8381 4.8381 9.6453 9.6453 9.6453 9.6453 11.4848 11.4848 11.4848 11.4848 14.0419 14.0419 k = 0.0000 0.4459 0.0659 ( 5076 PWs) bands (ev): -12.3711 -12.3711 -12.3711 -12.3711 -8.7830 -8.7830 -8.7830 -8.7830 -8.3325 -8.3325 -8.3325 -8.3325 -7.9581 -7.9581 -7.9581 -7.9581 -7.5586 -7.5586 -7.5586 -7.5586 -7.3081 -7.3081 -7.3081 -7.3081 -7.0526 -7.0526 -7.0526 -7.0526 0.2732 0.2732 0.2732 0.2732 2.3751 2.3751 2.3751 2.3751 2.8593 2.8593 2.8593 2.8593 3.4073 3.4073 3.4073 3.4073 3.9809 3.9809 3.9809 3.9809 4.8385 4.8385 4.8385 4.8385 9.6406 9.6406 9.6406 9.6406 11.4952 11.4952 11.4952 11.4952 14.0210 14.0210 k = 0.0000 0.4459 0.0769 ( 5076 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7830 -8.7830 -8.7830 -8.7830 -8.3326 -8.3326 -8.3326 -8.3326 -7.9581 -7.9581 -7.9581 -7.9581 -7.5586 -7.5586 -7.5586 -7.5586 -7.3081 -7.3081 -7.3081 -7.3081 -7.0525 -7.0525 -7.0525 -7.0525 0.2741 0.2741 0.2741 0.2741 2.3842 2.3842 2.3842 2.3842 2.8586 2.8586 2.8586 2.8586 3.3658 3.3658 3.3658 3.3658 4.0146 4.0146 4.0146 4.0146 4.8391 4.8391 4.8391 4.8391 9.6353 9.6353 9.6353 9.6353 11.5069 11.5069 11.5069 11.5069 13.9978 13.9979 k = 0.0000 0.4459 0.0879 ( 5074 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7829 -8.7829 -8.7829 -8.7829 -8.3326 -8.3326 -8.3326 -8.3326 -7.9582 -7.9582 -7.9582 -7.9582 -7.5586 -7.5586 -7.5586 -7.5586 -7.3081 -7.3081 -7.3081 -7.3081 -7.0524 -7.0524 -7.0524 -7.0524 0.2751 0.2751 0.2751 0.2751 2.3945 2.3945 2.3945 2.3945 2.8577 2.8577 2.8577 2.8577 3.3248 3.3248 3.3248 3.3248 4.0468 4.0468 4.0468 4.0468 4.8397 4.8397 4.8397 4.8397 9.6297 9.6297 9.6297 9.6297 11.5195 11.5195 11.5195 11.5195 13.9731 13.9731 k = 0.0000 0.4459 0.0989 ( 5078 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7829 -8.7829 -8.7829 -8.7829 -8.3327 -8.3327 -8.3327 -8.3327 -7.9583 -7.9583 -7.9583 -7.9583 -7.5587 -7.5587 -7.5587 -7.5587 -7.3082 -7.3082 -7.3082 -7.3082 -7.0523 -7.0523 -7.0523 -7.0523 0.2761 0.2761 0.2761 0.2761 2.4059 2.4059 2.4059 2.4059 2.8566 2.8566 2.8566 2.8566 3.2848 3.2848 3.2848 3.2848 4.0772 4.0772 4.0772 4.0772 4.8404 4.8404 4.8404 4.8404 9.6239 9.6239 9.6239 9.6239 11.5327 11.5327 11.5327 11.5327 13.9473 13.9473 k = 0.0000 0.4459 0.1099 ( 5078 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7828 -8.7828 -8.7828 -8.7828 -8.3327 -8.3327 -8.3327 -8.3327 -7.9583 -7.9583 -7.9583 -7.9583 -7.5587 -7.5587 -7.5587 -7.5587 -7.3083 -7.3083 -7.3083 -7.3083 -7.0522 -7.0522 -7.0522 -7.0522 0.2772 0.2772 0.2772 0.2772 2.4181 2.4181 2.4181 2.4181 2.8552 2.8552 2.8552 2.8552 3.2464 3.2464 3.2464 3.2464 4.1054 4.1054 4.1054 4.1054 4.8411 4.8411 4.8411 4.8411 9.6181 9.6181 9.6181 9.6181 11.5462 11.5462 11.5462 11.5462 13.9213 13.9213 k = 0.0000 0.4459 0.1209 ( 5090 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7828 -8.7828 -8.7828 -8.7828 -8.3328 -8.3328 -8.3328 -8.3328 -7.9585 -7.9585 -7.9585 -7.9585 -7.5587 -7.5587 -7.5587 -7.5587 -7.3085 -7.3085 -7.3085 -7.3085 -7.0521 -7.0521 -7.0521 -7.0521 0.2782 0.2782 0.2782 0.2782 2.4310 2.4310 2.4310 2.4310 2.8536 2.8536 2.8536 2.8536 3.2100 3.2100 3.2100 3.2100 4.1312 4.1312 4.1312 4.1312 4.8418 4.8418 4.8418 4.8418 9.6124 9.6124 9.6124 9.6124 11.5597 11.5597 11.5597 11.5597 13.8957 13.8957 k = 0.0000 0.4459 0.1318 ( 5094 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7828 -8.7828 -8.7828 -8.7828 -8.3328 -8.3328 -8.3328 -8.3328 -7.9585 -7.9585 -7.9585 -7.9585 -7.5588 -7.5588 -7.5588 -7.5588 -7.3086 -7.3086 -7.3086 -7.3086 -7.0520 -7.0520 -7.0520 -7.0520 0.2792 0.2792 0.2792 0.2792 2.4442 2.4442 2.4442 2.4442 2.8516 2.8516 2.8516 2.8516 3.1760 3.1760 3.1760 3.1760 4.1544 4.1544 4.1544 4.1544 4.8425 4.8425 4.8425 4.8425 9.6069 9.6069 9.6070 9.6070 11.5727 11.5727 11.5727 11.5727 13.8712 13.8712 k = 0.0000 0.4459 0.1428 ( 5096 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7828 -8.7828 -8.7828 -8.7828 -8.3328 -8.3328 -8.3328 -8.3328 -7.9586 -7.9586 -7.9586 -7.9586 -7.5588 -7.5588 -7.5588 -7.5588 -7.3086 -7.3086 -7.3086 -7.3086 -7.0520 -7.0520 -7.0520 -7.0520 0.2801 0.2801 0.2801 0.2801 2.4575 2.4575 2.4575 2.4575 2.8493 2.8493 2.8493 2.8493 3.1452 3.1452 3.1452 3.1452 4.1748 4.1748 4.1748 4.1748 4.8432 4.8432 4.8432 4.8432 9.6019 9.6019 9.6019 9.6019 11.5848 11.5848 11.5848 11.5848 13.8486 13.8486 k = 0.0000 0.4459 0.1538 ( 5094 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7827 -8.7827 -8.7827 -8.7827 -8.3329 -8.3329 -8.3329 -8.3329 -7.9586 -7.9586 -7.9586 -7.9586 -7.5588 -7.5588 -7.5588 -7.5588 -7.3087 -7.3087 -7.3087 -7.3087 -7.0519 -7.0519 -7.0519 -7.0519 0.2809 0.2809 0.2809 0.2809 2.4704 2.4704 2.4704 2.4704 2.8466 2.8466 2.8466 2.8466 3.1179 3.1179 3.1179 3.1179 4.1923 4.1923 4.1923 4.1923 4.8438 4.8438 4.8438 4.8438 9.5974 9.5974 9.5974 9.5974 11.5959 11.5959 11.5959 11.5959 13.8282 13.8282 k = 0.0000 0.4459 0.1648 ( 5094 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7827 -8.7827 -8.7827 -8.7827 -8.3329 -8.3329 -8.3329 -8.3329 -7.9587 -7.9587 -7.9587 -7.9587 -7.5588 -7.5588 -7.5588 -7.5588 -7.3087 -7.3087 -7.3087 -7.3087 -7.0518 -7.0518 -7.0518 -7.0518 0.2816 0.2816 0.2816 0.2816 2.4823 2.4823 2.4823 2.4823 2.8438 2.8438 2.8438 2.8438 3.0947 3.0947 3.0947 3.0947 4.2067 4.2067 4.2067 4.2067 4.8444 4.8444 4.8444 4.8444 9.5936 9.5936 9.5936 9.5936 11.6054 11.6054 11.6054 11.6054 13.8108 13.8108 k = 0.0000 0.4459 0.1758 ( 5092 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7827 -8.7827 -8.7827 -8.7827 -8.3329 -8.3329 -8.3329 -8.3329 -7.9587 -7.9587 -7.9587 -7.9587 -7.5588 -7.5588 -7.5588 -7.5588 -7.3088 -7.3088 -7.3088 -7.3088 -7.0517 -7.0517 -7.0517 -7.0517 0.2822 0.2822 0.2822 0.2822 2.4926 2.4926 2.4926 2.4926 2.8409 2.8409 2.8409 2.8409 3.0762 3.0762 3.0762 3.0762 4.2180 4.2180 4.2180 4.2180 4.8449 4.8449 4.8449 4.8449 9.5905 9.5905 9.5905 9.5905 11.6131 11.6131 11.6131 11.6131 13.7968 13.7968 k = 0.0000 0.4459 0.1868 ( 5084 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7826 -8.7826 -8.7826 -8.7826 -8.3328 -8.3328 -8.3328 -8.3328 -7.9587 -7.9587 -7.9587 -7.9587 -7.5587 -7.5587 -7.5587 -7.5587 -7.3088 -7.3088 -7.3088 -7.3088 -7.0516 -7.0516 -7.0516 -7.0516 0.2826 0.2826 0.2826 0.2826 2.5006 2.5006 2.5006 2.5006 2.8385 2.8385 2.8385 2.8385 3.0628 3.0628 3.0628 3.0628 4.2262 4.2262 4.2262 4.2262 4.8452 4.8452 4.8452 4.8452 9.5882 9.5882 9.5882 9.5882 11.6188 11.6188 11.6189 11.6189 13.7865 13.7865 k = 0.0000 0.4459 0.1978 ( 5080 PWs) bands (ev): -12.3712 -12.3712 -12.3712 -12.3712 -8.7826 -8.7826 -8.7826 -8.7826 -8.3328 -8.3328 -8.3328 -8.3328 -7.9587 -7.9587 -7.9587 -7.9587 -7.5587 -7.5587 -7.5587 -7.5587 -7.3087 -7.3087 -7.3087 -7.3087 -7.0516 -7.0516 -7.0516 -7.0516 0.2829 0.2829 0.2829 0.2829 2.5057 2.5057 2.5057 2.5057 2.8367 2.8367 2.8367 2.8367 3.0546 3.0546 3.0546 3.0546 4.2311 4.2311 4.2311 4.2311 4.8454 4.8454 4.8454 4.8454 9.5869 9.5869 9.5869 9.5869 11.6223 11.6223 11.6224 11.6224 13.7802 13.7802 k = 0.0000 0.4459 0.2088 ( 5068 PWs) bands (ev): -12.3711 -12.3711 -12.3711 -12.3711 -8.7826 -8.7826 -8.7826 -8.7826 -8.3328 -8.3328 -8.3328 -8.3328 -7.9586 -7.9586 -7.9586 -7.9586 -7.5587 -7.5587 -7.5587 -7.5587 -7.3087 -7.3087 -7.3087 -7.3087 -7.0515 -7.0515 -7.0515 -7.0515 0.2829 0.2829 0.2829 0.2829 2.5075 2.5075 2.5075 2.5075 2.8361 2.8361 2.8361 2.8361 3.0518 3.0518 3.0518 3.0518 4.2327 4.2327 4.2327 4.2327 4.8455 4.8455 4.8455 4.8455 9.5864 9.5864 9.5864 9.5864 11.6235 11.6235 11.6235 11.6235 13.7781 13.7781 k = 0.5000-0.0000 0.2088 ( 5092 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8518 -8.8518 -8.8518 -8.8518 -8.2352 -8.2352 -8.2352 -8.2352 -7.8428 -7.8428 -7.8428 -7.8428 -7.4733 -7.4733 -7.4733 -7.4733 -7.2503 -7.2503 -7.2503 -7.2503 -6.5401 -6.5401 -6.5401 -6.5401 0.3520 0.3520 0.3520 0.3520 1.5656 1.5656 1.5656 1.5656 2.2386 2.2386 2.2386 2.2386 2.4537 2.4537 2.4537 2.4537 4.5121 4.5121 4.5121 4.5121 4.8224 4.8224 4.8224 4.8224 9.1362 9.1362 9.1362 9.1362 13.0109 13.0109 13.0109 13.0109 14.0362 14.0362 k = 0.5000-0.0000 0.1978 ( 5088 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8517 -8.8517 -8.8517 -8.8517 -8.2352 -8.2352 -8.2352 -8.2352 -7.8428 -7.8428 -7.8428 -7.8428 -7.4733 -7.4733 -7.4733 -7.4733 -7.2503 -7.2503 -7.2503 -7.2503 -6.5400 -6.5400 -6.5400 -6.5400 0.3516 0.3516 0.3516 0.3516 1.5642 1.5642 1.5642 1.5642 2.2415 2.2415 2.2415 2.2415 2.4538 2.4538 2.4538 2.4538 4.5108 4.5108 4.5108 4.5108 4.8219 4.8219 4.8219 4.8219 9.1371 9.1371 9.1371 9.1371 13.0077 13.0077 13.0077 13.0077 14.0360 14.0360 k = 0.5000-0.0000 0.1868 ( 5088 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8518 -8.8518 -8.8518 -8.8518 -8.2352 -8.2352 -8.2352 -8.2352 -7.8427 -7.8427 -7.8427 -7.8427 -7.4733 -7.4733 -7.4733 -7.4733 -7.2502 -7.2502 -7.2502 -7.2502 -6.5400 -6.5400 -6.5400 -6.5400 0.3506 0.3506 0.3506 0.3506 1.5601 1.5601 1.5601 1.5601 2.2501 2.2501 2.2501 2.2501 2.4540 2.4540 2.4540 2.4540 4.5068 4.5068 4.5068 4.5068 4.8206 4.8206 4.8206 4.8206 9.1398 9.1398 9.1398 9.1398 12.9984 12.9984 12.9984 12.9984 14.0354 14.0354 k = 0.5000-0.0000 0.1758 ( 5084 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8517 -8.8517 -8.8517 -8.8517 -8.2353 -8.2353 -8.2353 -8.2353 -7.8427 -7.8427 -7.8427 -7.8427 -7.4733 -7.4733 -7.4733 -7.4733 -7.2502 -7.2502 -7.2502 -7.2502 -6.5399 -6.5399 -6.5399 -6.5399 0.3489 0.3489 0.3489 0.3489 1.5535 1.5535 1.5535 1.5535 2.2641 2.2641 2.2641 2.2641 2.4545 2.4545 2.4545 2.4545 4.5002 4.5002 4.5002 4.5002 4.8185 4.8185 4.8185 4.8185 9.1442 9.1442 9.1442 9.1442 12.9834 12.9834 12.9834 12.9834 14.0342 14.0342 k = 0.5000-0.0000 0.1648 ( 5092 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8517 -8.8517 -8.8517 -8.8517 -8.2354 -8.2354 -8.2354 -8.2354 -7.8427 -7.8427 -7.8427 -7.8427 -7.4735 -7.4735 -7.4735 -7.4735 -7.2502 -7.2502 -7.2502 -7.2502 -6.5397 -6.5397 -6.5397 -6.5397 0.3466 0.3466 0.3466 0.3466 1.5450 1.5450 1.5450 1.5450 2.2826 2.2826 2.2826 2.2826 2.4553 2.4553 2.4553 2.4553 4.4910 4.4910 4.4910 4.4910 4.8157 4.8157 4.8157 4.8157 9.1501 9.1501 9.1501 9.1501 12.9635 12.9635 12.9635 12.9635 14.0325 14.0325 k = 0.5000-0.0000 0.1538 ( 5092 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8517 -8.8517 -8.8517 -8.8517 -8.2355 -8.2355 -8.2355 -8.2355 -7.8426 -7.8426 -7.8426 -7.8426 -7.4736 -7.4736 -7.4736 -7.4736 -7.2502 -7.2502 -7.2502 -7.2502 -6.5395 -6.5395 -6.5395 -6.5395 0.3438 0.3438 0.3438 0.3438 1.5351 1.5351 1.5351 1.5351 2.3049 2.3049 2.3049 2.3049 2.4564 2.4564 2.4564 2.4564 4.4792 4.4792 4.4792 4.4792 4.8125 4.8125 4.8125 4.8125 9.1575 9.1575 9.1575 9.1575 12.9396 12.9396 12.9396 12.9396 14.0303 14.0303 k = 0.5000-0.0000 0.1428 ( 5090 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8517 -8.8517 -8.8517 -8.8517 -8.2355 -8.2355 -8.2355 -8.2355 -7.8425 -7.8425 -7.8425 -7.8425 -7.4737 -7.4737 -7.4737 -7.4737 -7.2501 -7.2501 -7.2501 -7.2501 -6.5393 -6.5393 -6.5393 -6.5393 0.3405 0.3405 0.3405 0.3405 1.5241 1.5241 1.5241 1.5241 2.3300 2.3300 2.3300 2.3300 2.4583 2.4583 2.4583 2.4583 4.4651 4.4651 4.4651 4.4651 4.8090 4.8090 4.8090 4.8090 9.1662 9.1662 9.1662 9.1662 12.9128 12.9128 12.9128 12.9128 14.0275 14.0275 k = 0.5000-0.0000 0.1318 ( 5086 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8517 -8.8517 -8.8517 -8.8517 -8.2356 -8.2356 -8.2356 -8.2356 -7.8425 -7.8425 -7.8425 -7.8425 -7.4738 -7.4738 -7.4738 -7.4738 -7.2501 -7.2501 -7.2501 -7.2501 -6.5390 -6.5390 -6.5390 -6.5390 0.3369 0.3369 0.3369 0.3369 1.5127 1.5127 1.5127 1.5127 2.3564 2.3564 2.3564 2.3564 2.4614 2.4614 2.4614 2.4614 4.4487 4.4487 4.4487 4.4487 4.8054 4.8054 4.8054 4.8054 9.1758 9.1758 9.1758 9.1758 12.8839 12.8839 12.8839 12.8839 14.0243 14.0243 k = 0.5000-0.0000 0.1209 ( 5078 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8517 -8.8517 -8.8517 -8.8517 -8.2357 -8.2357 -8.2357 -8.2357 -7.8423 -7.8423 -7.8423 -7.8423 -7.4739 -7.4739 -7.4739 -7.4739 -7.2501 -7.2501 -7.2501 -7.2501 -6.5387 -6.5387 -6.5387 -6.5387 0.3330 0.3330 0.3330 0.3330 1.5012 1.5012 1.5012 1.5012 2.3823 2.3823 2.3823 2.3823 2.4669 2.4669 2.4669 2.4669 4.4305 4.4305 4.4305 4.4305 4.8019 4.8019 4.8019 4.8019 9.1862 9.1862 9.1862 9.1862 12.8540 12.8540 12.8540 12.8540 14.0207 14.0207 k = 0.5000-0.0000 0.1099 ( 5074 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8516 -8.8516 -8.8516 -8.8516 -8.2358 -8.2358 -8.2358 -8.2358 -7.8422 -7.8422 -7.8422 -7.8422 -7.4740 -7.4740 -7.4740 -7.4740 -7.2500 -7.2500 -7.2500 -7.2500 -6.5384 -6.5384 -6.5384 -6.5384 0.3289 0.3289 0.3289 0.3289 1.4899 1.4899 1.4899 1.4899 2.4046 2.4046 2.4046 2.4046 2.4770 2.4770 2.4770 2.4770 4.4107 4.4107 4.4107 4.4107 4.7985 4.7985 4.7985 4.7985 9.1970 9.1970 9.1970 9.1970 12.8239 12.8239 12.8239 12.8239 14.0169 14.0169 k = 0.5000-0.0000 0.0989 ( 5074 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8516 -8.8516 -8.8516 -8.8516 -8.2359 -8.2359 -8.2359 -8.2359 -7.8421 -7.8421 -7.8421 -7.8421 -7.4741 -7.4741 -7.4741 -7.4741 -7.2500 -7.2500 -7.2500 -7.2500 -6.5381 -6.5381 -6.5381 -6.5381 0.3248 0.3248 0.3248 0.3248 1.4792 1.4792 1.4792 1.4792 2.4202 2.4202 2.4202 2.4202 2.4941 2.4941 2.4941 2.4941 4.3899 4.3899 4.3899 4.3899 4.7954 4.7954 4.7954 4.7954 9.2080 9.2080 9.2080 9.2080 12.7944 12.7944 12.7944 12.7944 14.0129 14.0129 k = 0.5000-0.0000 0.0879 ( 5086 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8516 -8.8516 -8.8516 -8.8516 -8.2361 -8.2361 -8.2361 -8.2361 -7.8421 -7.8421 -7.8421 -7.8421 -7.4744 -7.4744 -7.4744 -7.4744 -7.2500 -7.2500 -7.2500 -7.2500 -6.5378 -6.5378 -6.5378 -6.5378 0.3207 0.3207 0.3207 0.3207 1.4692 1.4692 1.4692 1.4692 2.4291 2.4291 2.4291 2.4291 2.5172 2.5172 2.5172 2.5172 4.3686 4.3686 4.3686 4.3686 4.7926 4.7926 4.7926 4.7926 9.2188 9.2188 9.2188 9.2188 12.7662 12.7662 12.7662 12.7662 14.0089 14.0089 k = 0.5000-0.0000 0.0769 ( 5080 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8516 -8.8516 -8.8516 -8.8516 -8.2362 -8.2362 -8.2362 -8.2362 -7.8420 -7.8420 -7.8420 -7.8420 -7.4746 -7.4746 -7.4746 -7.4746 -7.2499 -7.2499 -7.2499 -7.2499 -6.5374 -6.5374 -6.5374 -6.5374 0.3168 0.3168 0.3168 0.3168 1.4601 1.4601 1.4601 1.4601 2.4340 2.4340 2.4340 2.4340 2.5432 2.5432 2.5432 2.5432 4.3475 4.3475 4.3475 4.3475 4.7901 4.7901 4.7901 4.7901 9.2292 9.2292 9.2292 9.2292 12.7399 12.7399 12.7399 12.7399 14.0050 14.0050 k = 0.5000-0.0000 0.0659 ( 5082 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8516 -8.8516 -8.8516 -8.8516 -8.2364 -8.2364 -8.2364 -8.2364 -7.8419 -7.8419 -7.8419 -7.8419 -7.4747 -7.4747 -7.4747 -7.4747 -7.2499 -7.2499 -7.2499 -7.2499 -6.5371 -6.5371 -6.5371 -6.5371 0.3132 0.3132 0.3132 0.3132 1.4520 1.4520 1.4520 1.4520 2.4368 2.4368 2.4368 2.4368 2.5692 2.5692 2.5692 2.5692 4.3271 4.3271 4.3271 4.3271 4.7880 4.7880 4.7880 4.7880 9.2390 9.2390 9.2390 9.2390 12.7160 12.7160 12.7160 12.7160 14.0013 14.0013 k = 0.5000-0.0000 0.0549 ( 5078 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8515 -8.8515 -8.8515 -8.8515 -8.2364 -8.2364 -8.2364 -8.2364 -7.8418 -7.8418 -7.8418 -7.8418 -7.4748 -7.4748 -7.4748 -7.4748 -7.2499 -7.2499 -7.2499 -7.2499 -6.5369 -6.5369 -6.5369 -6.5369 0.3100 0.3100 0.3100 0.3100 1.4451 1.4451 1.4451 1.4451 2.4385 2.4385 2.4385 2.4385 2.5935 2.5935 2.5935 2.5935 4.3083 4.3083 4.3083 4.3083 4.7862 4.7862 4.7862 4.7862 9.2477 9.2477 9.2477 9.2477 12.6951 12.6951 12.6951 12.6951 13.9981 13.9981 k = 0.5000-0.0000 0.0439 ( 5078 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8515 -8.8515 -8.8515 -8.8515 -8.2365 -8.2365 -8.2365 -8.2365 -7.8417 -7.8417 -7.8417 -7.8417 -7.4749 -7.4749 -7.4749 -7.4749 -7.2499 -7.2499 -7.2499 -7.2499 -6.5367 -6.5367 -6.5367 -6.5367 0.3072 0.3072 0.3072 0.3072 1.4394 1.4394 1.4394 1.4394 2.4395 2.4395 2.4395 2.4395 2.6149 2.6149 2.6149 2.6149 4.2917 4.2917 4.2917 4.2917 4.7848 4.7848 4.7848 4.7848 9.2552 9.2552 9.2552 9.2552 12.6774 12.6774 12.6774 12.6774 13.9952 13.9952 k = 0.5000-0.0000 0.0330 ( 5080 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8515 -8.8515 -8.8515 -8.8515 -8.2366 -8.2366 -8.2366 -8.2366 -7.8416 -7.8416 -7.8416 -7.8416 -7.4750 -7.4750 -7.4750 -7.4750 -7.2499 -7.2499 -7.2499 -7.2499 -6.5366 -6.5366 -6.5366 -6.5366 0.3050 0.3050 0.3050 0.3050 1.4349 1.4349 1.4349 1.4349 2.4402 2.4402 2.4402 2.4402 2.6324 2.6324 2.6324 2.6324 4.2780 4.2780 4.2780 4.2780 4.7837 4.7837 4.7837 4.7837 9.2612 9.2612 9.2612 9.2612 12.6633 12.6633 12.6633 12.6633 13.9929 13.9929 k = 0.5000-0.0000 0.0220 ( 5080 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8515 -8.8515 -8.8515 -8.8515 -8.2366 -8.2366 -8.2366 -8.2366 -7.8416 -7.8416 -7.8416 -7.8416 -7.4750 -7.4750 -7.4750 -7.4750 -7.2499 -7.2499 -7.2499 -7.2499 -6.5365 -6.5365 -6.5365 -6.5365 0.3033 0.3033 0.3033 0.3033 1.4317 1.4317 1.4317 1.4317 2.4407 2.4407 2.4407 2.4407 2.6455 2.6455 2.6455 2.6455 4.2678 4.2678 4.2678 4.2678 4.7829 4.7829 4.7829 4.7829 9.2657 9.2657 9.2657 9.2657 12.6531 12.6531 12.6531 12.6531 13.9913 13.9913 k = 0.5000-0.0000 0.0110 ( 5076 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8515 -8.8515 -8.8515 -8.8515 -8.2366 -8.2366 -8.2366 -8.2366 -7.8415 -7.8415 -7.8415 -7.8415 -7.4750 -7.4750 -7.4750 -7.4750 -7.2499 -7.2499 -7.2499 -7.2499 -6.5364 -6.5364 -6.5364 -6.5364 0.3023 0.3023 0.3023 0.3023 1.4297 1.4297 1.4297 1.4297 2.4409 2.4409 2.4409 2.4409 2.6535 2.6535 2.6535 2.6535 4.2614 4.2614 4.2614 4.2614 4.7824 4.7824 4.7824 4.7824 9.2684 9.2684 9.2684 9.2684 12.6469 12.6469 12.6469 12.6469 13.9902 13.9902 k = 0.5000-0.0000-0.0000 ( 5076 PWs) bands (ev): -12.4363 -12.4363 -12.4363 -12.4363 -8.8515 -8.8515 -8.8515 -8.8515 -8.2366 -8.2366 -8.2366 -8.2366 -7.8415 -7.8415 -7.8415 -7.8415 -7.4751 -7.4751 -7.4751 -7.4751 -7.2499 -7.2499 -7.2499 -7.2499 -6.5363 -6.5363 -6.5363 -6.5363 0.3020 0.3020 0.3020 0.3020 1.4291 1.4291 1.4291 1.4291 2.4410 2.4410 2.4410 2.4410 2.6563 2.6563 2.6563 2.6563 4.2593 4.2593 4.2593 4.2593 4.7823 4.7823 4.7823 4.7823 9.2693 9.2693 9.2693 9.2693 12.6448 12.6448 12.6448 12.6448 13.9899 13.9899 k = 0.5000 0.4459-0.0000 ( 5108 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7761 -8.7761 -8.7761 -8.7761 -8.2095 -8.2095 -8.2095 -8.2095 -7.8676 -7.8676 -7.8676 -7.8676 -7.4135 -7.4135 -7.4135 -7.4135 -7.2653 -7.2653 -7.2653 -7.2653 -6.6153 -6.6153 -6.6153 -6.6153 -1.0267 -1.0267 -1.0267 -1.0267 1.7265 1.7265 1.7265 1.7265 1.8734 1.8734 1.8734 1.8734 3.6645 3.6645 3.6645 3.6645 4.3541 4.3541 4.3541 4.3541 4.7969 4.7969 4.7969 4.7969 9.5111 9.5111 9.5111 9.5111 10.6193 10.6193 10.6193 10.6193 13.6100 13.6100 k = 0.5000 0.4459 0.0110 ( 5100 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7760 -8.7760 -8.7760 -8.7760 -8.2094 -8.2094 -8.2094 -8.2094 -7.8675 -7.8675 -7.8675 -7.8675 -7.4135 -7.4135 -7.4135 -7.4135 -7.2652 -7.2652 -7.2652 -7.2652 -6.6153 -6.6153 -6.6153 -6.6153 -1.0267 -1.0267 -1.0267 -1.0267 1.7263 1.7263 1.7263 1.7263 1.8735 1.8735 1.8735 1.8735 3.6649 3.6649 3.6649 3.6649 4.3537 4.3537 4.3537 4.3537 4.7968 4.7968 4.7968 4.7968 9.5100 9.5100 9.5100 9.5100 10.6217 10.6217 10.6217 10.6217 13.6116 13.6116 k = 0.5000 0.4459 0.0220 ( 5104 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7761 -8.7761 -8.7761 -8.7761 -8.2094 -8.2094 -8.2094 -8.2094 -7.8675 -7.8675 -7.8675 -7.8675 -7.4136 -7.4136 -7.4136 -7.4136 -7.2652 -7.2652 -7.2652 -7.2652 -6.6154 -6.6154 -6.6154 -6.6154 -1.0266 -1.0266 -1.0266 -1.0266 1.7257 1.7257 1.7257 1.7257 1.8740 1.8740 1.8740 1.8740 3.6661 3.6661 3.6661 3.6661 4.3526 4.3526 4.3526 4.3526 4.7965 4.7965 4.7965 4.7965 9.5067 9.5067 9.5067 9.5067 10.6288 10.6288 10.6288 10.6288 13.6162 13.6162 k = 0.5000 0.4459 0.0330 ( 5096 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7760 -8.7760 -8.7760 -8.7760 -8.2094 -8.2094 -8.2094 -8.2094 -7.8675 -7.8675 -7.8675 -7.8675 -7.4135 -7.4135 -7.4135 -7.4135 -7.2651 -7.2651 -7.2651 -7.2651 -6.6154 -6.6154 -6.6154 -6.6154 -1.0266 -1.0266 -1.0266 -1.0266 1.7248 1.7248 1.7248 1.7248 1.8748 1.8748 1.8748 1.8748 3.6682 3.6682 3.6682 3.6682 4.3508 4.3508 4.3508 4.3508 4.7961 4.7961 4.7961 4.7961 9.5013 9.5013 9.5013 9.5013 10.6407 10.6407 10.6407 10.6407 13.6237 13.6237 k = 0.5000 0.4459 0.0439 ( 5092 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7761 -8.7761 -8.7761 -8.7761 -8.2094 -8.2094 -8.2094 -8.2094 -7.8674 -7.8674 -7.8674 -7.8674 -7.4135 -7.4135 -7.4135 -7.4135 -7.2650 -7.2650 -7.2650 -7.2650 -6.6154 -6.6154 -6.6154 -6.6154 -1.0265 -1.0265 -1.0265 -1.0265 1.7234 1.7234 1.7234 1.7234 1.8759 1.8759 1.8759 1.8759 3.6710 3.6710 3.6710 3.6710 4.3482 4.3482 4.3482 4.3482 4.7955 4.7955 4.7955 4.7955 9.4940 9.4940 9.4940 9.4940 10.6569 10.6569 10.6569 10.6569 13.6339 13.6339 k = 0.5000 0.4459 0.0549 ( 5100 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7761 -8.7761 -8.7761 -8.7761 -8.2094 -8.2094 -8.2094 -8.2094 -7.8674 -7.8674 -7.8674 -7.8674 -7.4136 -7.4136 -7.4136 -7.4136 -7.2650 -7.2650 -7.2650 -7.2650 -6.6156 -6.6156 -6.6156 -6.6156 -1.0264 -1.0264 -1.0264 -1.0264 1.7218 1.7218 1.7218 1.7218 1.8772 1.8772 1.8772 1.8772 3.6745 3.6745 3.6745 3.6745 4.3451 4.3451 4.3451 4.3451 4.7948 4.7948 4.7948 4.7948 9.4850 9.4850 9.4850 9.4850 10.6774 10.6774 10.6774 10.6774 13.6463 13.6463 k = 0.5000 0.4459 0.0659 ( 5104 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7761 -8.7761 -8.7761 -8.7761 -8.2094 -8.2094 -8.2094 -8.2094 -7.8674 -7.8674 -7.8674 -7.8674 -7.4136 -7.4136 -7.4136 -7.4136 -7.2649 -7.2649 -7.2649 -7.2649 -6.6158 -6.6158 -6.6158 -6.6158 -1.0262 -1.0262 -1.0262 -1.0262 1.7198 1.7198 1.7198 1.7198 1.8787 1.8787 1.8787 1.8787 3.6786 3.6786 3.6786 3.6786 4.3415 4.3415 4.3415 4.3415 4.7939 4.7939 4.7939 4.7939 9.4745 9.4745 9.4745 9.4745 10.7018 10.7018 10.7018 10.7018 13.6607 13.6607 k = 0.5000 0.4459 0.0769 ( 5100 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7762 -8.7762 -8.7762 -8.7762 -8.2093 -8.2093 -8.2093 -8.2093 -7.8674 -7.8674 -7.8674 -7.8674 -7.4135 -7.4135 -7.4135 -7.4135 -7.2649 -7.2649 -7.2649 -7.2649 -6.6159 -6.6159 -6.6159 -6.6159 -1.0261 -1.0261 -1.0261 -1.0261 1.7177 1.7177 1.7177 1.7177 1.8804 1.8804 1.8804 1.8804 3.6831 3.6831 3.6831 3.6831 4.3376 4.3376 4.3376 4.3376 4.7930 4.7930 4.7930 4.7930 9.4629 9.4629 9.4629 9.4629 10.7296 10.7296 10.7296 10.7296 13.6765 13.6765 k = 0.5000 0.4459 0.0879 ( 5108 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7762 -8.7762 -8.7762 -8.7762 -8.2093 -8.2093 -8.2093 -8.2093 -7.8674 -7.8674 -7.8674 -7.8674 -7.4136 -7.4136 -7.4136 -7.4136 -7.2648 -7.2648 -7.2648 -7.2648 -6.6161 -6.6161 -6.6161 -6.6161 -1.0259 -1.0259 -1.0259 -1.0259 1.7154 1.7154 1.7154 1.7154 1.8823 1.8823 1.8823 1.8823 3.6879 3.6879 3.6879 3.6879 4.3333 4.3333 4.3333 4.3333 4.7919 4.7919 4.7919 4.7919 9.4505 9.4505 9.4505 9.4505 10.7603 10.7603 10.7603 10.7603 13.6933 13.6933 k = 0.5000 0.4459 0.0989 ( 5104 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7762 -8.7762 -8.7762 -8.7762 -8.2093 -8.2093 -8.2093 -8.2093 -7.8674 -7.8674 -7.8674 -7.8674 -7.4136 -7.4136 -7.4136 -7.4136 -7.2647 -7.2647 -7.2647 -7.2647 -6.6162 -6.6162 -6.6162 -6.6162 -1.0258 -1.0258 -1.0258 -1.0258 1.7130 1.7130 1.7130 1.7130 1.8842 1.8842 1.8842 1.8842 3.6929 3.6929 3.6929 3.6929 4.3289 4.3289 4.3289 4.3289 4.7908 4.7908 4.7908 4.7908 9.4377 9.4377 9.4377 9.4377 10.7934 10.7934 10.7934 10.7934 13.7104 13.7104 k = 0.5000 0.4459 0.1099 ( 5104 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7762 -8.7762 -8.7762 -8.7762 -8.2092 -8.2092 -8.2092 -8.2092 -7.8674 -7.8674 -7.8674 -7.8674 -7.4136 -7.4136 -7.4136 -7.4136 -7.2647 -7.2647 -7.2647 -7.2647 -6.6162 -6.6162 -6.6162 -6.6162 -1.0256 -1.0256 -1.0256 -1.0256 1.7106 1.7106 1.7106 1.7106 1.8862 1.8862 1.8862 1.8862 3.6980 3.6980 3.6980 3.6980 4.3244 4.3244 4.3244 4.3244 4.7897 4.7897 4.7897 4.7897 9.4248 9.4248 9.4248 9.4248 10.8280 10.8280 10.8280 10.8280 13.7272 13.7272 k = 0.5000 0.4459 0.1209 ( 5104 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7763 -8.7763 -8.7763 -8.7763 -8.2092 -8.2092 -8.2092 -8.2092 -7.8674 -7.8674 -7.8674 -7.8674 -7.4136 -7.4136 -7.4136 -7.4136 -7.2645 -7.2645 -7.2645 -7.2645 -6.6164 -6.6164 -6.6164 -6.6164 -1.0254 -1.0254 -1.0254 -1.0254 1.7082 1.7082 1.7082 1.7082 1.8882 1.8882 1.8882 1.8882 3.7030 3.7030 3.7030 3.7030 4.3200 4.3200 4.3200 4.3200 4.7886 4.7886 4.7886 4.7886 9.4122 9.4122 9.4122 9.4122 10.8635 10.8635 10.8635 10.8635 13.7419 13.7419 k = 0.5000 0.4459 0.1318 ( 5108 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7763 -8.7763 -8.7763 -8.7763 -8.2092 -8.2092 -8.2092 -8.2092 -7.8674 -7.8674 -7.8674 -7.8674 -7.4135 -7.4135 -7.4135 -7.4135 -7.2645 -7.2645 -7.2645 -7.2645 -6.6166 -6.6166 -6.6166 -6.6166 -1.0253 -1.0253 -1.0253 -1.0253 1.7060 1.7060 1.7060 1.7060 1.8901 1.8901 1.8901 1.8901 3.7078 3.7078 3.7078 3.7078 4.3158 4.3158 4.3158 4.3158 4.7875 4.7875 4.7875 4.7875 9.4001 9.4001 9.4001 9.4001 10.8987 10.8987 10.8987 10.8987 13.7090 13.7090 k = 0.5000 0.4459 0.1428 ( 5104 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7763 -8.7763 -8.7763 -8.7763 -8.2092 -8.2092 -8.2092 -8.2092 -7.8673 -7.8673 -7.8673 -7.8673 -7.4135 -7.4135 -7.4135 -7.4135 -7.2644 -7.2644 -7.2644 -7.2644 -6.6167 -6.6167 -6.6167 -6.6167 -1.0251 -1.0251 -1.0251 -1.0251 1.7039 1.7039 1.7039 1.7039 1.8918 1.8918 1.8918 1.8918 3.7122 3.7122 3.7122 3.7122 4.3120 4.3120 4.3120 4.3120 4.7865 4.7865 4.7865 4.7865 9.3890 9.3890 9.3890 9.3890 10.9328 10.9328 10.9328 10.9328 13.6296 13.6296 k = 0.5000 0.4459 0.1538 ( 5104 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7763 -8.7763 -8.7763 -8.7763 -8.2092 -8.2092 -8.2092 -8.2092 -7.8673 -7.8673 -7.8673 -7.8673 -7.4135 -7.4135 -7.4135 -7.4135 -7.2644 -7.2644 -7.2644 -7.2644 -6.6168 -6.6168 -6.6168 -6.6168 -1.0250 -1.0250 -1.0250 -1.0250 1.7020 1.7020 1.7020 1.7020 1.8934 1.8934 1.8934 1.8934 3.7162 3.7162 3.7162 3.7162 4.3085 4.3085 4.3085 4.3085 4.7855 4.7855 4.7855 4.7855 9.3790 9.3790 9.3790 9.3790 10.9644 10.9644 10.9644 10.9644 13.5578 13.5578 k = 0.5000 0.4459 0.1648 ( 5096 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7763 -8.7763 -8.7763 -8.7763 -8.2091 -8.2091 -8.2091 -8.2091 -7.8673 -7.8673 -7.8673 -7.8673 -7.4135 -7.4135 -7.4135 -7.4135 -7.2643 -7.2643 -7.2643 -7.2643 -6.6168 -6.6168 -6.6168 -6.6168 -1.0249 -1.0249 -1.0249 -1.0249 1.7004 1.7004 1.7004 1.7004 1.8947 1.8947 1.8947 1.8947 3.7196 3.7196 3.7196 3.7196 4.3056 4.3056 4.3056 4.3056 4.7847 4.7847 4.7847 4.7847 9.3706 9.3706 9.3706 9.3706 10.9926 10.9926 10.9926 10.9926 13.4964 13.4964 k = 0.5000 0.4459 0.1758 ( 5084 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7763 -8.7763 -8.7763 -8.7763 -8.2090 -8.2090 -8.2090 -8.2090 -7.8672 -7.8672 -7.8672 -7.8672 -7.4134 -7.4134 -7.4134 -7.4134 -7.2642 -7.2642 -7.2642 -7.2642 -6.6168 -6.6168 -6.6168 -6.6168 -1.0248 -1.0248 -1.0248 -1.0248 1.6991 1.6991 1.6991 1.6991 1.8958 1.8958 1.8958 1.8958 3.7223 3.7223 3.7223 3.7223 4.3032 4.3032 4.3032 4.3032 4.7841 4.7841 4.7841 4.7841 9.3637 9.3637 9.3637 9.3637 11.0160 11.0160 11.0160 11.0160 13.4470 13.4470 k = 0.5000 0.4459 0.1868 ( 5088 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7763 -8.7763 -8.7763 -8.7763 -8.2090 -8.2090 -8.2090 -8.2090 -7.8673 -7.8673 -7.8673 -7.8673 -7.4134 -7.4134 -7.4134 -7.4134 -7.2642 -7.2642 -7.2642 -7.2642 -6.6169 -6.6169 -6.6169 -6.6169 -1.0247 -1.0247 -1.0247 -1.0247 1.6982 1.6982 1.6982 1.6982 1.8966 1.8966 1.8966 1.8966 3.7243 3.7243 3.7243 3.7243 4.3015 4.3015 4.3015 4.3015 4.7836 4.7836 4.7836 4.7836 9.3587 9.3587 9.3587 9.3587 11.0336 11.0336 11.0336 11.0336 13.4108 13.4108 k = 0.5000 0.4459 0.1978 ( 5088 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7763 -8.7763 -8.7763 -8.7763 -8.2090 -8.2090 -8.2090 -8.2090 -7.8673 -7.8673 -7.8673 -7.8673 -7.4134 -7.4134 -7.4134 -7.4134 -7.2642 -7.2642 -7.2642 -7.2642 -6.6169 -6.6169 -6.6169 -6.6169 -1.0247 -1.0247 -1.0247 -1.0247 1.6976 1.6976 1.6976 1.6976 1.8971 1.8971 1.8971 1.8971 3.7255 3.7255 3.7255 3.7255 4.3005 4.3005 4.3005 4.3005 4.7833 4.7833 4.7833 4.7833 9.3557 9.3557 9.3557 9.3557 11.0446 11.0446 11.0446 11.0446 13.3887 13.3887 k = 0.5000 0.4459 0.2088 ( 5088 PWs) bands (ev): -12.2722 -12.2722 -12.2722 -12.2722 -8.7763 -8.7763 -8.7763 -8.7763 -8.2090 -8.2090 -8.2090 -8.2090 -7.8673 -7.8673 -7.8673 -7.8673 -7.4134 -7.4134 -7.4134 -7.4134 -7.2642 -7.2642 -7.2642 -7.2642 -6.6170 -6.6170 -6.6170 -6.6170 -1.0247 -1.0247 -1.0247 -1.0247 1.6974 1.6974 1.6974 1.6974 1.8973 1.8973 1.8973 1.8973 3.7259 3.7259 3.7259 3.7259 4.3001 4.3001 4.3001 4.3001 4.7832 4.7832 4.7832 4.7832 9.3547 9.3547 9.3547 9.3547 11.0483 11.0483 11.0483 11.0483 13.3812 13.3812 Writing output data file InBrO.save init_run : 0.47s CPU 0.80s WALL ( 1 calls) electrons : 278.90s CPU 285.32s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.10s WALL ( 1 calls) potinit : 0.02s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 278.90s CPU 285.31s 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 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.11s CPU 0.11s WALL ( 420 calls) cegterg : 263.14s CPU 266.92s WALL ( 837 calls) Called by sum_band: Called by *egterg: h_psi : 122.11s CPU 124.98s WALL ( 13687 calls) s_psi : 7.12s CPU 6.96s WALL ( 13687 calls) g_psi : 0.51s CPU 0.44s WALL ( 12430 calls) cdiaghg : 109.98s CPU 111.14s WALL ( 12850 calls) cegterg:over : 12.82s CPU 12.91s WALL ( 12430 calls) cegterg:upda : 12.26s CPU 12.42s WALL ( 12430 calls) cegterg:last : 5.16s CPU 5.22s WALL ( 1677 calls) cdiaghg:chol : 6.24s CPU 6.22s WALL ( 12850 calls) cdiaghg:inve : 4.39s CPU 4.36s WALL ( 12850 calls) cdiaghg:para : 6.92s CPU 6.80s WALL ( 25700 calls) Called by h_psi: h_psi:vloc : 104.83s CPU 107.58s WALL ( 13687 calls) h_psi:vnl : 16.79s CPU 16.87s WALL ( 13687 calls) add_vuspsi : 8.08s CPU 8.20s WALL ( 13687 calls) General routines calbec : 8.65s CPU 8.63s WALL ( 13687 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 97.25s CPU 100.18s WALL ( 1274104 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.26s CPU 0.38s WALL ( 840 calls) Parallel routines fft_scatter : 37.66s CPU 38.96s WALL ( 1274127 calls) PWSCF : 5m 6.07s CPU 5m50.16s WALL This run was terminated on: 16: 9:54 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=