Program PWSCF v.5.4.0 starts on 15Mar2017 at 15:20: 9 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 & OpenMP), running on 144 processor cores Number of MPI processes: 72 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 72 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: ./AlCuBr4.save/ file Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 31 26 7 2097 1550 231 Max 33 27 8 2108 1571 240 Sum 2285 1877 517 151215 112391 16827 bravais-lattice index = 14 lattice parameter (alat) = 10.8321 a.u. unit-cell volume = 2351.3556 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 84.00 number of Kohn-Sham states= 100 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 244.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.832098 celldm(2)= 1.000000 celldm(3)= 1.850038 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.850038 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.540530 ) PseudoPot. # 1 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 PseudoPot. # 2 for Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 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 Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Br 7.00 79.90400 Br( 1.00) Al 3.00 26.98150 Al( 1.00) Cu 11.00 63.54600 Cu( 1.00) 8 Sym. Ops. (no inversion) found ( 4 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.9250188 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.9250188 ) isym = 5 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 -1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 5) = ( -0.0000000 -1.0000000 0.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9250188 ) isym = 6 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 6) = ( 0.0000000 1.0000000 -0.0000000 ) f =( 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9250188 ) isym = 7 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 7) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 8) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group D_2d (-42m) there are 7 classes and 2 irreducible representations the character table: E -E 2S4 -2S4 C2 2C2' 2s_d -C2 -2C2' -2s_d G_6 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 G_7 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2S4 7 8 inv. 90 deg rotation - cart. axis [0,0,-1] -2S4 -7 -8 inv. 90 deg rotation - cart. axis [0,0,-1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 2C2' -2C2' 3 -3 4 -4 180 deg rotation - cart. axis [0,1,0] 2s_d -2s_d 5 -5 6 -6 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 244 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 2) = ( 0.0000000 0.0178571 -0.0000000), wk = 0.0040984 k( 3) = ( 0.0000000 0.0357143 -0.0000000), wk = 0.0040984 k( 4) = ( 0.0000000 0.0535714 -0.0000000), wk = 0.0040984 k( 5) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0040984 k( 6) = ( 0.0000000 0.0892857 -0.0000000), wk = 0.0040984 k( 7) = ( 0.0000000 0.1071429 -0.0000000), wk = 0.0040984 k( 8) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0040984 k( 9) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0040984 k( 10) = ( 0.0000000 0.1607143 -0.0000000), wk = 0.0040984 k( 11) = ( 0.0000000 0.1785714 -0.0000000), wk = 0.0040984 k( 12) = ( 0.0000000 0.1964286 -0.0000000), wk = 0.0040984 k( 13) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0040984 k( 14) = ( 0.0000000 0.2321429 -0.0000000), wk = 0.0040984 k( 15) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0040984 k( 16) = ( 0.0000000 0.2678571 -0.0000000), wk = 0.0040984 k( 17) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0040984 k( 18) = ( 0.0000000 0.3035714 -0.0000000), wk = 0.0040984 k( 19) = ( 0.0000000 0.3214286 -0.0000000), wk = 0.0040984 k( 20) = ( 0.0000000 0.3392857 -0.0000000), wk = 0.0040984 k( 21) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0040984 k( 22) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0040984 k( 23) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0040984 k( 24) = ( 0.0000000 0.4107143 -0.0000000), wk = 0.0040984 k( 25) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0040984 k( 26) = ( 0.0000000 0.4464286 -0.0000000), wk = 0.0040984 k( 27) = ( 0.0000000 0.4642857 -0.0000000), wk = 0.0040984 k( 28) = ( 0.0000000 0.4821429 -0.0000000), wk = 0.0040984 k( 29) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0040984 k( 30) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0040984 k( 31) = ( 0.0178571 0.5000000 -0.0000000), wk = 0.0040984 k( 32) = ( 0.0357143 0.5000000 -0.0000000), wk = 0.0040984 k( 33) = ( 0.0535714 0.5000000 -0.0000000), wk = 0.0040984 k( 34) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0040984 k( 35) = ( 0.0892857 0.5000000 -0.0000000), wk = 0.0040984 k( 36) = ( 0.1071429 0.5000000 -0.0000000), wk = 0.0040984 k( 37) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0040984 k( 38) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0040984 k( 39) = ( 0.1607143 0.5000000 -0.0000000), wk = 0.0040984 k( 40) = ( 0.1785714 0.5000000 -0.0000000), wk = 0.0040984 k( 41) = ( 0.1964286 0.5000000 -0.0000000), wk = 0.0040984 k( 42) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0040984 k( 43) = ( 0.2321429 0.5000000 -0.0000000), wk = 0.0040984 k( 44) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0040984 k( 45) = ( 0.2678571 0.5000000 -0.0000000), wk = 0.0040984 k( 46) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0040984 k( 47) = ( 0.3035714 0.5000000 -0.0000000), wk = 0.0040984 k( 48) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0040984 k( 49) = ( 0.3392857 0.5000000 -0.0000000), wk = 0.0040984 k( 50) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0040984 k( 51) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0040984 k( 52) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0040984 k( 53) = ( 0.4107143 0.5000000 -0.0000000), wk = 0.0040984 k( 54) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0040984 k( 55) = ( 0.4464286 0.5000000 -0.0000000), wk = 0.0040984 k( 56) = ( 0.4642857 0.5000000 -0.0000000), wk = 0.0040984 k( 57) = ( 0.4821429 0.5000000 -0.0000000), wk = 0.0040984 k( 58) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0040984 k( 59) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0040984 k( 60) = ( 0.4871795 0.4871795 -0.0000000), wk = 0.0040984 k( 61) = ( 0.4743590 0.4743590 -0.0000000), wk = 0.0040984 k( 62) = ( 0.4615385 0.4615385 -0.0000000), wk = 0.0040984 k( 63) = ( 0.4487179 0.4487179 -0.0000000), wk = 0.0040984 k( 64) = ( 0.4358974 0.4358974 -0.0000000), wk = 0.0040984 k( 65) = ( 0.4230769 0.4230769 -0.0000000), wk = 0.0040984 k( 66) = ( 0.4102564 0.4102564 -0.0000000), wk = 0.0040984 k( 67) = ( 0.3974359 0.3974359 -0.0000000), wk = 0.0040984 k( 68) = ( 0.3846154 0.3846154 -0.0000000), wk = 0.0040984 k( 69) = ( 0.3717949 0.3717949 -0.0000000), wk = 0.0040984 k( 70) = ( 0.3589744 0.3589744 -0.0000000), wk = 0.0040984 k( 71) = ( 0.3461538 0.3461538 -0.0000000), wk = 0.0040984 k( 72) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0040984 k( 73) = ( 0.3205128 0.3205128 -0.0000000), wk = 0.0040984 k( 74) = ( 0.3076923 0.3076923 -0.0000000), wk = 0.0040984 k( 75) = ( 0.2948718 0.2948718 -0.0000000), wk = 0.0040984 k( 76) = ( 0.2820513 0.2820513 -0.0000000), wk = 0.0040984 k( 77) = ( 0.2692308 0.2692308 -0.0000000), wk = 0.0040984 k( 78) = ( 0.2564103 0.2564103 -0.0000000), wk = 0.0040984 k( 79) = ( 0.2435897 0.2435897 -0.0000000), wk = 0.0040984 k( 80) = ( 0.2307692 0.2307692 -0.0000000), wk = 0.0040984 k( 81) = ( 0.2179487 0.2179487 -0.0000000), wk = 0.0040984 k( 82) = ( 0.2051282 0.2051282 -0.0000000), wk = 0.0040984 k( 83) = ( 0.1923077 0.1923077 -0.0000000), wk = 0.0040984 k( 84) = ( 0.1794872 0.1794872 -0.0000000), wk = 0.0040984 k( 85) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0040984 k( 86) = ( 0.1538461 0.1538461 -0.0000000), wk = 0.0040984 k( 87) = ( 0.1410256 0.1410256 -0.0000000), wk = 0.0040984 k( 88) = ( 0.1282051 0.1282051 -0.0000000), wk = 0.0040984 k( 89) = ( 0.1153846 0.1153846 -0.0000000), wk = 0.0040984 k( 90) = ( 0.1025641 0.1025641 -0.0000000), wk = 0.0040984 k( 91) = ( 0.0897436 0.0897436 -0.0000000), wk = 0.0040984 k( 92) = ( 0.0769231 0.0769231 -0.0000000), wk = 0.0040984 k( 93) = ( 0.0641026 0.0641026 -0.0000000), wk = 0.0040984 k( 94) = ( 0.0512821 0.0512820 -0.0000000), wk = 0.0040984 k( 95) = ( 0.0384615 0.0384615 -0.0000000), wk = 0.0040984 k( 96) = ( 0.0256410 0.0256410 -0.0000000), wk = 0.0040984 k( 97) = ( 0.0128205 0.0128205 -0.0000000), wk = 0.0040984 k( 98) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 100) = ( 0.0000000 0.0000000 0.0180177), wk = 0.0040984 k( 101) = ( 0.0000000 0.0000000 0.0360353), wk = 0.0040984 k( 102) = ( 0.0000000 0.0000000 0.0540530), wk = 0.0040984 k( 103) = ( 0.0000000 0.0000000 0.0720706), wk = 0.0040984 k( 104) = ( 0.0000000 0.0000000 0.0900883), wk = 0.0040984 k( 105) = ( 0.0000000 0.0000000 0.1081059), wk = 0.0040984 k( 106) = ( 0.0000000 0.0000000 0.1261236), wk = 0.0040984 k( 107) = ( 0.0000000 0.0000000 0.1441412), wk = 0.0040984 k( 108) = ( 0.0000000 0.0000000 0.1621589), wk = 0.0040984 k( 109) = ( 0.0000000 0.0000000 0.1801765), wk = 0.0040984 k( 110) = ( 0.0000000 0.0000000 0.1981942), wk = 0.0040984 k( 111) = ( 0.0000000 0.0000000 0.2162118), wk = 0.0040984 k( 112) = ( 0.0000000 0.0000000 0.2342295), wk = 0.0040984 k( 113) = ( 0.0000000 0.0000000 0.2522471), wk = 0.0040984 k( 114) = ( 0.0000000 0.0000000 0.2702648), wk = 0.0040984 k( 115) = ( 0.0000000 0.0000000 0.2702648), wk = 0.0040984 k( 116) = ( 0.0000000 0.0178571 0.2702648), wk = 0.0040984 k( 117) = ( 0.0000000 0.0357143 0.2702648), wk = 0.0040984 k( 118) = ( 0.0000000 0.0535714 0.2702648), wk = 0.0040984 k( 119) = ( 0.0000000 0.0714286 0.2702648), wk = 0.0040984 k( 120) = ( 0.0000000 0.0892857 0.2702648), wk = 0.0040984 k( 121) = ( 0.0000000 0.1071429 0.2702648), wk = 0.0040984 k( 122) = ( 0.0000000 0.1250000 0.2702648), wk = 0.0040984 k( 123) = ( 0.0000000 0.1428571 0.2702648), wk = 0.0040984 k( 124) = ( 0.0000000 0.1607143 0.2702648), wk = 0.0040984 k( 125) = ( 0.0000000 0.1785714 0.2702648), wk = 0.0040984 k( 126) = ( 0.0000000 0.1964286 0.2702648), wk = 0.0040984 k( 127) = ( 0.0000000 0.2142857 0.2702648), wk = 0.0040984 k( 128) = ( 0.0000000 0.2321429 0.2702648), wk = 0.0040984 k( 129) = ( 0.0000000 0.2500000 0.2702648), wk = 0.0040984 k( 130) = ( 0.0000000 0.2678571 0.2702648), wk = 0.0040984 k( 131) = ( 0.0000000 0.2857143 0.2702648), wk = 0.0040984 k( 132) = ( 0.0000000 0.3035714 0.2702648), wk = 0.0040984 k( 133) = ( 0.0000000 0.3214286 0.2702648), wk = 0.0040984 k( 134) = ( 0.0000000 0.3392857 0.2702648), wk = 0.0040984 k( 135) = ( 0.0000000 0.3571429 0.2702648), wk = 0.0040984 k( 136) = ( 0.0000000 0.3750000 0.2702648), wk = 0.0040984 k( 137) = ( 0.0000000 0.3928571 0.2702648), wk = 0.0040984 k( 138) = ( 0.0000000 0.4107143 0.2702648), wk = 0.0040984 k( 139) = ( 0.0000000 0.4285714 0.2702648), wk = 0.0040984 k( 140) = ( 0.0000000 0.4464286 0.2702648), wk = 0.0040984 k( 141) = ( 0.0000000 0.4642857 0.2702648), wk = 0.0040984 k( 142) = ( 0.0000000 0.4821429 0.2702648), wk = 0.0040984 k( 143) = ( 0.0000000 0.5000000 0.2702648), wk = 0.0040984 k( 144) = ( 0.0000000 0.5000000 0.2702648), wk = 0.0040984 k( 145) = ( 0.0178571 0.5000000 0.2702648), wk = 0.0040984 k( 146) = ( 0.0357143 0.5000000 0.2702648), wk = 0.0040984 k( 147) = ( 0.0535714 0.5000000 0.2702648), wk = 0.0040984 k( 148) = ( 0.0714286 0.5000000 0.2702648), wk = 0.0040984 k( 149) = ( 0.0892857 0.5000000 0.2702648), wk = 0.0040984 k( 150) = ( 0.1071429 0.5000000 0.2702648), wk = 0.0040984 k( 151) = ( 0.1250000 0.5000000 0.2702648), wk = 0.0040984 k( 152) = ( 0.1428571 0.5000000 0.2702648), wk = 0.0040984 k( 153) = ( 0.1607143 0.5000000 0.2702648), wk = 0.0040984 k( 154) = ( 0.1785714 0.5000000 0.2702648), wk = 0.0040984 k( 155) = ( 0.1964286 0.5000000 0.2702648), wk = 0.0040984 k( 156) = ( 0.2142857 0.5000000 0.2702648), wk = 0.0040984 k( 157) = ( 0.2321429 0.5000000 0.2702648), wk = 0.0040984 k( 158) = ( 0.2500000 0.5000000 0.2702648), wk = 0.0040984 k( 159) = ( 0.2678571 0.5000000 0.2702648), wk = 0.0040984 k( 160) = ( 0.2857143 0.5000000 0.2702648), wk = 0.0040984 k( 161) = ( 0.3035714 0.5000000 0.2702648), wk = 0.0040984 k( 162) = ( 0.3214286 0.5000000 0.2702648), wk = 0.0040984 k( 163) = ( 0.3392857 0.5000000 0.2702648), wk = 0.0040984 k( 164) = ( 0.3571429 0.5000000 0.2702648), wk = 0.0040984 k( 165) = ( 0.3750000 0.5000000 0.2702648), wk = 0.0040984 k( 166) = ( 0.3928571 0.5000000 0.2702648), wk = 0.0040984 k( 167) = ( 0.4107143 0.5000000 0.2702648), wk = 0.0040984 k( 168) = ( 0.4285714 0.5000000 0.2702648), wk = 0.0040984 k( 169) = ( 0.4464286 0.5000000 0.2702648), wk = 0.0040984 k( 170) = ( 0.4642857 0.5000000 0.2702648), wk = 0.0040984 k( 171) = ( 0.4821429 0.5000000 0.2702648), wk = 0.0040984 k( 172) = ( 0.5000000 0.5000000 0.2702648), wk = 0.0040984 k( 173) = ( 0.5000000 0.5000000 0.2702648), wk = 0.0040984 k( 174) = ( 0.4871795 0.4871795 0.2702648), wk = 0.0040984 k( 175) = ( 0.4743590 0.4743590 0.2702648), wk = 0.0040984 k( 176) = ( 0.4615385 0.4615385 0.2702648), wk = 0.0040984 k( 177) = ( 0.4487179 0.4487179 0.2702648), wk = 0.0040984 k( 178) = ( 0.4358974 0.4358974 0.2702648), wk = 0.0040984 k( 179) = ( 0.4230769 0.4230769 0.2702648), wk = 0.0040984 k( 180) = ( 0.4102564 0.4102564 0.2702648), wk = 0.0040984 k( 181) = ( 0.3974359 0.3974359 0.2702648), wk = 0.0040984 k( 182) = ( 0.3846154 0.3846154 0.2702648), wk = 0.0040984 k( 183) = ( 0.3717949 0.3717949 0.2702648), wk = 0.0040984 k( 184) = ( 0.3589744 0.3589744 0.2702648), wk = 0.0040984 k( 185) = ( 0.3461538 0.3461538 0.2702648), wk = 0.0040984 k( 186) = ( 0.3333333 0.3333333 0.2702648), wk = 0.0040984 k( 187) = ( 0.3205128 0.3205128 0.2702648), wk = 0.0040984 k( 188) = ( 0.3076923 0.3076923 0.2702648), wk = 0.0040984 k( 189) = ( 0.2948718 0.2948718 0.2702648), wk = 0.0040984 k( 190) = ( 0.2820513 0.2820513 0.2702648), wk = 0.0040984 k( 191) = ( 0.2692308 0.2692308 0.2702648), wk = 0.0040984 k( 192) = ( 0.2564103 0.2564103 0.2702648), wk = 0.0040984 k( 193) = ( 0.2435897 0.2435897 0.2702648), wk = 0.0040984 k( 194) = ( 0.2307692 0.2307692 0.2702648), wk = 0.0040984 k( 195) = ( 0.2179487 0.2179487 0.2702648), wk = 0.0040984 k( 196) = ( 0.2051282 0.2051282 0.2702648), wk = 0.0040984 k( 197) = ( 0.1923077 0.1923077 0.2702648), wk = 0.0040984 k( 198) = ( 0.1794872 0.1794872 0.2702648), wk = 0.0040984 k( 199) = ( 0.1666667 0.1666667 0.2702648), wk = 0.0040984 k( 200) = ( 0.1538461 0.1538461 0.2702648), wk = 0.0040984 k( 201) = ( 0.1410256 0.1410256 0.2702648), wk = 0.0040984 k( 202) = ( 0.1282051 0.1282051 0.2702648), wk = 0.0040984 k( 203) = ( 0.1153846 0.1153846 0.2702648), wk = 0.0040984 k( 204) = ( 0.1025641 0.1025641 0.2702648), wk = 0.0040984 k( 205) = ( 0.0897436 0.0897436 0.2702648), wk = 0.0040984 k( 206) = ( 0.0769231 0.0769231 0.2702648), wk = 0.0040984 k( 207) = ( 0.0641026 0.0641026 0.2702648), wk = 0.0040984 k( 208) = ( 0.0512821 0.0512820 0.2702648), wk = 0.0040984 k( 209) = ( 0.0384615 0.0384615 0.2702648), wk = 0.0040984 k( 210) = ( 0.0256410 0.0256410 0.2702648), wk = 0.0040984 k( 211) = ( 0.0128205 0.0128205 0.2702648), wk = 0.0040984 k( 212) = ( 0.0000000 0.0000000 0.2702648), wk = 0.0040984 k( 213) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0040984 k( 214) = ( 0.0000000 0.5000000 0.0180177), wk = 0.0040984 k( 215) = ( 0.0000000 0.5000000 0.0360353), wk = 0.0040984 k( 216) = ( 0.0000000 0.5000000 0.0540530), wk = 0.0040984 k( 217) = ( 0.0000000 0.5000000 0.0720706), wk = 0.0040984 k( 218) = ( 0.0000000 0.5000000 0.0900883), wk = 0.0040984 k( 219) = ( 0.0000000 0.5000000 0.1081059), wk = 0.0040984 k( 220) = ( 0.0000000 0.5000000 0.1261236), wk = 0.0040984 k( 221) = ( 0.0000000 0.5000000 0.1441412), wk = 0.0040984 k( 222) = ( 0.0000000 0.5000000 0.1621589), wk = 0.0040984 k( 223) = ( 0.0000000 0.5000000 0.1801765), wk = 0.0040984 k( 224) = ( 0.0000000 0.5000000 0.1981942), wk = 0.0040984 k( 225) = ( 0.0000000 0.5000000 0.2162118), wk = 0.0040984 k( 226) = ( 0.0000000 0.5000000 0.2342295), wk = 0.0040984 k( 227) = ( 0.0000000 0.5000000 0.2522471), wk = 0.0040984 k( 228) = ( 0.0000000 0.5000000 0.2702648), wk = 0.0040984 k( 229) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0040984 k( 230) = ( 0.5000000 0.5000000 0.0180177), wk = 0.0040984 k( 231) = ( 0.5000000 0.5000000 0.0360353), wk = 0.0040984 k( 232) = ( 0.5000000 0.5000000 0.0540530), wk = 0.0040984 k( 233) = ( 0.5000000 0.5000000 0.0720706), wk = 0.0040984 k( 234) = ( 0.5000000 0.5000000 0.0900883), wk = 0.0040984 k( 235) = ( 0.5000000 0.5000000 0.1081059), wk = 0.0040984 k( 236) = ( 0.5000000 0.5000000 0.1261236), wk = 0.0040984 k( 237) = ( 0.5000000 0.5000000 0.1441412), wk = 0.0040984 k( 238) = ( 0.5000000 0.5000000 0.1621589), wk = 0.0040984 k( 239) = ( 0.5000000 0.5000000 0.1801765), wk = 0.0040984 k( 240) = ( 0.5000000 0.5000000 0.1981942), wk = 0.0040984 k( 241) = ( 0.5000000 0.5000000 0.2162118), wk = 0.0040984 k( 242) = ( 0.5000000 0.5000000 0.2342295), wk = 0.0040984 k( 243) = ( 0.5000000 0.5000000 0.2522471), wk = 0.0040984 k( 244) = ( 0.5000000 0.5000000 0.2702648), wk = 0.0040984 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 2) = ( 0.0000000 0.0178571 -0.0000000), wk = 0.0040984 k( 3) = ( 0.0000000 0.0357143 0.0000000), wk = 0.0040984 k( 4) = ( 0.0000000 0.0535714 0.0000000), wk = 0.0040984 k( 5) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0040984 k( 6) = ( 0.0000000 0.0892857 -0.0000000), wk = 0.0040984 k( 7) = ( 0.0000000 0.1071429 0.0000000), wk = 0.0040984 k( 8) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0040984 k( 9) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0040984 k( 10) = ( 0.0000000 0.1607143 -0.0000000), wk = 0.0040984 k( 11) = ( 0.0000000 0.1785714 -0.0000000), wk = 0.0040984 k( 12) = ( 0.0000000 0.1964286 0.0000000), wk = 0.0040984 k( 13) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0040984 k( 14) = ( 0.0000000 0.2321429 0.0000000), wk = 0.0040984 k( 15) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0040984 k( 16) = ( 0.0000000 0.2678571 -0.0000000), wk = 0.0040984 k( 17) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0040984 k( 18) = ( 0.0000000 0.3035714 0.0000000), wk = 0.0040984 k( 19) = ( 0.0000000 0.3214286 -0.0000000), wk = 0.0040984 k( 20) = ( 0.0000000 0.3392857 -0.0000000), wk = 0.0040984 k( 21) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0040984 k( 22) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0040984 k( 23) = ( 0.0000000 0.3928571 0.0000000), wk = 0.0040984 k( 24) = ( 0.0000000 0.4107143 0.0000000), wk = 0.0040984 k( 25) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0040984 k( 26) = ( 0.0000000 0.4464286 -0.0000000), wk = 0.0040984 k( 27) = ( 0.0000000 0.4642857 -0.0000000), wk = 0.0040984 k( 28) = ( 0.0000000 0.4821429 -0.0000000), wk = 0.0040984 k( 29) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0040984 k( 30) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0040984 k( 31) = ( 0.0178571 0.5000000 0.0000000), wk = 0.0040984 k( 32) = ( 0.0357143 0.5000000 0.0000000), wk = 0.0040984 k( 33) = ( 0.0535714 0.5000000 0.0000000), wk = 0.0040984 k( 34) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0040984 k( 35) = ( 0.0892857 0.5000000 0.0000000), wk = 0.0040984 k( 36) = ( 0.1071429 0.5000000 0.0000000), wk = 0.0040984 k( 37) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0040984 k( 38) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0040984 k( 39) = ( 0.1607143 0.5000000 -0.0000000), wk = 0.0040984 k( 40) = ( 0.1785714 0.5000000 0.0000000), wk = 0.0040984 k( 41) = ( 0.1964286 0.5000000 -0.0000000), wk = 0.0040984 k( 42) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0040984 k( 43) = ( 0.2321429 0.5000000 0.0000000), wk = 0.0040984 k( 44) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0040984 k( 45) = ( 0.2678571 0.5000000 -0.0000000), wk = 0.0040984 k( 46) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0040984 k( 47) = ( 0.3035714 0.5000000 -0.0000000), wk = 0.0040984 k( 48) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0040984 k( 49) = ( 0.3392857 0.5000000 -0.0000000), wk = 0.0040984 k( 50) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0040984 k( 51) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0040984 k( 52) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0040984 k( 53) = ( 0.4107143 0.5000000 0.0000000), wk = 0.0040984 k( 54) = ( 0.4285714 0.5000000 0.0000000), wk = 0.0040984 k( 55) = ( 0.4464286 0.5000000 0.0000000), wk = 0.0040984 k( 56) = ( 0.4642857 0.5000000 0.0000000), wk = 0.0040984 k( 57) = ( 0.4821429 0.5000000 -0.0000000), wk = 0.0040984 k( 58) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0040984 k( 59) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0040984 k( 60) = ( 0.4871795 0.4871795 -0.0000000), wk = 0.0040984 k( 61) = ( 0.4743590 0.4743590 0.0000000), wk = 0.0040984 k( 62) = ( 0.4615385 0.4615385 0.0000000), wk = 0.0040984 k( 63) = ( 0.4487179 0.4487179 0.0000000), wk = 0.0040984 k( 64) = ( 0.4358974 0.4358974 0.0000000), wk = 0.0040984 k( 65) = ( 0.4230769 0.4230769 0.0000000), wk = 0.0040984 k( 66) = ( 0.4102564 0.4102564 -0.0000000), wk = 0.0040984 k( 67) = ( 0.3974359 0.3974359 -0.0000000), wk = 0.0040984 k( 68) = ( 0.3846154 0.3846154 -0.0000000), wk = 0.0040984 k( 69) = ( 0.3717949 0.3717949 -0.0000000), wk = 0.0040984 k( 70) = ( 0.3589744 0.3589744 -0.0000000), wk = 0.0040984 k( 71) = ( 0.3461538 0.3461538 -0.0000000), wk = 0.0040984 k( 72) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0040984 k( 73) = ( 0.3205128 0.3205128 -0.0000000), wk = 0.0040984 k( 74) = ( 0.3076923 0.3076923 -0.0000000), wk = 0.0040984 k( 75) = ( 0.2948718 0.2948718 -0.0000000), wk = 0.0040984 k( 76) = ( 0.2820513 0.2820513 -0.0000000), wk = 0.0040984 k( 77) = ( 0.2692308 0.2692308 0.0000000), wk = 0.0040984 k( 78) = ( 0.2564103 0.2564103 0.0000000), wk = 0.0040984 k( 79) = ( 0.2435897 0.2435897 0.0000000), wk = 0.0040984 k( 80) = ( 0.2307692 0.2307692 0.0000000), wk = 0.0040984 k( 81) = ( 0.2179487 0.2179487 0.0000000), wk = 0.0040984 k( 82) = ( 0.2051282 0.2051282 0.0000000), wk = 0.0040984 k( 83) = ( 0.1923077 0.1923077 -0.0000000), wk = 0.0040984 k( 84) = ( 0.1794872 0.1794872 -0.0000000), wk = 0.0040984 k( 85) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0040984 k( 86) = ( 0.1538461 0.1538461 -0.0000000), wk = 0.0040984 k( 87) = ( 0.1410256 0.1410256 -0.0000000), wk = 0.0040984 k( 88) = ( 0.1282051 0.1282051 0.0000000), wk = 0.0040984 k( 89) = ( 0.1153846 0.1153846 -0.0000000), wk = 0.0040984 k( 90) = ( 0.1025641 0.1025641 -0.0000000), wk = 0.0040984 k( 91) = ( 0.0897436 0.0897436 -0.0000000), wk = 0.0040984 k( 92) = ( 0.0769231 0.0769231 -0.0000000), wk = 0.0040984 k( 93) = ( 0.0641026 0.0641026 0.0000000), wk = 0.0040984 k( 94) = ( 0.0512821 0.0512821 -0.0000000), wk = 0.0040984 k( 95) = ( 0.0384615 0.0384615 -0.0000000), wk = 0.0040984 k( 96) = ( 0.0256410 0.0256410 -0.0000000), wk = 0.0040984 k( 97) = ( 0.0128205 0.0128205 -0.0000000), wk = 0.0040984 k( 98) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 100) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0040984 k( 101) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0040984 k( 102) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0040984 k( 103) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0040984 k( 104) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0040984 k( 105) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0040984 k( 106) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0040984 k( 107) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0040984 k( 108) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0040984 k( 109) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0040984 k( 110) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0040984 k( 111) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0040984 k( 112) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0040984 k( 113) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0040984 k( 114) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040984 k( 115) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040984 k( 116) = ( 0.0000000 0.0178571 0.5000000), wk = 0.0040984 k( 117) = ( 0.0000000 0.0357143 0.5000000), wk = 0.0040984 k( 118) = ( 0.0000000 0.0535714 0.5000000), wk = 0.0040984 k( 119) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0040984 k( 120) = ( 0.0000000 0.0892857 0.5000000), wk = 0.0040984 k( 121) = ( 0.0000000 0.1071429 0.5000000), wk = 0.0040984 k( 122) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0040984 k( 123) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0040984 k( 124) = ( 0.0000000 0.1607143 0.5000000), wk = 0.0040984 k( 125) = ( 0.0000000 0.1785714 0.5000000), wk = 0.0040984 k( 126) = ( 0.0000000 0.1964286 0.5000000), wk = 0.0040984 k( 127) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0040984 k( 128) = ( 0.0000000 0.2321429 0.5000000), wk = 0.0040984 k( 129) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0040984 k( 130) = ( 0.0000000 0.2678571 0.5000000), wk = 0.0040984 k( 131) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0040984 k( 132) = ( 0.0000000 0.3035714 0.5000000), wk = 0.0040984 k( 133) = ( 0.0000000 0.3214286 0.5000000), wk = 0.0040984 k( 134) = ( 0.0000000 0.3392857 0.5000000), wk = 0.0040984 k( 135) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0040984 k( 136) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0040984 k( 137) = ( 0.0000000 0.3928571 0.5000000), wk = 0.0040984 k( 138) = ( 0.0000000 0.4107143 0.5000000), wk = 0.0040984 k( 139) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0040984 k( 140) = ( 0.0000000 0.4464286 0.5000000), wk = 0.0040984 k( 141) = ( 0.0000000 0.4642857 0.5000000), wk = 0.0040984 k( 142) = ( 0.0000000 0.4821429 0.5000000), wk = 0.0040984 k( 143) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0040984 k( 144) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0040984 k( 145) = ( 0.0178571 0.5000000 0.5000000), wk = 0.0040984 k( 146) = ( 0.0357143 0.5000000 0.5000000), wk = 0.0040984 k( 147) = ( 0.0535714 0.5000000 0.5000000), wk = 0.0040984 k( 148) = ( 0.0714286 0.5000000 0.5000000), wk = 0.0040984 k( 149) = ( 0.0892857 0.5000000 0.5000000), wk = 0.0040984 k( 150) = ( 0.1071429 0.5000000 0.5000000), wk = 0.0040984 k( 151) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0040984 k( 152) = ( 0.1428571 0.5000000 0.5000000), wk = 0.0040984 k( 153) = ( 0.1607143 0.5000000 0.5000000), wk = 0.0040984 k( 154) = ( 0.1785714 0.5000000 0.5000000), wk = 0.0040984 k( 155) = ( 0.1964286 0.5000000 0.5000000), wk = 0.0040984 k( 156) = ( 0.2142857 0.5000000 0.5000000), wk = 0.0040984 k( 157) = ( 0.2321429 0.5000000 0.5000000), wk = 0.0040984 k( 158) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0040984 k( 159) = ( 0.2678571 0.5000000 0.5000000), wk = 0.0040984 k( 160) = ( 0.2857143 0.5000000 0.5000000), wk = 0.0040984 k( 161) = ( 0.3035714 0.5000000 0.5000000), wk = 0.0040984 k( 162) = ( 0.3214286 0.5000000 0.5000000), wk = 0.0040984 k( 163) = ( 0.3392857 0.5000000 0.5000000), wk = 0.0040984 k( 164) = ( 0.3571429 0.5000000 0.5000000), wk = 0.0040984 k( 165) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0040984 k( 166) = ( 0.3928571 0.5000000 0.5000000), wk = 0.0040984 k( 167) = ( 0.4107143 0.5000000 0.5000000), wk = 0.0040984 k( 168) = ( 0.4285714 0.5000000 0.5000000), wk = 0.0040984 k( 169) = ( 0.4464286 0.5000000 0.5000000), wk = 0.0040984 k( 170) = ( 0.4642857 0.5000000 0.5000000), wk = 0.0040984 k( 171) = ( 0.4821429 0.5000000 0.5000000), wk = 0.0040984 k( 172) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0040984 k( 173) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0040984 k( 174) = ( 0.4871795 0.4871795 0.5000000), wk = 0.0040984 k( 175) = ( 0.4743590 0.4743590 0.5000000), wk = 0.0040984 k( 176) = ( 0.4615385 0.4615385 0.5000000), wk = 0.0040984 k( 177) = ( 0.4487179 0.4487179 0.5000000), wk = 0.0040984 k( 178) = ( 0.4358974 0.4358974 0.5000000), wk = 0.0040984 k( 179) = ( 0.4230769 0.4230769 0.5000000), wk = 0.0040984 k( 180) = ( 0.4102564 0.4102564 0.5000000), wk = 0.0040984 k( 181) = ( 0.3974359 0.3974359 0.5000000), wk = 0.0040984 k( 182) = ( 0.3846154 0.3846154 0.5000000), wk = 0.0040984 k( 183) = ( 0.3717949 0.3717949 0.5000000), wk = 0.0040984 k( 184) = ( 0.3589744 0.3589744 0.5000000), wk = 0.0040984 k( 185) = ( 0.3461538 0.3461538 0.5000000), wk = 0.0040984 k( 186) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0040984 k( 187) = ( 0.3205128 0.3205128 0.5000000), wk = 0.0040984 k( 188) = ( 0.3076923 0.3076923 0.5000000), wk = 0.0040984 k( 189) = ( 0.2948718 0.2948718 0.5000000), wk = 0.0040984 k( 190) = ( 0.2820513 0.2820513 0.5000000), wk = 0.0040984 k( 191) = ( 0.2692308 0.2692308 0.5000000), wk = 0.0040984 k( 192) = ( 0.2564103 0.2564103 0.5000000), wk = 0.0040984 k( 193) = ( 0.2435897 0.2435897 0.5000000), wk = 0.0040984 k( 194) = ( 0.2307692 0.2307692 0.5000000), wk = 0.0040984 k( 195) = ( 0.2179487 0.2179487 0.5000000), wk = 0.0040984 k( 196) = ( 0.2051282 0.2051282 0.5000000), wk = 0.0040984 k( 197) = ( 0.1923077 0.1923077 0.5000000), wk = 0.0040984 k( 198) = ( 0.1794872 0.1794872 0.5000000), wk = 0.0040984 k( 199) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0040984 k( 200) = ( 0.1538461 0.1538461 0.5000000), wk = 0.0040984 k( 201) = ( 0.1410256 0.1410256 0.5000000), wk = 0.0040984 k( 202) = ( 0.1282051 0.1282051 0.5000000), wk = 0.0040984 k( 203) = ( 0.1153846 0.1153846 0.5000000), wk = 0.0040984 k( 204) = ( 0.1025641 0.1025641 0.5000000), wk = 0.0040984 k( 205) = ( 0.0897436 0.0897436 0.5000000), wk = 0.0040984 k( 206) = ( 0.0769231 0.0769231 0.5000000), wk = 0.0040984 k( 207) = ( 0.0641026 0.0641026 0.5000000), wk = 0.0040984 k( 208) = ( 0.0512821 0.0512821 0.5000000), wk = 0.0040984 k( 209) = ( 0.0384615 0.0384615 0.5000000), wk = 0.0040984 k( 210) = ( 0.0256410 0.0256410 0.5000000), wk = 0.0040984 k( 211) = ( 0.0128205 0.0128205 0.5000000), wk = 0.0040984 k( 212) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040984 k( 213) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0040984 k( 214) = ( 0.0000000 0.5000000 0.0333333), wk = 0.0040984 k( 215) = ( 0.0000000 0.5000000 0.0666667), wk = 0.0040984 k( 216) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0040984 k( 217) = ( 0.0000000 0.5000000 0.1333333), wk = 0.0040984 k( 218) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0040984 k( 219) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0040984 k( 220) = ( 0.0000000 0.5000000 0.2333333), wk = 0.0040984 k( 221) = ( 0.0000000 0.5000000 0.2666667), wk = 0.0040984 k( 222) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0040984 k( 223) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0040984 k( 224) = ( 0.0000000 0.5000000 0.3666667), wk = 0.0040984 k( 225) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0040984 k( 226) = ( 0.0000000 0.5000000 0.4333333), wk = 0.0040984 k( 227) = ( 0.0000000 0.5000000 0.4666667), wk = 0.0040984 k( 228) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0040984 k( 229) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0040984 k( 230) = ( 0.5000000 0.5000000 0.0333333), wk = 0.0040984 k( 231) = ( 0.5000000 0.5000000 0.0666667), wk = 0.0040984 k( 232) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0040984 k( 233) = ( 0.5000000 0.5000000 0.1333333), wk = 0.0040984 k( 234) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0040984 k( 235) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0040984 k( 236) = ( 0.5000000 0.5000000 0.2333333), wk = 0.0040984 k( 237) = ( 0.5000000 0.5000000 0.2666667), wk = 0.0040984 k( 238) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0040984 k( 239) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0040984 k( 240) = ( 0.5000000 0.5000000 0.3666667), wk = 0.0040984 k( 241) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0040984 k( 242) = ( 0.5000000 0.5000000 0.4333333), wk = 0.0040984 k( 243) = ( 0.5000000 0.5000000 0.4666667), wk = 0.0040984 k( 244) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0040984 Dense grid: 151215 G-vectors FFT dimensions: ( 54, 54, 100) Smooth grid: 112391 G-vectors FFT dimensions: ( 50, 50, 96) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.61 Mb ( 400, 100) NL pseudopotentials 0.76 Mb ( 200, 248) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.02 Mb ( 2098) G-vector shells 0.01 Mb ( 1065) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.44 Mb ( 400, 400) Each subspace H/S matrix 0.07 Mb ( 66, 66) Each matrix 0.76 Mb ( 248, 2, 100) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./AlCuBr4.save/charge-density.dat Starting wfc are 116 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 10.9 secs Computing kpt #: 2 total cpu time spent up to now is 18.2 secs Computing kpt #: 3 total cpu time spent up to now is 25.5 secs Computing kpt #: 4 total cpu time spent up to now is 32.8 secs Computing kpt #: 5 total cpu time spent up to now is 39.3 secs Computing kpt #: 6 total cpu time spent up to now is 45.5 secs Computing kpt #: 7 total cpu time spent up to now is 51.4 secs Computing kpt #: 8 total cpu time spent up to now is 58.8 secs Computing kpt #: 9 total cpu time spent up to now is 65.7 secs Computing kpt #: 10 total cpu time spent up to now is 71.5 secs Computing kpt #: 11 total cpu time spent up to now is 77.4 secs Computing kpt #: 12 total cpu time spent up to now is 83.1 secs Computing kpt #: 13 total cpu time spent up to now is 88.8 secs Computing kpt #: 14 total cpu time spent up to now is 95.1 secs Computing kpt #: 15 total cpu time spent up to now is 102.4 secs Computing kpt #: 16 total cpu time spent up to now is 108.6 secs Computing kpt #: 17 total cpu time spent up to now is 114.8 secs Computing kpt #: 18 total cpu time spent up to now is 120.6 secs Computing kpt #: 19 total cpu time spent up to now is 127.5 secs Computing kpt #: 20 total cpu time spent up to now is 135.8 secs Computing kpt #: 21 total cpu time spent up to now is 143.4 secs Computing kpt #: 22 total cpu time spent up to now is 149.2 secs Computing kpt #: 23 total cpu time spent up to now is 154.9 secs Computing kpt #: 24 total cpu time spent up to now is 160.8 secs Computing kpt #: 25 total cpu time spent up to now is 166.6 secs Computing kpt #: 26 total cpu time spent up to now is 173.2 secs Computing kpt #: 27 total cpu time spent up to now is 179.1 secs Computing kpt #: 28 total cpu time spent up to now is 185.7 secs Computing kpt #: 29 total cpu time spent up to now is 191.5 secs Computing kpt #: 30 total cpu time spent up to now is 198.9 secs Computing kpt #: 31 total cpu time spent up to now is 206.5 secs Computing kpt #: 32 total cpu time spent up to now is 213.7 secs Computing kpt #: 33 total cpu time spent up to now is 220.3 secs Computing kpt #: 34 total cpu time spent up to now is 226.7 secs Computing kpt #: 35 total cpu time spent up to now is 232.3 secs Computing kpt #: 36 total cpu time spent up to now is 238.4 secs Computing kpt #: 37 total cpu time spent up to now is 245.0 secs Computing kpt #: 38 total cpu time spent up to now is 251.1 secs Computing kpt #: 39 total cpu time spent up to now is 257.3 secs Computing kpt #: 40 total cpu time spent up to now is 262.9 secs Computing kpt #: 41 total cpu time spent up to now is 268.5 secs Computing kpt #: 42 total cpu time spent up to now is 275.4 secs Computing kpt #: 43 total cpu time spent up to now is 283.1 secs Computing kpt #: 44 total cpu time spent up to now is 288.8 secs Computing kpt #: 45 total cpu time spent up to now is 294.8 secs Computing kpt #: 46 total cpu time spent up to now is 301.4 secs Computing kpt #: 47 total cpu time spent up to now is 307.3 secs Computing kpt #: 48 total cpu time spent up to now is 313.5 secs Computing kpt #: 49 total cpu time spent up to now is 320.3 secs Computing kpt #: 50 total cpu time spent up to now is 327.1 secs Computing kpt #: 51 total cpu time spent up to now is 333.8 secs Computing kpt #: 52 total cpu time spent up to now is 341.2 secs Computing kpt #: 53 total cpu time spent up to now is 348.7 secs Computing kpt #: 54 total cpu time spent up to now is 356.2 secs Computing kpt #: 55 total cpu time spent up to now is 362.4 secs Computing kpt #: 56 total cpu time spent up to now is 368.2 secs Computing kpt #: 57 total cpu time spent up to now is 374.5 secs Computing kpt #: 58 total cpu time spent up to now is 381.2 secs Computing kpt #: 59 total cpu time spent up to now is 387.1 secs Computing kpt #: 60 total cpu time spent up to now is 393.3 secs Computing kpt #: 61 total cpu time spent up to now is 399.6 secs Computing kpt #: 62 total cpu time spent up to now is 405.7 secs Computing kpt #: 63 total cpu time spent up to now is 412.1 secs Computing kpt #: 64 total cpu time spent up to now is 419.8 secs Computing kpt #: 65 total cpu time spent up to now is 426.9 secs Computing kpt #: 66 total cpu time spent up to now is 433.3 secs Computing kpt #: 67 total cpu time spent up to now is 440.0 secs Computing kpt #: 68 total cpu time spent up to now is 445.9 secs Computing kpt #: 69 total cpu time spent up to now is 452.9 secs Computing kpt #: 70 total cpu time spent up to now is 459.3 secs Computing kpt #: 71 total cpu time spent up to now is 465.7 secs Computing kpt #: 72 total cpu time spent up to now is 472.4 secs Computing kpt #: 73 total cpu time spent up to now is 478.5 secs Computing kpt #: 74 total cpu time spent up to now is 485.0 secs Computing kpt #: 75 total cpu time spent up to now is 491.3 secs Computing kpt #: 76 total cpu time spent up to now is 499.2 secs Computing kpt #: 77 total cpu time spent up to now is 506.5 secs Computing kpt #: 78 total cpu time spent up to now is 513.7 secs Computing kpt #: 79 total cpu time spent up to now is 519.9 secs Computing kpt #: 80 total cpu time spent up to now is 525.1 secs Computing kpt #: 81 total cpu time spent up to now is 531.2 secs Computing kpt #: 82 total cpu time spent up to now is 537.5 secs Computing kpt #: 83 total cpu time spent up to now is 543.6 secs Computing kpt #: 84 total cpu time spent up to now is 549.8 secs Computing kpt #: 85 total cpu time spent up to now is 555.8 secs Computing kpt #: 86 total cpu time spent up to now is 562.0 secs Computing kpt #: 87 total cpu time spent up to now is 568.4 secs Computing kpt #: 88 total cpu time spent up to now is 574.5 secs Computing kpt #: 89 total cpu time spent up to now is 580.8 secs Computing kpt #: 90 total cpu time spent up to now is 588.6 secs Computing kpt #: 91 total cpu time spent up to now is 595.1 secs Computing kpt #: 92 total cpu time spent up to now is 600.8 secs Computing kpt #: 93 total cpu time spent up to now is 606.9 secs Computing kpt #: 94 total cpu time spent up to now is 614.9 secs Computing kpt #: 95 total cpu time spent up to now is 622.7 secs Computing kpt #: 96 total cpu time spent up to now is 631.4 secs Computing kpt #: 97 total cpu time spent up to now is 638.7 secs Computing kpt #: 98 total cpu time spent up to now is 645.2 secs Computing kpt #: 99 total cpu time spent up to now is 652.2 secs Computing kpt #: 100 total cpu time spent up to now is 659.0 secs Computing kpt #: 101 total cpu time spent up to now is 665.3 secs Computing kpt #: 102 total cpu time spent up to now is 671.1 secs Computing kpt #: 103 total cpu time spent up to now is 676.4 secs Computing kpt #: 104 total cpu time spent up to now is 682.7 secs Computing kpt #: 105 total cpu time spent up to now is 689.2 secs Computing kpt #: 106 total cpu time spent up to now is 694.5 secs Computing kpt #: 107 total cpu time spent up to now is 700.4 secs Computing kpt #: 108 total cpu time spent up to now is 705.5 secs Computing kpt #: 109 total cpu time spent up to now is 710.8 secs Computing kpt #: 110 total cpu time spent up to now is 715.9 secs Computing kpt #: 111 total cpu time spent up to now is 721.6 secs Computing kpt #: 112 total cpu time spent up to now is 727.0 secs Computing kpt #: 113 total cpu time spent up to now is 733.1 secs Computing kpt #: 114 total cpu time spent up to now is 739.1 secs Computing kpt #: 115 total cpu time spent up to now is 745.7 secs Computing kpt #: 116 total cpu time spent up to now is 751.7 secs Computing kpt #: 117 total cpu time spent up to now is 759.4 secs Computing kpt #: 118 total cpu time spent up to now is 766.3 secs Computing kpt #: 119 total cpu time spent up to now is 773.3 secs Computing kpt #: 120 total cpu time spent up to now is 779.7 secs Computing kpt #: 121 total cpu time spent up to now is 786.1 secs Computing kpt #: 122 total cpu time spent up to now is 791.9 secs Computing kpt #: 123 total cpu time spent up to now is 797.6 secs Computing kpt #: 124 total cpu time spent up to now is 803.4 secs Computing kpt #: 125 total cpu time spent up to now is 809.4 secs Computing kpt #: 126 total cpu time spent up to now is 815.4 secs Computing kpt #: 127 total cpu time spent up to now is 820.9 secs Computing kpt #: 128 total cpu time spent up to now is 826.6 secs Computing kpt #: 129 total cpu time spent up to now is 832.6 secs Computing kpt #: 130 total cpu time spent up to now is 839.7 secs Computing kpt #: 131 total cpu time spent up to now is 846.4 secs Computing kpt #: 132 total cpu time spent up to now is 853.4 secs Computing kpt #: 133 total cpu time spent up to now is 861.4 secs Computing kpt #: 134 total cpu time spent up to now is 868.2 secs Computing kpt #: 135 total cpu time spent up to now is 874.8 secs Computing kpt #: 136 total cpu time spent up to now is 881.4 secs Computing kpt #: 137 total cpu time spent up to now is 887.9 secs Computing kpt #: 138 total cpu time spent up to now is 895.1 secs Computing kpt #: 139 total cpu time spent up to now is 901.1 secs Computing kpt #: 140 total cpu time spent up to now is 907.8 secs Computing kpt #: 141 total cpu time spent up to now is 914.4 secs Computing kpt #: 142 total cpu time spent up to now is 921.3 secs Computing kpt #: 143 total cpu time spent up to now is 929.4 secs Computing kpt #: 144 total cpu time spent up to now is 935.9 secs Computing kpt #: 145 total cpu time spent up to now is 942.1 secs Computing kpt #: 146 total cpu time spent up to now is 948.3 secs Computing kpt #: 147 total cpu time spent up to now is 954.9 secs Computing kpt #: 148 total cpu time spent up to now is 962.0 secs Computing kpt #: 149 total cpu time spent up to now is 969.0 secs Computing kpt #: 150 total cpu time spent up to now is 975.0 secs Computing kpt #: 151 total cpu time spent up to now is 981.1 secs Computing kpt #: 152 total cpu time spent up to now is 988.0 secs Computing kpt #: 153 total cpu time spent up to now is 995.4 secs Computing kpt #: 154 total cpu time spent up to now is 1038.4 secs Computing kpt #: 155 total cpu time spent up to now is 1045.1 secs Computing kpt #: 156 total cpu time spent up to now is 1052.2 secs Computing kpt #: 157 total cpu time spent up to now is 1058.2 secs Computing kpt #: 158 total cpu time spent up to now is 1064.1 secs Computing kpt #: 159 total cpu time spent up to now is 1069.4 secs Computing kpt #: 160 total cpu time spent up to now is 1075.9 secs Computing kpt #: 161 total cpu time spent up to now is 1081.6 secs Computing kpt #: 162 total cpu time spent up to now is 1087.9 secs Computing kpt #: 163 total cpu time spent up to now is 1094.2 secs Computing kpt #: 164 total cpu time spent up to now is 1100.9 secs Computing kpt #: 165 total cpu time spent up to now is 1107.2 secs Computing kpt #: 166 total cpu time spent up to now is 1112.5 secs Computing kpt #: 167 total cpu time spent up to now is 1118.8 secs Computing kpt #: 168 total cpu time spent up to now is 1125.5 secs Computing kpt #: 169 total cpu time spent up to now is 1166.8 secs Computing kpt #: 170 total cpu time spent up to now is 1173.7 secs Computing kpt #: 171 total cpu time spent up to now is 1180.0 secs Computing kpt #: 172 total cpu time spent up to now is 1186.2 secs Computing kpt #: 173 total cpu time spent up to now is 1193.0 secs Computing kpt #: 174 total cpu time spent up to now is 1211.4 secs Computing kpt #: 175 total cpu time spent up to now is 1216.3 secs Computing kpt #: 176 total cpu time spent up to now is 1221.8 secs Computing kpt #: 177 total cpu time spent up to now is 1227.7 secs Computing kpt #: 178 total cpu time spent up to now is 1234.2 secs Computing kpt #: 179 total cpu time spent up to now is 1278.1 secs Computing kpt #: 180 total cpu time spent up to now is 1284.4 secs Computing kpt #: 181 total cpu time spent up to now is 1290.4 secs Computing kpt #: 182 total cpu time spent up to now is 1295.1 secs Computing kpt #: 183 total cpu time spent up to now is 1301.6 secs Computing kpt #: 184 total cpu time spent up to now is 1309.5 secs Computing kpt #: 185 total cpu time spent up to now is 1316.3 secs Computing kpt #: 186 total cpu time spent up to now is 1323.0 secs Computing kpt #: 187 total cpu time spent up to now is 1329.3 secs Computing kpt #: 188 total cpu time spent up to now is 1335.6 secs Computing kpt #: 189 total cpu time spent up to now is 1341.5 secs Computing kpt #: 190 total cpu time spent up to now is 1347.6 secs Computing kpt #: 191 total cpu time spent up to now is 1353.6 secs Computing kpt #: 192 total cpu time spent up to now is 1359.9 secs Computing kpt #: 193 total cpu time spent up to now is 1368.9 secs Computing kpt #: 194 total cpu time spent up to now is 1376.7 secs Computing kpt #: 195 total cpu time spent up to now is 1383.0 secs Computing kpt #: 196 total cpu time spent up to now is 1389.3 secs Computing kpt #: 197 total cpu time spent up to now is 1395.4 secs Computing kpt #: 198 total cpu time spent up to now is 1401.4 secs Computing kpt #: 199 total cpu time spent up to now is 1407.8 secs Computing kpt #: 200 total cpu time spent up to now is 1415.5 secs Computing kpt #: 201 total cpu time spent up to now is 1421.8 secs Computing kpt #: 202 total cpu time spent up to now is 1428.1 secs Computing kpt #: 203 total cpu time spent up to now is 1434.7 secs Computing kpt #: 204 total cpu time spent up to now is 1441.4 secs Computing kpt #: 205 total cpu time spent up to now is 1448.3 secs Computing kpt #: 206 total cpu time spent up to now is 1454.3 secs Computing kpt #: 207 total cpu time spent up to now is 1460.7 secs Computing kpt #: 208 total cpu time spent up to now is 1466.6 secs Computing kpt #: 209 total cpu time spent up to now is 1473.3 secs Computing kpt #: 210 total cpu time spent up to now is 1478.8 secs Computing kpt #: 211 total cpu time spent up to now is 1485.1 secs Computing kpt #: 212 total cpu time spent up to now is 1490.9 secs Computing kpt #: 213 total cpu time spent up to now is 1496.9 secs Computing kpt #: 214 total cpu time spent up to now is 1504.1 secs Computing kpt #: 215 total cpu time spent up to now is 1513.4 secs Computing kpt #: 216 total cpu time spent up to now is 1519.7 secs Computing kpt #: 217 total cpu time spent up to now is 1526.0 secs Computing kpt #: 218 total cpu time spent up to now is 1533.4 secs Computing kpt #: 219 total cpu time spent up to now is 1539.7 secs Computing kpt #: 220 total cpu time spent up to now is 1546.9 secs Computing kpt #: 221 total cpu time spent up to now is 1553.2 secs Computing kpt #: 222 total cpu time spent up to now is 1559.0 secs Computing kpt #: 223 total cpu time spent up to now is 1565.8 secs Computing kpt #: 224 total cpu time spent up to now is 1572.2 secs Computing kpt #: 225 total cpu time spent up to now is 1580.0 secs Computing kpt #: 226 total cpu time spent up to now is 1588.3 secs Computing kpt #: 227 total cpu time spent up to now is 1595.0 secs Computing kpt #: 228 total cpu time spent up to now is 1601.4 secs Computing kpt #: 229 total cpu time spent up to now is 1609.8 secs Computing kpt #: 230 total cpu time spent up to now is 1616.6 secs Computing kpt #: 231 total cpu time spent up to now is 1624.8 secs Computing kpt #: 232 total cpu time spent up to now is 1631.5 secs Computing kpt #: 233 total cpu time spent up to now is 1637.4 secs Computing kpt #: 234 total cpu time spent up to now is 1644.6 secs Computing kpt #: 235 total cpu time spent up to now is 1651.4 secs Computing kpt #: 236 total cpu time spent up to now is 1658.6 secs Computing kpt #: 237 total cpu time spent up to now is 1665.6 secs Computing kpt #: 238 total cpu time spent up to now is 1672.0 secs Computing kpt #: 239 total cpu time spent up to now is 1679.0 secs Computing kpt #: 240 total cpu time spent up to now is 1685.7 secs Computing kpt #: 241 total cpu time spent up to now is 1691.8 secs Computing kpt #: 242 total cpu time spent up to now is 1697.9 secs Computing kpt #: 243 total cpu time spent up to now is 1705.1 secs Computing kpt #: 244 total cpu time spent up to now is 1713.0 secs ethr = 1.19E-08, avg # of iterations = 19.0 total cpu time spent up to now is 1713.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 14013 PWs) bands (ev): -12.3805 -12.3805 -12.1404 -12.1404 -11.8814 -11.8814 -11.6841 -11.6841 -11.6835 -11.6835 -11.6655 -11.6655 -11.6646 -11.6646 -11.6053 -11.6053 -3.1150 -3.1150 -3.0327 -3.0327 -1.3838 -1.3838 -1.2155 -1.2155 -1.2130 -1.2130 -1.1038 -1.1038 -1.0803 -1.0803 -0.7590 -0.7590 -0.6567 -0.6567 -0.5473 -0.5473 -0.3712 -0.3712 -0.1934 -0.1934 0.0070 0.0070 0.1074 0.1074 0.2082 0.2082 0.2429 0.2429 0.3037 0.3037 0.6068 0.6068 0.6278 0.6278 0.9531 0.9531 0.9560 0.9560 1.0844 1.0844 1.1506 1.1506 1.2226 1.2226 2.4499 2.4499 2.5670 2.5670 2.5964 2.5964 2.6162 2.6162 2.9092 2.9092 2.9623 2.9623 3.0098 3.0098 3.0887 3.0887 3.0905 3.0905 3.1218 3.1218 5.4852 5.4852 7.0245 7.0245 7.0606 7.0606 7.0670 7.0670 7.0835 7.0835 7.3943 7.3943 7.6957 7.6957 8.4454 8.4454 k = 0.0000 0.0179-0.0000 ( 14049 PWs) bands (ev): -12.3801 -12.3801 -12.1403 -12.1402 -11.8812 -11.8812 -11.6844 -11.6844 -11.6837 -11.6836 -11.6657 -11.6657 -11.6648 -11.6648 -11.6053 -11.6053 -3.1149 -3.1145 -3.0326 -3.0322 -1.3855 -1.3822 -1.2322 -1.2233 -1.2083 -1.2065 -1.1184 -1.0957 -1.0730 -1.0685 -0.7706 -0.7487 -0.6627 -0.6534 -0.5552 -0.5383 -0.3727 -0.3684 -0.1971 -0.1872 0.0014 0.0104 0.0982 0.1152 0.2079 0.2079 0.2391 0.2448 0.2970 0.3137 0.6054 0.6087 0.6268 0.6279 0.9500 0.9548 0.9562 0.9571 1.0822 1.0856 1.1496 1.1504 1.2219 1.2225 2.4495 2.4507 2.5650 2.5689 2.5933 2.6000 2.6159 2.6167 2.9077 2.9107 2.9600 2.9650 3.0071 3.0125 3.0873 3.0883 3.0894 3.0907 3.1210 3.1222 5.4892 5.4901 7.0215 7.0290 7.0571 7.0633 7.0680 7.0709 7.0859 7.0885 7.3947 7.3980 7.6955 7.6990 8.4471 8.4495 k = 0.0000 0.0357-0.0000 ( 14063 PWs) bands (ev): -12.3790 -12.3790 -12.1398 -12.1398 -11.8807 -11.8807 -11.6853 -11.6853 -11.6838 -11.6837 -11.6664 -11.6664 -11.6653 -11.6652 -11.6055 -11.6054 -3.1142 -3.1133 -3.0320 -3.0310 -1.3872 -1.3806 -1.2553 -1.2412 -1.2062 -1.2034 -1.1279 -1.0965 -1.0489 -1.0484 -0.7832 -0.7401 -0.6711 -0.6531 -0.5614 -0.5287 -0.3729 -0.3642 -0.1984 -0.1783 -0.0061 0.0114 0.0880 0.1214 0.2069 0.2071 0.2336 0.2451 0.2940 0.3260 0.6045 0.6110 0.6249 0.6269 0.9457 0.9558 0.9570 0.9592 1.0789 1.0857 1.1475 1.1492 1.2203 1.2214 2.4495 2.4519 2.5631 2.5709 2.5908 2.6038 2.6160 2.6177 2.9063 2.9121 2.9582 2.9678 3.0043 3.0153 3.0838 3.0866 3.0872 3.0906 3.1199 3.1223 5.5022 5.5039 7.0206 7.0344 7.0564 7.0661 7.0716 7.0797 7.0954 7.0996 7.3992 7.4058 7.6984 7.7054 8.4544 8.4592 k = 0.0000 0.0536-0.0000 ( 14061 PWs) bands (ev): -12.3771 -12.3771 -12.1390 -12.1390 -11.8799 -11.8798 -11.6870 -11.6870 -11.6839 -11.6838 -11.6678 -11.6677 -11.6658 -11.6657 -11.6058 -11.6056 -3.1128 -3.1115 -3.0307 -3.0293 -1.3892 -1.3795 -1.2820 -1.2652 -1.2052 -1.2029 -1.1336 -1.0962 -1.0248 -1.0206 -0.7966 -0.7336 -0.6816 -0.6556 -0.5654 -0.5190 -0.3722 -0.3586 -0.1971 -0.1670 -0.0149 0.0099 0.0771 0.1256 0.2051 0.2058 0.2269 0.2438 0.2945 0.3400 0.6041 0.6129 0.6229 0.6247 0.9405 0.9567 0.9579 0.9622 1.0744 1.0844 1.1449 1.1472 1.2179 1.2195 2.4500 2.4535 2.5610 2.5730 2.5891 2.6077 2.6162 2.6192 2.9051 2.9133 2.9570 2.9708 3.0016 3.0182 3.0784 3.0826 3.0850 3.0900 3.1185 3.1222 5.5239 5.5264 7.0219 7.0395 7.0603 7.0719 7.0782 7.0910 7.1107 7.1159 7.4078 7.4176 7.7045 7.7150 8.4672 8.4745 k = 0.0000 0.0714-0.0000 ( 14065 PWs) bands (ev): -12.3744 -12.3744 -12.1380 -12.1379 -11.8787 -11.8787 -11.6894 -11.6894 -11.6840 -11.6839 -11.6698 -11.6696 -11.6664 -11.6662 -11.6061 -11.6059 -3.1109 -3.1092 -3.0289 -3.0270 -1.3920 -1.3799 -1.3095 -1.2922 -1.2044 -1.2031 -1.1374 -1.0948 -0.9985 -0.9923 -0.8103 -0.7294 -0.6938 -0.6607 -0.5670 -0.5095 -0.3707 -0.3518 -0.1934 -0.1531 -0.0247 0.0063 0.0659 0.1276 0.2024 0.2042 0.2198 0.2408 0.2977 0.3550 0.6038 0.6121 0.6213 0.6231 0.9348 0.9563 0.9603 0.9659 1.0684 1.0810 1.1423 1.1449 1.2148 1.2168 2.4509 2.4554 2.5588 2.5752 2.5882 2.6114 2.6167 2.6216 2.9040 2.9142 2.9566 2.9738 2.9989 3.0211 3.0715 3.0768 3.0825 3.0890 3.1169 3.1216 5.5539 5.5573 7.0256 7.0442 7.0690 7.0815 7.0879 7.1041 7.1311 7.1369 7.4205 7.4333 7.7138 7.7277 8.4845 8.4950 k = 0.0000 0.0893-0.0000 ( 14069 PWs) bands (ev): -12.3710 -12.3710 -12.1367 -12.1366 -11.8773 -11.8772 -11.6926 -11.6925 -11.6843 -11.6841 -11.6723 -11.6721 -11.6670 -11.6668 -11.6066 -11.6063 -3.1083 -3.1062 -3.0265 -3.0242 -1.3965 -1.3844 -1.3341 -1.3192 -1.2036 -1.2032 -1.1402 -1.0925 -0.9716 -0.9651 -0.8239 -0.7281 -0.7075 -0.6678 -0.5664 -0.5003 -0.3686 -0.3443 -0.1872 -0.1370 -0.0349 0.0007 0.0547 0.1273 0.1989 0.2022 0.2130 0.2360 0.3027 0.3707 0.6033 0.6072 0.6167 0.6264 0.9288 0.9554 0.9636 0.9702 1.0607 1.0752 1.1405 1.1429 1.2109 1.2132 2.4522 2.4576 2.5564 2.5774 2.5883 2.6146 2.6173 2.6249 2.9030 2.9145 2.9570 2.9769 2.9962 3.0240 3.0633 3.0696 3.0795 3.0874 3.1151 3.1208 5.5919 5.5960 7.0317 7.0499 7.0815 7.0946 7.1004 7.1186 7.1562 7.1624 7.4369 7.4528 7.7264 7.7436 8.4946 8.5134 k = 0.0000 0.1071-0.0000 ( 14063 PWs) bands (ev): -12.3669 -12.3668 -12.1351 -12.1350 -11.8755 -11.8754 -11.6964 -11.6963 -11.6847 -11.6845 -11.6753 -11.6750 -11.6677 -11.6674 -11.6071 -11.6067 -3.1052 -3.1027 -3.0236 -3.0209 -1.4052 -1.3986 -1.3499 -1.3430 -1.2038 -1.2013 -1.1425 -1.0896 -0.9451 -0.9403 -0.8365 -0.7295 -0.7220 -0.6760 -0.5637 -0.4915 -0.3661 -0.3363 -0.1785 -0.1187 -0.0453 -0.0063 0.0437 0.1246 0.1946 0.1998 0.2068 0.2292 0.3086 0.3867 0.5998 0.6013 0.6119 0.6314 0.9231 0.9545 0.9675 0.9746 1.0515 1.0665 1.1398 1.1415 1.2065 1.2090 2.4538 2.4600 2.5539 2.5796 2.5894 2.6173 2.6181 2.6292 2.9021 2.9142 2.9582 2.9800 2.9935 3.0267 3.0542 3.0616 3.0761 3.0854 3.1131 3.1199 5.6372 5.6421 7.0405 7.0574 7.0966 7.1110 7.1155 7.1341 7.1860 7.1923 7.4571 7.4758 7.7424 7.7630 8.4941 8.5266 k = 0.0000 0.1250-0.0000 ( 14075 PWs) bands (ev): -12.3620 -12.3620 -12.1333 -12.1332 -11.8734 -11.8733 -11.7008 -11.7008 -11.6853 -11.6852 -11.6787 -11.6784 -11.6682 -11.6678 -11.6078 -11.6073 -3.1016 -3.0988 -3.0203 -3.0171 -1.4228 -1.4212 -1.3599 -1.3564 -1.2034 -1.1981 -1.1442 -1.0861 -0.9207 -0.9198 -0.8460 -0.7370 -0.7338 -0.6847 -0.5595 -0.4833 -0.3634 -0.3285 -0.1672 -0.0987 -0.0551 -0.0145 0.0332 0.1196 0.1896 0.1971 0.2014 0.2204 0.3148 0.4027 0.5902 0.5951 0.6088 0.6372 0.9183 0.9540 0.9720 0.9779 1.0417 1.0552 1.1406 1.1409 1.2015 1.2042 2.4558 2.4626 2.5514 2.5816 2.5912 2.6189 2.6198 2.6343 2.9012 2.9133 2.9600 2.9831 2.9908 3.0288 3.0448 3.0535 3.0723 3.0830 3.1110 3.1187 5.6892 5.6950 7.0518 7.0672 7.1132 7.1303 7.1331 7.1504 7.2201 7.2265 7.4808 7.5022 7.7620 7.7857 8.4936 8.5269 k = 0.0000 0.1429-0.0000 ( 14045 PWs) bands (ev): -12.3565 -12.3564 -12.1314 -12.1312 -11.8710 -11.8708 -11.7059 -11.7058 -11.6864 -11.6862 -11.6825 -11.6822 -11.6685 -11.6681 -11.6085 -11.6080 -3.0975 -3.0943 -3.0165 -3.0129 -1.4511 -1.4443 -1.3698 -1.3593 -1.2023 -1.1934 -1.1454 -1.0822 -0.9113 -0.8961 -0.8483 -0.7514 -0.7404 -0.6934 -0.5541 -0.4755 -0.3605 -0.3212 -0.1536 -0.0800 -0.0617 -0.0232 0.0233 0.1127 0.1840 0.1939 0.1968 0.2098 0.3207 0.4187 0.5784 0.5846 0.6072 0.6436 0.9150 0.9543 0.9764 0.9779 1.0336 1.0420 1.1411 1.1425 1.1962 1.1990 2.4580 2.4653 2.5491 2.5834 2.5938 2.6198 2.6222 2.6399 2.9002 2.9118 2.9619 2.9861 2.9882 3.0289 3.0357 3.0468 3.0682 3.0804 3.1089 3.1175 5.7473 5.7538 7.0658 7.0794 7.1306 7.1520 7.1534 7.1672 7.2587 7.2649 7.5077 7.5317 7.7853 7.8119 8.4945 8.5269 k = 0.0000 0.1607-0.0000 ( 14049 PWs) bands (ev): -12.3503 -12.3502 -12.1292 -12.1291 -11.8682 -11.8681 -11.7115 -11.7114 -11.6879 -11.6878 -11.6866 -11.6863 -11.6686 -11.6681 -11.6093 -11.6087 -3.0930 -3.0895 -3.0123 -3.0084 -1.4803 -1.4712 -1.3758 -1.3615 -1.2003 -1.1870 -1.1460 -1.0779 -0.9144 -0.8748 -0.8424 -0.7635 -0.7488 -0.7018 -0.5481 -0.4683 -0.3573 -0.3147 -0.1376 -0.0792 -0.0485 -0.0322 0.0144 0.1040 0.1781 0.1891 0.1927 0.1985 0.3260 0.4343 0.5644 0.5708 0.6057 0.6507 0.9136 0.9557 0.9712 0.9797 1.0282 1.0306 1.1421 1.1454 1.1907 1.1934 2.4605 2.4680 2.5469 2.5850 2.5971 2.6207 2.6246 2.6459 2.8990 2.9099 2.9632 2.9857 2.9890 3.0245 3.0275 3.0444 3.0639 3.0775 3.1067 3.1163 5.8109 5.8181 7.0825 7.0939 7.1483 7.1753 7.1761 7.1842 7.3014 7.3074 7.5375 7.5638 7.8124 7.8417 8.4970 8.5272 k = 0.0000 0.1786-0.0000 ( 14037 PWs) bands (ev): -12.3434 -12.3433 -12.1270 -12.1268 -11.8653 -11.8651 -11.7177 -11.7175 -11.6915 -11.6910 -11.6896 -11.6894 -11.6683 -11.6678 -11.6102 -11.6096 -3.0881 -3.0842 -3.0078 -3.0036 -1.5094 -1.4993 -1.3803 -1.3640 -1.1974 -1.1787 -1.1461 -1.0733 -0.9248 -0.8564 -0.8370 -0.7696 -0.7582 -0.7095 -0.5417 -0.4617 -0.3538 -0.3093 -0.1198 -0.0870 -0.0411 -0.0261 0.0074 0.0937 0.1721 0.1781 0.1890 0.1914 0.3304 0.4494 0.5482 0.5542 0.6037 0.6581 0.9145 0.9571 0.9581 0.9790 1.0173 1.0337 1.1435 1.1489 1.1852 1.1877 2.4631 2.4708 2.5450 2.5862 2.6010 2.6216 2.6270 2.6522 2.8978 2.9076 2.9632 2.9833 2.9917 3.0166 3.0213 3.0457 3.0593 3.0745 3.1046 3.1151 5.8791 5.8870 7.1017 7.1106 7.1661 7.1991 7.2005 7.2018 7.3481 7.3539 7.5698 7.5983 7.8433 7.8751 8.5014 8.5285 k = 0.0000 0.1964-0.0000 ( 14030 PWs) bands (ev): -12.3359 -12.3358 -12.1248 -12.1246 -11.8620 -11.8618 -11.7242 -11.7241 -11.6963 -11.6958 -11.6920 -11.6918 -11.6678 -11.6672 -11.6112 -11.6105 -3.0828 -3.0787 -3.0031 -2.9986 -1.5378 -1.5275 -1.3842 -1.3670 -1.1937 -1.1687 -1.1455 -1.0685 -0.9377 -0.8413 -0.8398 -0.7678 -0.7663 -0.7164 -0.5353 -0.4558 -0.3496 -0.3050 -0.1008 -0.0949 -0.0494 -0.0120 0.0111 0.0818 0.1621 0.1665 0.1857 0.1878 0.3338 0.4638 0.5298 0.5352 0.6010 0.6659 0.9178 0.9379 0.9594 0.9720 1.0140 1.0408 1.1448 1.1530 1.1802 1.1821 2.4658 2.4734 2.5433 2.5871 2.6055 2.6225 2.6294 2.6588 2.8965 2.9051 2.9611 2.9810 2.9937 3.0080 3.0178 3.0482 3.0546 3.0715 3.1025 3.1140 5.9512 5.9599 7.1233 7.1290 7.1842 7.2171 7.2252 7.2259 7.3987 7.4043 7.6044 7.6346 7.8780 7.9118 8.5082 8.5314 k = 0.0000 0.2143-0.0000 ( 14036 PWs) bands (ev): -12.3278 -12.3277 -12.1226 -12.1223 -11.8585 -11.8583 -11.7311 -11.7310 -11.7015 -11.7010 -11.6947 -11.6945 -11.6671 -11.6664 -11.6122 -11.6115 -3.0773 -3.0730 -2.9982 -2.9934 -1.5653 -1.5550 -1.3879 -1.3704 -1.1896 -1.1574 -1.1441 -1.0638 -0.9512 -0.8499 -0.8303 -0.7770 -0.7561 -0.7220 -0.5294 -0.4507 -0.3447 -0.3017 -0.1023 -0.0825 -0.0556 -0.0155 0.0339 0.0684 0.1442 0.1614 0.1829 0.1849 0.3360 0.4767 0.5097 0.5145 0.5979 0.6739 0.9153 0.9234 0.9478 0.9719 1.0166 1.0500 1.1453 1.1574 1.1763 1.1768 2.4685 2.4760 2.5421 2.5876 2.6104 2.6234 2.6317 2.6654 2.8950 2.9024 2.9569 2.9788 2.9928 3.0020 3.0170 3.0497 3.0511 3.0686 3.1005 3.1130 6.0266 6.0359 7.1472 7.1484 7.2032 7.2331 7.2497 7.2516 7.4530 7.4584 7.6406 7.6723 7.9161 7.9517 8.5178 8.5364 k = 0.0000 0.2321-0.0000 ( 14026 PWs) bands (ev): -12.3191 -12.3190 -12.1204 -12.1202 -11.8547 -11.8545 -11.7383 -11.7381 -11.7069 -11.7064 -11.6978 -11.6976 -11.6662 -11.6654 -11.6134 -11.6126 -3.0715 -3.0670 -2.9932 -2.9882 -1.5917 -1.5817 -1.3915 -1.3741 -1.1855 -1.1451 -1.1418 -1.0593 -0.9638 -0.8630 -0.8237 -0.7849 -0.7435 -0.7261 -0.5241 -0.4465 -0.3389 -0.2992 -0.1091 -0.0746 -0.0508 -0.0227 0.0539 0.0606 0.1254 0.1571 0.1808 0.1826 0.3371 0.4826 0.4881 0.4976 0.5947 0.6820 0.8906 0.9276 0.9310 0.9780 1.0213 1.0603 1.1439 1.1619 1.1722 1.1745 2.4712 2.4785 2.5412 2.5878 2.6157 2.6243 2.6340 2.6721 2.8934 2.8996 2.9511 2.9766 2.9861 3.0017 3.0184 3.0450 3.0541 3.0660 3.0986 3.1123 6.1044 6.1144 7.1677 7.1730 7.2238 7.2484 7.2737 7.2770 7.5107 7.5161 7.6782 7.7106 7.9574 7.9943 8.5306 8.5442 k = 0.0000 0.2500-0.0000 ( 14036 PWs) bands (ev): -12.3099 -12.3099 -12.1185 -12.1182 -11.8507 -11.8505 -11.7456 -11.7454 -11.7126 -11.7120 -11.7012 -11.7010 -11.6650 -11.6643 -11.6146 -11.6138 -3.0656 -3.0610 -2.9882 -2.9830 -1.6169 -1.6072 -1.3949 -1.3778 -1.1819 -1.1385 -1.1327 -1.0556 -0.9744 -0.8766 -0.8212 -0.7913 -0.7310 -0.7286 -0.5196 -0.4433 -0.3319 -0.2973 -0.1151 -0.0794 -0.0340 -0.0311 0.0392 0.0861 0.1083 0.1538 0.1795 0.1810 0.3373 0.4636 0.4655 0.5024 0.5920 0.6899 0.8643 0.9048 0.9403 0.9857 1.0265 1.0713 1.1404 1.1665 1.1686 1.1751 2.4737 2.4808 2.5407 2.5875 2.6214 2.6252 2.6362 2.6786 2.8916 2.8968 2.9447 2.9745 2.9780 3.0029 3.0210 3.0402 3.0573 3.0639 3.0969 3.1117 6.1839 6.1946 7.1855 7.1999 7.2469 7.2635 7.2965 7.3013 7.5713 7.5772 7.7167 7.7491 8.0010 8.0388 8.5475 8.5558 k = 0.0000 0.2679-0.0000 ( 14022 PWs) bands (ev): -12.3003 -12.3002 -12.1168 -12.1166 -11.8465 -11.8463 -11.7529 -11.7527 -11.7185 -11.7179 -11.7049 -11.7046 -11.6638 -11.6630 -11.6159 -11.6151 -3.0596 -3.0548 -2.9832 -2.9779 -1.6406 -1.6315 -1.3980 -1.3815 -1.1790 -1.1345 -1.1213 -1.0535 -0.9813 -0.8893 -0.8212 -0.7965 -0.7300 -0.7196 -0.5161 -0.4413 -0.3237 -0.2961 -0.1206 -0.0864 -0.0410 -0.0195 0.0277 0.0841 0.1189 0.1518 0.1793 0.1806 0.3366 0.4390 0.4425 0.5092 0.5910 0.6976 0.8366 0.8806 0.9509 0.9941 1.0315 1.0825 1.1353 1.1658 1.1714 1.1775 2.4762 2.4829 2.5407 2.5870 2.6257 2.6277 2.6382 2.6848 2.8899 2.8941 2.9385 2.9700 2.9725 3.0040 3.0239 3.0357 3.0606 3.0627 3.0954 3.1113 6.2643 6.2757 7.2007 7.2263 7.2734 7.2794 7.3179 7.3243 7.6344 7.6413 7.7559 7.7871 8.0461 8.0842 8.5691 8.5722 k = 0.0000 0.2857-0.0000 ( 14018 PWs) bands (ev): -12.2902 -12.2901 -12.1155 -12.1153 -11.8421 -11.8419 -11.7601 -11.7598 -11.7245 -11.7239 -11.7088 -11.7086 -11.6624 -11.6615 -11.6173 -11.6164 -3.0536 -3.0487 -2.9783 -2.9729 -1.6629 -1.6544 -1.4007 -1.3849 -1.1770 -1.1300 -1.1121 -1.0542 -0.9825 -0.9002 -0.8218 -0.8011 -0.7311 -0.7098 -0.5135 -0.4404 -0.3144 -0.2956 -0.1255 -0.0938 -0.0530 -0.0187 0.0286 0.0682 0.1426 0.1512 0.1803 0.1835 0.3354 0.4139 0.4195 0.5127 0.5926 0.7048 0.8080 0.8555 0.9625 1.0024 1.0361 1.0935 1.1296 1.1647 1.1760 1.1809 2.4785 2.4848 2.5411 2.5861 2.6266 2.6338 2.6400 2.6906 2.8881 2.8915 2.9327 2.9626 2.9707 3.0046 3.0262 3.0316 3.0624 3.0638 3.0941 3.1110 6.3450 6.3571 7.2129 7.2487 7.2990 7.3032 7.3378 7.3455 7.6988 7.7078 7.7956 7.8240 8.0914 8.1291 8.5944 8.5959 k = 0.0000 0.3036-0.0000 ( 14026 PWs) bands (ev): -12.2797 -12.2797 -12.1147 -12.1144 -11.8376 -11.8373 -11.7670 -11.7668 -11.7306 -11.7299 -11.7130 -11.7127 -11.6609 -11.6600 -11.6187 -11.6178 -3.0476 -3.0427 -2.9736 -2.9682 -1.6837 -1.6757 -1.4030 -1.3879 -1.1758 -1.1257 -1.1066 -1.0577 -0.9771 -0.9086 -0.8211 -0.8054 -0.7325 -0.7016 -0.5118 -0.4406 -0.3044 -0.2960 -0.1301 -0.1012 -0.0680 -0.0313 0.0404 0.0545 0.1524 0.1581 0.1831 0.1955 0.3339 0.3891 0.3971 0.5120 0.5973 0.7114 0.7785 0.8297 0.9745 1.0101 1.0405 1.1031 1.1247 1.1650 1.1804 1.1848 2.4805 2.4865 2.5418 2.5849 2.6274 2.6402 2.6416 2.6958 2.8864 2.8890 2.9276 2.9558 2.9692 3.0045 3.0277 3.0279 3.0632 3.0670 3.0933 3.1108 6.4250 6.4378 7.2221 7.2639 7.3245 7.3356 7.3566 7.3647 7.7624 7.7763 7.8370 7.8589 8.1358 8.1722 8.6234 8.6242 k = 0.0000 0.3214-0.0000 ( 14032 PWs) bands (ev): -12.2690 -12.2689 -12.1144 -12.1142 -11.8329 -11.8326 -11.7736 -11.7733 -11.7367 -11.7361 -11.7173 -11.7170 -11.6593 -11.6584 -11.6202 -11.6193 -3.0417 -3.0369 -2.9692 -2.9638 -1.7028 -1.6955 -1.4047 -1.3906 -1.1751 -1.1222 -1.1054 -1.0634 -0.9656 -0.9140 -0.8181 -0.8094 -0.7348 -0.6951 -0.5110 -0.4419 -0.2977 -0.2941 -0.1345 -0.1087 -0.0858 -0.0476 0.0442 0.0531 0.1552 0.1633 0.1885 0.2181 0.3325 0.3652 0.3757 0.5078 0.6048 0.7171 0.7484 0.8035 0.9867 1.0161 1.0454 1.1070 1.1250 1.1668 1.1846 1.1888 2.4824 2.4879 2.5429 2.5835 2.6283 2.6428 2.6466 2.7004 2.8847 2.8867 2.9235 2.9496 2.9681 3.0038 3.0248 3.0282 3.0647 3.0699 3.0929 3.1107 6.5038 6.5173 7.2284 7.2723 7.3533 7.3700 7.3760 7.3821 7.8203 7.8457 7.8832 7.8914 8.1782 8.2124 8.6098 8.6181 k = 0.0000 0.3393-0.0000 ( 14034 PWs) bands (ev): -12.2579 -12.2578 -12.1149 -12.1147 -11.8280 -11.8278 -11.7797 -11.7794 -11.7428 -11.7422 -11.7218 -11.7215 -11.6576 -11.6567 -11.6217 -11.6208 -3.0360 -3.0313 -2.9650 -2.9598 -1.7202 -1.7136 -1.4060 -1.3928 -1.1747 -1.1198 -1.1080 -1.0702 -0.9495 -0.9161 -0.8140 -0.8112 -0.7380 -0.6902 -0.5108 -0.4441 -0.3012 -0.2842 -0.1394 -0.1160 -0.1053 -0.0640 0.0375 0.0627 0.1588 0.1645 0.1977 0.2444 0.3315 0.3428 0.3559 0.5010 0.6141 0.7179 0.7216 0.7771 0.9986 1.0200 1.0511 1.1034 1.1325 1.1698 1.1885 1.1927 2.4840 2.4892 2.5444 2.5819 2.6291 2.6438 2.6531 2.7041 2.8832 2.8847 2.9202 2.9440 2.9674 3.0024 3.0226 3.0280 3.0663 3.0724 3.0933 3.1107 6.5805 6.5948 7.2317 7.2759 7.3767 7.3958 7.4022 7.4073 7.8665 7.9115 7.9242 7.9387 8.2182 8.2492 8.5829 8.5888 k = 0.0000 0.3571-0.0000 ( 14020 PWs) bands (ev): -12.2467 -12.2466 -12.1161 -12.1159 -11.8231 -11.8229 -11.7851 -11.7848 -11.7488 -11.7482 -11.7264 -11.7261 -11.6559 -11.6550 -11.6233 -11.6223 -3.0306 -3.0261 -2.9611 -2.9561 -1.7359 -1.7299 -1.4067 -1.3946 -1.1744 -1.1189 -1.1132 -1.0780 -0.9303 -0.9152 -0.8169 -0.8023 -0.7423 -0.6866 -0.5113 -0.4472 -0.3068 -0.2756 -0.1462 -0.1232 -0.1230 -0.0791 0.0338 0.0687 0.1618 0.1647 0.2115 0.2712 0.3222 0.3303 0.3390 0.4929 0.6244 0.6871 0.7239 0.7515 1.0100 1.0220 1.0577 1.0976 1.1420 1.1737 1.1919 1.1964 2.4855 2.4903 2.5460 2.5801 2.6300 2.6444 2.6594 2.7069 2.8818 2.8829 2.9178 2.9391 2.9673 3.0004 3.0211 3.0275 3.0676 3.0743 3.0946 3.1110 6.6544 6.6696 7.2321 7.2755 7.3921 7.4088 7.4364 7.4441 7.9013 7.9428 7.9859 8.0007 8.2561 8.2831 8.5565 8.5604 k = 0.0000 0.3750-0.0000 ( 14032 PWs) bands (ev): -12.2354 -12.2353 -12.1182 -12.1181 -11.8182 -11.8179 -11.7898 -11.7895 -11.7546 -11.7540 -11.7310 -11.7307 -11.6542 -11.6532 -11.6249 -11.6239 -3.0254 -3.0212 -2.9576 -2.9529 -1.7498 -1.7446 -1.4069 -1.3959 -1.1741 -1.1197 -1.1193 -1.0864 -0.9129 -0.9080 -0.8200 -0.7900 -0.7473 -0.6843 -0.5123 -0.4512 -0.3148 -0.2703 -0.1576 -0.1346 -0.1294 -0.0926 0.0324 0.0715 0.1634 0.1644 0.2294 0.2960 0.3053 0.3193 0.3355 0.4842 0.6347 0.6567 0.7163 0.7343 1.0203 1.0228 1.0644 1.0917 1.1514 1.1781 1.1949 1.1996 2.4868 2.4911 2.5479 2.5781 2.6310 2.6447 2.6656 2.7087 2.8806 2.8814 2.9161 2.9346 2.9677 2.9981 3.0203 3.0267 3.0681 3.0754 3.0967 3.1114 6.7249 6.7409 7.2295 7.2715 7.4039 7.4194 7.4733 7.4814 7.9280 7.9625 8.0505 8.0629 8.2933 8.3159 8.5324 8.5344 k = 0.0000 0.3929-0.0000 ( 14034 PWs) bands (ev): -12.2240 -12.2239 -12.1213 -12.1212 -11.8133 -11.8130 -11.7938 -11.7934 -11.7602 -11.7596 -11.7357 -11.7354 -11.6524 -11.6515 -11.6265 -11.6256 -3.0207 -3.0169 -2.9545 -2.9502 -1.7619 -1.7574 -1.4067 -1.3970 -1.1735 -1.1265 -1.1208 -1.0951 -0.9068 -0.8868 -0.8231 -0.7751 -0.7528 -0.6827 -0.5138 -0.4564 -0.3245 -0.2706 -0.1694 -0.1401 -0.1347 -0.1041 0.0329 0.0720 0.1636 0.1639 0.2499 0.2872 0.3051 0.3230 0.3393 0.4762 0.6236 0.6479 0.6924 0.7319 1.0232 1.0292 1.0707 1.0865 1.1603 1.1827 1.1974 1.2024 2.4879 2.4917 2.5499 2.5761 2.6320 2.6447 2.6715 2.7097 2.8796 2.8801 2.9150 2.9307 2.9688 2.9956 3.0201 3.0261 3.0679 3.0756 3.0995 3.1121 6.7912 6.8082 7.2238 7.2640 7.4137 7.4279 7.5104 7.5183 7.9479 7.9762 8.1090 8.1200 8.3319 8.3501 8.5117 8.5120 k = 0.0000 0.4107-0.0000 ( 14034 PWs) bands (ev): -12.2127 -12.2126 -12.1254 -12.1253 -11.8085 -11.8082 -11.7968 -11.7965 -11.7654 -11.7648 -11.7403 -11.7400 -11.6507 -11.6497 -11.6281 -11.6272 -3.0165 -3.0131 -2.9518 -2.9480 -1.7721 -1.7683 -1.4061 -1.3978 -1.1726 -1.1331 -1.1230 -1.1037 -0.8998 -0.8652 -0.8264 -0.7603 -0.7567 -0.6817 -0.5156 -0.4630 -0.3348 -0.2783 -0.1755 -0.1434 -0.1390 -0.1140 0.0348 0.0710 0.1628 0.1631 0.2712 0.2743 0.2927 0.3446 0.3464 0.4703 0.5931 0.6584 0.6658 0.7308 1.0236 1.0360 1.0762 1.0826 1.1684 1.1872 1.1994 1.2046 2.4889 2.4922 2.5521 2.5741 2.6331 2.6443 2.6772 2.7098 2.8787 2.8790 2.9144 2.9273 2.9703 2.9930 3.0204 3.0256 3.0672 3.0749 3.1026 3.1129 6.8528 6.8708 7.2150 7.2529 7.4219 7.4344 7.5465 7.5538 7.9613 7.9839 8.1579 8.1678 8.3743 8.3887 8.4939 8.4950 k = 0.0000 0.4286-0.0000 ( 14032 PWs) bands (ev): -12.2015 -12.2015 -12.1305 -12.1304 -11.8038 -11.8036 -11.7991 -11.7987 -11.7700 -11.7695 -11.7447 -11.7445 -11.6489 -11.6481 -11.6297 -11.6288 -3.0129 -3.0100 -2.9495 -2.9463 -1.7804 -1.7774 -1.4052 -1.3984 -1.1711 -1.1393 -1.1256 -1.1118 -0.8918 -0.8447 -0.8304 -0.7648 -0.7402 -0.6809 -0.5177 -0.4716 -0.3440 -0.2920 -0.1755 -0.1454 -0.1425 -0.1223 0.0377 0.0689 0.1614 0.1621 0.2644 0.2802 0.2938 0.3573 0.3610 0.4692 0.5623 0.6388 0.6691 0.7286 1.0244 1.0399 1.0806 1.0807 1.1756 1.1913 1.2008 1.2063 2.4897 2.4925 2.5543 2.5719 2.6343 2.6437 2.6826 2.7092 2.8781 2.8782 2.9141 2.9244 2.9723 2.9905 3.0211 3.0253 3.0663 3.0735 3.1057 3.1137 6.9091 6.9280 7.2031 7.2383 7.4287 7.4393 7.5804 7.5867 7.9686 7.9858 8.1955 8.2038 8.4212 8.4328 8.4805 8.4826 k = 0.0000 0.4464-0.0000 ( 14026 PWs) bands (ev): -12.1906 -12.1906 -12.1366 -12.1365 -11.8005 -11.8002 -11.7996 -11.7994 -11.7740 -11.7736 -11.7488 -11.7486 -11.6473 -11.6465 -11.6311 -11.6303 -3.0098 -3.0076 -2.9476 -2.9451 -1.7868 -1.7845 -1.4042 -1.3990 -1.1691 -1.1449 -1.1280 -1.1188 -0.8831 -0.8353 -0.8264 -0.7704 -0.7227 -0.6802 -0.5195 -0.4820 -0.3506 -0.3081 -0.1717 -0.1464 -0.1457 -0.1294 0.0414 0.0660 0.1598 0.1608 0.2576 0.2716 0.3122 0.3694 0.3728 0.4755 0.5319 0.6119 0.6795 0.7251 1.0258 1.0408 1.0808 1.0839 1.1819 1.1945 1.2018 1.2072 2.4904 2.4926 2.5565 2.5698 2.6356 2.6429 2.6875 2.7078 2.8776 2.8777 2.9142 2.9218 2.9744 2.9881 3.0219 3.0251 3.0656 3.0717 3.1085 3.1143 6.9596 6.9790 7.1884 7.2204 7.4342 7.4425 7.6104 7.6155 7.9709 7.9832 8.2220 8.2283 8.4684 8.4713 8.4758 8.4801 k = 0.0000 0.4643-0.0000 ( 14026 PWs) bands (ev): -12.1801 -12.1801 -12.1436 -12.1436 -11.8013 -11.8011 -11.7961 -11.7959 -11.7771 -11.7767 -11.7522 -11.7521 -11.6459 -11.6453 -11.6323 -11.6317 -3.0075 -3.0060 -2.9462 -2.9444 -1.7913 -1.7898 -1.4032 -1.3996 -1.1664 -1.1501 -1.1298 -1.1243 -0.8741 -0.8413 -0.8110 -0.7760 -0.7069 -0.6800 -0.5201 -0.4935 -0.3535 -0.3236 -0.1665 -0.1488 -0.1465 -0.1351 0.0455 0.0625 0.1584 0.1595 0.2539 0.2641 0.3285 0.3694 0.3930 0.4888 0.5030 0.5853 0.6894 0.7202 1.0278 1.0393 1.0825 1.0859 1.1871 1.1963 1.2029 1.2074 2.4911 2.4925 2.5587 2.5676 2.6369 2.6419 2.6921 2.7057 2.8772 2.8773 2.9147 2.9197 2.9767 2.9858 3.0229 3.0250 3.0652 3.0697 3.1108 3.1147 7.0032 7.0219 7.1724 7.1996 7.4386 7.4443 7.6346 7.6383 7.9701 7.9780 8.2393 8.2434 8.4664 8.4680 8.5165 8.5236 k = 0.0000 0.4821-0.0000 ( 14026 PWs) bands (ev): -12.1702 -12.1701 -12.1514 -12.1514 -11.8016 -11.8015 -11.7936 -11.7935 -11.7790 -11.7788 -11.7546 -11.7545 -11.6448 -11.6445 -11.6331 -11.6328 -3.0059 -3.0051 -2.9451 -2.9442 -1.7939 -1.7931 -1.4021 -1.4003 -1.1631 -1.1548 -1.1307 -1.1282 -0.8651 -0.8484 -0.7987 -0.7820 -0.6942 -0.6813 -0.5183 -0.5045 -0.3521 -0.3368 -0.1612 -0.1523 -0.1454 -0.1397 0.0498 0.0585 0.1577 0.1583 0.2531 0.2584 0.3423 0.3635 0.4170 0.4716 0.5110 0.5592 0.6985 0.7141 1.0304 1.0366 1.0844 1.0865 1.1913 1.1961 1.2045 1.2070 2.4916 2.4924 2.5610 2.5654 2.6382 2.6408 2.6962 2.7031 2.8770 2.8771 2.9154 2.9179 2.9790 2.9835 3.0237 3.0248 3.0654 3.0678 3.1126 3.1145 7.0380 7.0518 7.1597 7.1778 7.4418 7.4447 7.6509 7.6529 7.9688 7.9727 8.2493 8.2513 8.4641 8.4651 8.5514 8.5556 k = 0.0000 0.5000-0.0000 ( 14040 PWs) bands (ev): -12.1625 -12.1625 -12.1583 -12.1583 -11.8017 -11.8017 -11.7926 -11.7926 -11.7796 -11.7796 -11.7554 -11.7554 -11.6443 -11.6443 -11.6333 -11.6333 -3.0051 -3.0051 -2.9444 -2.9444 -1.7944 -1.7944 -1.4012 -1.4012 -1.1592 -1.1592 -1.1303 -1.1303 -0.8565 -0.8565 -0.7893 -0.7893 -0.6857 -0.6857 -0.5132 -0.5132 -0.3464 -0.3464 -0.1564 -0.1564 -0.1432 -0.1432 0.0542 0.0542 0.1577 0.1577 0.2547 0.2547 0.3540 0.3540 0.4436 0.4436 0.5342 0.5342 0.7068 0.7068 1.0334 1.0334 1.0860 1.0860 1.1944 1.1944 1.2060 1.2060 2.4920 2.4920 2.5632 2.5632 2.6395 2.6395 2.6999 2.6999 2.8770 2.8770 2.9165 2.9165 2.9812 2.9812 3.0244 3.0244 3.0663 3.0663 3.1139 3.1139 7.0578 7.0578 7.1608 7.1608 7.4438 7.4438 7.6573 7.6573 7.9693 7.9693 8.2531 8.2531 8.4637 8.4637 8.5663 8.5663 k = 0.0000 0.5000-0.0000 ( 14040 PWs) bands (ev): -12.1625 -12.1625 -12.1583 -12.1583 -11.8017 -11.8017 -11.7926 -11.7926 -11.7796 -11.7796 -11.7554 -11.7554 -11.6443 -11.6443 -11.6333 -11.6333 -3.0051 -3.0051 -2.9444 -2.9444 -1.7944 -1.7944 -1.4012 -1.4012 -1.1592 -1.1592 -1.1303 -1.1303 -0.8565 -0.8565 -0.7893 -0.7893 -0.6857 -0.6857 -0.5132 -0.5132 -0.3464 -0.3464 -0.1564 -0.1564 -0.1432 -0.1432 0.0542 0.0542 0.1577 0.1577 0.2547 0.2547 0.3540 0.3540 0.4436 0.4436 0.5342 0.5342 0.7068 0.7068 1.0334 1.0334 1.0860 1.0860 1.1944 1.1944 1.2060 1.2060 2.4920 2.4920 2.5632 2.5632 2.6395 2.6395 2.6999 2.6999 2.8770 2.8770 2.9165 2.9165 2.9812 2.9812 3.0244 3.0244 3.0663 3.0663 3.1139 3.1139 7.0578 7.0578 7.1608 7.1608 7.4438 7.4438 7.6573 7.6573 7.9693 7.9693 8.2531 8.2531 8.4637 8.4637 8.5663 8.5663 k = 0.0179 0.5000-0.0000 ( 14036 PWs) bands (ev): -12.1623 -12.1623 -12.1581 -12.1581 -11.8017 -11.8017 -11.7926 -11.7926 -11.7796 -11.7796 -11.7554 -11.7553 -11.6446 -11.6445 -11.6335 -11.6335 -3.0059 -3.0050 -2.9451 -2.9448 -1.7973 -1.7961 -1.4022 -1.3984 -1.1620 -1.1584 -1.1340 -1.1263 -0.8605 -0.8571 -0.7923 -0.7897 -0.6900 -0.6805 -0.5117 -0.5110 -0.3474 -0.3457 -0.1645 -0.1536 -0.1456 -0.1310 0.0471 0.0638 0.1465 0.1698 0.2449 0.2654 0.3519 0.3566 0.4358 0.4534 0.5338 0.5363 0.7064 0.7088 1.0275 1.0384 1.0832 1.0885 1.1905 1.1975 1.2060 1.2061 2.4899 2.4947 2.5619 2.5645 2.6373 2.6419 2.6981 2.7023 2.8741 2.8803 2.9156 2.9176 2.9795 2.9829 3.0223 3.0263 3.0649 3.0683 3.1125 3.1159 7.0557 7.0607 7.1601 7.1613 7.4389 7.4401 7.6596 7.6612 7.9660 7.9693 8.2521 8.2549 8.4633 8.4659 8.5651 8.5654 k = 0.0357 0.5000-0.0000 ( 14040 PWs) bands (ev): -12.1616 -12.1616 -12.1574 -12.1574 -11.8019 -11.8018 -11.7924 -11.7924 -11.7797 -11.7796 -11.7554 -11.7553 -11.6453 -11.6452 -11.6343 -11.6343 -3.0072 -3.0054 -2.9468 -2.9462 -1.8046 -1.8022 -1.4014 -1.3939 -1.1671 -1.1593 -1.1371 -1.1224 -0.8688 -0.8621 -0.7994 -0.7931 -0.6930 -0.6755 -0.5071 -0.5048 -0.3487 -0.3450 -0.1740 -0.1506 -0.1413 -0.1156 0.0433 0.0746 0.1372 0.1817 0.2368 0.2771 0.3504 0.3597 0.4304 0.4649 0.5352 0.5401 0.7077 0.7125 1.0207 1.0421 1.0805 1.0906 1.1860 1.1995 1.2061 1.2069 2.4885 2.4981 2.5607 2.5658 2.6355 2.6445 2.6968 2.7052 2.8718 2.8841 2.9150 2.9190 2.9777 2.9845 3.0200 3.0279 3.0641 3.0706 3.1118 3.1185 7.0543 7.0644 7.1590 7.1614 7.4261 7.4284 7.6677 7.6712 7.9595 7.9661 8.2520 8.2575 8.4645 8.4696 8.5621 8.5626 k = 0.0536 0.5000-0.0000 ( 14026 PWs) bands (ev): -12.1604 -12.1603 -12.1563 -12.1562 -11.8021 -11.8020 -11.7921 -11.7921 -11.7797 -11.7796 -11.7553 -11.7551 -11.6465 -11.6464 -11.6356 -11.6356 -3.0091 -3.0065 -2.9496 -2.9486 -1.8159 -1.8125 -1.3993 -1.3879 -1.1742 -1.1617 -1.1396 -1.1190 -0.8806 -0.8707 -0.8106 -0.7992 -0.6947 -0.6717 -0.4999 -0.4944 -0.3500 -0.3434 -0.1812 -0.1459 -0.1340 -0.1001 0.0437 0.0846 0.1310 0.1909 0.2326 0.2900 0.3494 0.3632 0.4276 0.4780 0.5386 0.5453 0.7108 0.7178 1.0131 1.0443 1.0782 1.0921 1.1811 1.1996 1.2064 1.2087 2.4878 2.5020 2.5596 2.5672 2.6339 2.6473 2.6962 2.7086 2.8701 2.8882 2.9148 2.9205 2.9760 2.9857 3.0176 3.0293 3.0641 3.0732 3.1120 3.1216 7.0537 7.0686 7.1572 7.1609 7.4061 7.4095 7.6811 7.6865 7.9501 7.9600 8.2526 8.2607 8.4674 8.4749 8.5572 8.5580 k = 0.0714 0.5000-0.0000 ( 14036 PWs) bands (ev): -12.1588 -12.1587 -12.1547 -12.1546 -11.8023 -11.8022 -11.7918 -11.7918 -11.7797 -11.7796 -11.7552 -11.7550 -11.6482 -11.6480 -11.6374 -11.6373 -3.0116 -3.0081 -2.9533 -2.9520 -1.8307 -1.8264 -1.3960 -1.3808 -1.1829 -1.1656 -1.1419 -1.1164 -0.8948 -0.8820 -0.8254 -0.8081 -0.6960 -0.6697 -0.4907 -0.4802 -0.3511 -0.3405 -0.1855 -0.1393 -0.1243 -0.0862 0.0485 0.0908 0.1302 0.1924 0.2368 0.3041 0.3492 0.3674 0.4277 0.4922 0.5440 0.5518 0.7155 0.7246 1.0047 1.0447 1.0768 1.0925 1.1760 1.1982 1.2071 1.2115 2.4877 2.5064 2.5585 2.5686 2.6326 2.6502 2.6962 2.7123 2.8689 2.8925 2.9150 2.9223 2.9744 2.9868 3.0151 3.0305 3.0649 3.0759 3.1132 3.1253 7.0535 7.0730 7.1545 7.1593 7.3803 7.3846 7.6990 7.7066 7.9382 7.9515 8.2539 8.2646 8.4721 8.4816 8.5506 8.5515 k = 0.0893 0.5000-0.0000 ( 14036 PWs) bands (ev): -12.1566 -12.1565 -12.1526 -12.1526 -11.8026 -11.8025 -11.7913 -11.7913 -11.7797 -11.7796 -11.7550 -11.7548 -11.6503 -11.6501 -11.6396 -11.6396 -3.0145 -3.0103 -2.9579 -2.9563 -1.8485 -1.8435 -1.3921 -1.3730 -1.1929 -1.1706 -1.1440 -1.1146 -0.9107 -0.8954 -0.8428 -0.8200 -0.6973 -0.6696 -0.4800 -0.4628 -0.3511 -0.3353 -0.1869 -0.1310 -0.1128 -0.0747 0.0576 0.0911 0.1361 0.1865 0.2488 0.3190 0.3499 0.3728 0.4310 0.5075 0.5512 0.5594 0.7220 0.7330 0.9956 1.0430 1.0763 1.0917 1.1710 1.1958 1.2083 1.2149 2.4883 2.5113 2.5576 2.5700 2.6316 2.6532 2.6968 2.7162 2.8685 2.8966 2.9161 2.9242 2.9731 2.9875 3.0126 3.0315 3.0664 3.0785 3.1153 3.1294 7.0535 7.0770 7.1505 7.1561 7.3493 7.3545 7.7213 7.7313 7.9244 7.9411 8.2561 8.2691 8.4783 8.4897 8.5423 8.5434 k = 0.1071 0.5000-0.0000 ( 14042 PWs) bands (ev): -12.1541 -12.1539 -12.1502 -12.1501 -11.8029 -11.8028 -11.7909 -11.7908 -11.7797 -11.7796 -11.7549 -11.7546 -11.6528 -11.6526 -11.6423 -11.6423 -3.0180 -3.0130 -2.9633 -2.9615 -1.8687 -1.8631 -1.3877 -1.3648 -1.2038 -1.1769 -1.1462 -1.1139 -0.9274 -0.9102 -0.8618 -0.8348 -0.6991 -0.6713 -0.4688 -0.4434 -0.3491 -0.3276 -0.1856 -0.1215 -0.0999 -0.0657 0.0700 0.0880 0.1458 0.1772 0.2642 0.3337 0.3519 0.3805 0.4376 0.5237 0.5603 0.5680 0.7303 0.7429 0.9858 1.0394 1.0767 1.0893 1.1665 1.1926 1.2100 1.2187 2.4895 2.5167 2.5568 2.5715 2.6309 2.6561 2.6981 2.7204 2.8686 2.8999 2.9184 2.9262 2.9721 2.9881 3.0102 3.0324 3.0685 3.0810 3.1186 3.1341 7.0531 7.0799 7.1448 7.1508 7.3138 7.3198 7.7482 7.7606 7.9097 7.9297 8.2589 8.2741 8.4859 8.4988 8.5326 8.5339 k = 0.1250 0.5000-0.0000 ( 14048 PWs) bands (ev): -12.1511 -12.1509 -12.1473 -12.1472 -11.8032 -11.8031 -11.7904 -11.7903 -11.7798 -11.7797 -11.7547 -11.7543 -11.6557 -11.6554 -11.6455 -11.6455 -3.0218 -3.0163 -2.9695 -2.9675 -1.8908 -1.8847 -1.3833 -1.3565 -1.2154 -1.1843 -1.1486 -1.1143 -0.9446 -0.9260 -0.8819 -0.8520 -0.7012 -0.6745 -0.4575 -0.4242 -0.3435 -0.3172 -0.1820 -0.1110 -0.0858 -0.0585 0.0838 0.0841 0.1562 0.1666 0.2803 0.3460 0.3559 0.3925 0.4474 0.5404 0.5712 0.5774 0.7404 0.7542 0.9753 1.0345 1.0775 1.0848 1.1630 1.1888 1.2122 1.2229 2.4914 2.5224 2.5561 2.5730 2.6304 2.6589 2.7000 2.7245 2.8695 2.9018 2.9226 2.9284 2.9716 2.9886 3.0081 3.0332 3.0712 3.0831 3.1229 3.1391 7.0519 7.0810 7.1374 7.1430 7.2743 7.2811 7.7798 7.7947 7.8951 7.9181 8.2623 8.2794 8.4945 8.5086 8.5221 8.5236 k = 0.1429 0.5000-0.0000 ( 14060 PWs) bands (ev): -12.1477 -12.1475 -12.1441 -12.1440 -11.8035 -11.8034 -11.7899 -11.7898 -11.7798 -11.7797 -11.7544 -11.7541 -11.6590 -11.6587 -11.6490 -11.6490 -3.0260 -3.0199 -2.9764 -2.9742 -1.9141 -1.9077 -1.3790 -1.3485 -1.2274 -1.1926 -1.1513 -1.1160 -0.9618 -0.9424 -0.9023 -0.8712 -0.7035 -0.6787 -0.4469 -0.4078 -0.3321 -0.3040 -0.1763 -0.0999 -0.0709 -0.0525 0.0796 0.0982 0.1556 0.1663 0.2952 0.3545 0.3629 0.4098 0.4605 0.5577 0.5836 0.5874 0.7521 0.7667 0.9644 1.0284 1.0782 1.0783 1.1606 1.1846 1.2152 1.2275 2.4940 2.5284 2.5555 2.5745 2.6302 2.6616 2.7024 2.7286 2.8709 2.9025 2.9285 2.9307 2.9715 2.9892 3.0063 3.0341 3.0742 3.0851 3.1282 3.1445 7.0493 7.0790 7.1281 7.1322 7.2314 7.2388 7.8161 7.8336 7.8815 7.9074 8.2662 8.2849 8.5012 8.5086 8.5154 8.5212 k = 0.1607 0.5000-0.0000 ( 14072 PWs) bands (ev): -12.1439 -12.1437 -12.1404 -12.1404 -11.8039 -11.8037 -11.7894 -11.7893 -11.7799 -11.7798 -11.7541 -11.7538 -11.6627 -11.6623 -11.6530 -11.6530 -3.0305 -3.0240 -2.9838 -2.9814 -1.9383 -1.9318 -1.3751 -1.3410 -1.2397 -1.2016 -1.1544 -1.1192 -0.9787 -0.9589 -0.9226 -0.8918 -0.7057 -0.6836 -0.4371 -0.3960 -0.3138 -0.2886 -0.1689 -0.0884 -0.0551 -0.0471 0.0757 0.1104 0.1456 0.1755 0.3075 0.3599 0.3738 0.4313 0.4765 0.5754 0.5974 0.5979 0.7656 0.7802 0.9529 1.0216 1.0696 1.0788 1.1593 1.1801 1.2189 1.2326 2.4970 2.5346 2.5552 2.5760 2.6301 2.6641 2.7053 2.7325 2.8727 2.9021 2.9331 2.9357 2.9721 2.9899 3.0050 3.0350 3.0775 3.0869 3.1343 3.1503 7.0446 7.0730 7.1171 7.1184 7.1857 7.1938 7.8566 7.8702 7.8774 7.8993 8.2705 8.2906 8.4958 8.4968 8.5197 8.5319 k = 0.1786 0.5000-0.0000 ( 14080 PWs) bands (ev): -12.1398 -12.1396 -12.1365 -12.1364 -11.8042 -11.8040 -11.7889 -11.7888 -11.7800 -11.7799 -11.7539 -11.7534 -11.6666 -11.6662 -11.6573 -11.6572 -3.0353 -3.0284 -2.9916 -2.9891 -1.9631 -1.9565 -1.3716 -1.3344 -1.2518 -1.2113 -1.1580 -1.1240 -0.9952 -0.9754 -0.9424 -0.9134 -0.7076 -0.6887 -0.4284 -0.3884 -0.2897 -0.2714 -0.1600 -0.0768 -0.0419 -0.0388 0.0721 0.1158 0.1409 0.1838 0.3167 0.3635 0.3890 0.4551 0.4953 0.5936 0.6088 0.6123 0.7805 0.7947 0.9412 1.0142 1.0593 1.0789 1.1591 1.1758 1.2232 1.2381 2.5006 2.5408 2.5552 2.5777 2.6303 2.6664 2.7088 2.7361 2.8748 2.9010 2.9358 2.9439 2.9735 2.9909 3.0042 3.0361 3.0809 3.0887 3.1410 3.1564 7.0372 7.0620 7.1010 7.1036 7.1383 7.1476 7.8622 7.8848 7.9109 7.9259 8.2751 8.2962 8.4846 8.4849 8.5298 8.5429 k = 0.1964 0.5000-0.0000 ( 14072 PWs) bands (ev): -12.1353 -12.1351 -12.1322 -12.1321 -11.8045 -11.8043 -11.7885 -11.7884 -11.7801 -11.7800 -11.7535 -11.7531 -11.6709 -11.6704 -11.6619 -11.6618 -3.0403 -3.0331 -2.9998 -2.9972 -1.9879 -1.9814 -1.3688 -1.3290 -1.2635 -1.2213 -1.1622 -1.1305 -1.0111 -0.9913 -0.9614 -0.9353 -0.7091 -0.6938 -0.4208 -0.3830 -0.2622 -0.2533 -0.1499 -0.0653 -0.0365 -0.0219 0.0688 0.1096 0.1462 0.1912 0.3235 0.3660 0.4075 0.4797 0.5164 0.6125 0.6200 0.6279 0.7969 0.8097 0.9293 1.0063 1.0476 1.0784 1.1596 1.1718 1.2283 1.2441 2.5046 2.5469 2.5555 2.5793 2.6307 2.6686 2.7126 2.7395 2.8767 2.8995 2.9390 2.9527 2.9758 2.9924 3.0040 3.0373 3.0843 3.0905 3.1482 3.1627 7.0261 7.0455 7.0758 7.0812 7.0949 7.1074 7.8582 7.8844 7.9588 7.9784 8.2797 8.3016 8.4730 8.4743 8.5404 8.5532 k = 0.2143 0.5000-0.0000 ( 14072 PWs) bands (ev): -12.1306 -12.1304 -12.1277 -12.1276 -11.8047 -11.8046 -11.7882 -11.7880 -11.7803 -11.7802 -11.7532 -11.7528 -11.6753 -11.6748 -11.6667 -11.6666 -3.0454 -3.0380 -3.0082 -3.0056 -2.0126 -2.0063 -1.3666 -1.3253 -1.2739 -1.2316 -1.1670 -1.1386 -1.0262 -1.0066 -0.9794 -0.9572 -0.7098 -0.6984 -0.4141 -0.3789 -0.2349 -0.2331 -0.1388 -0.0544 -0.0308 -0.0046 0.0657 0.0986 0.1548 0.1979 0.3288 0.3677 0.4279 0.5043 0.5390 0.6313 0.6320 0.6437 0.8144 0.8251 0.9173 0.9981 1.0349 1.0771 1.1607 1.1683 1.2341 1.2505 2.5088 2.5527 2.5562 2.5813 2.6313 2.6704 2.7167 2.7427 2.8782 2.8975 2.9427 2.9619 2.9793 2.9944 3.0044 3.0386 3.0876 3.0923 3.1558 3.1693 7.0066 7.0198 7.0367 7.0437 7.0668 7.0836 7.8589 7.8848 8.0134 8.0342 8.2843 8.3065 8.4629 8.4654 8.5503 8.5623 k = 0.2321 0.5000-0.0000 ( 14052 PWs) bands (ev): -12.1257 -12.1254 -12.1229 -12.1228 -11.8050 -11.8049 -11.7879 -11.7876 -11.7805 -11.7804 -11.7529 -11.7524 -11.6799 -11.6794 -11.6718 -11.6717 -3.0505 -3.0431 -3.0167 -3.0141 -2.0369 -2.0308 -1.3652 -1.3244 -1.2822 -1.2418 -1.1724 -1.1483 -1.0404 -1.0210 -0.9963 -0.9786 -0.7097 -0.7024 -0.4081 -0.3753 -0.2171 -0.2038 -0.1270 -0.0442 -0.0244 0.0132 0.0628 0.0866 0.1632 0.2041 0.3333 0.3688 0.4493 0.5283 0.5626 0.6428 0.6523 0.6594 0.8327 0.8405 0.9056 0.9898 1.0217 1.0750 1.1622 1.1658 1.2405 1.2572 2.5131 2.5574 2.5578 2.5836 2.6322 2.6722 2.7211 2.7456 2.8790 2.8952 2.9471 2.9712 2.9839 2.9974 3.0054 3.0399 3.0909 3.0942 3.1635 3.1760 6.9664 6.9758 7.0086 7.0143 7.0425 7.0634 7.8644 7.8888 8.0710 8.0916 8.2887 8.3110 8.4554 8.4601 8.5587 8.5696 k = 0.2500 0.5000-0.0000 ( 14056 PWs) bands (ev): -12.1205 -12.1203 -12.1180 -12.1179 -11.8053 -11.8052 -11.7877 -11.7874 -11.7808 -11.7807 -11.7525 -11.7521 -11.6845 -11.6840 -11.6770 -11.6768 -3.0556 -3.0483 -3.0252 -3.0226 -2.0605 -2.0547 -1.3646 -1.3273 -1.2871 -1.2518 -1.1785 -1.1591 -1.0537 -1.0344 -1.0121 -0.9991 -0.7088 -0.7055 -0.4029 -0.3720 -0.2004 -0.1753 -0.1147 -0.0349 -0.0170 0.0313 0.0599 0.0746 0.1708 0.2097 0.3375 0.3693 0.4713 0.5511 0.5862 0.6545 0.6732 0.6745 0.8515 0.8555 0.8942 0.9814 1.0082 1.0721 1.1640 1.1643 1.2475 1.2643 2.5173 2.5592 2.5619 2.5865 2.6332 2.6736 2.7256 2.7482 2.8791 2.8927 2.9518 2.9798 2.9899 3.0017 3.0069 3.0413 3.0940 3.0962 3.1713 3.1827 6.9149 6.9236 6.9878 6.9894 7.0177 7.0415 7.8745 7.8966 8.1293 8.1480 8.2926 8.3146 8.4525 8.4606 8.5650 8.5743 k = 0.2679 0.5000-0.0000 ( 14062 PWs) bands (ev): -12.1152 -12.1150 -12.1129 -12.1128 -11.8055 -11.8055 -11.7876 -11.7873 -11.7811 -11.7810 -11.7522 -11.7517 -11.6892 -11.6887 -11.6822 -11.6821 -3.0607 -3.0535 -3.0336 -3.0311 -2.0832 -2.0777 -1.3649 -1.3338 -1.2890 -1.2613 -1.1852 -1.1708 -1.0661 -1.0470 -1.0268 -1.0185 -0.7075 -0.7071 -0.3981 -0.3689 -0.1853 -0.1489 -0.1021 -0.0265 -0.0084 0.0497 0.0571 0.0632 0.1776 0.2151 0.3415 0.3692 0.4933 0.5727 0.6091 0.6665 0.6888 0.6945 0.8697 0.8698 0.8839 0.9731 0.9948 1.0685 1.1641 1.1661 1.2549 1.2715 2.5212 2.5619 2.5647 2.5902 2.6343 2.6749 2.7302 2.7508 2.8786 2.8900 2.9566 2.9868 2.9972 3.0081 3.0088 3.0426 3.0970 3.0983 3.1792 3.1894 6.8615 6.8699 6.9646 6.9666 6.9920 7.0174 7.8888 7.9081 8.1844 8.1992 8.2959 8.3172 8.4575 8.4712 8.5686 8.5763 k = 0.2857 0.5000-0.0000 ( 14062 PWs) bands (ev): -12.1099 -12.1096 -12.1078 -12.1077 -11.8058 -11.8057 -11.7876 -11.7873 -11.7815 -11.7815 -11.7518 -11.7514 -11.6939 -11.6934 -11.6875 -11.6873 -3.0657 -3.0586 -3.0419 -3.0394 -2.1049 -2.0997 -1.3660 -1.3422 -1.2892 -1.2703 -1.1923 -1.1827 -1.0776 -1.0587 -1.0404 -1.0365 -0.7084 -0.7045 -0.3938 -0.3661 -0.1721 -0.1257 -0.0894 -0.0195 0.0019 0.0530 0.0545 0.0683 0.1837 0.2202 0.3453 0.3684 0.5152 0.5930 0.6302 0.6792 0.7018 0.7159 0.8726 0.8829 0.8891 0.9651 0.9824 1.0644 1.1650 1.1684 1.2626 1.2788 2.5247 2.5655 2.5662 2.5945 2.6357 2.6759 2.7349 2.7532 2.8776 2.8874 2.9612 2.9920 3.0057 3.0114 3.0166 3.0439 3.0999 3.1005 3.1869 3.1961 6.8083 6.8164 6.9396 6.9443 6.9658 6.9916 7.9065 7.9228 8.2308 8.2394 8.2985 8.3188 8.4754 8.4968 8.5692 8.5753 k = 0.3036 0.5000-0.0000 ( 14050 PWs) bands (ev): -12.1045 -12.1042 -12.1026 -12.1025 -11.8060 -11.8060 -11.7877 -11.7874 -11.7820 -11.7819 -11.7515 -11.7510 -11.6985 -11.6979 -11.6927 -11.6925 -3.0704 -3.0636 -3.0498 -3.0474 -2.1253 -2.1206 -1.3681 -1.3514 -1.2889 -1.2785 -1.1996 -1.1945 -1.0883 -1.0696 -1.0530 -1.0529 -0.7082 -0.7011 -0.3899 -0.3637 -0.1610 -0.1068 -0.0771 -0.0144 0.0148 0.0453 0.0520 0.0869 0.1891 0.2251 0.3489 0.3670 0.5369 0.6120 0.6486 0.6929 0.7133 0.7370 0.8642 0.8944 0.9043 0.9576 0.9724 1.0601 1.1670 1.1710 1.2705 1.2861 2.5276 2.5667 2.5699 2.5992 2.6371 2.6767 2.7395 2.7556 2.8764 2.8849 2.9654 2.9959 3.0127 3.0168 3.0264 3.0452 3.1027 3.1029 3.1945 3.2026 6.7562 6.7641 6.9147 6.9213 6.9394 6.9646 7.9270 7.9402 8.2629 8.2653 8.3003 8.3191 8.5104 8.5399 8.5668 8.5720 k = 0.3214 0.5000-0.0000 ( 14032 PWs) bands (ev): -12.0991 -12.0989 -12.0975 -12.0974 -11.8063 -11.8062 -11.7880 -11.7876 -11.7825 -11.7825 -11.7511 -11.7507 -11.7029 -11.7023 -11.6978 -11.6975 -3.0749 -3.0685 -3.0573 -3.0550 -2.1444 -2.1401 -1.3710 -1.3606 -1.2889 -1.2858 -1.2070 -1.2057 -1.0980 -1.0797 -1.0677 -1.0647 -0.7068 -0.6971 -0.3864 -0.3616 -0.1518 -0.0930 -0.0655 -0.0123 0.0285 0.0428 0.0497 0.1052 0.1939 0.2301 0.3522 0.3648 0.5582 0.6299 0.6639 0.7075 0.7229 0.7573 0.8568 0.9040 0.9141 0.9506 0.9678 1.0560 1.1701 1.1738 1.2785 1.2932 2.5299 2.5663 2.5752 2.6040 2.6388 2.6773 2.7440 2.7579 2.8751 2.8825 2.9693 2.9989 3.0161 3.0269 3.0362 3.0468 3.1053 3.1054 3.2018 3.2089 6.7061 6.7136 6.8904 6.8981 6.9132 6.9372 7.9492 7.9595 8.2789 8.2806 8.3010 8.3183 8.5536 8.5614 8.5746 8.5971 k = 0.3393 0.5000-0.0000 ( 14036 PWs) bands (ev): -12.0940 -12.0937 -12.0925 -12.0925 -11.8065 -11.8065 -11.7883 -11.7880 -11.7832 -11.7831 -11.7508 -11.7504 -11.7070 -11.7065 -11.7026 -11.7023 -3.0792 -3.0731 -3.0644 -3.0622 -2.1620 -2.1581 -1.3747 -1.3694 -1.2922 -1.2894 -1.2161 -1.2142 -1.1068 -1.0889 -1.0808 -1.0756 -0.7043 -0.6927 -0.3831 -0.3600 -0.1444 -0.0844 -0.0548 -0.0128 0.0333 0.0477 0.0554 0.1227 0.1982 0.2352 0.3551 0.3618 0.5791 0.6466 0.6763 0.7221 0.7304 0.7765 0.8507 0.9113 0.9150 0.9446 0.9720 1.0523 1.1739 1.1769 1.2863 1.3001 2.5318 2.5653 2.5810 2.6085 2.6405 2.6776 2.7483 2.7601 2.8739 2.8803 2.9729 3.0013 3.0192 3.0376 3.0433 3.0509 3.1078 3.1082 3.2087 3.2148 6.6587 6.6657 6.8670 6.8755 6.8878 6.9101 7.9725 7.9801 8.2847 8.2884 8.3008 8.3162 8.5534 8.5538 8.6281 8.6606 k = 0.3571 0.5000-0.0000 ( 14036 PWs) bands (ev): -12.0890 -12.0887 -12.0878 -12.0877 -11.8068 -11.8068 -11.7888 -11.7884 -11.7839 -11.7838 -11.7505 -11.7501 -11.7109 -11.7103 -11.7071 -11.7069 -3.0831 -3.0775 -3.0709 -3.0689 -2.1780 -2.1745 -1.3790 -1.3775 -1.2975 -1.2905 -1.2253 -1.2211 -1.1146 -1.0974 -1.0923 -1.0857 -0.7009 -0.6880 -0.3801 -0.3588 -0.1386 -0.0804 -0.0453 -0.0148 0.0343 0.0460 0.0760 0.1392 0.2021 0.2406 0.3574 0.3580 0.5995 0.6624 0.6865 0.7355 0.7358 0.7941 0.8459 0.9099 0.9159 0.9395 0.9825 1.0494 1.1783 1.1803 1.2939 1.3065 2.5334 2.5638 2.5872 2.6126 2.6425 2.6777 2.7523 2.7622 2.8729 2.8784 2.9761 3.0032 3.0223 3.0454 3.0483 3.0591 3.1105 3.1109 3.2152 3.2204 6.6144 6.6208 6.8450 6.8538 6.8636 6.8840 7.9960 8.0012 8.2865 8.2908 8.2996 8.3131 8.5441 8.5445 8.6904 8.7206 k = 0.3750 0.5000-0.0000 ( 14046 PWs) bands (ev): -12.0843 -12.0840 -12.0833 -12.0832 -11.8071 -11.8071 -11.7894 -11.7890 -11.7847 -11.7846 -11.7502 -11.7498 -11.7143 -11.7138 -11.7113 -11.7110 -3.0865 -3.0815 -3.0768 -3.0750 -2.1923 -2.1893 -1.3849 -1.3836 -1.3018 -1.2921 -1.2333 -1.2276 -1.1214 -1.1049 -1.1021 -1.0951 -0.6967 -0.6833 -0.3773 -0.3582 -0.1340 -0.0803 -0.0372 -0.0166 0.0358 0.0447 0.0982 0.1541 0.2056 0.2463 0.3534 0.3588 0.6192 0.6772 0.6952 0.7384 0.7475 0.8093 0.8420 0.9036 0.9181 0.9353 0.9947 1.0474 1.1830 1.1838 1.3012 1.3124 2.5349 2.5620 2.5934 2.6161 2.6445 2.6774 2.7560 2.7641 2.8721 2.8768 2.9792 3.0045 3.0254 3.0460 3.0584 3.0678 3.1132 3.1139 3.2211 3.2255 6.5739 6.5797 6.8248 6.8336 6.8410 6.8595 8.0189 8.0222 8.2862 8.2906 8.2976 8.3091 8.5335 8.5342 8.7433 8.7573 k = 0.3929 0.5000-0.0000 ( 14060 PWs) bands (ev): -12.0800 -12.0798 -12.0791 -12.0791 -11.8074 -11.8074 -11.7900 -11.7896 -11.7855 -11.7854 -11.7499 -11.7496 -11.7174 -11.7169 -11.7150 -11.7147 -3.0896 -3.0851 -3.0821 -3.0803 -2.2049 -2.2023 -1.3913 -1.3885 -1.3052 -1.2942 -1.2400 -1.2336 -1.1269 -1.1116 -1.1105 -1.1036 -0.6921 -0.6788 -0.3748 -0.3580 -0.1305 -0.0831 -0.0304 -0.0175 0.0375 0.0438 0.1205 0.1671 0.2089 0.2523 0.3482 0.3593 0.6383 0.6910 0.7029 0.7393 0.7567 0.8197 0.8404 0.8991 0.9184 0.9317 1.0065 1.0464 1.1875 1.1877 1.3078 1.3177 2.5362 2.5599 2.5994 2.6192 2.6468 2.6767 2.7592 2.7659 2.8715 2.8754 2.9822 3.0053 3.0284 3.0461 3.0675 3.0755 3.1162 3.1169 3.2264 3.2301 6.5377 6.5429 6.8066 6.8152 6.8206 6.8371 8.0406 8.0423 8.2852 8.2892 8.2949 8.3045 8.5227 8.5236 8.7637 8.7647 k = 0.4107 0.5000-0.0000 ( 14060 PWs) bands (ev): -12.0762 -12.0760 -12.0754 -12.0754 -11.8077 -11.8077 -11.7906 -11.7903 -11.7863 -11.7862 -11.7497 -11.7494 -11.7200 -11.7195 -11.7182 -11.7179 -3.0922 -3.0882 -3.0866 -3.0850 -2.2156 -2.2134 -1.3968 -1.3932 -1.3077 -1.2967 -1.2454 -1.2389 -1.1313 -1.1174 -1.1173 -1.1113 -0.6872 -0.6748 -0.3725 -0.3583 -0.1277 -0.0878 -0.0249 -0.0175 0.0390 0.0432 0.1419 0.1778 0.2121 0.2582 0.3428 0.3588 0.6565 0.7038 0.7100 0.7385 0.7631 0.8191 0.8461 0.8975 0.9176 0.9278 1.0170 1.0460 1.1911 1.1922 1.3138 1.3222 2.5376 2.5576 2.6051 2.6216 2.6493 2.6756 2.7621 2.7674 2.8711 2.8743 2.9850 3.0055 3.0312 3.0460 3.0754 3.0818 3.1193 3.1202 3.2311 3.2340 6.5063 6.5107 6.7908 6.7990 6.8028 6.8172 8.0603 8.0609 8.2840 8.2875 8.2919 8.2995 8.5125 8.5134 8.7643 8.7659 k = 0.4286 0.5000-0.0000 ( 14056 PWs) bands (ev): -12.0729 -12.0728 -12.0723 -12.0722 -11.8080 -11.8080 -11.7912 -11.7909 -11.7871 -11.7870 -11.7494 -11.7492 -11.7221 -11.7217 -11.7208 -11.7206 -3.0943 -3.0910 -3.0903 -3.0889 -2.2244 -2.2226 -1.4012 -1.3976 -1.3093 -1.2994 -1.2496 -1.2436 -1.1345 -1.1228 -1.1224 -1.1179 -0.6823 -0.6715 -0.3705 -0.3589 -0.1253 -0.0933 -0.0207 -0.0169 0.0403 0.0429 0.1616 0.1862 0.2155 0.2631 0.3379 0.3570 0.6737 0.7156 0.7168 0.7367 0.7666 0.8109 0.8561 0.8986 0.9161 0.9234 1.0259 1.0462 1.1946 1.1962 1.3191 1.3258 2.5391 2.5553 2.6103 2.6233 2.6520 2.6742 2.7646 2.7686 2.8709 2.8735 2.9879 3.0051 3.0339 3.0456 3.0818 3.0867 3.1225 3.1234 3.2350 3.2373 6.4801 6.4837 6.7777 6.7848 6.7883 6.8003 8.0774 8.0776 8.2829 8.2856 8.2889 8.2944 8.5033 8.5042 8.7643 8.7653 k = 0.4464 0.5000-0.0000 ( 14052 PWs) bands (ev): -12.0703 -12.0702 -12.0697 -12.0697 -11.8082 -11.8082 -11.7917 -11.7915 -11.7878 -11.7877 -11.7492 -11.7491 -11.7238 -11.7235 -11.7229 -11.7227 -3.0960 -3.0934 -3.0930 -3.0920 -2.2312 -2.2299 -1.4045 -1.4013 -1.3101 -1.3020 -1.2525 -1.2475 -1.1364 -1.1268 -1.1266 -1.1234 -0.6777 -0.6691 -0.3686 -0.3598 -0.1229 -0.0991 -0.0177 -0.0160 0.0413 0.0427 0.1783 0.1923 0.2202 0.2655 0.3346 0.3541 0.6893 0.7238 0.7261 0.7340 0.7677 0.7998 0.8663 0.9014 0.9134 0.9192 1.0330 1.0465 1.1978 1.1994 1.3234 1.3285 2.5406 2.5529 2.6148 2.6243 2.6550 2.6723 2.7666 2.7695 2.8709 2.8728 2.9907 3.0042 3.0363 3.0450 3.0867 3.0902 3.1254 3.1264 3.2382 3.2399 6.4594 6.4622 6.7674 6.7729 6.7774 6.7865 8.0912 8.0917 8.2821 8.2837 8.2862 8.2898 8.4958 8.4965 8.7642 8.7647 k = 0.4643 0.5000-0.0000 ( 14072 PWs) bands (ev): -12.0684 -12.0683 -12.0678 -12.0678 -11.8084 -11.8084 -11.7920 -11.7919 -11.7883 -11.7882 -11.7491 -11.7490 -11.7250 -11.7248 -11.7243 -11.7241 -3.0970 -3.0956 -3.0947 -3.0942 -2.2360 -2.2352 -1.4067 -1.4044 -1.3102 -1.3045 -1.2542 -1.2507 -1.1373 -1.1302 -1.1295 -1.1275 -0.6738 -0.6677 -0.3668 -0.3610 -0.1203 -0.1045 -0.0157 -0.0151 0.0420 0.0427 0.1903 0.1965 0.2273 0.2638 0.3340 0.3502 0.7026 0.7301 0.7317 0.7357 0.7667 0.7876 0.8759 0.9048 0.9082 0.9162 1.0384 1.0466 1.2004 1.2016 1.3268 1.3303 2.5423 2.5506 2.6184 2.6247 2.6580 2.6699 2.7681 2.7700 2.8710 2.8722 2.9934 3.0027 3.0385 3.0442 3.0901 3.0924 3.1279 3.1286 3.2405 3.2417 6.4446 6.4464 6.7601 6.7638 6.7701 6.7761 8.1017 8.1022 8.2815 8.2819 8.2844 8.2860 8.4902 8.4907 8.7641 8.7643 k = 0.4821 0.5000-0.0000 ( 14048 PWs) bands (ev): -12.0672 -12.0672 -12.0666 -12.0666 -11.8086 -11.8085 -11.7923 -11.7922 -11.7886 -11.7886 -11.7490 -11.7489 -11.7257 -11.7256 -11.7250 -11.7250 -3.0976 -3.0969 -3.0957 -3.0955 -2.2389 -2.2384 -1.4077 -1.4065 -1.3096 -1.3066 -1.2548 -1.2530 -1.1370 -1.1334 -1.1309 -1.1300 -0.6706 -0.6675 -0.3652 -0.3623 -0.1173 -0.1095 -0.0146 -0.0145 0.0424 0.0427 0.1968 0.1988 0.2374 0.2578 0.3364 0.3455 0.7129 0.7259 0.7401 0.7427 0.7650 0.7756 0.8850 0.9014 0.9083 0.9139 1.0423 1.0461 1.2022 1.2029 1.3293 1.3310 2.5442 2.5483 2.6212 2.6243 2.6612 2.6673 2.7692 2.7702 2.8712 2.8718 2.9961 3.0008 3.0403 3.0432 3.0923 3.0934 3.1296 3.1301 3.2421 3.2427 6.4358 6.4367 6.7561 6.7579 6.7663 6.7692 8.1083 8.1086 8.2807 8.2810 8.2834 8.2837 8.4868 8.4870 8.7640 8.7641 k = 0.5000 0.5000-0.0000 ( 14044 PWs) bands (ev): -12.0668 -12.0668 -12.0662 -12.0662 -11.8086 -11.8086 -11.7923 -11.7923 -11.7887 -11.7887 -11.7489 -11.7489 -11.7259 -11.7259 -11.7253 -11.7253 -3.0976 -3.0976 -3.0960 -3.0960 -2.2397 -2.2397 -1.4076 -1.4076 -1.3084 -1.3084 -1.2544 -1.2544 -1.1357 -1.1357 -1.1311 -1.1311 -0.6685 -0.6685 -0.3637 -0.3637 -0.1137 -0.1137 -0.0142 -0.0142 0.0427 0.0427 0.1991 0.1991 0.2483 0.2483 0.3406 0.3406 0.7204 0.7204 0.7453 0.7453 0.7667 0.7667 0.8935 0.8935 0.9113 0.9113 1.0448 1.0448 1.2031 1.2031 1.3307 1.3307 2.5462 2.5462 2.6232 2.6232 2.6643 2.6643 2.7699 2.7699 2.8715 2.8715 2.9986 2.9986 3.0419 3.0419 3.0934 3.0934 3.1304 3.1304 3.2428 3.2428 6.4332 6.4332 6.7554 6.7554 6.7660 6.7660 8.1107 8.1107 8.2805 8.2805 8.2830 8.2830 8.4857 8.4857 8.7641 8.7641 k = 0.5000 0.5000-0.0000 ( 14044 PWs) bands (ev): -12.0668 -12.0668 -12.0662 -12.0662 -11.8086 -11.8086 -11.7923 -11.7923 -11.7887 -11.7887 -11.7489 -11.7489 -11.7259 -11.7259 -11.7253 -11.7253 -3.0976 -3.0976 -3.0960 -3.0960 -2.2397 -2.2397 -1.4076 -1.4076 -1.3084 -1.3084 -1.2544 -1.2544 -1.1357 -1.1357 -1.1311 -1.1311 -0.6685 -0.6685 -0.3637 -0.3637 -0.1137 -0.1137 -0.0142 -0.0142 0.0427 0.0427 0.1991 0.1991 0.2483 0.2483 0.3406 0.3406 0.7204 0.7204 0.7453 0.7453 0.7667 0.7667 0.8935 0.8935 0.9113 0.9113 1.0448 1.0448 1.2031 1.2031 1.3307 1.3307 2.5462 2.5462 2.6232 2.6232 2.6643 2.6643 2.7699 2.7699 2.8715 2.8715 2.9986 2.9986 3.0419 3.0419 3.0934 3.0934 3.1304 3.1304 3.2428 3.2428 6.4332 6.4332 6.7554 6.7554 6.7660 6.7660 8.1107 8.1107 8.2805 8.2805 8.2830 8.2830 8.4857 8.4857 8.7641 8.7641 k = 0.4872 0.4872-0.0000 ( 14052 PWs) bands (ev): -12.0674 -12.0673 -12.0665 -12.0665 -11.8086 -11.8085 -11.7923 -11.7922 -11.7886 -11.7886 -11.7490 -11.7489 -11.7258 -11.7258 -11.7249 -11.7249 -3.0976 -3.0969 -3.0956 -3.0955 -2.2388 -2.2384 -1.4077 -1.4065 -1.3096 -1.3066 -1.2548 -1.2529 -1.1372 -1.1332 -1.1310 -1.1298 -0.6706 -0.6675 -0.3652 -0.3623 -0.1174 -0.1094 -0.0146 -0.0145 0.0425 0.0427 0.1971 0.1984 0.2373 0.2579 0.3363 0.3456 0.7129 0.7258 0.7409 0.7411 0.7663 0.7750 0.8849 0.9015 0.9082 0.9140 1.0423 1.0461 1.2021 1.2029 1.3292 1.3310 2.5442 2.5484 2.6212 2.6243 2.6612 2.6673 2.7692 2.7702 2.8712 2.8718 2.9960 3.0009 3.0403 3.0432 3.0923 3.0934 3.1296 3.1301 3.2421 3.2427 6.4359 6.4368 6.7562 6.7580 6.7663 6.7693 8.1082 8.1085 8.2793 8.2799 8.2842 8.2853 8.4868 8.4871 8.7640 8.7641 k = 0.4744 0.4744-0.0000 ( 14068 PWs) bands (ev): -12.0695 -12.0695 -12.0667 -12.0667 -11.8084 -11.8084 -11.7920 -11.7919 -11.7882 -11.7881 -11.7491 -11.7490 -11.7258 -11.7257 -11.7234 -11.7232 -3.0972 -3.0955 -3.0944 -3.0942 -2.2359 -2.2350 -1.4066 -1.4043 -1.3101 -1.3045 -1.2542 -1.2505 -1.1385 -1.1305 -1.1286 -1.1266 -0.6738 -0.6678 -0.3666 -0.3611 -0.1204 -0.1044 -0.0155 -0.0153 0.0422 0.0425 0.1927 0.1930 0.2278 0.2639 0.3340 0.3503 0.7033 0.7276 0.7308 0.7350 0.7725 0.7848 0.8756 0.9044 0.9089 0.9163 1.0386 1.0463 1.2001 1.2017 1.3268 1.3302 2.5423 2.5506 2.6185 2.6245 2.6579 2.6701 2.7680 2.7700 2.8710 2.8722 2.9932 3.0029 3.0384 3.0443 3.0900 3.0923 3.1277 3.1287 3.2405 3.2416 6.4449 6.4468 6.7605 6.7638 6.7701 6.7765 8.1014 8.1017 8.2737 8.2755 8.2913 8.2939 8.4902 8.4908 8.7627 8.7639 k = 0.4615 0.4615-0.0000 ( 14068 PWs) bands (ev): -12.0732 -12.0731 -12.0671 -12.0670 -11.8082 -11.8082 -11.7916 -11.7914 -11.7875 -11.7874 -11.7492 -11.7491 -11.7259 -11.7258 -11.7208 -11.7204 -3.0965 -3.0937 -3.0921 -3.0917 -2.2309 -2.2296 -1.4043 -1.4012 -1.3099 -1.3025 -1.2525 -1.2471 -1.1400 -1.1291 -1.1222 -1.1210 -0.6777 -0.6696 -0.3677 -0.3603 -0.1231 -0.0991 -0.0170 -0.0165 0.0420 0.0421 0.1803 0.1867 0.2226 0.2656 0.3346 0.3541 0.6918 0.7127 0.7285 0.7330 0.7799 0.7942 0.8659 0.8999 0.9159 0.9185 1.0337 1.0456 1.1969 1.1995 1.3233 1.3284 2.5405 2.5531 2.6151 2.6237 2.6547 2.6725 2.7664 2.7695 2.8710 2.8726 2.9900 3.0047 3.0362 3.0450 3.0865 3.0902 3.1249 3.1267 3.2381 3.2397 6.4601 6.4630 6.7681 6.7727 6.7771 6.7872 8.0903 8.0904 8.2647 8.2675 8.3038 8.3078 8.4957 8.4967 8.7581 8.7621 k = 0.4487 0.4487-0.0000 ( 14062 PWs) bands (ev): -12.0782 -12.0782 -12.0675 -12.0674 -11.8080 -11.8079 -11.7910 -11.7908 -11.7864 -11.7863 -11.7494 -11.7492 -11.7260 -11.7259 -11.7172 -11.7168 -3.0954 -3.0917 -3.0887 -3.0882 -2.2239 -2.2220 -1.4007 -1.3974 -1.3089 -1.3008 -1.2496 -1.2428 -1.1415 -1.1270 -1.1136 -1.1133 -0.6822 -0.6727 -0.3683 -0.3598 -0.1258 -0.0937 -0.0187 -0.0180 0.0413 0.0422 0.1625 0.1779 0.2205 0.2636 0.3378 0.3569 0.6788 0.6951 0.7215 0.7345 0.7868 0.8028 0.8566 0.8951 0.9208 0.9226 1.0277 1.0441 1.1926 1.1964 1.3188 1.3254 2.5389 2.5556 2.6112 2.6218 2.6516 2.6746 2.7641 2.7687 2.8712 2.8730 2.9866 3.0062 3.0338 3.0454 3.0817 3.0868 3.1216 3.1242 3.2348 3.2370 6.4812 6.4850 6.7788 6.7843 6.7871 6.8012 8.0745 8.0755 8.2526 8.2564 8.3214 8.3266 8.5026 8.5040 8.7485 8.7566 k = 0.4359 0.4359-0.0000 ( 14054 PWs) bands (ev): -12.0844 -12.0844 -12.0681 -12.0679 -11.8077 -11.8077 -11.7902 -11.7899 -11.7850 -11.7848 -11.7496 -11.7493 -11.7261 -11.7260 -11.7129 -11.7124 -3.0940 -3.0895 -3.0844 -3.0839 -2.2148 -2.2125 -1.3959 -1.3930 -1.3071 -1.3000 -1.2454 -1.2375 -1.1428 -1.1238 -1.1037 -1.1030 -0.6870 -0.6771 -0.3683 -0.3594 -0.1289 -0.0889 -0.0205 -0.0197 0.0401 0.0427 0.1417 0.1660 0.2198 0.2597 0.3422 0.3583 0.6648 0.6756 0.7133 0.7342 0.7923 0.8104 0.8488 0.8901 0.9234 0.9291 1.0209 1.0420 1.1871 1.1923 1.3135 1.3215 2.5375 2.5581 2.6069 2.6189 2.6487 2.6764 2.7613 2.7676 2.8717 2.8733 2.9829 3.0073 3.0313 3.0451 3.0759 3.0822 3.1179 3.1216 3.2308 3.2334 6.5077 6.5125 6.7920 6.7986 6.7997 6.8177 8.0546 8.0569 8.2381 8.2426 8.3435 8.3499 8.5101 8.5121 8.7323 8.7447 k = 0.4231 0.4231-0.0000 ( 14062 PWs) bands (ev): -12.0919 -12.0919 -12.0688 -12.0686 -11.8074 -11.8074 -11.7891 -11.7887 -11.7832 -11.7830 -11.7497 -11.7494 -11.7262 -11.7260 -11.7080 -11.7074 -3.0922 -3.0870 -3.0792 -3.0787 -2.2036 -2.2009 -1.3899 -1.3883 -1.3046 -1.3004 -1.2398 -1.2314 -1.1435 -1.1192 -1.0924 -1.0905 -0.6920 -0.6826 -0.3676 -0.3589 -0.1327 -0.0854 -0.0218 -0.0218 0.0387 0.0438 0.1190 0.1510 0.2195 0.2556 0.3468 0.3583 0.6501 0.6543 0.7034 0.7313 0.7958 0.8167 0.8439 0.8858 0.9265 0.9354 1.0133 1.0393 1.1804 1.1874 1.3073 1.3165 2.5361 2.5606 2.6022 2.6151 2.6459 2.6778 2.7577 2.7661 2.8724 2.8736 2.9789 3.0077 3.0288 3.0435 3.0700 3.0763 3.1144 3.1191 3.2259 3.2291 6.5393 6.5451 6.8068 6.8145 6.8151 6.8358 8.0307 8.0347 8.2220 8.2267 8.3696 8.3771 8.5167 8.5196 8.7087 8.7240 k = 0.4103 0.4103-0.0000 ( 14048 PWs) bands (ev): -12.1003 -12.1003 -12.0696 -12.0695 -11.8073 -11.8073 -11.7876 -11.7872 -11.7810 -11.7807 -11.7498 -11.7494 -11.7261 -11.7260 -11.7027 -11.7021 -3.0902 -3.0842 -3.0733 -3.0728 -2.1906 -2.1873 -1.3837 -1.3826 -1.3024 -1.3015 -1.2328 -1.2245 -1.1429 -1.1127 -1.0798 -1.0765 -0.6973 -0.6892 -0.3662 -0.3579 -0.1375 -0.0840 -0.0242 -0.0221 0.0369 0.0455 0.0955 0.1331 0.2192 0.2520 0.3506 0.3570 0.6312 0.6349 0.6914 0.7247 0.7976 0.8214 0.8431 0.8827 0.9300 0.9415 1.0055 1.0364 1.1727 1.1816 1.3003 1.3106 2.5348 2.5631 2.5973 2.6106 2.6432 2.6788 2.7535 2.7644 2.8734 2.8738 2.9749 3.0072 3.0268 3.0392 3.0654 3.0695 3.1110 3.1167 3.2204 3.2240 6.5753 6.5822 6.8220 6.8315 6.8337 6.8546 8.0032 8.0088 8.2054 8.2095 8.3991 8.4074 8.5203 8.5245 8.6770 8.6928 k = 0.3974 0.3974-0.0000 ( 14042 PWs) bands (ev): -12.1097 -12.1097 -12.0707 -12.0705 -11.8073 -11.8073 -11.7857 -11.7854 -11.7784 -11.7782 -11.7497 -11.7493 -11.7260 -11.7258 -11.6970 -11.6964 -3.0879 -3.0813 -3.0668 -3.0664 -2.1756 -2.1718 -1.3795 -1.3743 -1.3060 -1.2976 -1.2244 -1.2169 -1.1406 -1.1043 -1.0661 -1.0612 -0.7027 -0.6966 -0.3641 -0.3560 -0.1436 -0.0853 -0.0273 -0.0217 0.0347 0.0477 0.0723 0.1127 0.2188 0.2492 0.3532 0.3543 0.6064 0.6194 0.6769 0.7140 0.7990 0.8241 0.8455 0.8818 0.9341 0.9468 0.9981 1.0333 1.1639 1.1751 1.2927 1.3039 2.5336 2.5655 2.5922 2.6056 2.6405 2.6795 2.7485 2.7624 2.8740 2.8749 2.9708 3.0055 3.0251 3.0318 3.0622 3.0630 3.1080 3.1145 3.2141 3.2182 6.6152 6.6231 6.8360 6.8508 6.8536 6.8730 7.9721 7.9792 8.1895 8.1923 8.4310 8.4399 8.5177 8.5239 8.6370 8.6512 k = 0.3846 0.3846-0.0000 ( 14042 PWs) bands (ev): -12.1199 -12.1198 -12.0719 -12.0717 -11.8076 -11.8075 -11.7835 -11.7832 -11.7755 -11.7753 -11.7495 -11.7490 -11.7257 -11.7255 -11.6912 -11.6905 -3.0854 -3.0782 -3.0599 -3.0596 -2.1587 -2.1544 -1.3764 -1.3649 -1.3110 -1.2930 -1.2147 -1.2089 -1.1360 -1.0938 -1.0518 -1.0449 -0.7084 -0.7047 -0.3613 -0.3527 -0.1508 -0.0892 -0.0313 -0.0222 0.0311 0.0494 0.0522 0.0916 0.2182 0.2473 0.3505 0.3540 0.5801 0.6040 0.6600 0.6997 0.8010 0.8247 0.8499 0.8833 0.9387 0.9505 0.9924 1.0303 1.1542 1.1678 1.2844 1.2963 2.5323 2.5675 2.5870 2.6004 2.6378 2.6798 2.7428 2.7601 2.8740 2.8768 2.9667 3.0027 3.0220 3.0237 3.0550 3.0624 3.1051 3.1124 3.2073 3.2118 6.6583 6.6673 6.8478 6.8718 6.8737 6.8905 7.9376 7.9459 8.1755 8.1762 8.4644 8.4727 8.5049 8.5147 8.5891 8.6009 k = 0.3718 0.3718-0.0000 ( 14047 PWs) bands (ev): -12.1307 -12.1307 -12.0733 -12.0730 -11.8081 -11.8080 -11.7809 -11.7806 -11.7724 -11.7721 -11.7490 -11.7485 -11.7252 -11.7251 -11.6853 -11.6846 -3.0829 -3.0751 -3.0527 -3.0525 -2.1400 -2.1352 -1.3748 -1.3553 -1.3164 -1.2872 -1.2039 -1.2003 -1.1288 -1.0813 -1.0371 -1.0281 -0.7144 -0.7133 -0.3579 -0.3476 -0.1592 -0.0953 -0.0364 -0.0273 0.0243 0.0409 0.0457 0.0751 0.2172 0.2462 0.3456 0.3529 0.5523 0.5886 0.6409 0.6829 0.8037 0.8234 0.8554 0.8871 0.9436 0.9508 0.9902 1.0276 1.1437 1.1600 1.2755 1.2881 2.5309 2.5691 2.5818 2.5953 2.6350 2.6797 2.7363 2.7575 2.8739 2.8791 2.9627 2.9991 3.0112 3.0217 3.0487 3.0627 3.1025 3.1104 3.1999 3.2047 6.7038 6.7139 6.8560 6.8905 6.8942 6.9087 7.9001 7.9092 8.1623 8.1645 8.4777 8.4837 8.4979 8.5125 8.5359 8.5452 k = 0.3590 0.3590-0.0000 ( 14049 PWs) bands (ev): -12.1421 -12.1420 -12.0748 -12.0746 -11.8089 -11.8088 -11.7780 -11.7776 -11.7689 -11.7686 -11.7482 -11.7478 -11.7245 -11.7244 -11.6795 -11.6787 -3.0803 -3.0720 -3.0453 -3.0453 -2.1196 -2.1142 -1.3751 -1.3476 -1.3198 -1.2800 -1.1922 -1.1914 -1.1188 -1.0670 -1.0226 -1.0113 -0.7221 -0.7210 -0.3541 -0.3402 -0.1685 -0.1035 -0.0431 -0.0408 0.0186 0.0290 0.0378 0.0715 0.2158 0.2458 0.3397 0.3497 0.5235 0.5732 0.6204 0.6646 0.8068 0.8206 0.8615 0.8924 0.9472 0.9486 0.9927 1.0257 1.1324 1.1516 1.2662 1.2792 2.5294 2.5696 2.5768 2.5908 2.6323 2.6793 2.7291 2.7547 2.8736 2.8819 2.9587 2.9951 3.0005 3.0186 3.0441 3.0633 3.1001 3.1086 3.1920 3.1972 6.7508 6.7620 6.8596 6.8997 6.9174 6.9301 7.8601 7.8698 8.1516 8.1570 8.4356 8.4473 8.4735 8.4818 8.5341 8.5454 k = 0.3462 0.3462-0.0000 ( 14051 PWs) bands (ev): -12.1538 -12.1538 -12.0766 -12.0763 -11.8102 -11.8101 -11.7747 -11.7744 -11.7652 -11.7649 -11.7472 -11.7467 -11.7235 -11.7235 -11.6736 -11.6729 -3.0777 -3.0690 -3.0381 -3.0379 -2.0974 -2.0914 -1.3774 -1.3473 -1.3154 -1.2712 -1.1822 -1.1798 -1.1063 -1.0510 -1.0085 -0.9948 -0.7308 -0.7279 -0.3502 -0.3302 -0.1787 -0.1137 -0.0599 -0.0526 0.0069 0.0169 0.0382 0.0747 0.2140 0.2459 0.3331 0.3441 0.4937 0.5570 0.6000 0.6458 0.8099 0.8166 0.8679 0.8988 0.9410 0.9533 0.9987 1.0250 1.1207 1.1429 1.2564 1.2697 2.5276 2.5684 2.5722 2.5877 2.6296 2.6786 2.7214 2.7516 2.8733 2.8852 2.9542 2.9908 2.9908 3.0140 3.0412 3.0641 3.0980 3.1068 3.1838 3.1893 6.7976 6.8103 6.8581 6.9011 6.9411 6.9537 7.8186 7.8286 8.1443 8.1533 8.3814 8.3954 8.4104 8.4192 8.5649 8.5755 k = 0.3333 0.3333-0.0000 ( 14049 PWs) bands (ev): -12.1660 -12.1659 -12.0786 -12.0783 -11.8118 -11.8117 -11.7712 -11.7708 -11.7613 -11.7609 -11.7458 -11.7453 -11.7223 -11.7223 -11.6680 -11.6672 -3.0752 -3.0662 -3.0311 -3.0306 -2.0736 -2.0671 -1.3813 -1.3538 -1.3035 -1.2607 -1.1727 -1.1669 -1.0916 -1.0337 -0.9952 -0.9795 -0.7389 -0.7353 -0.3468 -0.3173 -0.1897 -0.1270 -0.0786 -0.0671 -0.0130 0.0160 0.0408 0.0796 0.2116 0.2465 0.3262 0.3363 0.4635 0.5387 0.5817 0.6269 0.8113 0.8124 0.8745 0.9056 0.9341 0.9573 1.0067 1.0260 1.1086 1.1340 1.2462 1.2597 2.5255 2.5652 2.5679 2.5864 2.6270 2.6775 2.7130 2.7482 2.8730 2.8889 2.9488 2.9831 2.9865 3.0086 3.0396 3.0648 3.0960 3.1053 3.1753 3.1809 6.8319 6.8541 6.8620 6.8984 6.9651 6.9779 7.7764 7.7863 8.1399 8.1528 8.3203 8.3350 8.3449 8.3541 8.5931 8.6026 k = 0.3205 0.3205-0.0000 ( 14033 PWs) bands (ev): -12.1783 -12.1783 -12.0807 -12.0804 -11.8139 -11.8137 -11.7673 -11.7669 -11.7571 -11.7567 -11.7440 -11.7436 -11.7209 -11.7209 -11.6624 -11.6617 -3.0729 -3.0637 -3.0245 -3.0237 -2.0483 -2.0411 -1.3865 -1.3625 -1.2881 -1.2487 -1.1630 -1.1537 -1.0751 -1.0156 -0.9833 -0.9658 -0.7459 -0.7427 -0.3444 -0.3016 -0.2014 -0.1444 -0.0927 -0.0881 -0.0275 0.0148 0.0444 0.0850 0.2085 0.2471 0.3192 0.3262 0.4333 0.5173 0.5674 0.6086 0.8047 0.8140 0.8813 0.9118 0.9284 0.9604 1.0159 1.0289 1.0964 1.1251 1.2357 1.2492 2.5230 2.5605 2.5641 2.5863 2.6245 2.6761 2.7043 2.7446 2.8728 2.8931 2.9420 2.9781 2.9823 3.0029 3.0386 3.0654 3.0944 3.1039 3.1667 3.1724 6.8222 6.8632 6.9010 6.9204 6.9890 7.0022 7.7346 7.7441 8.1360 8.1532 8.2571 8.2713 8.2788 8.2887 8.6172 8.6251 k = 0.3077 0.3077-0.0000 ( 14031 PWs) bands (ev): -12.1908 -12.1908 -12.0831 -12.0828 -11.8163 -11.8161 -11.7632 -11.7629 -11.7527 -11.7523 -11.7420 -11.7415 -11.7192 -11.7191 -11.6572 -11.6564 -3.0709 -3.0615 -3.0183 -3.0171 -2.0214 -2.0136 -1.3925 -1.3718 -1.2708 -1.2352 -1.1534 -1.1407 -1.0576 -0.9973 -0.9730 -0.9542 -0.7510 -0.7498 -0.3443 -0.2832 -0.2138 -0.1653 -0.1142 -0.1008 -0.0371 0.0131 0.0482 0.0903 0.2046 0.2475 0.3127 0.3144 0.4037 0.4936 0.5569 0.5911 0.7967 0.8142 0.8884 0.9136 0.9279 0.9627 1.0258 1.0336 1.0845 1.1165 1.2249 1.2383 2.5200 2.5549 2.5609 2.5868 2.6223 2.6744 2.6953 2.7406 2.8729 2.8976 2.9341 2.9756 2.9784 2.9974 3.0377 3.0657 3.0930 3.1027 3.1580 3.1637 6.7963 6.8395 6.9455 6.9638 7.0128 7.0260 7.6938 7.7026 8.1249 8.1456 8.1980 8.2129 8.2155 8.2274 8.6360 8.6422 k = 0.2949 0.2949-0.0000 ( 14045 PWs) bands (ev): -12.2034 -12.2033 -12.0856 -12.0853 -11.8191 -11.8189 -11.7590 -11.7586 -11.7482 -11.7478 -11.7396 -11.7392 -11.7173 -11.7172 -11.6521 -11.6513 -3.0693 -3.0598 -3.0127 -3.0112 -1.9932 -1.9847 -1.3988 -1.3810 -1.2520 -1.2205 -1.1440 -1.1280 -1.0396 -0.9803 -0.9646 -0.9444 -0.7558 -0.7533 -0.3475 -0.2625 -0.2268 -0.1873 -0.1427 -0.1036 -0.0436 0.0110 0.0509 0.0956 0.2001 0.2469 0.3012 0.3068 0.3753 0.4694 0.5492 0.5749 0.7872 0.8128 0.8957 0.9102 0.9337 0.9644 1.0362 1.0393 1.0737 1.1084 1.2138 1.2271 2.5166 2.5490 2.5583 2.5874 2.6204 2.6723 2.6861 2.7362 2.8733 2.9025 2.9258 2.9748 2.9749 2.9924 3.0367 3.0657 3.0919 3.1018 3.1494 3.1549 6.7610 6.8034 6.9874 7.0070 7.0369 7.0493 7.6545 7.6624 8.0873 8.1038 8.1472 8.1508 8.1859 8.1911 8.6490 8.6534 k = 0.2821 0.2821-0.0000 ( 14057 PWs) bands (ev): -12.2159 -12.2158 -12.0883 -12.0880 -11.8221 -11.8220 -11.7545 -11.7542 -11.7435 -11.7431 -11.7370 -11.7366 -11.7151 -11.7149 -11.6473 -11.6465 -3.0680 -3.0586 -3.0078 -3.0060 -1.9636 -1.9544 -1.4048 -1.3896 -1.2320 -1.2047 -1.1351 -1.1162 -1.0224 -0.9677 -0.9579 -0.9340 -0.7601 -0.7523 -0.3549 -0.2451 -0.2359 -0.2084 -0.1714 -0.1018 -0.0480 0.0087 0.0517 0.1007 0.1952 0.2442 0.2874 0.3012 0.3496 0.4465 0.5435 0.5600 0.7763 0.8095 0.9033 0.9058 0.9414 0.9658 1.0432 1.0468 1.0668 1.1009 1.2026 1.2156 2.5128 2.5429 2.5562 2.5879 2.6187 2.6700 2.6770 2.7315 2.8743 2.9077 2.9180 2.9718 2.9755 2.9878 3.0353 3.0654 3.0911 3.1011 3.1410 3.1461 6.7173 6.7578 7.0236 7.0459 7.0622 7.0725 7.6171 7.6238 8.0264 8.0387 8.0918 8.0938 8.1715 8.1879 8.6547 8.6569 k = 0.2692 0.2692-0.0000 ( 14059 PWs) bands (ev): -12.2283 -12.2282 -12.0912 -12.0909 -11.8255 -11.8253 -11.7500 -11.7496 -11.7387 -11.7383 -11.7341 -11.7338 -11.7127 -11.7125 -11.6428 -11.6420 -3.0672 -3.0579 -3.0037 -3.0015 -1.9327 -1.9228 -1.4103 -1.3973 -1.2109 -1.1881 -1.1270 -1.1058 -1.0076 -0.9628 -0.9518 -0.9197 -0.7621 -0.7480 -0.3667 -0.2586 -0.2276 -0.2148 -0.1989 -0.0961 -0.0504 0.0061 0.0499 0.1056 0.1905 0.2382 0.2734 0.2934 0.3300 0.4269 0.5390 0.5465 0.7642 0.8044 0.9018 0.9111 0.9497 0.9671 1.0403 1.0573 1.0686 1.0942 1.1914 1.2039 2.5087 2.5368 2.5546 2.5882 2.6175 2.6674 2.6681 2.7265 2.8759 2.9110 2.9130 2.9694 2.9767 2.9838 3.0335 3.0649 3.0907 3.1007 3.1330 3.1376 6.6660 6.7040 7.0521 7.0768 7.0893 7.0975 7.5816 7.5870 7.9590 7.9691 8.0376 8.0428 8.1611 8.1843 8.6398 8.6561 k = 0.2564 0.2564-0.0000 ( 14063 PWs) bands (ev): -12.2406 -12.2405 -12.0942 -12.0939 -11.8290 -11.8288 -11.7454 -11.7450 -11.7338 -11.7334 -11.7311 -11.7308 -11.7101 -11.7098 -11.6385 -11.6378 -3.0670 -3.0577 -3.0005 -2.9979 -1.9007 -1.8901 -1.4150 -1.4039 -1.1892 -1.1709 -1.1201 -1.0975 -0.9979 -0.9638 -0.9441 -0.9024 -0.7615 -0.7411 -0.3825 -0.2772 -0.2447 -0.2235 -0.1908 -0.0874 -0.0507 0.0035 0.0448 0.1102 0.1865 0.2286 0.2588 0.2791 0.3215 0.4126 0.5344 0.5351 0.7513 0.7975 0.8981 0.9192 0.9582 0.9681 1.0333 1.0675 1.0765 1.0886 1.1805 1.1921 2.5044 2.5307 2.5535 2.5881 2.6165 2.6594 2.6646 2.7211 2.8781 2.9053 2.9184 2.9677 2.9782 2.9802 3.0314 3.0641 3.0905 3.1004 3.1256 3.1295 6.6080 6.6432 7.0736 7.0988 7.1160 7.1235 7.5478 7.5519 7.8903 7.8989 7.9891 7.9976 8.1448 8.1736 8.6305 8.6450 k = 0.2436 0.2436-0.0000 ( 14067 PWs) bands (ev): -12.2526 -12.2525 -12.0973 -12.0970 -11.8326 -11.8325 -11.7407 -11.7403 -11.7289 -11.7286 -11.7278 -11.7277 -11.7073 -11.7070 -11.6346 -11.6338 -3.0672 -3.0582 -2.9981 -2.9952 -1.8677 -1.8563 -1.4185 -1.4092 -1.1670 -1.1536 -1.1147 -1.0923 -0.9946 -0.9671 -0.9331 -0.8843 -0.7582 -0.7326 -0.4010 -0.2990 -0.2598 -0.2443 -0.1676 -0.0773 -0.0483 0.0011 0.0364 0.1144 0.1839 0.2164 0.2421 0.2607 0.3218 0.4050 0.5239 0.5314 0.7378 0.7891 0.8948 0.9275 0.9669 0.9684 1.0268 1.0767 1.0843 1.0863 1.1702 1.1803 2.4999 2.5246 2.5526 2.5878 2.6160 2.6512 2.6616 2.7154 2.8805 2.9015 2.9237 2.9668 2.9771 2.9798 3.0288 3.0630 3.0907 3.1004 3.1188 3.1219 6.5444 6.5766 7.0906 7.1155 7.1389 7.1458 7.5156 7.5184 7.8219 7.8296 7.9472 7.9594 8.1192 8.1528 8.6285 8.6351 k = 0.2308 0.2308-0.0000 ( 14053 PWs) bands (ev): -12.2643 -12.2643 -12.1005 -12.1002 -11.8364 -11.8362 -11.7360 -11.7356 -11.7248 -11.7245 -11.7239 -11.7234 -11.7044 -11.7040 -11.6309 -11.6302 -3.0680 -3.0594 -2.9966 -2.9934 -1.8337 -1.8214 -1.4208 -1.4131 -1.1452 -1.1367 -1.1111 -1.0910 -0.9959 -0.9696 -0.9200 -0.8666 -0.7526 -0.7239 -0.4208 -0.3229 -0.2732 -0.2618 -0.1468 -0.0679 -0.0426 -0.0001 0.0254 0.1179 0.1827 0.2033 0.2227 0.2429 0.3267 0.4040 0.5151 0.5277 0.7240 0.7794 0.8917 0.9359 0.9674 0.9756 1.0223 1.0795 1.0862 1.0965 1.1613 1.1688 2.4954 2.5187 2.5520 2.5871 2.6157 2.6436 2.6583 2.7093 2.8821 2.9007 2.9290 2.9668 2.9744 2.9811 3.0258 3.0618 3.0911 3.1004 3.1127 3.1152 6.4763 6.5054 7.1041 7.1286 7.1560 7.1618 7.4846 7.4863 7.7548 7.7617 7.9123 7.9284 8.0838 8.1207 8.6224 8.6237 k = 0.2179 0.2179-0.0000 ( 14041 PWs) bands (ev): -12.2757 -12.2757 -12.1038 -12.1035 -11.8402 -11.8401 -11.7313 -11.7310 -11.7214 -11.7212 -11.7189 -11.7184 -11.7013 -11.7010 -11.6276 -11.6268 -3.0694 -3.0611 -2.9960 -2.9926 -1.7988 -1.7857 -1.4218 -1.4155 -1.1256 -1.1214 -1.1096 -1.0929 -0.9986 -0.9692 -0.9070 -0.8499 -0.7452 -0.7163 -0.4403 -0.3472 -0.2849 -0.2768 -0.1294 -0.0623 -0.0331 -0.0002 0.0143 0.1199 0.1825 0.1911 0.2014 0.2276 0.3340 0.4087 0.5080 0.5235 0.7104 0.7687 0.8890 0.9441 0.9652 0.9844 1.0206 1.0769 1.0920 1.1066 1.1548 1.1578 2.4910 2.5128 2.5517 2.5861 2.6157 2.6365 2.6549 2.7030 2.8824 2.9037 2.9338 2.9675 2.9723 2.9820 3.0226 3.0603 3.0917 3.1002 3.1075 3.1097 6.4046 6.4308 7.1146 7.1383 7.1662 7.1710 7.4546 7.4552 7.6895 7.6958 7.8843 7.9041 8.0396 8.0784 8.6020 8.6055 k = 0.2051 0.2051-0.0000 ( 14035 PWs) bands (ev): -12.2867 -12.2867 -12.1071 -12.1068 -11.8441 -11.8439 -11.7268 -11.7264 -11.7181 -11.7179 -11.7139 -11.7135 -11.6982 -11.6978 -11.6245 -11.6238 -3.0713 -3.0634 -2.9963 -2.9926 -1.7632 -1.7492 -1.4214 -1.4163 -1.1166 -1.1140 -1.1054 -1.0901 -0.9994 -0.9647 -0.8956 -0.8346 -0.7367 -0.7112 -0.4585 -0.3706 -0.2948 -0.2903 -0.1159 -0.0631 -0.0204 -0.0070 0.0139 0.1190 0.1798 0.1815 0.1828 0.2157 0.3425 0.4177 0.5030 0.5186 0.6972 0.7573 0.8866 0.9507 0.9634 0.9932 1.0212 1.0741 1.0953 1.1155 1.1485 1.1521 2.4866 2.5071 2.5515 2.5849 2.6160 2.6300 2.6515 2.6964 2.8818 2.9097 2.9381 2.9679 2.9721 2.9824 3.0193 3.0585 3.0926 3.0991 3.1031 3.1063 6.3304 6.3538 7.1221 7.1439 7.1698 7.1744 7.4249 7.4253 7.6265 7.6322 7.8624 7.8848 7.9893 8.0278 8.5791 8.5836 k = 0.1923 0.1923-0.0000 ( 14023 PWs) bands (ev): -12.2973 -12.2972 -12.1103 -12.1101 -11.8479 -11.8477 -11.7223 -11.7219 -11.7147 -11.7145 -11.7090 -11.7086 -11.6951 -11.6947 -11.6217 -11.6210 -3.0737 -3.0663 -2.9973 -2.9934 -1.7270 -1.7121 -1.4197 -1.4156 -1.1247 -1.1179 -1.0964 -1.0764 -0.9960 -0.9561 -0.8867 -0.8211 -0.7276 -0.7096 -0.4745 -0.3920 -0.3028 -0.3027 -0.1054 -0.0702 -0.0197 -0.0064 0.0235 0.1128 0.1615 0.1756 0.1829 0.2079 0.3508 0.4297 0.5008 0.5130 0.6848 0.7454 0.8848 0.9516 0.9668 1.0017 1.0232 1.0705 1.0964 1.1205 1.1437 1.1536 2.4823 2.5015 2.5515 2.5834 2.6164 2.6242 2.6479 2.6896 2.8813 2.9178 2.9415 2.9671 2.9748 2.9821 3.0159 3.0563 3.0938 3.0969 3.0995 3.1054 6.2546 6.2754 7.1265 7.1443 7.1677 7.1742 7.3950 7.3964 7.5664 7.5714 7.8451 7.8672 7.9369 7.9716 8.5553 8.5604 k = 0.1795 0.1795-0.0000 ( 14025 PWs) bands (ev): -12.3074 -12.3073 -12.1136 -12.1133 -11.8516 -11.8515 -11.7179 -11.7175 -11.7114 -11.7112 -11.7042 -11.7038 -11.6919 -11.6915 -11.6192 -11.6185 -3.0766 -3.0696 -2.9989 -2.9950 -1.6904 -1.6744 -1.4168 -1.4134 -1.1389 -1.1254 -1.0908 -1.0619 -0.9874 -0.9434 -0.8812 -0.8097 -0.7184 -0.7118 -0.4881 -0.4109 -0.3140 -0.3086 -0.0968 -0.0816 -0.0323 0.0059 0.0359 0.1004 0.1487 0.1742 0.1822 0.2044 0.3576 0.4431 0.5020 0.5072 0.6733 0.7333 0.8838 0.9485 0.9742 1.0096 1.0257 1.0653 1.0970 1.1186 1.1469 1.1582 2.4782 2.4961 2.5516 2.5818 2.6166 2.6191 2.6443 2.6827 2.8813 2.9274 2.9433 2.9668 2.9792 2.9813 3.0127 3.0536 3.0947 3.0951 3.0968 3.1059 6.1781 6.1966 7.1275 7.1385 7.1615 7.1728 7.3654 7.3674 7.5095 7.5138 7.8302 7.8408 7.8930 7.9130 8.5325 8.5377 k = 0.1667 0.1667-0.0000 ( 14025 PWs) bands (ev): -12.3170 -12.3169 -12.1168 -12.1165 -11.8553 -11.8551 -11.7137 -11.7133 -11.7082 -11.7080 -11.6996 -11.6992 -11.6888 -11.6884 -11.6169 -11.6163 -3.0798 -3.0734 -3.0012 -2.9972 -1.6534 -1.6364 -1.4128 -1.4098 -1.1552 -1.1348 -1.0890 -1.0503 -0.9744 -0.9273 -0.8794 -0.8013 -0.7171 -0.7097 -0.4996 -0.4269 -0.3244 -0.3124 -0.0954 -0.0893 -0.0436 0.0132 0.0490 0.0849 0.1426 0.1760 0.1814 0.2042 0.3616 0.4552 0.5030 0.5069 0.6629 0.7211 0.8836 0.9452 0.9820 1.0162 1.0279 1.0592 1.0987 1.1139 1.1543 1.1645 2.4743 2.4908 2.5518 2.5802 2.6138 2.6175 2.6408 2.6757 2.8818 2.9381 2.9434 2.9676 2.9802 2.9848 3.0098 3.0506 3.0931 3.0943 3.0969 3.1070 6.1018 6.1181 7.1246 7.1275 7.1533 7.1708 7.3357 7.3380 7.4565 7.4597 7.7937 7.8119 7.8580 7.8694 8.5123 8.5169 k = 0.1538 0.1538-0.0000 ( 14031 PWs) bands (ev): -12.3260 -12.3259 -12.1199 -12.1196 -11.8588 -11.8586 -11.7096 -11.7093 -11.7050 -11.7049 -11.6951 -11.6947 -11.6857 -11.6854 -11.6149 -11.6143 -3.0833 -3.0775 -3.0040 -3.0000 -1.6162 -1.5982 -1.4079 -1.4049 -1.1721 -1.1450 -1.0900 -1.0423 -0.9586 -0.9090 -0.8816 -0.7969 -0.7232 -0.7015 -0.5097 -0.4400 -0.3336 -0.3146 -0.1101 -0.0823 -0.0532 0.0121 0.0618 0.0718 0.1425 0.1796 0.1813 0.2058 0.3623 0.4604 0.5052 0.5156 0.6537 0.7090 0.8845 0.9426 0.9890 1.0199 1.0295 1.0544 1.1017 1.1104 1.1627 1.1715 2.4705 2.4858 2.5522 2.5787 2.6095 2.6179 2.6373 2.6687 2.8830 2.9419 2.9491 2.9694 2.9794 2.9909 3.0080 3.0473 3.0921 3.0927 3.0988 3.1084 6.0264 6.0407 7.1134 7.1173 7.1451 7.1676 7.3055 7.3077 7.4078 7.4095 7.7377 7.7728 7.8244 7.8548 8.4957 8.4992 k = 0.1410 0.1410-0.0000 ( 14031 PWs) bands (ev): -12.3344 -12.3343 -12.1228 -12.1226 -11.8621 -11.8619 -11.7058 -11.7055 -11.7020 -11.7018 -11.6908 -11.6904 -11.6828 -11.6824 -11.6131 -11.6126 -3.0871 -3.0817 -3.0071 -3.0032 -1.5790 -1.5600 -1.4022 -1.3990 -1.1887 -1.1550 -1.0932 -1.0377 -0.9415 -0.8905 -0.8875 -0.7971 -0.7276 -0.6938 -0.5191 -0.4509 -0.3416 -0.3159 -0.1246 -0.0764 -0.0604 0.0023 0.0639 0.0739 0.1474 0.1824 0.1841 0.2085 0.3597 0.4557 0.5163 0.5272 0.6456 0.6972 0.8867 0.9412 0.9940 1.0184 1.0310 1.0536 1.1057 1.1094 1.1710 1.1787 2.4670 2.4810 2.5527 2.5773 2.6054 2.6182 2.6339 2.6617 2.8847 2.9393 2.9585 2.9718 2.9808 2.9955 3.0091 3.0439 3.0915 3.0915 3.1009 3.1102 5.9529 5.9654 7.0980 7.1065 7.1373 7.1628 7.2748 7.2762 7.3635 7.3636 7.6813 7.7179 7.8078 7.8410 8.4834 8.4855 k = 0.1282 0.1282-0.0000 ( 14033 PWs) bands (ev): -12.3421 -12.3421 -12.1257 -12.1254 -11.8652 -11.8651 -11.7023 -11.7020 -11.6991 -11.6990 -11.6867 -11.6864 -11.6800 -11.6796 -11.6116 -11.6110 -3.0910 -3.0861 -3.0104 -3.0067 -1.5421 -1.5222 -1.3961 -1.3922 -1.2042 -1.1640 -1.0979 -1.0360 -0.9258 -0.8953 -0.8763 -0.7992 -0.7286 -0.6868 -0.5283 -0.4600 -0.3484 -0.3175 -0.1382 -0.0730 -0.0646 -0.0107 0.0596 0.0850 0.1557 0.1846 0.1889 0.2116 0.3544 0.4452 0.5316 0.5406 0.6385 0.6858 0.8902 0.9409 0.9956 1.0121 1.0336 1.0570 1.1106 1.1107 1.1789 1.1857 2.4638 2.4764 2.5533 2.5763 2.6017 2.6183 2.6306 2.6549 2.8868 2.9360 2.9628 2.9744 2.9878 2.9962 3.0153 3.0405 3.0906 3.0912 3.1031 3.1121 5.8819 5.8928 7.0827 7.0942 7.1292 7.1563 7.2436 7.2439 7.3217 7.3237 7.6277 7.6626 7.7937 7.8261 8.4755 8.4759 k = 0.1154 0.1154-0.0000 ( 14049 PWs) bands (ev): -12.3493 -12.3492 -12.1283 -12.1281 -11.8682 -11.8680 -11.6990 -11.6987 -11.6964 -11.6963 -11.6829 -11.6826 -11.6774 -11.6770 -11.6103 -11.6098 -3.0948 -3.0905 -3.0139 -3.0103 -1.5056 -1.4854 -1.3892 -1.3849 -1.2181 -1.1713 -1.1040 -1.0367 -0.9225 -0.8942 -0.8735 -0.7953 -0.7270 -0.6802 -0.5373 -0.4681 -0.3540 -0.3201 -0.1508 -0.0758 -0.0653 -0.0193 0.0572 0.0951 0.1655 0.1876 0.1938 0.2150 0.3471 0.4320 0.5477 0.5545 0.6324 0.6750 0.8950 0.9417 0.9936 1.0037 1.0382 1.0621 1.1141 1.1161 1.1864 1.1923 2.4608 2.4721 2.5540 2.5755 2.5982 2.6183 2.6275 2.6482 2.8893 2.9325 2.9626 2.9767 2.9951 2.9997 3.0245 3.0371 3.0900 3.0910 3.1055 3.1141 5.8144 5.8238 7.0682 7.0820 7.1203 7.1483 7.2115 7.2126 7.2834 7.2873 7.5786 7.6109 7.7795 7.8097 8.4704 8.4714 k = 0.1026 0.1026-0.0000 ( 14049 PWs) bands (ev): -12.3557 -12.3557 -12.1307 -12.1305 -11.8708 -11.8707 -11.6959 -11.6957 -11.6939 -11.6938 -11.6794 -11.6791 -11.6749 -11.6746 -11.6091 -11.6087 -3.0986 -3.0948 -3.0174 -3.0141 -1.4702 -1.4510 -1.3807 -1.3772 -1.2297 -1.1765 -1.1110 -1.0396 -0.9362 -0.8848 -0.8796 -0.7816 -0.7245 -0.6740 -0.5459 -0.4759 -0.3585 -0.3244 -0.1621 -0.0870 -0.0623 -0.0197 0.0563 0.1042 0.1756 0.1910 0.1988 0.2188 0.3385 0.4174 0.5630 0.5680 0.6272 0.6647 0.9010 0.9435 0.9889 0.9949 1.0443 1.0675 1.1187 1.1218 1.1933 1.1985 2.4581 2.4682 2.5549 2.5750 2.5951 2.6181 2.6245 2.6418 2.8919 2.9289 2.9611 2.9783 2.9941 3.0133 3.0338 3.0349 3.0895 3.0908 3.1079 3.1160 5.7511 5.7591 7.0552 7.0709 7.1104 7.1389 7.1805 7.1828 7.2483 7.2534 7.5351 7.5642 7.7650 7.7924 8.4685 8.4704 k = 0.0897 0.0897-0.0000 ( 14043 PWs) bands (ev): -12.3614 -12.3614 -12.1329 -12.1327 -11.8732 -11.8731 -11.6932 -11.6930 -11.6916 -11.6915 -11.6762 -11.6760 -11.6727 -11.6724 -11.6082 -11.6077 -3.1022 -3.0989 -3.0207 -3.0177 -1.4368 -1.4225 -1.3687 -1.3677 -1.2384 -1.1796 -1.1186 -1.0442 -0.9552 -0.9047 -0.8624 -0.7626 -0.7222 -0.6682 -0.5535 -0.4838 -0.3623 -0.3303 -0.1722 -0.1031 -0.0560 -0.0145 0.0570 0.1120 0.1850 0.1946 0.2038 0.2227 0.3291 0.4020 0.5768 0.5805 0.6229 0.6552 0.9080 0.9461 0.9830 0.9863 1.0510 1.0726 1.1241 1.1276 1.1996 1.2040 2.4557 2.4645 2.5560 2.5748 2.5923 2.6178 2.6216 2.6357 2.8947 2.9255 2.9593 2.9788 2.9940 3.0267 3.0311 3.0456 3.0893 3.0907 3.1103 3.1178 5.6928 5.6996 7.0442 7.0614 7.0997 7.1284 7.1519 7.1553 7.2156 7.2214 7.4977 7.5233 7.7504 7.7747 8.4695 8.4713 k = 0.0769 0.0769-0.0000 ( 14053 PWs) bands (ev): -12.3664 -12.3664 -12.1348 -12.1347 -11.8754 -11.8753 -11.6908 -11.6906 -11.6896 -11.6895 -11.6734 -11.6732 -11.6707 -11.6705 -11.6074 -11.6070 -3.1055 -3.1027 -3.0238 -3.0211 -1.4083 -1.4047 -1.3575 -1.3454 -1.2436 -1.1807 -1.1262 -1.0503 -0.9768 -0.9290 -0.8453 -0.7429 -0.7204 -0.6631 -0.5597 -0.4920 -0.3654 -0.3372 -0.1810 -0.1205 -0.0473 -0.0072 0.0595 0.1183 0.1928 0.1979 0.2094 0.2270 0.3196 0.3862 0.5883 0.5913 0.6196 0.6465 0.9157 0.9490 0.9768 0.9784 1.0577 1.0770 1.1296 1.1332 1.2052 1.2090 2.4537 2.4612 2.5572 2.5747 2.5901 2.6174 2.6187 2.6302 2.8974 2.9222 2.9578 2.9779 2.9949 3.0271 3.0412 3.0560 3.0891 3.0906 3.1126 3.1193 5.6403 5.6460 7.0352 7.0539 7.0883 7.1168 7.1272 7.1310 7.1852 7.1912 7.4668 7.4885 7.7365 7.7575 8.4725 8.4727 k = 0.0641 0.0641-0.0000 ( 14061 PWs) bands (ev): -12.3707 -12.3707 -12.1365 -12.1364 -11.8772 -11.8771 -11.6888 -11.6886 -11.6878 -11.6877 -11.6710 -11.6708 -11.6690 -11.6688 -11.6067 -11.6064 -3.1084 -3.1061 -3.0265 -3.0242 -1.3960 -1.3900 -1.3387 -1.3159 -1.2451 -1.1810 -1.1329 -1.0575 -0.9997 -0.9556 -0.8287 -0.7290 -0.7151 -0.6586 -0.5640 -0.5006 -0.3681 -0.3446 -0.1882 -0.1375 -0.0370 0.0001 0.0640 0.1227 0.1986 0.2009 0.2156 0.2316 0.3105 0.3704 0.5970 0.6002 0.6179 0.6389 0.9236 0.9519 0.9709 0.9715 1.0641 1.0806 1.1350 1.1383 1.2101 1.2132 2.4521 2.4583 2.5585 2.5745 2.5886 2.6156 2.6170 2.6255 2.9000 2.9193 2.9568 2.9760 2.9967 3.0241 3.0538 3.0658 3.0891 3.0905 3.1147 3.1206 5.5944 5.5990 7.0283 7.0482 7.0768 7.1021 7.1093 7.1106 7.1575 7.1633 7.4419 7.4597 7.7238 7.7414 8.4727 8.4762 k = 0.0513 0.0513-0.0000 ( 14063 PWs) bands (ev): -12.3742 -12.3742 -12.1379 -12.1378 -11.8787 -11.8786 -11.6871 -11.6870 -11.6863 -11.6863 -11.6690 -11.6688 -11.6675 -11.6674 -11.6062 -11.6059 -3.1109 -3.1091 -3.0288 -3.0270 -1.3917 -1.3824 -1.3123 -1.2844 -1.2429 -1.1820 -1.1370 -1.0656 -1.0231 -0.9835 -0.8128 -0.7284 -0.7002 -0.6552 -0.5659 -0.5096 -0.3704 -0.3519 -0.1937 -0.1530 -0.0262 0.0061 0.0706 0.1248 0.2026 0.2034 0.2221 0.2363 0.3027 0.3549 0.6020 0.6066 0.6186 0.6329 0.9314 0.9544 0.9656 0.9658 1.0698 1.0833 1.1399 1.1428 1.2143 1.2167 2.4508 2.4558 2.5599 2.5737 2.5881 2.6121 2.6165 2.6219 2.9023 2.9167 2.9566 2.9735 2.9990 3.0212 3.0651 3.0743 3.0892 3.0903 3.1167 3.1215 5.5557 5.5593 7.0236 7.0440 7.0662 7.0863 7.0945 7.0971 7.1329 7.1383 7.4227 7.4367 7.7129 7.7271 8.4695 8.4779 k = 0.0385 0.0385-0.0000 ( 14053 PWs) bands (ev): -12.3770 -12.3769 -12.1390 -12.1389 -11.8799 -11.8798 -11.6858 -11.6857 -11.6851 -11.6851 -11.6674 -11.6673 -11.6663 -11.6663 -11.6058 -11.6056 -3.1128 -3.1115 -3.0307 -3.0293 -1.3891 -1.3804 -1.2836 -1.2545 -1.2376 -1.1860 -1.1365 -1.0742 -1.0457 -1.0121 -0.7979 -0.7328 -0.6849 -0.6529 -0.5650 -0.5190 -0.3720 -0.3585 -0.1972 -0.1667 -0.0158 0.0100 0.0788 0.1243 0.2053 0.2054 0.2284 0.2407 0.2970 0.3400 0.6039 0.6101 0.6214 0.6291 0.9386 0.9562 0.9612 0.9613 1.0748 1.0851 1.1441 1.1464 1.2177 1.2195 2.4500 2.4537 2.5615 2.5725 2.5889 2.6081 2.6162 2.6194 2.9043 2.9144 2.9570 2.9707 3.0016 3.0183 3.0747 3.0813 3.0894 3.0902 3.1184 3.1221 5.5250 5.5276 7.0209 7.0400 7.0584 7.0743 7.0826 7.0865 7.1121 7.1170 7.4087 7.4190 7.7044 7.7150 8.4623 8.4714 k = 0.0256 0.0256-0.0000 ( 14055 PWs) bands (ev): -12.3789 -12.3789 -12.1398 -12.1397 -11.8807 -11.8807 -11.6849 -11.6848 -11.6843 -11.6842 -11.6663 -11.6663 -11.6654 -11.6654 -11.6055 -11.6054 -3.1142 -3.1133 -3.0319 -3.0310 -1.3872 -1.3808 -1.2561 -1.2299 -1.2294 -1.1932 -1.1308 -1.0829 -1.0653 -1.0402 -0.7838 -0.7397 -0.6723 -0.6522 -0.5614 -0.5286 -0.3729 -0.3641 -0.1984 -0.1781 -0.0065 0.0114 0.0883 0.1210 0.2069 0.2070 0.2342 0.2438 0.2948 0.3262 0.6046 0.6104 0.6244 0.6278 0.9448 0.9567 0.9581 0.9581 1.0789 1.0858 1.1473 1.1490 1.2202 1.2214 2.4495 2.4520 2.5632 2.5708 2.5907 2.6040 2.6160 2.6178 2.9060 2.9124 2.9582 2.9678 3.0043 3.0154 3.0820 3.0861 3.0897 3.0901 3.1198 3.1224 5.5027 5.5045 7.0202 7.0348 7.0555 7.0668 7.0743 7.0772 7.0961 7.1002 7.3995 7.4062 7.6985 7.7056 8.4535 8.4592 k = 0.0128 0.0128-0.0000 ( 14047 PWs) bands (ev): -12.3801 -12.3801 -12.1402 -12.1402 -11.8812 -11.8812 -11.6843 -11.6843 -11.6837 -11.6837 -11.6657 -11.6657 -11.6648 -11.6648 -11.6053 -11.6053 -3.1149 -3.1145 -3.0326 -3.0322 -1.3855 -1.3822 -1.2325 -1.2210 -1.2146 -1.2028 -1.1195 -1.0916 -1.0784 -1.0656 -0.7708 -0.7486 -0.6630 -0.6533 -0.5553 -0.5382 -0.3727 -0.3683 -0.1972 -0.1870 0.0012 0.0104 0.0981 0.1152 0.2079 0.2079 0.2392 0.2446 0.2970 0.3138 0.6054 0.6087 0.6267 0.6280 0.9498 0.9551 0.9563 0.9569 1.0822 1.0856 1.1495 1.1504 1.2219 1.2225 2.4495 2.4507 2.5650 2.5689 2.5932 2.6001 2.6159 2.6168 2.9076 2.9107 2.9600 2.9650 3.0070 3.0126 3.0869 3.0884 3.0900 3.0904 3.1210 3.1223 5.4894 5.4902 7.0214 7.0292 7.0569 7.0634 7.0693 7.0698 7.0860 7.0887 7.3947 7.3981 7.6955 7.6991 8.4471 8.4496 k = 0.0000 0.0000 0.0000 ( 14013 PWs) bands (ev): -12.3805 -12.3805 -12.1404 -12.1404 -11.8814 -11.8814 -11.6841 -11.6841 -11.6835 -11.6835 -11.6655 -11.6655 -11.6646 -11.6646 -11.6053 -11.6053 -3.1150 -3.1150 -3.0327 -3.0327 -1.3838 -1.3838 -1.2155 -1.2155 -1.2130 -1.2130 -1.1038 -1.1038 -1.0803 -1.0803 -0.7590 -0.7590 -0.6567 -0.6567 -0.5473 -0.5473 -0.3712 -0.3712 -0.1934 -0.1934 0.0070 0.0070 0.1074 0.1074 0.2082 0.2082 0.2429 0.2429 0.3037 0.3037 0.6068 0.6068 0.6278 0.6278 0.9531 0.9531 0.9560 0.9560 1.0844 1.0844 1.1506 1.1506 1.2226 1.2226 2.4499 2.4499 2.5670 2.5670 2.5964 2.5964 2.6162 2.6162 2.9092 2.9092 2.9623 2.9623 3.0098 3.0098 3.0887 3.0887 3.0905 3.0905 3.1218 3.1218 5.4852 5.4852 7.0245 7.0245 7.0606 7.0606 7.0670 7.0670 7.0835 7.0835 7.3943 7.3943 7.6957 7.6957 8.4454 8.4454 k = 0.0000 0.0000 0.0000 ( 14013 PWs) bands (ev): -12.3805 -12.3805 -12.1404 -12.1404 -11.8814 -11.8814 -11.6841 -11.6841 -11.6835 -11.6835 -11.6655 -11.6655 -11.6646 -11.6646 -11.6053 -11.6053 -3.1150 -3.1150 -3.0327 -3.0327 -1.3838 -1.3838 -1.2155 -1.2155 -1.2130 -1.2130 -1.1038 -1.1038 -1.0803 -1.0803 -0.7590 -0.7590 -0.6567 -0.6567 -0.5473 -0.5473 -0.3712 -0.3712 -0.1934 -0.1934 0.0070 0.0070 0.1074 0.1074 0.2082 0.2082 0.2429 0.2429 0.3037 0.3037 0.6068 0.6068 0.6278 0.6278 0.9531 0.9531 0.9560 0.9560 1.0844 1.0844 1.1506 1.1506 1.2226 1.2226 2.4499 2.4499 2.5670 2.5670 2.5964 2.5964 2.6162 2.6162 2.9092 2.9092 2.9623 2.9623 3.0098 3.0098 3.0887 3.0887 3.0905 3.0905 3.1218 3.1218 5.4852 5.4852 7.0245 7.0245 7.0606 7.0606 7.0670 7.0670 7.0835 7.0835 7.3943 7.3943 7.6957 7.6957 8.4454 8.4454 k = 0.0000 0.0000 0.0180 ( 14073 PWs) bands (ev): -12.3801 -12.3801 -12.1417 -12.1417 -11.8799 -11.8799 -11.6841 -11.6841 -11.6835 -11.6835 -11.6655 -11.6655 -11.6647 -11.6647 -11.6058 -11.6058 -3.1148 -3.1148 -3.0329 -3.0329 -1.3841 -1.3841 -1.2156 -1.2156 -1.2126 -1.2126 -1.1094 -1.1094 -1.0752 -1.0752 -0.7578 -0.7578 -0.6571 -0.6571 -0.5470 -0.5470 -0.3729 -0.3729 -0.1933 -0.1933 0.0073 0.0073 0.1085 0.1085 0.2068 0.2068 0.2421 0.2421 0.3066 0.3066 0.6073 0.6073 0.6277 0.6277 0.9531 0.9531 0.9567 0.9567 1.0839 1.0839 1.1501 1.1501 1.2206 1.2206 2.4503 2.4503 2.5666 2.5666 2.5965 2.5965 2.6163 2.6163 2.9093 2.9093 2.9626 2.9626 3.0100 3.0100 3.0879 3.0879 3.0904 3.0904 3.1207 3.1207 5.4901 5.4901 7.0244 7.0244 7.0620 7.0620 7.0702 7.0702 7.0855 7.0855 7.3954 7.3954 7.6926 7.6926 8.4091 8.4091 k = 0.0000 0.0000 0.0360 ( 14069 PWs) bands (ev): -12.3788 -12.3788 -12.1457 -12.1457 -11.8757 -11.8757 -11.6841 -11.6841 -11.6835 -11.6835 -11.6655 -11.6655 -11.6647 -11.6647 -11.6074 -11.6074 -3.1141 -3.1141 -3.0336 -3.0336 -1.3849 -1.3849 -1.2159 -1.2159 -1.2114 -1.2114 -1.1202 -1.1202 -1.0653 -1.0653 -0.7544 -0.7544 -0.6582 -0.6582 -0.5464 -0.5464 -0.3773 -0.3773 -0.1929 -0.1929 0.0081 0.0081 0.1117 0.1117 0.2024 0.2024 0.2401 0.2401 0.3149 0.3149 0.6088 0.6088 0.6273 0.6273 0.9532 0.9532 0.9585 0.9585 1.0823 1.0823 1.1486 1.1486 1.2145 1.2145 2.4515 2.4515 2.5656 2.5656 2.5968 2.5968 2.6165 2.6165 2.9100 2.9100 2.9635 2.9635 3.0107 3.0107 3.0861 3.0861 3.0899 3.0899 3.1176 3.1176 5.5049 5.5049 7.0226 7.0226 7.0677 7.0677 7.0796 7.0796 7.0915 7.0915 7.3986 7.3986 7.6836 7.6836 8.3483 8.3483 k = 0.0000 0.0000 0.0541 ( 14053 PWs) bands (ev): -12.3767 -12.3767 -12.1519 -12.1519 -11.8690 -11.8690 -11.6841 -11.6841 -11.6835 -11.6835 -11.6655 -11.6655 -11.6647 -11.6647 -11.6100 -11.6100 -3.1130 -3.1130 -3.0346 -3.0346 -1.3860 -1.3860 -1.2171 -1.2171 -1.2096 -1.2096 -1.1317 -1.1317 -1.0541 -1.0541 -0.7495 -0.7495 -0.6600 -0.6600 -0.5464 -0.5464 -0.3830 -0.3830 -0.1918 -0.1918 0.0085 0.0085 0.1168 0.1168 0.1952 0.1952 0.2375 0.2375 0.3281 0.3281 0.6114 0.6114 0.6267 0.6267 0.9537 0.9537 0.9610 0.9610 1.0796 1.0796 1.1461 1.1461 1.2045 1.2045 2.4535 2.4535 2.5641 2.5641 2.5974 2.5974 2.6170 2.6170 2.9111 2.9111 2.9649 2.9649 3.0118 3.0118 3.0835 3.0835 3.0886 3.0886 3.1127 3.1127 5.5292 5.5292 7.0164 7.0164 7.0799 7.0799 7.0950 7.0950 7.1018 7.1018 7.4040 7.4040 7.6691 7.6691 8.2825 8.2825 k = 0.0000 0.0000 0.0721 ( 14065 PWs) bands (ev): -12.3737 -12.3737 -12.1601 -12.1601 -11.8601 -11.8601 -11.6840 -11.6840 -11.6835 -11.6835 -11.6656 -11.6656 -11.6648 -11.6648 -11.6136 -11.6136 -3.1114 -3.1114 -3.0361 -3.0361 -1.3873 -1.3873 -1.2201 -1.2201 -1.2073 -1.2073 -1.1422 -1.1422 -1.0420 -1.0420 -0.7440 -0.7440 -0.6625 -0.6625 -0.5484 -0.5484 -0.3873 -0.3873 -0.1896 -0.1896 0.0075 0.0075 0.1230 0.1230 0.1855 0.1855 0.2349 0.2349 0.3457 0.3457 0.6150 0.6150 0.6259 0.6259 0.9547 0.9547 0.9642 0.9642 1.0760 1.0760 1.1427 1.1427 1.1907 1.1907 2.4562 2.4562 2.5619 2.5619 2.5982 2.5982 2.6176 2.6176 2.9126 2.9126 2.9669 2.9669 3.0133 3.0133 3.0801 3.0801 3.0861 3.0861 3.1067 3.1067 5.5627 5.5627 7.0042 7.0042 7.0990 7.0990 7.1150 7.1150 7.1175 7.1175 7.4113 7.4113 7.6504 7.6504 8.2149 8.2149 k = 0.0000 0.0000 0.0901 ( 14053 PWs) bands (ev): -12.3699 -12.3699 -12.1698 -12.1698 -11.8495 -11.8495 -11.6840 -11.6840 -11.6834 -11.6834 -11.6656 -11.6656 -11.6649 -11.6649 -11.6183 -11.6183 -3.1094 -3.1094 -3.0380 -3.0380 -1.3885 -1.3885 -1.2263 -1.2263 -1.2045 -1.2045 -1.1500 -1.1500 -1.0288 -1.0288 -0.7387 -0.7387 -0.6655 -0.6655 -0.5544 -0.5544 -0.3873 -0.3873 -0.1861 -0.1861 0.0046 0.0046 0.1285 0.1285 0.1745 0.1745 0.2325 0.2325 0.3672 0.3672 0.6198 0.6198 0.6248 0.6248 0.9563 0.9563 0.9680 0.9680 1.0713 1.0713 1.1383 1.1383 1.1737 1.1737 2.4596 2.4596 2.5593 2.5593 2.5992 2.5992 2.6181 2.6181 2.9146 2.9146 2.9695 2.9695 3.0153 3.0153 3.0758 3.0758 3.0819 3.0819 3.1004 3.1004 5.6049 5.6049 6.9850 6.9850 7.1236 7.1236 7.1351 7.1351 7.1440 7.1440 7.4203 7.4203 7.6288 7.6288 8.1472 8.1472 k = 0.0000 0.0000 0.1081 ( 14041 PWs) bands (ev): -12.3653 -12.3653 -12.1807 -12.1807 -11.8376 -11.8376 -11.6839 -11.6839 -11.6834 -11.6834 -11.6656 -11.6656 -11.6649 -11.6649 -11.6239 -11.6239 -3.1070 -3.1070 -3.0403 -3.0403 -1.3894 -1.3894 -1.2360 -1.2360 -1.2012 -1.2012 -1.1548 -1.1548 -1.0142 -1.0142 -0.7343 -0.7343 -0.6689 -0.6689 -0.5658 -0.5658 -0.3806 -0.3806 -0.1812 -0.1812 -0.0001 -0.0001 0.1295 0.1295 0.1655 0.1655 0.2301 0.2301 0.3922 0.3922 0.6233 0.6233 0.6261 0.6261 0.9583 0.9583 0.9721 0.9721 1.0655 1.0655 1.1328 1.1328 1.1540 1.1540 2.4636 2.4636 2.5562 2.5562 2.6003 2.6003 2.6187 2.6187 2.9171 2.9171 2.9726 2.9726 3.0176 3.0176 3.0701 3.0701 3.0760 3.0760 3.0948 3.0948 5.6553 5.6553 6.9578 6.9578 7.1500 7.1500 7.1626 7.1626 7.1767 7.1767 7.4308 7.4308 7.6060 7.6060 8.0801 8.0801 k = 0.0000 0.0000 0.1261 ( 14029 PWs) bands (ev): -12.3599 -12.3599 -12.1924 -12.1924 -11.8248 -11.8248 -11.6838 -11.6838 -11.6833 -11.6833 -11.6657 -11.6657 -11.6650 -11.6650 -11.6305 -11.6305 -3.1042 -3.1042 -3.0429 -3.0429 -1.3897 -1.3897 -1.2486 -1.2486 -1.1976 -1.1976 -1.1569 -1.1569 -0.9980 -0.9980 -0.7311 -0.7311 -0.6728 -0.6728 -0.5825 -0.5825 -0.3667 -0.3667 -0.1750 -0.1750 -0.0067 -0.0067 0.1204 0.1204 0.1638 0.1638 0.2279 0.2279 0.4196 0.4196 0.6216 0.6216 0.6341 0.6341 0.9608 0.9608 0.9764 0.9764 1.0585 1.0585 1.1247 1.1247 1.1341 1.1341 2.4681 2.4681 2.5528 2.5528 2.6017 2.6017 2.6191 2.6191 2.9202 2.9202 2.9762 2.9762 3.0202 3.0202 3.0620 3.0620 3.0699 3.0699 3.0901 3.0901 5.7130 5.7130 6.9217 6.9217 7.1764 7.1764 7.1991 7.1991 7.2150 7.2150 7.4426 7.4426 7.5838 7.5838 8.0145 8.0145 k = 0.0000 0.0000 0.1441 ( 14049 PWs) bands (ev): -12.3537 -12.3537 -12.2047 -12.2047 -11.8112 -11.8112 -11.6837 -11.6837 -11.6833 -11.6833 -11.6657 -11.6657 -11.6651 -11.6651 -11.6381 -11.6381 -3.1011 -3.1011 -3.0459 -3.0459 -1.3893 -1.3893 -1.2629 -1.2629 -1.1936 -1.1936 -1.1576 -1.1576 -0.9802 -0.9802 -0.7293 -0.7293 -0.6769 -0.6769 -0.6033 -0.6033 -0.3465 -0.3465 -0.1675 -0.1675 -0.0150 -0.0150 0.1026 0.1026 0.1678 0.1678 0.2256 0.2256 0.4484 0.4484 0.6194 0.6194 0.6442 0.6442 0.9636 0.9636 0.9802 0.9802 1.0499 1.0499 1.1065 1.1065 1.1228 1.1228 2.4731 2.4731 2.5489 2.5489 2.6032 2.6032 2.6194 2.6194 2.9239 2.9239 2.9803 2.9803 3.0229 3.0229 3.0517 3.0517 3.0641 3.0641 3.0859 3.0859 5.7775 5.7775 6.8759 6.8759 7.2050 7.2050 7.2420 7.2420 7.2584 7.2584 7.4553 7.4553 7.5635 7.5635 7.9506 7.9506 k = 0.0000 0.0000 0.1622 ( 14029 PWs) bands (ev): -12.3467 -12.3467 -12.2172 -12.2172 -11.7972 -11.7972 -11.6836 -11.6836 -11.6832 -11.6832 -11.6657 -11.6657 -11.6652 -11.6652 -11.6465 -11.6465 -3.0977 -3.0977 -3.0492 -3.0492 -1.3879 -1.3879 -1.2778 -1.2778 -1.1893 -1.1893 -1.1576 -1.1576 -0.9608 -0.9608 -0.7291 -0.7291 -0.6813 -0.6813 -0.6263 -0.6263 -0.3214 -0.3214 -0.1589 -0.1589 -0.0247 -0.0247 0.0804 0.0804 0.1735 0.1735 0.2233 0.2233 0.4771 0.4771 0.6168 0.6168 0.6573 0.6573 0.9663 0.9663 0.9824 0.9824 1.0390 1.0390 1.0863 1.0863 1.1151 1.1151 2.4785 2.4785 2.5447 2.5447 2.6048 2.6048 2.6194 2.6194 2.9282 2.9282 2.9849 2.9849 3.0252 3.0252 3.0412 3.0412 3.0583 3.0583 3.0817 3.0817 5.8479 5.8479 6.8205 6.8205 7.2362 7.2362 7.2900 7.2900 7.3065 7.3065 7.4687 7.4687 7.5459 7.5459 7.8889 7.8889 k = 0.0000 0.0000 0.1802 ( 14001 PWs) bands (ev): -12.3390 -12.3390 -12.2299 -12.2299 -11.7829 -11.7829 -11.6835 -11.6835 -11.6832 -11.6832 -11.6658 -11.6658 -11.6653 -11.6653 -11.6558 -11.6558 -3.0940 -3.0940 -3.0528 -3.0528 -1.3855 -1.3855 -1.2928 -1.2928 -1.1850 -1.1850 -1.1577 -1.1577 -0.9397 -0.9397 -0.7310 -0.7310 -0.6859 -0.6859 -0.6495 -0.6495 -0.2929 -0.2929 -0.1493 -0.1493 -0.0357 -0.0357 0.0555 0.0555 0.1794 0.1794 0.2209 0.2209 0.5042 0.5042 0.6138 0.6138 0.6742 0.6742 0.9663 0.9663 0.9816 0.9816 1.0272 1.0272 1.0706 1.0706 1.1073 1.1073 2.4841 2.4841 2.5402 2.5402 2.6065 2.6065 2.6192 2.6192 2.9333 2.9333 2.9898 2.9898 3.0230 3.0230 3.0350 3.0350 3.0524 3.0524 3.0775 3.0775 5.9235 5.9235 6.7562 6.7562 7.2699 7.2699 7.3423 7.3423 7.3586 7.3586 7.4823 7.4823 7.5315 7.5315 7.8297 7.8297 k = 0.0000 0.0000 0.1982 ( 14001 PWs) bands (ev): -12.3306 -12.3306 -12.2425 -12.2425 -11.7686 -11.7686 -11.6835 -11.6835 -11.6832 -11.6832 -11.6663 -11.6663 -11.6655 -11.6655 -11.6653 -11.6653 -3.0901 -3.0901 -3.0565 -3.0565 -1.3820 -1.3820 -1.3072 -1.3072 -1.1806 -1.1806 -1.1580 -1.1580 -0.9172 -0.9172 -0.7367 -0.7367 -0.6907 -0.6907 -0.6699 -0.6699 -0.2622 -0.2622 -0.1392 -0.1392 -0.0477 -0.0477 0.0290 0.0290 0.1852 0.1852 0.2182 0.2182 0.5281 0.5281 0.6101 0.6101 0.6958 0.6958 0.9540 0.9540 0.9817 0.9817 1.0194 1.0194 1.0610 1.0610 1.0992 1.0992 2.4900 2.4900 2.5354 2.5354 2.6082 2.6082 2.6188 2.6188 2.9390 2.9390 2.9950 2.9950 3.0133 3.0133 3.0362 3.0362 3.0468 3.0468 3.0731 3.0731 6.0034 6.0034 6.6841 6.6841 7.3054 7.3054 7.3976 7.3976 7.4137 7.4137 7.4943 7.4943 7.5217 7.5217 7.7732 7.7732 k = 0.0000 0.0000 0.2162 ( 14005 PWs) bands (ev): -12.3215 -12.3215 -12.2550 -12.2550 -11.7544 -11.7544 -11.6834 -11.6834 -11.6832 -11.6832 -11.6768 -11.6768 -11.6657 -11.6657 -11.6655 -11.6655 -3.0860 -3.0860 -3.0605 -3.0605 -1.3772 -1.3772 -1.3208 -1.3208 -1.1763 -1.1763 -1.1589 -1.1589 -0.8935 -0.8935 -0.7488 -0.7488 -0.6954 -0.6954 -0.6841 -0.6841 -0.2303 -0.2303 -0.1290 -0.1290 -0.0604 -0.0604 0.0019 0.0019 0.1906 0.1906 0.2153 0.2153 0.5480 0.5480 0.6057 0.6057 0.7223 0.7223 0.9278 0.9278 0.9855 0.9855 1.0157 1.0157 1.0568 1.0568 1.0910 1.0910 2.4959 2.4959 2.5303 2.5303 2.6099 2.6099 2.6181 2.6181 2.9456 2.9456 2.9991 2.9991 3.0036 3.0036 3.0366 3.0366 3.0437 3.0437 3.0686 3.0686 6.0868 6.0868 6.6058 6.6058 7.3419 7.3419 7.4532 7.4532 7.4695 7.4695 7.4972 7.4972 7.5247 7.5247 7.7202 7.7202 k = 0.0000 0.0000 0.2342 ( 14013 PWs) bands (ev): -12.3117 -12.3117 -12.2672 -12.2672 -11.7404 -11.7404 -11.6884 -11.6884 -11.6833 -11.6833 -11.6832 -11.6832 -11.6657 -11.6657 -11.6656 -11.6656 -3.0818 -3.0818 -3.0647 -3.0647 -1.3711 -1.3711 -1.3334 -1.3334 -1.1723 -1.1723 -1.1605 -1.1605 -0.8687 -0.8687 -0.7681 -0.7681 -0.6988 -0.6988 -0.6919 -0.6919 -0.1983 -0.1983 -0.1212 -0.1212 -0.0721 -0.0721 -0.0245 -0.0245 0.1956 0.1956 0.2121 0.2121 0.5639 0.5639 0.6004 0.6004 0.7531 0.7531 0.8950 0.8950 0.9905 0.9905 1.0121 1.0121 1.0572 1.0572 1.0828 1.0828 2.5019 2.5019 2.5250 2.5250 2.6116 2.6116 2.6172 2.6172 2.9529 2.9529 2.9903 2.9903 3.0072 3.0072 3.0319 3.0319 3.0462 3.0462 3.0640 3.0640 6.1729 6.1729 6.5229 6.5229 7.3779 7.3779 7.4777 7.4777 7.5135 7.5135 7.5258 7.5258 7.5422 7.5422 7.6717 7.6717 k = 0.0000 0.0000 0.2522 ( 14034 PWs) bands (ev): -12.3013 -12.3013 -12.2790 -12.2790 -11.7267 -11.7267 -11.7006 -11.7006 -11.6833 -11.6833 -11.6832 -11.6832 -11.6657 -11.6657 -11.6656 -11.6656 -3.0775 -3.0775 -3.0689 -3.0689 -1.3637 -1.3637 -1.3448 -1.3448 -1.1686 -1.1686 -1.1626 -1.1626 -0.8432 -0.8432 -0.7918 -0.7918 -0.6998 -0.6998 -0.6962 -0.6962 -0.1678 -0.1678 -0.1234 -0.1234 -0.0758 -0.0758 -0.0479 -0.0479 0.2003 0.2003 0.2085 0.2085 0.5764 0.5764 0.5940 0.5940 0.7872 0.7872 0.8595 0.8595 0.9962 0.9962 1.0074 1.0074 1.0612 1.0612 1.0748 1.0748 2.5079 2.5079 2.5195 2.5195 2.6132 2.6132 2.6160 2.6160 2.9611 2.9611 2.9799 2.9799 3.0132 3.0132 3.0257 3.0257 3.0503 3.0503 3.0594 3.0594 6.2606 6.2606 6.4368 6.4368 7.4115 7.4115 7.4629 7.4629 7.5530 7.5530 7.5633 7.5633 7.5750 7.5750 7.6300 7.6300 k = 0.0000 0.0000 0.2703 ( 14038 PWs) bands (ev): -12.2904 -12.2904 -12.2904 -12.2904 -11.7134 -11.7134 -11.7134 -11.7134 -11.6832 -11.6832 -11.6832 -11.6832 -11.6657 -11.6657 -11.6657 -11.6657 -3.0732 -3.0732 -3.0732 -3.0732 -1.3549 -1.3549 -1.3549 -1.3549 -1.1653 -1.1653 -1.1653 -1.1653 -0.8173 -0.8173 -0.8173 -0.8173 -0.6988 -0.6988 -0.6988 -0.6988 -0.1411 -0.1411 -0.1411 -0.1411 -0.0661 -0.0661 -0.0661 -0.0661 0.2046 0.2046 0.2046 0.2046 0.5862 0.5862 0.5862 0.5862 0.8231 0.8231 0.8231 0.8231 1.0019 1.0019 1.0019 1.0019 1.0674 1.0674 1.0674 1.0674 2.5137 2.5137 2.5137 2.5137 2.6147 2.6147 2.6147 2.6147 2.9701 2.9701 2.9701 2.9701 3.0194 3.0194 3.0194 3.0194 3.0548 3.0548 3.0548 3.0548 6.3489 6.3489 6.3489 6.3489 7.4404 7.4404 7.4404 7.4404 7.5755 7.5755 7.5755 7.5755 7.6008 7.6008 7.6008 7.6008 k = 0.0000 0.0000 0.2703 ( 14038 PWs) bands (ev): -12.2904 -12.2904 -12.2904 -12.2904 -11.7134 -11.7134 -11.7134 -11.7134 -11.6832 -11.6832 -11.6832 -11.6832 -11.6657 -11.6657 -11.6657 -11.6657 -3.0732 -3.0732 -3.0732 -3.0732 -1.3549 -1.3549 -1.3549 -1.3549 -1.1653 -1.1653 -1.1653 -1.1653 -0.8173 -0.8173 -0.8173 -0.8173 -0.6988 -0.6988 -0.6988 -0.6988 -0.1411 -0.1411 -0.1411 -0.1411 -0.0661 -0.0661 -0.0661 -0.0661 0.2046 0.2046 0.2046 0.2046 0.5862 0.5862 0.5862 0.5862 0.8231 0.8231 0.8231 0.8231 1.0019 1.0019 1.0019 1.0019 1.0674 1.0674 1.0674 1.0674 2.5137 2.5137 2.5137 2.5137 2.6147 2.6147 2.6147 2.6147 2.9701 2.9701 2.9701 2.9701 3.0194 3.0194 3.0194 3.0194 3.0548 3.0548 3.0548 3.0548 6.3489 6.3489 6.3489 6.3489 7.4404 7.4404 7.4404 7.4404 7.5755 7.5755 7.5755 7.5755 7.6008 7.6008 7.6008 7.6008 k = 0.0000 0.0179 0.2703 ( 14022 PWs) bands (ev): -12.2901 -12.2901 -12.2901 -12.2901 -11.7136 -11.7135 -11.7135 -11.7135 -11.6835 -11.6835 -11.6832 -11.6832 -11.6659 -11.6659 -11.6657 -11.6657 -3.0732 -3.0730 -3.0729 -3.0727 -1.3589 -1.3585 -1.3550 -1.3537 -1.1715 -1.1659 -1.1604 -1.1582 -0.8266 -0.8227 -0.8134 -0.8071 -0.7081 -0.7052 -0.6927 -0.6894 -0.1454 -0.1431 -0.1393 -0.1366 -0.0761 -0.0722 -0.0601 -0.0549 0.2023 0.2025 0.2055 0.2077 0.5799 0.5808 0.5886 0.5892 0.8124 0.8167 0.8268 0.8332 0.9985 0.9988 1.0046 1.0086 1.0623 1.0648 1.0704 1.0745 2.5128 2.5139 2.5139 2.5147 2.6116 2.6135 2.6162 2.6181 2.9649 2.9667 2.9697 2.9713 3.0189 3.0189 3.0207 3.0246 3.0528 3.0533 3.0571 3.0584 6.3493 6.3502 6.3509 6.3513 7.4277 7.4376 7.4431 7.4432 7.5490 7.5557 7.5831 7.5856 7.5935 7.6001 7.6279 7.6437 k = 0.0000 0.0357 0.2703 ( 14032 PWs) bands (ev): -12.2892 -12.2892 -12.2892 -12.2891 -11.7141 -11.7140 -11.7138 -11.7138 -11.6844 -11.6843 -11.6831 -11.6831 -11.6665 -11.6665 -11.6658 -11.6656 -3.0728 -3.0722 -3.0720 -3.0715 -1.3695 -1.3692 -1.3541 -1.3516 -1.1795 -1.1640 -1.1536 -1.1447 -0.8351 -0.8300 -0.8104 -0.7962 -0.7172 -0.7123 -0.6864 -0.6802 -0.1495 -0.1454 -0.1373 -0.1317 -0.0847 -0.0782 -0.0544 -0.0428 0.1991 0.2007 0.2052 0.2118 0.5701 0.5722 0.5886 0.5894 0.8011 0.8077 0.8285 0.8428 0.9953 0.9980 1.0070 1.0184 1.0596 1.0628 1.0741 1.0833 2.5119 2.5143 2.5145 2.5158 2.6089 2.6127 2.6180 2.6217 2.9560 2.9599 2.9665 2.9698 3.0182 3.0189 3.0251 3.0332 3.0522 3.0526 3.0605 3.0637 6.3519 6.3545 6.3560 6.3575 7.4036 7.4225 7.4477 7.4495 7.5372 7.5412 7.5866 7.5906 7.5998 7.6054 7.6792 7.6975 k = 0.0000 0.0536 0.2703 ( 14038 PWs) bands (ev): -12.2877 -12.2876 -12.2876 -12.2876 -11.7149 -11.7148 -11.7143 -11.7143 -11.6857 -11.6856 -11.6830 -11.6830 -11.6674 -11.6674 -11.6658 -11.6656 -3.0720 -3.0711 -3.0703 -3.0696 -1.3849 -1.3848 -1.3523 -1.3484 -1.1892 -1.1649 -1.1418 -1.1269 -0.8428 -0.8393 -0.8076 -0.7848 -0.7261 -0.7202 -0.6798 -0.6713 -0.1533 -0.1483 -0.1353 -0.1266 -0.0917 -0.0837 -0.0492 -0.0300 0.1946 0.1995 0.2039 0.2170 0.5569 0.5603 0.5867 0.5870 0.7893 0.7963 0.8289 0.8515 0.9913 0.9992 1.0094 1.0303 1.0595 1.0613 1.0785 1.0934 2.5108 2.5147 2.5155 2.5172 2.6067 2.6122 2.6201 2.6256 2.9452 2.9516 2.9619 2.9666 3.0169 3.0183 3.0302 3.0413 3.0536 3.0540 3.0653 3.0704 6.3568 6.3608 6.3652 6.3676 7.3734 7.3968 7.4561 7.4594 7.5385 7.5422 7.5921 7.6003 7.6084 7.6152 7.7382 7.7573 k = 0.0000 0.0714 0.2703 ( 14034 PWs) bands (ev): -12.2855 -12.2855 -12.2854 -12.2853 -11.7161 -11.7159 -11.7151 -11.7150 -11.6875 -11.6873 -11.6829 -11.6828 -11.6687 -11.6686 -11.6659 -11.6657 -3.0709 -3.0697 -3.0679 -3.0670 -1.4037 -1.4029 -1.3495 -1.3443 -1.2001 -1.1689 -1.1270 -1.1066 -0.8504 -0.8498 -0.8042 -0.7735 -0.7343 -0.7292 -0.6725 -0.6629 -0.1572 -0.1521 -0.1330 -0.1215 -0.0967 -0.0884 -0.0445 -0.0169 0.1890 0.1986 0.2018 0.2236 0.5405 0.5453 0.5823 0.5833 0.7770 0.7832 0.8284 0.8593 0.9867 1.0002 1.0127 1.0435 1.0609 1.0620 1.0839 1.1044 2.5095 2.5150 2.5170 2.5191 2.6049 2.6120 2.6224 2.6298 2.9336 2.9428 2.9568 2.9626 3.0148 3.0169 3.0330 3.0444 3.0577 3.0612 3.0715 3.0781 6.3639 6.3693 6.3783 6.3814 7.3427 7.3682 7.4680 7.4729 7.5484 7.5543 7.6004 7.6123 7.6208 7.6296 7.8017 7.8212 k = 0.0000 0.0893 0.2703 ( 14020 PWs) bands (ev): -12.2827 -12.2827 -12.2826 -12.2825 -11.7177 -11.7176 -11.7163 -11.7162 -11.6896 -11.6894 -11.6826 -11.6826 -11.6701 -11.6701 -11.6660 -11.6657 -3.0694 -3.0679 -3.0648 -3.0637 -1.4243 -1.4226 -1.3459 -1.3392 -1.2122 -1.1754 -1.1112 -1.0854 -0.8630 -0.8562 -0.7999 -0.7643 -0.7398 -0.7389 -0.6645 -0.6551 -0.1615 -0.1568 -0.1306 -0.1179 -0.0986 -0.0919 -0.0405 -0.0039 0.1825 0.1977 0.1990 0.2314 0.5215 0.5277 0.5754 0.5788 0.7645 0.7692 0.8272 0.8657 0.9817 0.9999 1.0173 1.0546 1.0640 1.0669 1.0901 1.1159 2.5081 2.5152 2.5189 2.5213 2.6036 2.6121 2.6251 2.6341 2.9222 2.9341 2.9516 2.9585 3.0122 3.0149 3.0328 3.0440 3.0648 3.0710 3.0790 3.0863 6.3732 6.3799 6.3952 6.3990 7.3147 7.3413 7.4830 7.4898 7.5640 7.5736 7.6111 7.6271 7.6376 7.6486 7.8590 7.8637 k = 0.0000 0.1071 0.2703 ( 14028 PWs) bands (ev): -12.2794 -12.2794 -12.2792 -12.2791 -11.7199 -11.7197 -11.7180 -11.7178 -11.6919 -11.6916 -11.6824 -11.6823 -11.6717 -11.6716 -11.6661 -11.6658 -3.0676 -3.0658 -3.0610 -3.0597 -1.4456 -1.4431 -1.3417 -1.3334 -1.2249 -1.1841 -1.0959 -1.0647 -0.8766 -0.8622 -0.7948 -0.7624 -0.7486 -0.7372 -0.6558 -0.6480 -0.1671 -0.1618 -0.1282 -0.1177 -0.0956 -0.0940 -0.0370 0.0087 0.1752 0.1955 0.1971 0.2406 0.5006 0.5079 0.5664 0.5735 0.7519 0.7550 0.8251 0.8704 0.9765 0.9984 1.0228 1.0585 1.0737 1.0755 1.0972 1.1276 2.5064 2.5152 2.5212 2.5239 2.6029 2.6126 2.6280 2.6385 2.9112 2.9257 2.9466 2.9544 3.0089 3.0121 3.0308 3.0423 3.0731 3.0803 3.0876 3.0947 6.3846 6.3926 6.4158 6.4202 7.2908 7.3181 7.5010 7.5098 7.5835 7.5987 7.6238 7.6455 7.6592 7.6720 7.8687 7.8700 k = 0.0000 0.1250 0.2703 ( 14008 PWs) bands (ev): -12.2755 -12.2755 -12.2752 -12.2751 -11.7226 -11.7225 -11.7203 -11.7201 -11.6941 -11.6938 -11.6821 -11.6820 -11.6733 -11.6732 -11.6663 -11.6658 -3.0655 -3.0634 -3.0567 -3.0552 -1.4670 -1.4639 -1.3369 -1.3268 -1.2379 -1.1945 -1.0822 -1.0457 -0.8910 -0.8681 -0.7898 -0.7668 -0.7567 -0.7270 -0.6464 -0.6414 -0.1752 -0.1665 -0.1265 -0.1200 -0.0944 -0.0886 -0.0338 0.0208 0.1674 0.1920 0.1961 0.2511 0.4782 0.4866 0.5556 0.5677 0.7395 0.7409 0.8218 0.8733 0.9715 0.9965 1.0288 1.0605 1.0818 1.0893 1.1048 1.1390 2.5046 2.5151 2.5240 2.5268 2.6028 2.6134 2.6311 2.6431 2.9009 2.9179 2.9421 2.9508 3.0052 3.0087 3.0280 3.0400 3.0818 3.0886 3.0967 3.1029 6.3982 6.4074 6.4402 6.4450 7.2718 7.2996 7.5216 7.5328 7.6053 7.6280 7.6394 7.6684 7.6854 7.6996 7.8765 7.8780 k = 0.0000 0.1429 0.2703 ( 14012 PWs) bands (ev): -12.2711 -12.2711 -12.2707 -12.2706 -11.7260 -11.7259 -11.7234 -11.7232 -11.6963 -11.6959 -11.6818 -11.6817 -11.6749 -11.6747 -11.6664 -11.6659 -3.0631 -3.0608 -3.0518 -3.0500 -1.4882 -1.4845 -1.3321 -1.3199 -1.2507 -1.2060 -1.0709 -1.0295 -0.9056 -0.8744 -0.7876 -0.7715 -0.7596 -0.7145 -0.6364 -0.6354 -0.1856 -0.1709 -0.1285 -0.1209 -0.0931 -0.0797 -0.0306 0.0319 0.1593 0.1883 0.1951 0.2625 0.4549 0.4643 0.5433 0.5616 0.7274 0.7276 0.8167 0.8740 0.9672 0.9948 1.0347 1.0631 1.0908 1.1026 1.1128 1.1500 2.5025 2.5147 2.5270 2.5299 2.6032 2.6145 2.6344 2.6477 2.8915 2.9107 2.9381 2.9477 3.0012 3.0046 3.0247 3.0372 3.0900 3.0960 3.1054 3.1105 6.4139 6.4242 6.4682 6.4733 7.2581 7.2862 7.5445 7.5582 7.6281 7.6520 7.6667 7.6970 7.7162 7.7312 7.8861 7.8884 k = 0.0000 0.1607 0.2703 ( 14016 PWs) bands (ev): -12.2661 -12.2661 -12.2657 -12.2655 -11.7301 -11.7300 -11.7274 -11.7272 -11.6981 -11.6977 -11.6814 -11.6813 -11.6763 -11.6760 -11.6666 -11.6660 -3.0604 -3.0580 -3.0463 -3.0444 -1.5089 -1.5047 -1.3279 -1.3129 -1.2624 -1.2179 -1.0626 -1.0173 -0.9203 -0.8819 -0.7896 -0.7741 -0.7547 -0.7012 -0.6296 -0.6257 -0.1980 -0.1756 -0.1345 -0.1197 -0.0902 -0.0700 -0.0267 0.0421 0.1511 0.1844 0.1942 0.2744 0.4313 0.4414 0.5299 0.5555 0.7145 0.7163 0.8094 0.8722 0.9641 0.9940 1.0405 1.0664 1.1000 1.1150 1.1208 1.1604 2.5002 2.5141 2.5303 2.5333 2.6042 2.6158 2.6379 2.6523 2.8832 2.9043 2.9349 2.9451 2.9969 3.0000 3.0211 3.0340 3.0977 3.1026 3.1133 3.1175 6.4316 6.4430 6.4997 6.5049 7.2498 7.2782 7.5695 7.5859 7.6511 7.6705 7.7057 7.7315 7.7515 7.7667 7.8981 7.9015 k = 0.0000 0.1786 0.2703 ( 14018 PWs) bands (ev): -12.2607 -12.2607 -12.2601 -12.2599 -11.7349 -11.7348 -11.7322 -11.7320 -11.6996 -11.6992 -11.6810 -11.6809 -11.6775 -11.6771 -11.6667 -11.6661 -3.0575 -3.0549 -3.0404 -3.0383 -1.5289 -1.5243 -1.3258 -1.3068 -1.2715 -1.2292 -1.0575 -1.0099 -0.9348 -0.8915 -0.7919 -0.7736 -0.7450 -0.6875 -0.6240 -0.6145 -0.2121 -0.1809 -0.1428 -0.1188 -0.0858 -0.0604 -0.0212 0.0509 0.1433 0.1800 0.1937 0.2861 0.4078 0.4187 0.5160 0.5496 0.7025 0.7058 0.7996 0.8679 0.9625 0.9944 1.0461 1.0704 1.1092 1.1259 1.1286 1.1702 2.4977 2.5133 2.5339 2.5367 2.6058 2.6174 2.6415 2.6570 2.8760 2.8986 2.9324 2.9431 2.9925 2.9950 3.0175 3.0306 3.1046 3.1085 3.1200 3.1235 6.4513 6.4637 6.5346 6.5398 7.2469 7.2755 7.5965 7.6155 7.6741 7.6898 7.7495 7.7718 7.7908 7.8057 7.9127 7.9177 k = 0.0000 0.1964 0.2703 ( 14016 PWs) bands (ev): -12.2548 -12.2548 -12.2541 -12.2539 -11.7404 -11.7404 -11.7379 -11.7377 -11.7007 -11.7004 -11.6806 -11.6805 -11.6784 -11.6780 -11.6669 -11.6663 -3.0545 -3.0517 -3.0340 -3.0318 -1.5481 -1.5432 -1.3279 -1.3031 -1.2759 -1.2380 -1.0555 -1.0076 -0.9489 -0.9037 -0.7916 -0.7699 -0.7331 -0.6734 -0.6182 -0.6026 -0.2278 -0.1868 -0.1531 -0.1189 -0.0797 -0.0517 -0.0134 0.0584 0.1362 0.1752 0.1936 0.2965 0.3849 0.3967 0.5024 0.5440 0.6915 0.6964 0.7873 0.8611 0.9625 0.9961 1.0511 1.0751 1.1179 1.1352 1.1362 1.1792 2.4952 2.5122 2.5376 2.5402 2.6078 2.6191 2.6453 2.6615 2.8700 2.8938 2.9306 2.9415 2.9882 2.9897 3.0138 3.0269 3.1106 3.1135 3.1254 3.1285 6.4730 6.4862 6.5726 6.5777 7.2495 7.2782 7.6252 7.6467 7.6972 7.7102 7.7974 7.8171 7.8337 7.8479 7.9301 7.9374 k = 0.0000 0.2143 0.2703 ( 14038 PWs) bands (ev): -12.2486 -12.2485 -12.2477 -12.2475 -11.7466 -11.7466 -11.7442 -11.7440 -11.7016 -11.7012 -11.6803 -11.6801 -11.6791 -11.6787 -11.6671 -11.6664 -3.0513 -3.0484 -3.0273 -3.0250 -1.5663 -1.5613 -1.3349 -1.3041 -1.2750 -1.2418 -1.0563 -1.0098 -0.9625 -0.9182 -0.7886 -0.7635 -0.7200 -0.6588 -0.6120 -0.5900 -0.2449 -0.1936 -0.1653 -0.1203 -0.0721 -0.0441 -0.0033 0.0642 0.1302 0.1698 0.1942 0.3036 0.3628 0.3765 0.4900 0.5389 0.6816 0.6883 0.7727 0.8523 0.9642 0.9991 1.0555 1.0802 1.1259 1.1425 1.1433 1.1874 2.4927 2.5109 2.5413 2.5437 2.6103 2.6211 2.6490 2.6659 2.8653 2.8897 2.9295 2.9401 2.9841 2.9842 3.0101 3.0231 3.1156 3.1175 3.1293 3.1322 6.4967 6.5106 6.6136 6.6183 7.2573 7.2859 7.6552 7.6791 7.7207 7.7315 7.8489 7.8668 7.8795 7.8922 7.9505 7.9614 k = 0.0000 0.2321 0.2703 ( 14042 PWs) bands (ev): -12.2420 -12.2419 -12.2409 -12.2407 -11.7534 -11.7534 -11.7511 -11.7510 -11.7022 -11.7019 -11.6800 -11.6797 -11.6794 -11.6791 -11.6674 -11.6666 -3.0479 -3.0450 -3.0203 -3.0179 -1.5835 -1.5784 -1.3451 -1.3109 -1.2705 -1.2398 -1.0594 -1.0157 -0.9753 -0.9341 -0.7835 -0.7554 -0.7064 -0.6438 -0.6051 -0.5767 -0.2632 -0.2014 -0.1792 -0.1234 -0.0630 -0.0370 0.0085 0.0680 0.1260 0.1638 0.1953 0.3047 0.3420 0.3597 0.4799 0.5343 0.6732 0.6818 0.7560 0.8417 0.9673 1.0030 1.0591 1.0857 1.1332 1.1477 1.1501 1.1949 2.4901 2.5094 2.5452 2.5472 2.6131 2.6232 2.6528 2.6702 2.8618 2.8865 2.9290 2.9389 2.9786 2.9808 3.0065 3.0192 3.1195 3.1205 3.1320 3.1347 6.5221 6.5367 6.6573 6.6616 7.2700 7.2986 7.6864 7.7122 7.7446 7.7537 7.9033 7.9197 7.9271 7.9371 7.9745 7.9908 k = 0.0000 0.2500 0.2703 ( 14016 PWs) bands (ev): -12.2351 -12.2350 -12.2338 -12.2336 -11.7606 -11.7606 -11.7585 -11.7584 -11.7027 -11.7024 -11.6801 -11.6795 -11.6792 -11.6792 -11.6676 -11.6668 -3.0445 -3.0415 -3.0132 -3.0107 -1.5997 -1.5946 -1.3567 -1.3216 -1.2642 -1.2334 -1.0643 -1.0243 -0.9870 -0.9504 -0.7773 -0.7467 -0.6926 -0.6283 -0.5974 -0.5626 -0.2824 -0.2102 -0.1945 -0.1283 -0.0525 -0.0300 0.0210 0.0697 0.1239 0.1574 0.1970 0.2977 0.3225 0.3477 0.4727 0.5303 0.6670 0.6772 0.7376 0.8298 0.9715 1.0077 1.0616 1.0914 1.1397 1.1509 1.1565 1.2017 2.4877 2.5077 2.5490 2.5507 2.6163 2.6254 2.6567 2.6741 2.8597 2.8842 2.9291 2.9375 2.9732 2.9781 3.0031 3.0153 3.1222 3.1222 3.1334 3.1360 6.5493 6.5642 6.7034 6.7071 7.2874 7.3158 7.7182 7.7451 7.7693 7.7766 7.9580 7.9708 7.9756 7.9839 8.0038 8.0273 k = 0.0000 0.2679 0.2703 ( 14024 PWs) bands (ev): -12.2279 -12.2279 -12.2265 -12.2263 -11.7683 -11.7682 -11.7663 -11.7661 -11.7031 -11.7029 -11.6803 -11.6795 -11.6788 -11.6788 -11.6679 -11.6671 -3.0411 -3.0381 -3.0059 -3.0034 -1.6147 -1.6098 -1.3687 -1.3343 -1.2572 -1.2249 -1.0708 -1.0346 -0.9973 -0.9664 -0.7708 -0.7385 -0.6790 -0.6126 -0.5885 -0.5476 -0.3023 -0.2201 -0.2109 -0.1348 -0.0408 -0.0227 0.0332 0.0695 0.1238 0.1508 0.1992 0.2841 0.3047 0.3382 0.4684 0.5266 0.6635 0.6748 0.7178 0.8168 0.9765 1.0128 1.0627 1.0970 1.1455 1.1522 1.1623 1.2076 2.4854 2.5059 2.5527 2.5541 2.6196 2.6276 2.6604 2.6778 2.8588 2.8825 2.9295 2.9357 2.9681 2.9765 3.0000 3.0116 3.1225 3.1237 3.1339 3.1363 6.5779 6.5931 6.7514 6.7545 7.3090 7.3371 7.7499 7.7761 7.7959 7.8003 8.0028 8.0099 8.0297 8.0402 8.0414 8.0697 k = 0.0000 0.2857 0.2703 ( 14020 PWs) bands (ev): -12.2206 -12.2205 -12.2190 -12.2187 -11.7762 -11.7761 -11.7743 -11.7741 -11.7034 -11.7032 -11.6802 -11.6795 -11.6784 -11.6784 -11.6682 -11.6673 -3.0377 -3.0348 -2.9986 -2.9961 -1.6287 -1.6239 -1.3805 -1.3478 -1.2505 -1.2157 -1.0784 -1.0458 -1.0059 -0.9810 -0.7646 -0.7313 -0.6658 -0.5969 -0.5784 -0.5315 -0.3227 -0.2310 -0.2280 -0.1430 -0.0282 -0.0150 0.0444 0.0683 0.1254 0.1444 0.2019 0.2679 0.2887 0.3284 0.4656 0.5232 0.6634 0.6750 0.6972 0.8032 0.9822 1.0181 1.0623 1.1021 1.1508 1.1518 1.1677 1.2126 2.4833 2.5039 2.5563 2.5573 2.6231 2.6300 2.6640 2.6812 2.8590 2.8816 2.9299 2.9335 2.9637 2.9760 2.9971 3.0081 3.1211 3.1239 3.1337 3.1356 6.6078 6.6231 6.8011 6.8034 7.3344 7.3622 7.7802 7.8030 7.8248 7.8258 8.0366 8.0434 8.0838 8.0914 8.0972 8.1153 k = 0.0000 0.3036 0.2703 ( 14026 PWs) bands (ev): -12.2132 -12.2131 -12.2114 -12.2111 -11.7843 -11.7842 -11.7824 -11.7822 -11.7037 -11.7034 -11.6801 -11.6793 -11.6780 -11.6780 -11.6685 -11.6676 -3.0344 -3.0315 -2.9914 -2.9889 -1.6414 -1.6369 -1.3919 -1.3612 -1.2443 -1.2066 -1.0870 -1.0573 -1.0126 -0.9936 -0.7591 -0.7254 -0.6531 -0.5814 -0.5673 -0.5144 -0.3432 -0.2455 -0.2429 -0.1526 -0.0154 -0.0072 0.0538 0.0671 0.1280 0.1386 0.2050 0.2513 0.2745 0.3171 0.4628 0.5199 0.6671 0.6748 0.6791 0.7893 0.9884 1.0234 1.0603 1.1062 1.1505 1.1558 1.1724 1.2168 2.4814 2.5017 2.5598 2.5603 2.6267 2.6323 2.6674 2.6841 2.8603 2.8814 2.9299 2.9307 2.9603 2.9764 2.9946 3.0050 3.1181 3.1226 3.1331 3.1343 6.6386 6.6538 6.8518 6.8534 7.3631 7.3903 7.8077 7.8260 7.8504 7.8574 8.0672 8.0747 8.1264 8.1420 8.1554 8.1725 k = 0.0000 0.3214 0.2703 ( 14032 PWs) bands (ev): -12.2058 -12.2058 -12.2038 -12.2035 -11.7925 -11.7923 -11.7905 -11.7903 -11.7038 -11.7036 -11.6799 -11.6791 -11.6777 -11.6776 -11.6688 -11.6679 -3.0312 -3.0284 -2.9844 -2.9820 -1.6531 -1.6488 -1.4026 -1.3743 -1.2392 -1.1986 -1.0963 -1.0685 -1.0173 -1.0036 -0.7545 -0.7212 -0.6411 -0.5665 -0.5551 -0.4964 -0.3635 -0.2631 -0.2556 -0.1634 -0.0036 0.0004 0.0609 0.0673 0.1309 0.1338 0.2087 0.2355 0.2622 0.3050 0.4588 0.5167 0.6542 0.6743 0.6841 0.7757 0.9948 1.0284 1.0568 1.1083 1.1490 1.1606 1.1765 1.2200 2.4798 2.4995 2.5630 2.5632 2.6302 2.6347 2.6707 2.6866 2.8625 2.8817 2.9276 2.9290 2.9583 2.9776 2.9926 3.0025 3.1135 3.1198 3.1320 3.1327 6.6699 6.6847 6.9031 6.9038 7.3945 7.4210 7.8316 7.8463 7.8766 7.8881 8.0970 8.1045 8.1675 8.1813 8.2205 8.2363 k = 0.0000 0.3393 0.2703 ( 14032 PWs) bands (ev): -12.1985 -12.1985 -12.1962 -12.1960 -11.8006 -11.8004 -11.7985 -11.7983 -11.7040 -11.7038 -11.6797 -11.6788 -11.6773 -11.6772 -11.6691 -11.6682 -3.0281 -3.0254 -2.9776 -2.9753 -1.6635 -1.6596 -1.4125 -1.3868 -1.2353 -1.1923 -1.1056 -1.0792 -1.0198 -1.0106 -0.7509 -0.7185 -0.6295 -0.5520 -0.5422 -0.4781 -0.3831 -0.2806 -0.2691 -0.1751 0.0058 0.0074 0.0657 0.0705 0.1303 0.1336 0.2130 0.2213 0.2517 0.2925 0.4529 0.5134 0.6331 0.6836 0.6927 0.7634 1.0013 1.0326 1.0521 1.1072 1.1487 1.1652 1.1799 1.2222 2.4784 2.4972 2.5659 2.5660 2.6337 2.6370 2.6737 2.6888 2.8655 2.8826 2.9244 2.9272 2.9579 2.9790 2.9912 3.0009 3.1076 3.1157 3.1306 3.1307 6.7012 6.7155 6.9541 6.9542 7.4279 7.4536 7.8515 7.8644 7.9020 7.9161 8.1266 8.1332 8.2086 8.2217 8.2854 8.3009 k = 0.0000 0.3571 0.2703 ( 14024 PWs) bands (ev): -12.1915 -12.1914 -12.1889 -12.1887 -11.8084 -11.8082 -11.8062 -11.8061 -11.7041 -11.7039 -11.6793 -11.6785 -11.6769 -11.6769 -11.6694 -11.6686 -3.0252 -3.0227 -2.9712 -2.9690 -1.6728 -1.6693 -1.4214 -1.3984 -1.2326 -1.1885 -1.1142 -1.0890 -1.0202 -1.0145 -0.7483 -0.7174 -0.6184 -0.5381 -0.5288 -0.4604 -0.4009 -0.2977 -0.2830 -0.1876 0.0115 0.0132 0.0687 0.0774 0.1280 0.1357 0.2096 0.2178 0.2431 0.2802 0.4456 0.5099 0.6129 0.6917 0.7037 0.7548 1.0077 1.0342 1.0480 1.1023 1.1503 1.1696 1.1829 1.2236 2.4774 2.4949 2.5683 2.5687 2.6371 2.6393 2.6764 2.6904 2.8691 2.8839 2.9212 2.9246 2.9589 2.9800 2.9906 3.0009 3.1006 3.1103 3.1286 3.1288 6.7320 6.7456 7.0036 7.0045 7.4628 7.4874 7.8680 7.8800 7.9248 7.9398 8.1560 8.1612 8.2508 8.2646 8.3487 8.3645 k = 0.0000 0.3750 0.2703 ( 14040 PWs) bands (ev): -12.1848 -12.1847 -12.1820 -12.1818 -11.8159 -11.8157 -11.8136 -11.8134 -11.7042 -11.7040 -11.6789 -11.6781 -11.6766 -11.6766 -11.6698 -11.6689 -3.0225 -3.0202 -2.9653 -2.9633 -1.6810 -1.6778 -1.4293 -1.4091 -1.2311 -1.1878 -1.1214 -1.0977 -1.0189 -1.0156 -0.7466 -0.7176 -0.6076 -0.5246 -0.5151 -0.4478 -0.4127 -0.3144 -0.2972 -0.2005 0.0137 0.0172 0.0710 0.0872 0.1267 0.1364 0.2014 0.2229 0.2361 0.2687 0.4372 0.5054 0.5949 0.6932 0.7168 0.7543 1.0140 1.0304 1.0477 1.0941 1.1534 1.1736 1.1856 1.2241 2.4766 2.4927 2.5705 2.5710 2.6402 2.6415 2.6789 2.6917 2.8732 2.8854 2.9181 2.9214 2.9606 2.9801 2.9908 3.0027 3.0927 3.1040 3.1263 3.1268 6.7617 6.7742 7.0514 7.0529 7.4981 7.5215 7.8813 7.8930 7.9436 7.9584 8.1850 8.1887 8.2951 8.3101 8.4092 8.4253 k = 0.0000 0.3929 0.2703 ( 14040 PWs) bands (ev): -12.1785 -12.1785 -12.1755 -12.1753 -11.8228 -11.8227 -11.8204 -11.8203 -11.7042 -11.7041 -11.6785 -11.6777 -11.6763 -11.6763 -11.6701 -11.6693 -3.0200 -3.0181 -2.9599 -2.9581 -1.6880 -1.6853 -1.4361 -1.4187 -1.2304 -1.1901 -1.1266 -1.1055 -1.0160 -1.0143 -0.7456 -0.7191 -0.5971 -0.5116 -0.5014 -0.4513 -0.4075 -0.3304 -0.3114 -0.2138 0.0136 0.0189 0.0734 0.0977 0.1261 0.1354 0.1979 0.2278 0.2309 0.2582 0.4287 0.4990 0.5807 0.6861 0.7314 0.7633 1.0199 1.0227 1.0498 1.0836 1.1572 1.1770 1.1881 1.2237 2.4761 2.4904 2.5725 2.5731 2.6431 2.6436 2.6812 2.6925 2.8774 2.8871 2.9153 2.9181 2.9626 2.9794 2.9922 3.0061 3.0843 3.0971 3.1239 3.1246 6.7895 6.8008 7.0966 7.0986 7.5331 7.5548 7.8916 7.9032 7.9578 7.9714 8.2130 8.2154 8.3414 8.3574 8.4653 8.4817 k = 0.0000 0.4107 0.2703 ( 14052 PWs) bands (ev): -12.1729 -12.1729 -12.1697 -12.1695 -11.8291 -11.8290 -11.8265 -11.8264 -11.7043 -11.7042 -11.6781 -11.6774 -11.6761 -11.6761 -11.6704 -11.6696 -3.0179 -3.0162 -2.9551 -2.9536 -1.6939 -1.6916 -1.4417 -1.4272 -1.2301 -1.1949 -1.1299 -1.1121 -1.0123 -1.0114 -0.7451 -0.7216 -0.5867 -0.4991 -0.4878 -0.4645 -0.3921 -0.3456 -0.3252 -0.2274 0.0124 0.0186 0.0765 0.1063 0.1260 0.1331 0.1996 0.2264 0.2331 0.2490 0.4209 0.4892 0.5720 0.6738 0.7470 0.7770 1.0140 1.0250 1.0520 1.0717 1.1614 1.1795 1.1909 1.2227 2.4759 2.4882 2.5742 2.5748 2.6456 2.6456 2.6832 2.6930 2.8816 2.8889 2.9127 2.9149 2.9647 2.9782 2.9947 3.0107 3.0754 3.0896 3.1216 3.1224 6.8148 6.8247 7.1381 7.1404 7.5667 7.5864 7.8991 7.9105 7.9675 7.9792 8.2391 8.2406 8.3892 8.4058 8.5156 8.5317 k = 0.0000 0.4286 0.2703 ( 14044 PWs) bands (ev): -12.1681 -12.1680 -12.1646 -12.1645 -11.8345 -11.8344 -11.8318 -11.8317 -11.7043 -11.7042 -11.6777 -11.6770 -11.6759 -11.6758 -11.6707 -11.6700 -3.0161 -3.0147 -2.9511 -2.9498 -1.6986 -1.6968 -1.4461 -1.4346 -1.2299 -1.2009 -1.1319 -1.1178 -1.0080 -1.0076 -0.7447 -0.7249 -0.5763 -0.4889 -0.4771 -0.4747 -0.3761 -0.3598 -0.3374 -0.2412 0.0109 0.0169 0.0800 0.1103 0.1266 0.1315 0.2057 0.2235 0.2371 0.2411 0.4145 0.4760 0.5696 0.6594 0.7629 0.7913 1.0057 1.0287 1.0536 1.0598 1.1654 1.1809 1.1942 1.2209 2.4761 2.4861 2.5756 2.5762 2.6473 2.6477 2.6850 2.6931 2.8855 2.8907 2.9105 2.9119 2.9665 2.9769 2.9984 3.0160 3.0665 3.0819 3.1195 3.1203 6.8369 6.8451 7.1747 7.1771 7.5977 7.6148 7.9042 7.9150 7.9733 7.9829 8.2623 8.2632 8.4371 8.4533 8.5590 8.5735 k = 0.0000 0.4464 0.2703 ( 14048 PWs) bands (ev): -12.1641 -12.1641 -12.1605 -12.1604 -11.8389 -11.8388 -11.8360 -11.8360 -11.7043 -11.7043 -11.6774 -11.6768 -11.6757 -11.6757 -11.6709 -11.6703 -3.0146 -3.0135 -2.9478 -2.9468 -1.7022 -1.7008 -1.4493 -1.4406 -1.2294 -1.2073 -1.1328 -1.1224 -1.0040 -1.0037 -0.7441 -0.7287 -0.5660 -0.4957 -0.4725 -0.4625 -0.3727 -0.3672 -0.3419 -0.2553 0.0095 0.0146 0.0837 0.1089 0.1278 0.1319 0.2144 0.2218 0.2346 0.2402 0.4104 0.4607 0.5726 0.6443 0.7784 0.8036 0.9992 1.0283 1.0510 1.0545 1.1691 1.1812 1.1978 1.2186 2.4765 2.4842 2.5768 2.5773 2.6488 2.6493 2.6866 2.6928 2.8891 2.8924 2.9086 2.9093 2.9681 2.9756 3.0033 3.0214 3.0581 3.0741 3.1177 3.1184 6.8552 6.8615 7.2053 7.2074 7.6248 7.6387 7.9075 7.9169 7.9764 7.9835 8.2816 8.2821 8.4827 8.4973 8.5944 8.6062 k = 0.0000 0.4643 0.2703 ( 14064 PWs) bands (ev): -12.1612 -12.1612 -12.1574 -12.1573 -11.8422 -11.8421 -11.8392 -11.8392 -11.7043 -11.7043 -11.6770 -11.6766 -11.6756 -11.6755 -11.6711 -11.6707 -3.0134 -3.0127 -2.9454 -2.9447 -1.7047 -1.7038 -1.4512 -1.4454 -1.2282 -1.2134 -1.1329 -1.1262 -1.0006 -1.0004 -0.7432 -0.7325 -0.5554 -0.5087 -0.4618 -0.4522 -0.3834 -0.3731 -0.3312 -0.2698 0.0087 0.0123 0.0873 0.1047 0.1294 0.1329 0.2210 0.2235 0.2297 0.2416 0.4096 0.4453 0.5795 0.6293 0.7926 0.8120 0.9959 1.0211 1.0488 1.0545 1.1725 1.1807 1.2016 1.2158 2.4772 2.4824 2.5777 2.5780 2.6500 2.6504 2.6881 2.6923 2.8920 2.8938 2.9070 2.9072 2.9695 2.9743 3.0091 3.0257 3.0514 3.0663 3.1164 3.1169 6.8690 6.8733 7.2284 7.2300 7.6465 7.6564 7.9097 7.9168 7.9777 7.9825 8.2961 8.2964 8.5225 8.5337 8.6209 8.6291 k = 0.0000 0.4821 0.2703 ( 14072 PWs) bands (ev): -12.1594 -12.1594 -12.1555 -12.1555 -11.8442 -11.8442 -11.8411 -11.8411 -11.7043 -11.7043 -11.6768 -11.6766 -11.6755 -11.6755 -11.6711 -11.6709 -3.0127 -3.0123 -2.9439 -2.9435 -1.7062 -1.7057 -1.4517 -1.4488 -1.2261 -1.2187 -1.1324 -1.1290 -0.9984 -0.9982 -0.7415 -0.7361 -0.5445 -0.5213 -0.4522 -0.4457 -0.3898 -0.3826 -0.3158 -0.2847 0.0085 0.0103 0.0911 0.0999 0.1311 0.1332 0.2213 0.2251 0.2324 0.2411 0.4128 0.4313 0.5894 0.6148 0.8043 0.8150 0.9968 1.0110 1.0502 1.0537 1.1754 1.1795 1.2054 1.2126 2.4781 2.4807 2.5782 2.5784 2.6508 2.6510 2.6894 2.6915 2.8941 2.8948 2.9058 2.9058 2.9708 2.9731 3.0156 3.0262 3.0492 3.0590 3.1156 3.1159 6.8779 6.8801 7.2430 7.2439 7.6614 7.6666 7.9116 7.9154 7.9785 7.9808 8.3051 8.3052 8.5512 8.5573 8.6378 8.6420 k = 0.0000 0.5000 0.2703 ( 14076 PWs) bands (ev): -12.1588 -12.1588 -12.1548 -12.1548 -11.8448 -11.8448 -11.8418 -11.8418 -11.7043 -11.7043 -11.6766 -11.6766 -11.6754 -11.6754 -11.6711 -11.6711 -3.0123 -3.0123 -2.9432 -2.9432 -1.7065 -1.7065 -1.4509 -1.4509 -1.2229 -1.2229 -1.1311 -1.1311 -0.9975 -0.9975 -0.7392 -0.7392 -0.5332 -0.5332 -0.4459 -0.4459 -0.3893 -0.3893 -0.3001 -0.3001 0.0090 0.0090 0.0953 0.0953 0.1325 0.1325 0.2227 0.2227 0.2380 0.2380 0.4201 0.4201 0.6013 0.6013 0.8122 0.8122 1.0021 1.0021 1.0521 1.0521 1.1777 1.1777 1.2092 1.2092 2.4793 2.4793 2.5785 2.5785 2.6511 2.6511 2.6905 2.6905 2.8950 2.8950 2.9054 2.9054 2.9720 2.9720 3.0219 3.0219 3.0527 3.0527 3.1154 3.1154 6.8816 6.8816 7.2483 7.2483 7.6683 7.6683 7.9135 7.9135 7.9794 7.9794 8.3082 8.3082 8.5637 8.5637 8.6449 8.6449 k = 0.0000 0.5000 0.2703 ( 14076 PWs) bands (ev): -12.1588 -12.1588 -12.1548 -12.1548 -11.8448 -11.8448 -11.8418 -11.8418 -11.7043 -11.7043 -11.6766 -11.6766 -11.6754 -11.6754 -11.6711 -11.6711 -3.0123 -3.0123 -2.9432 -2.9432 -1.7065 -1.7065 -1.4509 -1.4509 -1.2229 -1.2229 -1.1311 -1.1311 -0.9975 -0.9975 -0.7392 -0.7392 -0.5332 -0.5332 -0.4459 -0.4459 -0.3893 -0.3893 -0.3001 -0.3001 0.0090 0.0090 0.0953 0.0953 0.1325 0.1325 0.2227 0.2227 0.2380 0.2380 0.4201 0.4201 0.6013 0.6013 0.8122 0.8122 1.0021 1.0021 1.0521 1.0521 1.1777 1.1777 1.2092 1.2092 2.4793 2.4793 2.5785 2.5785 2.6511 2.6511 2.6905 2.6905 2.8950 2.8950 2.9054 2.9054 2.9720 2.9720 3.0219 3.0219 3.0527 3.0527 3.1154 3.1154 6.8816 6.8816 7.2483 7.2483 7.6683 7.6683 7.9135 7.9135 7.9794 7.9794 8.3082 8.3082 8.5637 8.5637 8.6449 8.6449 k = 0.0179 0.5000 0.2703 ( 14068 PWs) bands (ev): -12.1586 -12.1585 -12.1546 -12.1546 -11.8449 -11.8449 -11.8415 -11.8415 -11.7046 -11.7046 -11.6769 -11.6768 -11.6756 -11.6756 -11.6712 -11.6711 -3.0131 -3.0122 -2.9439 -2.9436 -1.7078 -1.7067 -1.4565 -1.4535 -1.2250 -1.2175 -1.1334 -1.1276 -0.9976 -0.9975 -0.7489 -0.7295 -0.5365 -0.5322 -0.4507 -0.4470 -0.4096 -0.3657 -0.3153 -0.2810 -0.0021 0.0191 0.0915 0.0991 0.1315 0.1388 0.2167 0.2295 0.2366 0.2425 0.4187 0.4244 0.5981 0.6049 0.8123 0.8124 0.9998 1.0033 1.0510 1.0544 1.1672 1.1881 1.2039 1.2146 2.4792 2.4801 2.5781 2.5791 2.6505 2.6521 2.6889 2.6924 2.8936 2.8952 2.9036 2.9089 2.9702 2.9736 3.0205 3.0241 3.0527 3.0532 3.1154 3.1158 6.8787 6.8820 7.2454 7.2470 7.6661 7.6675 7.8822 7.9149 7.9779 8.0078 8.3088 8.3093 8.5590 8.5676 8.6422 8.6472 k = 0.0357 0.5000 0.2703 ( 14040 PWs) bands (ev): -12.1579 -12.1578 -12.1540 -12.1539 -11.8450 -11.8450 -11.8407 -11.8406 -11.7054 -11.7053 -11.6775 -11.6774 -11.6760 -11.6760 -11.6714 -11.6713 -3.0144 -3.0126 -2.9456 -2.9450 -1.7105 -1.7083 -1.4695 -1.4638 -1.2245 -1.2096 -1.1342 -1.1231 -0.9979 -0.9973 -0.7588 -0.7200 -0.5425 -0.5342 -0.4595 -0.4559 -0.4225 -0.3439 -0.3234 -0.2593 -0.0127 0.0270 0.0896 0.1001 0.1396 0.1463 0.2120 0.2319 0.2441 0.2494 0.4202 0.4315 0.5953 0.6088 0.8126 0.8129 0.9968 1.0031 1.0513 1.0573 1.1568 1.1971 1.1998 1.2201 2.4797 2.4815 2.5779 2.5800 2.6502 2.6533 2.6874 2.6944 2.8910 2.8951 2.9036 2.9133 2.9683 2.9750 3.0198 3.0270 3.0533 3.0543 3.1159 3.1168 6.8734 6.8801 7.2385 7.2415 7.6608 7.6637 7.8448 7.8842 8.0055 8.0392 8.3111 8.3123 8.5536 8.5703 8.6391 8.6484 k = 0.0536 0.5000 0.2703 ( 14048 PWs) bands (ev): -12.1568 -12.1567 -12.1528 -12.1528 -11.8449 -11.8449 -11.8395 -11.8394 -11.7066 -11.7066 -11.6786 -11.6784 -11.6767 -11.6767 -11.6718 -11.6717 -3.0163 -3.0137 -2.9483 -2.9474 -1.7147 -1.7114 -1.4882 -1.4803 -1.2230 -1.2011 -1.1331 -1.1183 -0.9986 -0.9969 -0.7686 -0.7103 -0.5520 -0.5412 -0.4701 -0.4672 -0.4294 -0.3397 -0.3100 -0.2363 -0.0212 0.0327 0.0898 0.0997 0.1528 0.1543 0.2088 0.2325 0.2586 0.2591 0.4245 0.4411 0.5929 0.6130 0.8132 0.8136 0.9935 1.0013 1.0531 1.0601 1.1470 1.1939 1.2079 1.2254 2.4807 2.4835 2.5778 2.5811 2.6502 2.6547 2.6862 2.6965 2.8880 2.8950 2.9046 2.9182 2.9663 2.9761 3.0198 3.0305 3.0543 3.0559 3.1168 3.1182 6.8658 6.8757 7.2276 7.2320 7.6528 7.6572 7.8055 7.8465 8.0371 8.0696 8.3153 8.3169 8.5477 8.5713 8.6358 8.6475 k = 0.0714 0.5000 0.2703 ( 14052 PWs) bands (ev): -12.1553 -12.1551 -12.1513 -12.1512 -11.8447 -11.8447 -11.8380 -11.8378 -11.7084 -11.7083 -11.6801 -11.6799 -11.6777 -11.6776 -11.6724 -11.6723 -3.0188 -3.0153 -2.9520 -2.9508 -1.7202 -1.7160 -1.5110 -1.5014 -1.2217 -1.1942 -1.1296 -1.1135 -0.9999 -0.9964 -0.7780 -0.7005 -0.5660 -0.5550 -0.4797 -0.4736 -0.4342 -0.3427 -0.2867 -0.2129 -0.0268 0.0367 0.0918 0.1003 0.1573 0.1700 0.2082 0.2339 0.2724 0.2777 0.4314 0.4531 0.5909 0.6176 0.8141 0.8146 0.9901 0.9983 1.0561 1.0620 1.1382 1.1898 1.2166 1.2305 2.4824 2.4861 2.5780 2.5824 2.6506 2.6564 2.6852 2.6987 2.8852 2.8953 2.9060 2.9233 2.9644 2.9772 3.0205 3.0347 3.0558 3.0581 3.1180 3.1201 6.8561 6.8693 7.2132 7.2189 7.6421 7.6483 7.7653 7.8066 8.0680 8.0980 8.3212 8.3234 8.5412 8.5700 8.6323 8.6444 k = 0.0893 0.5000 0.2703 ( 14064 PWs) bands (ev): -12.1533 -12.1531 -12.1493 -12.1492 -11.8443 -11.8443 -11.8362 -11.8360 -11.7107 -11.7106 -11.6821 -11.6818 -11.6789 -11.6788 -11.6731 -11.6730 -3.0217 -3.0174 -2.9566 -2.9551 -1.7271 -1.7219 -1.5364 -1.5256 -1.2217 -1.1904 -1.1239 -1.1096 -1.0023 -0.9961 -0.7868 -0.6906 -0.5843 -0.5741 -0.4868 -0.4738 -0.4378 -0.3442 -0.2634 -0.1898 -0.0289 0.0403 0.0953 0.1025 0.1597 0.1803 0.2135 0.2364 0.2903 0.3006 0.4407 0.4672 0.5894 0.6224 0.8152 0.8158 0.9868 0.9944 1.0599 1.0624 1.1312 1.1864 1.2245 1.2351 2.4847 2.4892 2.5782 2.5838 2.6513 2.6583 2.6844 2.7009 2.8829 2.8959 2.9076 2.9283 2.9627 2.9781 3.0217 3.0393 3.0576 3.0609 3.1195 3.1224 6.8445 6.8611 7.1957 7.2026 7.6293 7.6373 7.7248 7.7657 8.0970 8.1241 8.3290 8.3316 8.5338 8.5660 8.6289 8.6403 k = 0.1071 0.5000 0.2703 ( 14040 PWs) bands (ev): -12.1509 -12.1507 -12.1469 -12.1468 -11.8437 -11.8437 -11.8342 -11.8339 -11.7134 -11.7133 -11.6844 -11.6841 -11.6803 -11.6801 -11.6740 -11.6739 -3.0250 -3.0200 -2.9619 -2.9602 -1.7352 -1.7292 -1.5634 -1.5518 -1.2231 -1.1900 -1.1170 -1.1070 -1.0062 -0.9963 -0.7945 -0.6813 -0.6054 -0.5953 -0.4906 -0.4708 -0.4392 -0.3437 -0.2411 -0.1677 -0.0275 0.0441 0.0999 0.1060 0.1604 0.1831 0.2251 0.2401 0.3129 0.3265 0.4520 0.4833 0.5884 0.6276 0.8168 0.8174 0.9837 0.9900 1.0603 1.0640 1.1268 1.1838 1.2314 1.2391 2.4876 2.4928 2.5786 2.5855 2.6524 2.6604 2.6840 2.7032 2.8812 2.8971 2.9093 2.9332 2.9614 2.9790 3.0233 3.0444 3.0599 3.0642 3.1213 3.1250 6.8315 6.8514 7.1755 7.1836 7.6146 7.6244 7.6846 7.7245 8.1239 8.1477 8.3386 8.3417 8.5255 8.5592 8.6258 8.6361 k = 0.1250 0.5000 0.2703 ( 14036 PWs) bands (ev): -12.1481 -12.1479 -12.1441 -12.1440 -11.8429 -11.8428 -11.8319 -11.8316 -11.7166 -11.7165 -11.6872 -11.6869 -11.6819 -11.6817 -11.6751 -11.6750 -3.0287 -3.0231 -2.9680 -2.9660 -1.7445 -1.7378 -1.5912 -1.5792 -1.2262 -1.1921 -1.1103 -1.1061 -1.0124 -0.9976 -0.8015 -0.6758 -0.6244 -0.6158 -0.4913 -0.4683 -0.4356 -0.3412 -0.2201 -0.1467 -0.0227 0.0487 0.1053 0.1105 0.1599 0.1825 0.2385 0.2449 0.3397 0.3547 0.4650 0.5012 0.5881 0.6331 0.8186 0.8193 0.9808 0.9851 1.0556 1.0679 1.1252 1.1820 1.2372 1.2425 2.4910 2.4970 2.5790 2.5873 2.6539 2.6627 2.6837 2.7054 2.8801 2.8989 2.9111 2.9376 2.9607 2.9800 3.0254 3.0496 3.0625 3.0679 3.1232 3.1281 6.8174 6.8405 7.1534 7.1623 7.5981 7.6093 7.6454 7.6833 8.1482 8.1688 8.3500 8.3537 8.5158 8.5496 8.6231 8.6321 k = 0.1429 0.5000 0.2703 ( 14012 PWs) bands (ev): -12.1449 -12.1447 -12.1409 -12.1408 -11.8418 -11.8417 -11.8294 -11.8291 -11.7202 -11.7200 -11.6903 -11.6899 -11.6836 -11.6834 -11.6764 -11.6763 -3.0327 -3.0265 -2.9747 -2.9725 -1.7548 -1.7474 -1.6193 -1.6072 -1.2308 -1.1964 -1.1072 -1.1048 -1.0211 -1.0005 -0.8084 -0.6842 -0.6332 -0.6301 -0.4892 -0.4685 -0.4254 -0.3367 -0.2004 -0.1273 -0.0152 0.0544 0.1114 0.1157 0.1586 0.1810 0.2507 0.2517 0.3692 0.3842 0.4793 0.5207 0.5888 0.6389 0.8209 0.8215 0.9780 0.9801 1.0485 1.0715 1.1259 1.1812 1.2418 1.2450 2.4950 2.5016 2.5796 2.5892 2.6557 2.6652 2.6837 2.7075 2.8798 2.9012 2.9129 2.9414 2.9609 2.9811 3.0279 3.0550 3.0654 3.0719 3.1252 3.1313 6.8027 6.8290 7.1297 7.1393 7.5798 7.5892 7.6106 7.6427 8.1698 8.1874 8.3633 8.3675 8.5045 8.5374 8.6214 8.6286 k = 0.1607 0.5000 0.2703 ( 14024 PWs) bands (ev): -12.1414 -12.1411 -12.1374 -12.1372 -11.8406 -11.8404 -11.8267 -11.8264 -11.7242 -11.7240 -11.6937 -11.6934 -11.6856 -11.6854 -11.6780 -11.6778 -3.0369 -3.0302 -2.9819 -2.9796 -1.7661 -1.7582 -1.6473 -1.6353 -1.2365 -1.2021 -1.1103 -1.1009 -1.0325 -1.0052 -0.8171 -0.7071 -0.6451 -0.6212 -0.4849 -0.4702 -0.4099 -0.3301 -0.1819 -0.1096 -0.0054 0.0611 0.1179 0.1214 0.1569 0.1793 0.2576 0.2643 0.4002 0.4143 0.4947 0.5418 0.5905 0.6450 0.8237 0.8241 0.9750 0.9754 1.0399 1.0744 1.1283 1.1813 1.2450 1.2467 2.4994 2.5065 2.5801 2.5911 2.6578 2.6677 2.6840 2.7095 2.8801 2.9042 2.9147 2.9442 2.9622 2.9824 3.0307 3.0603 3.0686 3.0760 3.1272 3.1347 6.7879 6.8173 7.1049 7.1152 7.5580 7.5595 7.5864 7.6035 8.1886 8.2033 8.3783 8.3830 8.4914 8.5226 8.6206 8.6256 k = 0.1786 0.5000 0.2703 ( 14016 PWs) bands (ev): -12.1375 -12.1372 -12.1335 -12.1334 -11.8391 -11.8390 -11.8238 -11.8234 -11.7285 -11.7284 -11.6975 -11.6971 -11.6877 -11.6874 -11.6797 -11.6794 -3.0413 -3.0342 -2.9894 -2.9870 -1.7781 -1.7698 -1.6750 -1.6632 -1.2433 -1.2090 -1.1155 -1.0989 -1.0462 -1.0115 -0.8293 -0.7352 -0.6500 -0.6066 -0.4787 -0.4721 -0.3907 -0.3211 -0.1644 -0.0935 0.0059 0.0684 0.1248 0.1275 0.1550 0.1780 0.2653 0.2765 0.4316 0.4438 0.5110 0.5642 0.5937 0.6515 0.8270 0.8272 0.9699 0.9727 1.0305 1.0766 1.1315 1.1822 1.2469 1.2475 2.5043 2.5119 2.5807 2.5930 2.6602 2.6704 2.6845 2.7114 2.8813 2.9078 2.9167 2.9460 2.9648 2.9838 3.0337 3.0654 3.0721 3.0802 3.1292 3.1382 6.7734 6.8058 7.0797 7.0904 7.5218 7.5360 7.5671 7.5672 8.2044 8.2167 8.3950 8.4004 8.4765 8.5056 8.6210 8.6234 k = 0.1964 0.5000 0.2703 ( 14020 PWs) bands (ev): -12.1333 -12.1330 -12.1294 -12.1292 -11.8375 -11.8373 -11.8206 -11.8203 -11.7332 -11.7331 -11.7015 -11.7012 -11.6899 -11.6897 -11.6816 -11.6813 -3.0458 -3.0384 -2.9973 -2.9948 -1.7908 -1.7823 -1.7019 -1.6905 -1.2507 -1.2167 -1.1228 -1.0992 -1.0609 -1.0191 -0.8456 -0.7651 -0.6476 -0.5896 -0.4733 -0.4712 -0.3686 -0.3096 -0.1477 -0.0789 0.0180 0.0758 0.1318 0.1340 0.1532 0.1770 0.2736 0.2881 0.4625 0.4713 0.5288 0.5879 0.5989 0.6584 0.8306 0.8309 0.9649 0.9698 1.0209 1.0779 1.1351 1.1839 1.2472 1.2475 2.5096 2.5175 2.5812 2.5949 2.6628 2.6731 2.6853 2.7132 2.8833 2.9121 2.9189 2.9471 2.9682 2.9853 3.0369 3.0702 3.0758 3.0844 3.1312 3.1417 6.7598 6.7949 7.0543 7.0653 7.4855 7.5076 7.5354 7.5482 8.2172 8.2275 8.4132 8.4193 8.4597 8.4868 8.6221 8.6227 k = 0.2143 0.5000 0.2703 ( 14024 PWs) bands (ev): -12.1288 -12.1285 -12.1250 -12.1248 -11.8356 -11.8355 -11.8173 -11.8170 -11.7382 -11.7380 -11.7059 -11.7055 -11.6923 -11.6920 -11.6837 -11.6834 -3.0502 -3.0426 -3.0054 -3.0029 -1.8040 -1.7953 -1.7280 -1.7171 -1.2585 -1.2249 -1.1320 -1.1034 -1.0747 -1.0275 -0.8655 -0.7954 -0.6391 -0.5716 -0.4735 -0.4628 -0.3443 -0.2957 -0.1315 -0.0657 0.0304 0.0830 0.1391 0.1410 0.1517 0.1763 0.2824 0.2991 0.4924 0.4946 0.5491 0.6065 0.6124 0.6657 0.8346 0.8355 0.9599 0.9662 1.0119 1.0785 1.1387 1.1860 1.2460 1.2467 2.5152 2.5234 2.5818 2.5966 2.6655 2.6759 2.6863 2.7148 2.8860 2.9171 2.9214 2.9480 2.9722 2.9870 3.0402 3.0744 3.0797 3.0884 3.1329 3.1450 6.7473 6.7852 7.0293 7.0404 7.4502 7.4748 7.5082 7.5284 8.2271 8.2359 8.4320 8.4394 8.4417 8.4673 8.6220 8.6256 k = 0.2321 0.5000 0.2703 ( 14016 PWs) bands (ev): -12.1241 -12.1238 -12.1204 -12.1202 -11.8337 -11.8335 -11.8139 -11.8135 -11.7434 -11.7433 -11.7104 -11.7100 -11.6948 -11.6945 -11.6860 -11.6857 -3.0546 -3.0469 -3.0135 -3.0110 -1.8175 -1.8088 -1.7530 -1.7427 -1.2664 -1.2335 -1.1432 -1.1138 -1.0842 -1.0363 -0.8879 -0.8256 -0.6262 -0.5531 -0.4727 -0.4540 -0.3181 -0.2794 -0.1157 -0.0536 0.0424 0.0892 0.1464 0.1486 0.1506 0.1761 0.2912 0.3093 0.5124 0.5209 0.5724 0.6169 0.6373 0.6737 0.8391 0.8410 0.9549 0.9613 1.0043 1.0783 1.1420 1.1883 1.2438 1.2447 2.5211 2.5294 2.5823 2.5982 2.6683 2.6787 2.6876 2.7162 2.8896 2.9227 2.9243 2.9489 2.9764 2.9889 3.0434 3.0779 3.0837 3.0924 3.1344 3.1481 6.7365 6.7768 7.0048 7.0159 7.4163 7.4408 7.4825 7.5075 8.2342 8.2418 8.4215 8.4386 8.4599 8.4617 8.6231 8.6297 k = 0.2500 0.5000 0.2703 ( 14008 PWs) bands (ev): -12.1192 -12.1189 -12.1156 -12.1155 -11.8316 -11.8314 -11.8103 -11.8099 -11.7488 -11.7487 -11.7151 -11.7147 -11.6974 -11.6971 -11.6884 -11.6881 -3.0589 -3.0512 -3.0216 -3.0191 -1.8312 -1.8225 -1.7769 -1.7672 -1.2743 -1.2422 -1.1559 -1.1295 -1.0897 -1.0453 -0.9115 -0.8554 -0.6104 -0.5347 -0.4707 -0.4451 -0.2904 -0.2608 -0.1000 -0.0425 0.0537 0.0942 0.1497 0.1543 0.1568 0.1761 0.2998 0.3185 0.5254 0.5478 0.5970 0.6308 0.6616 0.6828 0.8441 0.8475 0.9501 0.9544 0.9987 1.0775 1.1448 1.1905 1.2408 1.2415 2.5272 2.5355 2.5828 2.5996 2.6712 2.6815 2.6892 2.7175 2.8939 2.9276 2.9289 2.9501 2.9806 2.9908 3.0465 3.0806 3.0879 3.0961 3.1357 3.1509 6.7277 6.7703 6.9813 6.9923 7.3841 7.4074 7.4567 7.4855 8.2385 8.2453 8.4007 8.4187 8.4793 8.4847 8.6256 8.6350 k = 0.2679 0.5000 0.2703 ( 14016 PWs) bands (ev): -12.1141 -12.1138 -12.1107 -12.1106 -11.8293 -11.8291 -11.8065 -11.8061 -11.7544 -11.7542 -11.7199 -11.7196 -11.7000 -11.6997 -11.6910 -11.6907 -3.0630 -3.0554 -3.0296 -3.0271 -1.8448 -1.8364 -1.7994 -1.7905 -1.2819 -1.2507 -1.1698 -1.1474 -1.0938 -1.0540 -0.9356 -0.8845 -0.5929 -0.5169 -0.4676 -0.4364 -0.2615 -0.2405 -0.0845 -0.0322 0.0638 0.0979 0.1499 0.1619 0.1656 0.1765 0.3076 0.3264 0.5356 0.5729 0.6194 0.6493 0.6819 0.6958 0.8498 0.8552 0.9453 0.9454 0.9953 1.0761 1.1469 1.1922 1.2369 1.2374 2.5335 2.5416 2.5833 2.6006 2.6740 2.6842 2.6911 2.7185 2.8989 2.9315 2.9357 2.9516 2.9847 2.9928 3.0492 3.0824 3.0922 3.0996 3.1367 3.1532 6.7212 6.7657 6.9588 6.9696 7.3537 7.3755 7.4302 7.4623 8.2404 8.2466 8.3792 8.3956 8.5022 8.5086 8.6296 8.6412 k = 0.2857 0.5000 0.2703 ( 14004 PWs) bands (ev): -12.1090 -12.1087 -12.1058 -12.1056 -11.8270 -11.8268 -11.8027 -11.8023 -11.7600 -11.7599 -11.7248 -11.7244 -11.7027 -11.7024 -11.6938 -11.6935 -3.0669 -3.0594 -3.0374 -3.0349 -1.8582 -1.8502 -1.8206 -1.8125 -1.2890 -1.2590 -1.1844 -1.1657 -1.0977 -1.0626 -0.9595 -0.9126 -0.5745 -0.5000 -0.4636 -0.4281 -0.2319 -0.2186 -0.0690 -0.0224 0.0728 0.1002 0.1509 0.1696 0.1742 0.1776 0.3143 0.3329 0.5446 0.5964 0.6377 0.6726 0.6946 0.7157 0.8561 0.8642 0.9346 0.9406 0.9941 1.0741 1.1482 1.1930 1.2323 1.2327 2.5398 2.5477 2.5837 2.6014 2.6769 2.6870 2.6931 2.7194 2.9047 2.9360 2.9429 2.9536 2.9887 2.9947 3.0515 3.0833 3.0964 3.1030 3.1373 3.1551 6.7170 6.7633 6.9377 6.9481 7.3253 7.3452 7.4029 7.4379 8.2401 8.2458 8.3574 8.3721 8.5261 8.5330 8.6349 8.6484 k = 0.3036 0.5000 0.2703 ( 14008 PWs) bands (ev): -12.1038 -12.1035 -12.1008 -12.1007 -11.8246 -11.8244 -11.7988 -11.7983 -11.7657 -11.7656 -11.7297 -11.7293 -11.7055 -11.7051 -11.6968 -11.6964 -3.0705 -3.0633 -3.0448 -3.0425 -1.8713 -1.8637 -1.8403 -1.8330 -1.2955 -1.2668 -1.1994 -1.1837 -1.1016 -1.0708 -0.9828 -0.9397 -0.5559 -0.4842 -0.4588 -0.4204 -0.2019 -0.1959 -0.0537 -0.0131 0.0805 0.1012 0.1527 0.1770 0.1772 0.1845 0.3195 0.3378 0.5537 0.6182 0.6528 0.6981 0.7048 0.7369 0.8629 0.8745 0.9225 0.9361 0.9944 1.0717 1.1487 1.1926 1.2272 1.2279 2.5460 2.5536 2.5841 2.6018 2.6796 2.6897 2.6953 2.7200 2.9111 2.9411 2.9503 2.9562 2.9925 2.9966 3.0531 3.0830 3.1005 3.1063 3.1376 3.1563 6.7155 6.7631 6.9179 6.9279 7.2989 7.3170 7.3750 7.4124 8.2381 8.2433 8.3356 8.3487 8.5503 8.5576 8.6416 8.6563 k = 0.3214 0.5000 0.2703 ( 14032 PWs) bands (ev): -12.0986 -12.0984 -12.0959 -12.0958 -11.8222 -11.8220 -11.7948 -11.7943 -11.7713 -11.7712 -11.7345 -11.7342 -11.7082 -11.7079 -11.6998 -11.6995 -3.0739 -3.0670 -3.0518 -3.0496 -1.8838 -1.8768 -1.8585 -1.8521 -1.3012 -1.2741 -1.2142 -1.2010 -1.1056 -1.0787 -1.0050 -0.9654 -0.5375 -0.4697 -0.4534 -0.4134 -0.1726 -0.1720 -0.0388 -0.0041 0.0872 0.1013 0.1554 0.1777 0.1847 0.1935 0.3227 0.3407 0.5635 0.6381 0.6661 0.7149 0.7236 0.7564 0.8703 0.8859 0.9095 0.9318 0.9959 1.0687 1.1483 1.1905 1.2217 1.2232 2.5521 2.5593 2.5845 2.6019 2.6824 2.6923 2.6975 2.7204 2.9181 2.9470 2.9566 2.9606 2.9961 2.9985 3.0540 3.0818 3.1045 3.1094 3.1375 3.1569 6.7166 6.7652 6.8998 6.9092 7.2747 7.2909 7.3466 7.3860 8.2345 8.2394 8.3143 8.3258 8.5744 8.5820 8.6494 8.6647 k = 0.3393 0.5000 0.2703 ( 14036 PWs) bands (ev): -12.0936 -12.0933 -12.0912 -12.0911 -11.8198 -11.8195 -11.7907 -11.7903 -11.7768 -11.7767 -11.7392 -11.7389 -11.7109 -11.7106 -11.7030 -11.7026 -3.0769 -3.0705 -3.0584 -3.0564 -1.8955 -1.8893 -1.8750 -1.8695 -1.3061 -1.2808 -1.2286 -1.2173 -1.1097 -1.0861 -1.0259 -0.9897 -0.5196 -0.4566 -0.4475 -0.4073 -0.1493 -0.1426 -0.0245 0.0048 0.0935 0.1006 0.1589 0.1781 0.1918 0.2023 0.3236 0.3417 0.5747 0.6562 0.6779 0.7253 0.7477 0.7738 0.8780 0.8942 0.8999 0.9281 0.9986 1.0652 1.1471 1.1868 1.2160 1.2190 2.5580 2.5647 2.5849 2.6016 2.6851 2.6948 2.6997 2.7205 2.9256 2.9534 2.9607 2.9678 2.9994 3.0001 3.0540 3.0795 3.1082 3.1125 3.1370 3.1568 6.7204 6.7693 6.8832 6.8920 7.2526 7.2670 7.3181 7.3590 8.2299 8.2344 8.2939 8.3039 8.5981 8.6056 8.6581 8.6735 k = 0.3571 0.5000 0.2703 ( 14056 PWs) bands (ev): -12.0887 -12.0884 -12.0866 -12.0865 -11.8174 -11.8171 -11.7867 -11.7862 -11.7820 -11.7819 -11.7437 -11.7434 -11.7135 -11.7132 -11.7062 -11.7059 -3.0796 -3.0737 -3.0644 -3.0626 -1.9065 -1.9010 -1.8898 -1.8853 -1.3100 -1.2869 -1.2423 -1.2324 -1.1136 -1.0931 -1.0452 -1.0124 -0.5025 -0.4451 -0.4414 -0.4022 -0.1265 -0.1144 -0.0114 0.0135 0.0995 0.1000 0.1630 0.1783 0.1984 0.2107 0.3222 0.3405 0.5873 0.6723 0.6884 0.7361 0.7699 0.7886 0.8811 0.8851 0.9117 0.9256 1.0020 1.0610 1.1455 1.1819 1.2101 1.2152 2.5636 2.5697 2.5854 2.6010 2.6879 2.6972 2.7018 2.7203 2.9335 2.9605 2.9644 2.9758 3.0016 3.0024 3.0531 3.0762 3.1116 3.1155 3.1363 3.1560 6.7266 6.7754 6.8684 6.8765 7.2329 7.2454 7.2898 7.3315 8.2246 8.2287 8.2746 8.2832 8.6207 8.6282 8.6673 8.6823 k = 0.3750 0.5000 0.2703 ( 14056 PWs) bands (ev): -12.0841 -12.0838 -12.0823 -12.0823 -11.8151 -11.8148 -11.7870 -11.7869 -11.7827 -11.7822 -11.7479 -11.7477 -11.7160 -11.7157 -11.7095 -11.7091 -3.0820 -3.0766 -3.0698 -3.0682 -1.9164 -1.9118 -1.9030 -1.8994 -1.3130 -1.2922 -1.2550 -1.2462 -1.1173 -1.0995 -1.0626 -1.0333 -0.4862 -0.4353 -0.4352 -0.3981 -0.1045 -0.0880 -0.0000 0.0219 0.0986 0.1072 0.1675 0.1782 0.2045 0.2186 0.3184 0.3372 0.6015 0.6861 0.6976 0.7475 0.7894 0.8011 0.8668 0.8901 0.9244 0.9261 1.0060 1.0560 1.1438 1.1765 1.2042 1.2113 2.5688 2.5742 2.5859 2.6002 2.6907 2.6995 2.7038 2.7200 2.9418 2.9681 2.9684 2.9836 3.0028 3.0050 3.0514 3.0719 3.1148 3.1184 3.1354 3.1546 6.7351 6.7829 6.8554 6.8627 7.2155 7.2262 7.2622 7.3039 8.2190 8.2226 8.2569 8.2642 8.6420 8.6491 8.6768 8.6909 k = 0.3929 0.5000 0.2703 ( 14052 PWs) bands (ev): -12.0798 -12.0796 -12.0784 -12.0784 -11.8129 -11.8127 -11.7915 -11.7915 -11.7788 -11.7783 -11.7518 -11.7516 -11.7183 -11.7180 -11.7128 -11.7124 -3.0839 -3.0792 -3.0746 -3.0732 -1.9251 -1.9215 -1.9145 -1.9118 -1.3149 -1.2967 -1.2665 -1.2585 -1.1206 -1.1052 -1.0779 -1.0524 -0.4711 -0.4294 -0.4268 -0.3953 -0.0836 -0.0641 0.0089 0.0296 0.0989 0.1157 0.1724 0.1778 0.2099 0.2260 0.3126 0.3318 0.6171 0.6976 0.7055 0.7589 0.8061 0.8109 0.8533 0.8910 0.9312 0.9364 1.0100 1.0501 1.1425 1.1713 1.1983 1.2070 2.5734 2.5783 2.5865 2.5991 2.6935 2.7017 2.7055 2.7193 2.9504 2.9726 2.9762 2.9911 3.0036 3.0073 3.0489 3.0668 3.1175 3.1212 3.1345 3.1524 6.7456 6.7915 6.8441 6.8505 7.2005 7.2094 7.2362 7.2767 8.2135 8.2166 8.2409 8.2471 8.6614 8.6679 8.6862 8.6990 k = 0.4107 0.5000 0.2703 ( 14064 PWs) bands (ev): -12.0760 -12.0758 -12.0750 -12.0749 -11.8109 -11.8107 -11.7956 -11.7956 -11.7750 -11.7746 -11.7552 -11.7550 -11.7204 -11.7202 -11.7160 -11.7156 -3.0855 -3.0815 -3.0787 -3.0775 -1.9327 -1.9300 -1.9242 -1.9224 -1.3158 -1.3005 -1.2767 -1.2695 -1.1234 -1.1103 -1.0910 -1.0694 -0.4571 -0.4239 -0.4199 -0.3937 -0.0641 -0.0436 0.0151 0.0353 0.1020 0.1252 0.1769 0.1772 0.2150 0.2328 0.3050 0.3242 0.6339 0.7068 0.7121 0.7694 0.8169 0.8197 0.8429 0.8880 0.9405 0.9476 1.0133 1.0431 1.1424 1.1670 1.1924 1.2021 2.5775 2.5818 2.5872 2.5978 2.6963 2.7037 2.7070 2.7183 2.9590 2.9770 2.9844 2.9979 3.0041 3.0090 3.0457 3.0609 3.1198 3.1237 3.1337 3.1496 6.7576 6.8002 6.8347 6.8402 7.1879 7.1948 7.2124 7.2505 8.2082 8.2109 8.2270 8.2320 8.6785 8.6843 8.6951 8.7063 k = 0.4286 0.5000 0.2703 ( 14072 PWs) bands (ev): -12.0727 -12.0726 -12.0720 -12.0720 -11.8092 -11.8090 -11.7991 -11.7991 -11.7715 -11.7711 -11.7581 -11.7580 -11.7223 -11.7220 -11.7190 -11.7186 -3.0868 -3.0835 -3.0821 -3.0811 -1.9388 -1.9370 -1.9324 -1.9313 -1.3156 -1.3035 -1.2854 -1.2791 -1.1254 -1.1145 -1.1016 -1.0843 -0.4444 -0.4189 -0.4146 -0.3936 -0.0459 -0.0266 0.0186 0.0375 0.1094 0.1350 0.1756 0.1814 0.2204 0.2391 0.2962 0.3146 0.6517 0.7141 0.7175 0.7756 0.8175 0.8304 0.8400 0.8826 0.9520 0.9581 1.0150 1.0352 1.1439 1.1640 1.1866 1.1964 2.5810 2.5847 2.5879 2.5964 2.6991 2.7054 2.7082 2.7171 2.9676 2.9815 2.9928 3.0034 3.0041 3.0105 3.0421 3.0545 3.1218 3.1260 3.1332 3.1464 6.7706 6.8084 6.8271 6.8316 7.1777 7.1825 7.1922 7.2258 8.2036 8.2057 8.2154 8.2194 8.6930 8.6979 8.7031 8.7124 k = 0.4464 0.5000 0.2703 ( 14064 PWs) bands (ev): -12.0700 -12.0699 -12.0696 -12.0696 -11.8077 -11.8076 -11.8019 -11.8019 -11.7684 -11.7681 -11.7605 -11.7604 -11.7237 -11.7236 -11.7217 -11.7214 -3.0876 -3.0851 -3.0848 -3.0840 -1.9435 -1.9424 -1.9388 -1.9383 -1.3144 -1.3056 -1.2926 -1.2873 -1.1265 -1.1178 -1.1098 -1.0970 -0.4331 -0.4146 -0.4107 -0.3948 -0.0292 -0.0131 0.0197 0.0355 0.1211 0.1443 0.1737 0.1833 0.2274 0.2450 0.2869 0.3033 0.6702 0.7195 0.7216 0.7724 0.8198 0.8384 0.8425 0.8757 0.9642 0.9680 1.0143 1.0264 1.1475 1.1626 1.1811 1.1899 2.5839 2.5870 2.5887 2.5949 2.7018 2.7069 2.7090 2.7156 2.9761 2.9860 3.0012 3.0036 3.0062 3.0129 3.0380 3.0476 3.1238 3.1279 3.1328 3.1427 6.7838 6.8148 6.8213 6.8248 7.1699 7.1718 7.1772 7.2035 8.1998 8.2014 8.2063 8.2093 8.7047 8.7085 8.7101 8.7172 k = 0.4643 0.5000 0.2703 ( 14076 PWs) bands (ev): -12.0681 -12.0680 -12.0679 -12.0678 -11.8066 -11.8065 -11.8040 -11.8040 -11.7659 -11.7657 -11.7622 -11.7621 -11.7249 -11.7247 -11.7238 -11.7236 -3.0881 -3.0866 -3.0864 -3.0861 -1.9467 -1.9461 -1.9437 -1.9435 -1.3123 -1.3066 -1.2984 -1.2943 -1.1264 -1.1202 -1.1157 -1.1074 -0.4231 -0.4112 -0.4083 -0.3975 -0.0140 -0.0026 0.0187 0.0300 0.1355 0.1523 0.1713 0.1813 0.2369 0.2507 0.2779 0.2906 0.6890 0.7232 0.7245 0.7604 0.8277 0.8439 0.8457 0.8675 0.9762 0.9777 1.0110 1.0169 1.1528 1.1627 1.1758 1.1827 2.5863 2.5887 2.5895 2.5934 2.7045 2.7081 2.7096 2.7138 2.9841 2.9904 3.0023 3.0055 3.0095 3.0168 3.0338 3.0403 3.1259 3.1295 3.1325 3.1389 6.7962 6.8173 6.8178 6.8204 7.1628 7.1646 7.1685 7.1846 8.1971 8.1982 8.1999 8.2018 8.7133 8.7157 8.7160 8.7204 k = 0.4821 0.5000 0.2703 ( 14080 PWs) bands (ev): -12.0669 -12.0668 -12.0668 -12.0668 -11.8059 -11.8059 -11.8053 -11.8053 -11.7642 -11.7641 -11.7633 -11.7632 -11.7255 -11.7255 -11.7253 -11.7251 -3.0882 -3.0877 -3.0875 -3.0874 -1.9484 -1.9482 -1.9469 -1.9469 -1.3092 -1.3066 -1.3025 -1.3003 -1.1247 -1.1213 -1.1194 -1.1154 -0.4145 -0.4087 -0.4072 -0.4017 -0.0004 0.0055 0.0160 0.0218 0.1504 0.1589 0.1681 0.1747 0.2490 0.2565 0.2698 0.2768 0.7079 0.7255 0.7261 0.7443 0.8379 0.8472 0.8478 0.8584 0.9874 0.9874 1.0052 1.0071 1.1596 1.1643 1.1711 1.1751 2.5883 2.5897 2.5900 2.5918 2.7071 2.7090 2.7097 2.7118 2.9914 2.9943 3.0004 3.0025 3.0175 3.0211 3.0295 3.0329 3.1285 3.1307 3.1322 3.1351 6.8069 6.8151 6.8160 6.8189 7.1588 7.1617 7.1635 7.1702 8.1955 8.1960 8.1961 8.1970 8.7188 8.7196 8.7203 8.7219 k = 0.5000 0.5000 0.2703 ( 14064 PWs) bands (ev): -12.0664 -12.0664 -12.0664 -12.0664 -11.8057 -11.8057 -11.8057 -11.8057 -11.7636 -11.7636 -11.7636 -11.7636 -11.7257 -11.7257 -11.7257 -11.7257 -3.0880 -3.0880 -3.0880 -3.0880 -1.9484 -1.9484 -1.9484 -1.9484 -1.3052 -1.3052 -1.3052 -1.3052 -1.1211 -1.1211 -1.1211 -1.1211 -0.4074 -0.4074 -0.4074 -0.4074 0.0116 0.0116 0.0116 0.0116 0.1641 0.1641 0.1641 0.1641 0.2627 0.2627 0.2627 0.2627 0.7265 0.7265 0.7265 0.7265 0.8484 0.8484 0.8484 0.8484 0.9972 0.9972 0.9972 0.9972 1.1672 1.1672 1.1672 1.1672 2.5901 2.5901 2.5901 2.5901 2.7095 2.7095 2.7095 2.7095 2.9977 2.9977 2.9977 2.9977 3.0253 3.0253 3.0253 3.0253 3.1316 3.1316 3.1316 3.1316 6.8147 6.8147 6.8147 6.8147 7.1613 7.1613 7.1613 7.1613 8.1951 8.1951 8.1951 8.1951 8.7214 8.7214 8.7214 8.7214 k = 0.5000 0.5000 0.2703 ( 14064 PWs) bands (ev): -12.0664 -12.0664 -12.0664 -12.0664 -11.8057 -11.8057 -11.8057 -11.8057 -11.7636 -11.7636 -11.7636 -11.7636 -11.7257 -11.7257 -11.7257 -11.7257 -3.0880 -3.0880 -3.0880 -3.0880 -1.9484 -1.9484 -1.9484 -1.9484 -1.3052 -1.3052 -1.3052 -1.3052 -1.1211 -1.1211 -1.1211 -1.1211 -0.4074 -0.4074 -0.4074 -0.4074 0.0116 0.0116 0.0116 0.0116 0.1641 0.1641 0.1641 0.1641 0.2627 0.2627 0.2627 0.2627 0.7265 0.7265 0.7265 0.7265 0.8484 0.8484 0.8484 0.8484 0.9972 0.9972 0.9972 0.9972 1.1672 1.1672 1.1672 1.1672 2.5901 2.5901 2.5901 2.5901 2.7095 2.7095 2.7095 2.7095 2.9977 2.9977 2.9977 2.9977 3.0253 3.0253 3.0253 3.0253 3.1316 3.1316 3.1316 3.1316 6.8147 6.8147 6.8147 6.8147 7.1613 7.1613 7.1613 7.1613 8.1951 8.1951 8.1951 8.1951 8.7214 8.7214 8.7214 8.7214 k = 0.4872 0.4872 0.2703 ( 14080 PWs) bands (ev): -12.0668 -12.0668 -12.0668 -12.0668 -11.8056 -11.8056 -11.8056 -11.8056 -11.7638 -11.7638 -11.7637 -11.7637 -11.7254 -11.7254 -11.7253 -11.7253 -3.0880 -3.0880 -3.0874 -3.0874 -1.9483 -1.9483 -1.9468 -1.9468 -1.3081 -1.3081 -1.3011 -1.3011 -1.1235 -1.1235 -1.1168 -1.1168 -0.4127 -0.4127 -0.4035 -0.4035 0.0019 0.0019 0.0195 0.0195 0.1537 0.1537 0.1723 0.1723 0.2521 0.2521 0.2740 0.2740 0.7128 0.7128 0.7390 0.7390 0.8405 0.8405 0.8552 0.8552 0.9872 0.9872 1.0062 1.0062 1.1615 1.1615 1.1736 1.1736 2.5887 2.5887 2.5912 2.5912 2.7077 2.7077 2.7111 2.7111 2.9926 2.9926 3.0015 3.0015 3.0191 3.0191 3.0315 3.0315 3.1292 3.1292 3.1341 3.1341 6.8099 6.8099 6.8185 6.8185 7.1595 7.1595 7.1678 7.1678 8.1958 8.1958 8.1966 8.1966 8.7190 8.7190 8.7212 8.7212 k = 0.4744 0.4744 0.2703 ( 14082 PWs) bands (ev): -12.0680 -12.0680 -12.0680 -12.0680 -11.8053 -11.8053 -11.8052 -11.8052 -11.7641 -11.7641 -11.7639 -11.7639 -11.7243 -11.7243 -11.7241 -11.7241 -3.0874 -3.0874 -3.0862 -3.0862 -1.9463 -1.9463 -1.9435 -1.9435 -1.3098 -1.3098 -1.2959 -1.2959 -1.1240 -1.1240 -1.1106 -1.1106 -0.4192 -0.4192 -0.4010 -0.4010 -0.0094 -0.0094 0.0252 0.0252 0.1421 0.1421 0.1770 0.1770 0.2437 0.2437 0.2852 0.2852 0.6984 0.6984 0.7501 0.7501 0.8318 0.8318 0.8603 0.8603 0.9770 0.9770 1.0139 1.0139 1.1568 1.1568 1.1804 1.1804 2.5870 2.5870 2.5919 2.5919 2.7056 2.7056 2.7123 2.7123 2.9867 2.9867 3.0027 3.0027 3.0146 3.0146 3.0372 3.0372 3.1270 3.1270 3.1365 3.1365 6.8043 6.8043 6.8211 6.8211 7.1623 7.1623 7.1785 7.1785 8.1985 8.1985 8.2001 8.2001 8.7140 8.7140 8.7183 8.7183 k = 0.4615 0.4615 0.2703 ( 14074 PWs) bands (ev): -12.0700 -12.0700 -12.0699 -12.0699 -11.8048 -11.8048 -11.8047 -11.8047 -11.7645 -11.7645 -11.7642 -11.7642 -11.7226 -11.7226 -11.7223 -11.7223 -3.0863 -3.0863 -3.0844 -3.0844 -1.9427 -1.9427 -1.9384 -1.9384 -1.3103 -1.3103 -1.2895 -1.2895 -1.1224 -1.1224 -1.1025 -1.1025 -0.4270 -0.4270 -0.3999 -0.3999 -0.0220 -0.0220 0.0283 0.0283 0.1299 0.1299 0.1767 0.1767 0.2394 0.2394 0.2958 0.2958 0.6832 0.6832 0.7589 0.7589 0.8229 0.8229 0.8636 0.8636 0.9671 0.9671 1.0199 1.0199 1.1535 1.1535 1.1872 1.1872 2.5850 2.5850 2.5922 2.5922 2.7034 2.7034 2.7132 2.7132 2.9800 2.9800 2.9984 2.9984 3.0146 3.0146 3.0423 3.0423 3.1251 3.1251 3.1388 3.1388 6.7983 6.7983 6.8223 6.8223 7.1698 7.1698 7.1929 7.1929 8.2031 8.2031 8.2054 8.2054 8.7064 8.7064 8.7127 8.7127 k = 0.4487 0.4487 0.2703 ( 14078 PWs) bands (ev): -12.0727 -12.0727 -12.0726 -12.0726 -11.8041 -11.8041 -11.8039 -11.8039 -11.7649 -11.7649 -11.7645 -11.7645 -11.7203 -11.7203 -11.7200 -11.7200 -3.0846 -3.0846 -3.0821 -3.0821 -1.9373 -1.9373 -1.9316 -1.9316 -1.3095 -1.3095 -1.2821 -1.2821 -1.1189 -1.1189 -1.0925 -1.0925 -0.4357 -0.4357 -0.4004 -0.4004 -0.0360 -0.0360 0.0280 0.0280 0.1179 0.1179 0.1712 0.1712 0.2398 0.2398 0.3054 0.3054 0.6675 0.6675 0.7639 0.7639 0.8153 0.8153 0.8647 0.8647 0.9581 0.9581 1.0238 1.0238 1.1520 1.1520 1.1940 1.1940 2.5827 2.5827 2.5922 2.5922 2.7009 2.7009 2.7138 2.7138 2.9727 2.9727 2.9912 2.9912 3.0167 3.0167 3.0468 3.0468 3.1236 3.1236 3.1408 3.1408 6.7920 6.7920 6.8219 6.8219 7.1814 7.1814 7.2103 7.2103 8.2092 8.2092 8.2123 8.2123 8.6964 8.6964 8.7045 8.7045 k = 0.4359 0.4359 0.2703 ( 14070 PWs) bands (ev): -12.0762 -12.0762 -12.0761 -12.0761 -11.8031 -11.8031 -11.8030 -11.8030 -11.7651 -11.7651 -11.7647 -11.7647 -11.7177 -11.7177 -11.7173 -11.7173 -3.0823 -3.0823 -3.0793 -3.0793 -1.9303 -1.9303 -1.9232 -1.9232 -1.3075 -1.3075 -1.2738 -1.2738 -1.1134 -1.1134 -1.0808 -1.0808 -0.4454 -0.4454 -0.4024 -0.4024 -0.0512 -0.0512 0.0236 0.0236 0.1066 0.1066 0.1624 0.1624 0.2433 0.2433 0.3138 0.3138 0.6512 0.6512 0.7627 0.7627 0.8110 0.8110 0.8637 0.8637 0.9505 0.9505 1.0258 1.0258 1.1523 1.1523 1.2007 1.2007 2.5801 2.5801 2.5918 2.5918 2.6984 2.6984 2.7139 2.7139 2.9647 2.9647 2.9830 2.9830 3.0191 3.0191 3.0506 3.0506 3.1226 3.1226 3.1427 3.1427 6.7856 6.7856 6.8202 6.8202 7.1966 7.1966 7.2301 7.2301 8.2166 8.2166 8.2202 8.2202 8.6839 8.6839 8.6937 8.6937 k = 0.4231 0.4231 0.2703 ( 14044 PWs) bands (ev): -12.0804 -12.0804 -12.0803 -12.0803 -11.8020 -11.8020 -11.8018 -11.8018 -11.7650 -11.7650 -11.7646 -11.7646 -11.7149 -11.7149 -11.7144 -11.7144 -3.0796 -3.0796 -3.0761 -3.0761 -1.9217 -1.9217 -1.9132 -1.9132 -1.3043 -1.3043 -1.2646 -1.2646 -1.1060 -1.1060 -1.0674 -1.0674 -0.4558 -0.4558 -0.4057 -0.4057 -0.0676 -0.0676 0.0147 0.0147 0.0963 0.0963 0.1525 0.1525 0.2482 0.2482 0.3210 0.3210 0.6344 0.6344 0.7545 0.7545 0.8101 0.8101 0.8611 0.8611 0.9446 0.9446 1.0262 1.0262 1.1545 1.1545 1.2071 1.2071 2.5773 2.5773 2.5910 2.5910 2.6958 2.6958 2.7137 2.7137 2.9562 2.9562 2.9745 2.9745 3.0215 3.0215 3.0538 3.0538 3.1220 3.1220 3.1442 3.1442 6.7791 6.7791 6.8170 6.8170 7.2144 7.2144 7.2514 7.2514 8.2246 8.2246 8.2287 8.2287 8.6692 8.6692 8.6803 8.6803 k = 0.4103 0.4103 0.2703 ( 14044 PWs) bands (ev): -12.0853 -12.0853 -12.0852 -12.0852 -11.8006 -11.8006 -11.8004 -11.8004 -11.7646 -11.7646 -11.7641 -11.7641 -11.7119 -11.7119 -11.7114 -11.7114 -3.0765 -3.0765 -3.0725 -3.0725 -1.9116 -1.9116 -1.9017 -1.9017 -1.2999 -1.2999 -1.2548 -1.2548 -1.0965 -1.0965 -1.0524 -1.0524 -0.4669 -0.4669 -0.4104 -0.4104 -0.0852 -0.0852 0.0016 0.0016 0.0868 0.0868 0.1431 0.1431 0.2535 0.2535 0.3268 0.3268 0.6172 0.6172 0.7411 0.7411 0.8102 0.8102 0.8582 0.8582 0.9400 0.9400 1.0253 1.0253 1.1581 1.1581 1.2132 1.2132 2.5743 2.5743 2.5898 2.5898 2.6932 2.6932 2.7131 2.7131 2.9474 2.9474 2.9656 2.9656 3.0236 3.0236 3.0564 3.0564 3.1219 3.1219 3.1455 3.1455 6.7725 6.7725 6.8126 6.8126 7.2339 7.2339 7.2733 7.2733 8.2326 8.2326 8.2370 8.2370 8.6525 8.6525 8.6646 8.6646 k = 0.3974 0.3974 0.2703 ( 14054 PWs) bands (ev): -12.0909 -12.0909 -12.0907 -12.0907 -11.7990 -11.7990 -11.7987 -11.7987 -11.7638 -11.7638 -11.7633 -11.7633 -11.7088 -11.7088 -11.7083 -11.7083 -3.0731 -3.0731 -3.0686 -3.0686 -1.9000 -1.9000 -1.8888 -1.8888 -1.2945 -1.2945 -1.2443 -1.2443 -1.0852 -1.0852 -1.0359 -1.0359 -0.4786 -0.4786 -0.4163 -0.4163 -0.1040 -0.1040 -0.0149 -0.0149 0.0774 0.0774 0.1349 0.1349 0.2586 0.2586 0.3313 0.3313 0.5996 0.5996 0.7245 0.7245 0.8088 0.8088 0.8561 0.8561 0.9363 0.9363 1.0238 1.0238 1.1627 1.1627 1.2189 1.2189 2.5710 2.5710 2.5882 2.5882 2.6906 2.6906 2.7120 2.7120 2.9385 2.9385 2.9567 2.9567 3.0254 3.0254 3.0584 3.0584 3.1223 3.1223 3.1464 3.1464 6.7659 6.7659 6.8071 6.8071 7.2541 7.2541 7.2950 7.2950 8.2398 8.2398 8.2443 8.2443 8.6340 8.6340 8.6467 8.6467 k = 0.3846 0.3846 0.2703 ( 14052 PWs) bands (ev): -12.0971 -12.0971 -12.0969 -12.0969 -11.7972 -11.7972 -11.7969 -11.7969 -11.7625 -11.7625 -11.7620 -11.7620 -11.7058 -11.7058 -11.7053 -11.7053 -3.0694 -3.0694 -3.0645 -3.0645 -1.8872 -1.8872 -1.8746 -1.8746 -1.2879 -1.2879 -1.2333 -1.2333 -1.0721 -1.0721 -1.0180 -1.0180 -0.4906 -0.4906 -0.4233 -0.4233 -0.1239 -0.1239 -0.0337 -0.0337 0.0678 0.0678 0.1280 0.1280 0.2632 0.2632 0.3343 0.3343 0.5817 0.5817 0.7056 0.7056 0.8051 0.8051 0.8553 0.8553 0.9333 0.9333 1.0220 1.0220 1.1680 1.1680 1.2243 1.2243 2.5676 2.5676 2.5863 2.5863 2.6879 2.6879 2.7105 2.7105 2.9295 2.9295 2.9477 2.9477 3.0271 3.0271 3.0601 3.0601 3.1230 3.1230 3.1471 3.1471 6.7589 6.7589 6.8004 6.8004 7.2741 7.2741 7.3157 7.3157 8.2455 8.2455 8.2497 8.2497 8.6139 8.6139 8.6270 8.6270 k = 0.3718 0.3718 0.2703 ( 14058 PWs) bands (ev): -12.1039 -12.1039 -12.1036 -12.1036 -11.7951 -11.7951 -11.7947 -11.7947 -11.7609 -11.7609 -11.7604 -11.7604 -11.7028 -11.7028 -11.7023 -11.7023 -3.0655 -3.0655 -3.0603 -3.0603 -1.8730 -1.8730 -1.8593 -1.8593 -1.2804 -1.2804 -1.2219 -1.2219 -1.0573 -1.0573 -0.9989 -0.9989 -0.5031 -0.5031 -0.4313 -0.4313 -0.1446 -0.1446 -0.0538 -0.0538 0.0581 0.0581 0.1222 0.1222 0.2670 0.2670 0.3359 0.3359 0.5637 0.5637 0.6853 0.6853 0.7995 0.7995 0.8555 0.8555 0.9308 0.9308 1.0203 1.0203 1.1735 1.1735 1.2293 1.2293 2.5641 2.5641 2.5841 2.5841 2.6853 2.6853 2.7087 2.7087 2.9207 2.9207 2.9389 2.9389 3.0286 3.0286 3.0613 3.0613 3.1239 3.1239 3.1476 3.1476 6.7517 6.7517 6.7928 6.7928 7.2929 7.2929 7.3346 7.3346 8.2487 8.2487 8.2524 8.2524 8.5924 8.5924 8.6055 8.6055 k = 0.3590 0.3590 0.2703 ( 14050 PWs) bands (ev): -12.1111 -12.1111 -12.1109 -12.1109 -11.7927 -11.7927 -11.7924 -11.7924 -11.7589 -11.7589 -11.7584 -11.7584 -11.7000 -11.7000 -11.6994 -11.6994 -3.0615 -3.0615 -3.0561 -3.0561 -1.8577 -1.8577 -1.8428 -1.8428 -1.2719 -1.2719 -1.2102 -1.2102 -1.0411 -1.0411 -0.9789 -0.9789 -0.5159 -0.5159 -0.4402 -0.4402 -0.1659 -0.1659 -0.0746 -0.0746 0.0484 0.0484 0.1169 0.1169 0.2699 0.2699 0.3361 0.3361 0.5455 0.5455 0.6639 0.6639 0.7929 0.7929 0.8558 0.8558 0.9288 0.9288 1.0189 1.0189 1.1789 1.1789 1.2339 1.2339 2.5604 2.5604 2.5815 2.5815 2.6826 2.6826 2.7064 2.7064 2.9123 2.9123 2.9303 2.9303 3.0300 3.0300 3.0622 3.0622 3.1250 3.1250 3.1478 3.1478 6.7442 6.7442 6.7842 6.7842 7.3098 7.3098 7.3510 7.3510 8.2484 8.2484 8.2518 8.2518 8.5694 8.5694 8.5824 8.5824 k = 0.3462 0.3462 0.2703 ( 14062 PWs) bands (ev): -12.1188 -12.1188 -12.1186 -12.1186 -11.7901 -11.7901 -11.7897 -11.7897 -11.7565 -11.7565 -11.7560 -11.7560 -11.6973 -11.6973 -11.6967 -11.6967 -3.0575 -3.0575 -3.0519 -3.0519 -1.8414 -1.8414 -1.8253 -1.8253 -1.2625 -1.2625 -1.1982 -1.1982 -1.0236 -1.0236 -0.9581 -0.9581 -0.5291 -0.5291 -0.4498 -0.4498 -0.1873 -0.1873 -0.0954 -0.0954 0.0390 0.0390 0.1119 0.1119 0.2717 0.2717 0.3350 0.3350 0.5276 0.5276 0.6420 0.6420 0.7861 0.7861 0.8557 0.8557 0.9273 0.9273 1.0177 1.0177 1.1840 1.1840 1.2380 1.2380 2.5567 2.5567 2.5788 2.5788 2.6799 2.6799 2.7038 2.7038 2.9042 2.9042 2.9220 2.9220 3.0313 3.0313 3.0628 3.0628 3.1262 3.1262 3.1478 3.1478 6.7361 6.7361 6.7747 6.7747 7.3242 7.3242 7.3645 7.3645 8.2436 8.2436 8.2474 8.2474 8.5445 8.5445 8.5575 8.5575 k = 0.3333 0.3333 0.2703 ( 14046 PWs) bands (ev): -12.1270 -12.1270 -12.1267 -12.1267 -11.7872 -11.7872 -11.7868 -11.7868 -11.7537 -11.7537 -11.7532 -11.7532 -11.6947 -11.6947 -11.6942 -11.6942 -3.0536 -3.0536 -3.0479 -3.0479 -1.8241 -1.8241 -1.8070 -1.8070 -1.2524 -1.2524 -1.1860 -1.1860 -1.0052 -1.0052 -0.9369 -0.9369 -0.5427 -0.5427 -0.4602 -0.4602 -0.2084 -0.2084 -0.1153 -0.1153 0.0302 0.0302 0.1068 0.1068 0.2722 0.2722 0.3326 0.3326 0.5101 0.5101 0.6200 0.6200 0.7794 0.7794 0.8549 0.8549 0.9266 0.9266 1.0167 1.0167 1.1885 1.1885 1.2416 1.2416 2.5530 2.5530 2.5758 2.5758 2.6770 2.6770 2.7010 2.7010 2.8966 2.8966 2.9142 2.9142 3.0324 3.0324 3.0632 3.0632 3.1273 3.1273 3.1477 3.1477 6.7275 6.7275 6.7643 6.7643 7.3356 7.3356 7.3747 7.3747 8.2338 8.2338 8.2391 8.2391 8.5173 8.5173 8.5303 8.5303 k = 0.3205 0.3205 0.2703 ( 14048 PWs) bands (ev): -12.1354 -12.1354 -12.1351 -12.1351 -11.7841 -11.7841 -11.7837 -11.7837 -11.7507 -11.7507 -11.7502 -11.7502 -11.6924 -11.6924 -11.6918 -11.6918 -3.0499 -3.0499 -3.0441 -3.0441 -1.8060 -1.8060 -1.7880 -1.7880 -1.2415 -1.2415 -1.1738 -1.1738 -0.9862 -0.9862 -0.9157 -0.9157 -0.5567 -0.5567 -0.4713 -0.4713 -0.2286 -0.2286 -0.1340 -0.1340 0.0219 0.0219 0.1015 0.1015 0.2712 0.2712 0.3291 0.3291 0.4933 0.4933 0.5983 0.5983 0.7731 0.7731 0.8534 0.8534 0.9266 0.9266 1.0159 1.0159 1.1924 1.1924 1.2445 1.2445 2.5493 2.5493 2.5726 2.5726 2.6740 2.6740 2.6979 2.6979 2.8895 2.8895 2.9071 2.9071 3.0334 3.0334 3.0633 3.0633 3.1285 3.1285 3.1474 3.1474 6.7182 6.7182 6.7529 6.7529 7.3439 7.3439 7.3815 7.3815 8.2192 8.2192 8.2265 8.2265 8.4872 8.4872 8.5004 8.5004 k = 0.3077 0.3077 0.2703 ( 14048 PWs) bands (ev): -12.1441 -12.1441 -12.1438 -12.1438 -11.7807 -11.7807 -11.7803 -11.7803 -11.7474 -11.7474 -11.7469 -11.7469 -11.6902 -11.6902 -11.6896 -11.6896 -3.0465 -3.0465 -3.0407 -3.0407 -1.7870 -1.7870 -1.7683 -1.7683 -1.2300 -1.2300 -1.1615 -1.1615 -0.9670 -0.9670 -0.8949 -0.8949 -0.5710 -0.5710 -0.4833 -0.4833 -0.2469 -0.2469 -0.1508 -0.1508 0.0143 0.0143 0.0959 0.0959 0.2685 0.2685 0.3246 0.3246 0.4775 0.4775 0.5774 0.5774 0.7674 0.7674 0.8513 0.8513 0.9271 0.9271 1.0152 1.0152 1.1955 1.1955 1.2468 1.2468 2.5457 2.5457 2.5694 2.5694 2.6707 2.6707 2.6947 2.6947 2.8831 2.8831 2.9007 2.9007 3.0344 3.0344 3.0632 3.0632 3.1294 3.1294 3.1470 3.1470 6.7082 6.7082 6.7407 6.7407 7.3491 7.3491 7.3850 7.3850 8.2003 8.2003 8.2097 8.2097 8.4536 8.4536 8.4673 8.4673 k = 0.2949 0.2949 0.2703 ( 14052 PWs) bands (ev): -12.1530 -12.1530 -12.1527 -12.1527 -11.7772 -11.7772 -11.7768 -11.7768 -11.7439 -11.7439 -11.7434 -11.7434 -11.6882 -11.6882 -11.6876 -11.6876 -3.0435 -3.0435 -3.0377 -3.0377 -1.7675 -1.7675 -1.7480 -1.7480 -1.2180 -1.2180 -1.1491 -1.1491 -0.9481 -0.9481 -0.8750 -0.8750 -0.5858 -0.5858 -0.4963 -0.4963 -0.2628 -0.2628 -0.1652 -0.1652 0.0073 0.0073 0.0899 0.0899 0.2642 0.2642 0.3192 0.3192 0.4630 0.4630 0.5578 0.5578 0.7622 0.7622 0.8488 0.8488 0.9282 0.9282 1.0145 1.0145 1.1976 1.1976 1.2484 1.2484 2.5423 2.5423 2.5661 2.5661 2.6671 2.6671 2.6916 2.6916 2.8772 2.8772 2.8951 2.8951 3.0352 3.0352 3.0629 3.0629 3.1302 3.1302 3.1464 3.1464 6.6974 6.6974 6.7275 6.7275 7.3513 7.3513 7.3856 7.3856 8.1776 8.1776 8.1890 8.1890 8.4166 8.4166 8.4309 8.4309 k = 0.2821 0.2821 0.2703 ( 14036 PWs) bands (ev): -12.1620 -12.1620 -12.1618 -12.1618 -11.7734 -11.7734 -11.7730 -11.7730 -11.7403 -11.7403 -11.7398 -11.7398 -11.6864 -11.6864 -11.6858 -11.6858 -3.0409 -3.0409 -3.0352 -3.0352 -1.7473 -1.7473 -1.7273 -1.7273 -1.2056 -1.2056 -1.1368 -1.1368 -0.9301 -0.9301 -0.8567 -0.8567 -0.6006 -0.6006 -0.5103 -0.5103 -0.2754 -0.2754 -0.1769 -0.1769 0.0008 0.0008 0.0835 0.0835 0.2582 0.2582 0.3132 0.3132 0.4500 0.4500 0.5398 0.5398 0.7576 0.7576 0.8462 0.8462 0.9298 0.9298 1.0140 1.0140 1.1987 1.1987 1.2491 1.2491 2.5390 2.5390 2.5627 2.5627 2.6631 2.6631 2.6885 2.6885 2.8720 2.8720 2.8905 2.8905 3.0359 3.0359 3.0624 3.0624 3.1308 3.1308 3.1457 3.1457 6.6857 6.6857 6.7135 6.7135 7.3509 7.3509 7.3836 7.3836 8.1520 8.1520 8.1652 8.1652 8.3765 8.3765 8.3913 8.3913 k = 0.2692 0.2692 0.2703 ( 14028 PWs) bands (ev): -12.1711 -12.1711 -12.1709 -12.1709 -11.7695 -11.7695 -11.7691 -11.7691 -11.7364 -11.7364 -11.7360 -11.7360 -11.6847 -11.6847 -11.6842 -11.6842 -3.0388 -3.0388 -3.0333 -3.0333 -1.7266 -1.7266 -1.7063 -1.7063 -1.1929 -1.1929 -1.1247 -1.1247 -0.9135 -0.9135 -0.8404 -0.8404 -0.6153 -0.6153 -0.5255 -0.5255 -0.2842 -0.2842 -0.1856 -0.1856 -0.0051 -0.0051 0.0768 0.0768 0.2509 0.2509 0.3063 0.3063 0.4388 0.4388 0.5237 0.5237 0.7536 0.7536 0.8436 0.8436 0.9317 0.9317 1.0136 1.0136 1.1988 1.1988 1.2490 1.2490 2.5358 2.5358 2.5594 2.5594 2.6588 2.6588 2.6855 2.6855 2.8675 2.8675 2.8870 2.8870 3.0364 3.0364 3.0616 3.0616 3.1311 3.1311 3.1447 3.1447 6.6731 6.6731 6.6985 6.6985 7.3484 7.3484 7.3795 7.3795 8.1238 8.1238 8.1387 8.1387 8.3337 8.3337 8.3492 8.3492 k = 0.2564 0.2564 0.2703 ( 14026 PWs) bands (ev): -12.1802 -12.1802 -12.1800 -12.1800 -11.7655 -11.7655 -11.7651 -11.7651 -11.7325 -11.7325 -11.7321 -11.7321 -11.6833 -11.6833 -11.6827 -11.6827 -3.0373 -3.0373 -3.0319 -3.0319 -1.7055 -1.7055 -1.6850 -1.6850 -1.1802 -1.1802 -1.1127 -1.1127 -0.8989 -0.8989 -0.8269 -0.8269 -0.6291 -0.6291 -0.5415 -0.5415 -0.2888 -0.2888 -0.1910 -0.1910 -0.0107 -0.0107 0.0698 0.0698 0.2427 0.2427 0.2988 0.2988 0.4293 0.4293 0.5099 0.5099 0.7502 0.7502 0.8413 0.8413 0.9339 0.9339 1.0132 1.0132 1.1978 1.1978 1.2478 1.2478 2.5329 2.5329 2.5560 2.5560 2.6542 2.6542 2.6826 2.6826 2.8637 2.8637 2.8844 2.8844 3.0368 3.0368 3.0607 3.0607 3.1310 3.1310 3.1436 3.1436 6.6596 6.6596 6.6826 6.6826 7.3441 7.3441 7.3739 7.3739 8.0937 8.0937 8.1100 8.1100 8.2891 8.2891 8.3052 8.3052 k = 0.2436 0.2436 0.2703 ( 14016 PWs) bands (ev): -12.1892 -12.1892 -12.1890 -12.1890 -11.7614 -11.7614 -11.7610 -11.7610 -11.7286 -11.7286 -11.7281 -11.7281 -11.6819 -11.6819 -11.6814 -11.6814 -3.0363 -3.0363 -3.0312 -3.0312 -1.6840 -1.6840 -1.6635 -1.6635 -1.1677 -1.1677 -1.1010 -1.1010 -0.8872 -0.8872 -0.8166 -0.8166 -0.6415 -0.6415 -0.5580 -0.5580 -0.2893 -0.2893 -0.1933 -0.1933 -0.0162 -0.0162 0.0627 0.0627 0.2342 0.2342 0.2905 0.2905 0.4218 0.4218 0.4985 0.4985 0.7474 0.7474 0.8392 0.8392 0.9364 0.9364 1.0129 1.0129 1.1955 1.1955 1.2457 1.2457 2.5303 2.5303 2.5528 2.5528 2.6494 2.6494 2.6798 2.6798 2.8608 2.8608 2.8828 2.8828 3.0371 3.0371 3.0596 3.0596 3.1306 3.1306 3.1423 3.1423 6.6450 6.6450 6.6659 6.6659 7.3387 7.3387 7.3672 7.3672 8.0619 8.0619 8.0796 8.0796 8.2437 8.2437 8.2602 8.2602 k = 0.2308 0.2308 0.2703 ( 14004 PWs) bands (ev): -12.1981 -12.1981 -12.1979 -12.1979 -11.7573 -11.7573 -11.7568 -11.7568 -11.7246 -11.7246 -11.7242 -11.7242 -11.6808 -11.6808 -11.6802 -11.6802 -3.0360 -3.0360 -3.0312 -3.0312 -1.6622 -1.6622 -1.6419 -1.6419 -1.1557 -1.1557 -1.0896 -1.0896 -0.8787 -0.8787 -0.8101 -0.8101 -0.6516 -0.6516 -0.5746 -0.5746 -0.2860 -0.2860 -0.1926 -0.1926 -0.0217 -0.0217 0.0556 0.0556 0.2260 0.2260 0.2814 0.2814 0.4162 0.4162 0.4897 0.4897 0.7452 0.7452 0.8374 0.8374 0.9392 0.9392 1.0128 1.0128 1.1922 1.1922 1.2424 1.2424 2.5278 2.5278 2.5496 2.5496 2.6444 2.6444 2.6769 2.6769 2.8587 2.8587 2.8822 2.8822 3.0373 3.0373 3.0584 3.0584 3.1296 3.1296 3.1406 3.1406 6.6293 6.6293 6.6482 6.6482 7.3327 7.3327 7.3601 7.3601 8.0288 8.0288 8.0475 8.0475 8.1983 8.1983 8.2152 8.2152 k = 0.2179 0.2179 0.2703 ( 14028 PWs) bands (ev): -12.2069 -12.2069 -12.2067 -12.2067 -11.7531 -11.7531 -11.7527 -11.7527 -11.7206 -11.7206 -11.7202 -11.7202 -11.6797 -11.6797 -11.6791 -11.6791 -3.0363 -3.0363 -3.0317 -3.0317 -1.6403 -1.6403 -1.6202 -1.6202 -1.1446 -1.1446 -1.0788 -1.0788 -0.8742 -0.8742 -0.8070 -0.8070 -0.6591 -0.6591 -0.5907 -0.5907 -0.2793 -0.2793 -0.1892 -0.1892 -0.0276 -0.0276 0.0488 0.0488 0.2184 0.2184 0.2718 0.2718 0.4127 0.4127 0.4835 0.4835 0.7436 0.7436 0.8361 0.8361 0.9424 0.9424 1.0128 1.0128 1.1876 1.1876 1.2380 1.2380 2.5256 2.5256 2.5465 2.5465 2.6394 2.6394 2.6740 2.6740 2.8576 2.8576 2.8825 2.8825 3.0373 3.0373 3.0571 3.0571 3.1282 3.1282 3.1386 3.1386 6.6126 6.6126 6.6296 6.6296 7.3265 7.3265 7.3530 7.3530 7.9943 7.9943 8.0138 8.0138 8.1541 8.1541 8.1709 8.1709 k = 0.2051 0.2051 0.2703 ( 14020 PWs) bands (ev): -12.2154 -12.2154 -12.2152 -12.2152 -11.7490 -11.7490 -11.7486 -11.7486 -11.7167 -11.7167 -11.7163 -11.7163 -11.6787 -11.6787 -11.6781 -11.6781 -3.0372 -3.0372 -3.0329 -3.0329 -1.6182 -1.6182 -1.5986 -1.5986 -1.1346 -1.1346 -1.0688 -1.0688 -0.8735 -0.8735 -0.8067 -0.8067 -0.6640 -0.6640 -0.6057 -0.6057 -0.2699 -0.2699 -0.1835 -0.1835 -0.0340 -0.0340 0.0425 0.0425 0.2119 0.2119 0.2619 0.2619 0.4113 0.4113 0.4800 0.4800 0.7425 0.7425 0.8351 0.8351 0.9459 0.9459 1.0131 1.0131 1.1818 1.1818 1.2324 1.2324 2.5237 2.5237 2.5435 2.5435 2.6346 2.6346 2.6711 2.6711 2.8577 2.8577 2.8837 2.8837 3.0372 3.0372 3.0556 3.0556 3.1262 3.1262 3.1363 3.1363 6.5948 6.5948 6.6103 6.6103 7.3207 7.3207 7.3465 7.3465 7.9585 7.9585 7.9784 7.9784 8.1122 8.1122 8.1285 8.1285 k = 0.1923 0.1923 0.2703 ( 14020 PWs) bands (ev): -12.2236 -12.2236 -12.2234 -12.2234 -11.7450 -11.7450 -11.7445 -11.7445 -11.7129 -11.7129 -11.7125 -11.7125 -11.6778 -11.6778 -11.6772 -11.6772 -3.0386 -3.0386 -3.0346 -3.0346 -1.5960 -1.5960 -1.5771 -1.5771 -1.1263 -1.1263 -1.0599 -1.0599 -0.8764 -0.8764 -0.8080 -0.8080 -0.6672 -0.6672 -0.6191 -0.6191 -0.2587 -0.2587 -0.1762 -0.1762 -0.0411 -0.0411 0.0370 0.0370 0.2067 0.2067 0.2521 0.2521 0.4120 0.4120 0.4790 0.4790 0.7420 0.7420 0.8345 0.8345 0.9497 0.9497 1.0137 1.0137 1.1749 1.1749 1.2256 1.2256 2.5220 2.5220 2.5407 2.5407 2.6299 2.6299 2.6680 2.6680 2.8588 2.8588 2.8859 2.8859 3.0370 3.0370 3.0541 3.0541 3.1237 3.1237 3.1335 3.1335 6.5760 6.5760 6.5902 6.5902 7.3158 7.3158 7.3409 7.3409 7.9211 7.9211 7.9412 7.9412 8.0733 8.0733 8.0886 8.0886 k = 0.1795 0.1795 0.2703 ( 14014 PWs) bands (ev): -12.2316 -12.2316 -12.2314 -12.2314 -11.7411 -11.7411 -11.7406 -11.7406 -11.7092 -11.7092 -11.7089 -11.7089 -11.6769 -11.6769 -11.6763 -11.6763 -3.0406 -3.0406 -3.0369 -3.0369 -1.5739 -1.5739 -1.5558 -1.5558 -1.1202 -1.1202 -1.0526 -1.0526 -0.8816 -0.8816 -0.8098 -0.8098 -0.6701 -0.6701 -0.6302 -0.6302 -0.2464 -0.2464 -0.1679 -0.1679 -0.0488 -0.0488 0.0322 0.0322 0.2029 0.2029 0.2425 0.2425 0.4150 0.4150 0.4806 0.4806 0.7421 0.7421 0.8343 0.8343 0.9538 0.9538 1.0145 1.0145 1.1669 1.1669 1.2177 1.2177 2.5204 2.5204 2.5379 2.5379 2.6255 2.6255 2.6647 2.6647 2.8612 2.8612 2.8888 2.8888 3.0367 3.0367 3.0525 3.0525 3.1206 3.1206 3.1303 3.1303 6.5564 6.5564 6.5694 6.5694 7.3120 7.3120 7.3367 7.3367 7.8825 7.8825 7.9021 7.9021 8.0382 8.0382 8.0520 8.0520 k = 0.1667 0.1667 0.2703 ( 14000 PWs) bands (ev): -12.2391 -12.2391 -12.2389 -12.2389 -11.7374 -11.7374 -11.7369 -11.7369 -11.7057 -11.7057 -11.7054 -11.7054 -11.6760 -11.6760 -11.6754 -11.6754 -3.0430 -3.0430 -3.0395 -3.0395 -1.5519 -1.5519 -1.5348 -1.5348 -1.1165 -1.1165 -1.0476 -1.0476 -0.8875 -0.8875 -0.8111 -0.8111 -0.6744 -0.6744 -0.6382 -0.6382 -0.2336 -0.2336 -0.1593 -0.1593 -0.0571 -0.0571 0.0280 0.0280 0.2002 0.2002 0.2337 0.2337 0.4203 0.4203 0.4846 0.4846 0.7427 0.7427 0.8344 0.8344 0.9582 0.9582 1.0156 1.0156 1.1577 1.1577 1.2087 1.2087 2.5191 2.5191 2.5354 2.5354 2.6215 2.6215 2.6613 2.6613 2.8647 2.8647 2.8927 2.8927 3.0363 3.0363 3.0509 3.0509 3.1168 3.1168 3.1265 3.1265 6.5360 6.5360 6.5482 6.5482 7.3097 7.3097 7.3341 7.3341 7.8428 7.8428 7.8618 7.8618 8.0070 8.0070 8.0190 8.0190 k = 0.1538 0.1538 0.2703 ( 13992 PWs) bands (ev): -12.2463 -12.2463 -12.2461 -12.2461 -11.7338 -11.7338 -11.7334 -11.7334 -11.7024 -11.7024 -11.7021 -11.7021 -11.6752 -11.6752 -11.6746 -11.6746 -3.0458 -3.0458 -3.0426 -3.0426 -1.5301 -1.5301 -1.5142 -1.5142 -1.1154 -1.1154 -1.0459 -1.0459 -0.8921 -0.8921 -0.8115 -0.8115 -0.6809 -0.6809 -0.6432 -0.6432 -0.2209 -0.2209 -0.1507 -0.1507 -0.0656 -0.0656 0.0242 0.0242 0.1984 0.1984 0.2260 0.2260 0.4280 0.4280 0.4909 0.4909 0.7440 0.7440 0.8348 0.8348 0.9629 0.9629 1.0170 1.0170 1.1476 1.1476 1.1986 1.1986 2.5179 2.5179 2.5329 2.5329 2.6178 2.6178 2.6577 2.6577 2.8694 2.8694 2.8972 2.8972 3.0358 3.0358 3.0493 3.0493 3.1123 3.1123 3.1222 3.1222 6.5152 6.5152 6.5266 6.5266 7.3093 7.3093 7.3336 7.3336 7.8027 7.8027 7.8208 7.8208 7.9795 7.9795 7.9895 7.9895 k = 0.1410 0.1410 0.2703 ( 13988 PWs) bands (ev): -12.2530 -12.2530 -12.2528 -12.2528 -11.7305 -11.7305 -11.7301 -11.7301 -11.6994 -11.6994 -11.6990 -11.6990 -11.6743 -11.6743 -11.6737 -11.6737 -3.0488 -3.0488 -3.0459 -3.0459 -1.5087 -1.5087 -1.4941 -1.4941 -1.1168 -1.1168 -1.0479 -1.0479 -0.8942 -0.8942 -0.8106 -0.8106 -0.6890 -0.6890 -0.6460 -0.6460 -0.2088 -0.2088 -0.1428 -0.1428 -0.0741 -0.0741 0.0203 0.0203 0.1971 0.1971 0.2199 0.2199 0.4380 0.4380 0.4992 0.4992 0.7459 0.7459 0.8354 0.8354 0.9678 0.9678 1.0187 1.0187 1.1365 1.1365 1.1875 1.1875 2.5169 2.5169 2.5306 2.5306 2.6147 2.6147 2.6539 2.6539 2.8752 2.8752 2.9025 2.9025 3.0351 3.0351 3.0478 3.0478 3.1072 3.1072 3.1174 3.1174 6.4941 6.4941 6.5049 6.5049 7.3109 7.3109 7.3352 7.3352 7.7629 7.7629 7.7801 7.7801 7.9552 7.9552 7.9635 7.9635 k = 0.1282 0.1282 0.2703 ( 14014 PWs) bands (ev): -12.2593 -12.2593 -12.2591 -12.2591 -11.7275 -11.7275 -11.7270 -11.7270 -11.6965 -11.6965 -11.6962 -11.6962 -11.6733 -11.6733 -11.6727 -11.6727 -3.0520 -3.0520 -3.0493 -3.0493 -1.4877 -1.4877 -1.4746 -1.4746 -1.1205 -1.1205 -1.0540 -1.0540 -0.8932 -0.8932 -0.8083 -0.8083 -0.6978 -0.6978 -0.6480 -0.6480 -0.1977 -0.1977 -0.1357 -0.1357 -0.0823 -0.0823 0.0159 0.0159 0.1958 0.1958 0.2157 0.2157 0.4502 0.4502 0.5094 0.5094 0.7486 0.7486 0.8363 0.8363 0.9728 0.9728 1.0205 1.0205 1.1247 1.1247 1.1755 1.1755 2.5159 2.5159 2.5283 2.5283 2.6120 2.6120 2.6501 2.6501 2.8820 2.8820 2.9085 2.9085 3.0343 3.0343 3.0463 3.0463 3.1014 3.1014 3.1120 3.1120 6.4732 6.4732 6.4834 6.4834 7.3148 7.3148 7.3392 7.3392 7.7240 7.7240 7.7405 7.7405 7.9337 7.9337 7.9405 7.9405 k = 0.1154 0.1154 0.2703 ( 14004 PWs) bands (ev): -12.2650 -12.2650 -12.2649 -12.2649 -11.7247 -11.7247 -11.7243 -11.7243 -11.6940 -11.6940 -11.6937 -11.6937 -11.6723 -11.6723 -11.6718 -11.6718 -3.0553 -3.0553 -3.0529 -3.0529 -1.4673 -1.4673 -1.4558 -1.4558 -1.1261 -1.1261 -1.0633 -1.0633 -0.8892 -0.8892 -0.8048 -0.8048 -0.7066 -0.7066 -0.6500 -0.6500 -0.1877 -0.1877 -0.1295 -0.1295 -0.0899 -0.0899 0.0109 0.0109 0.1944 0.1944 0.2135 0.2135 0.4644 0.4644 0.5210 0.5210 0.7520 0.7520 0.8372 0.8372 0.9777 0.9777 1.0225 1.0225 1.1124 1.1124 1.1629 1.1629 2.5151 2.5151 2.5263 2.5263 2.6099 2.6099 2.6461 2.6461 2.8899 2.8899 2.9152 2.9152 3.0334 3.0334 3.0450 3.0450 3.0949 3.0949 3.1061 3.1061 6.4528 6.4528 6.4623 6.4623 7.3211 7.3211 7.3457 7.3457 7.6870 7.6870 7.7027 7.7027 7.9143 7.9143 7.9203 7.9203 k = 0.1026 0.1026 0.2703 ( 14004 PWs) bands (ev): -12.2702 -12.2702 -12.2701 -12.2701 -11.7223 -11.7223 -11.7219 -11.7219 -11.6917 -11.6917 -11.6914 -11.6914 -11.6713 -11.6713 -11.6708 -11.6708 -3.0586 -3.0586 -3.0564 -3.0564 -1.4477 -1.4477 -1.4380 -1.4380 -1.1330 -1.1330 -1.0750 -1.0750 -0.8830 -0.8830 -0.8005 -0.8005 -0.7147 -0.7147 -0.6526 -0.6526 -0.1790 -0.1790 -0.1244 -0.1244 -0.0965 -0.0965 0.0049 0.0049 0.1932 0.1932 0.2125 0.2125 0.4800 0.4800 0.5334 0.5334 0.7563 0.7563 0.8383 0.8383 0.9824 0.9824 1.0245 1.0245 1.0999 1.0999 1.1497 1.1497 2.5144 2.5144 2.5243 2.5243 2.6084 2.6084 2.6422 2.6422 2.8986 2.8986 2.9223 2.9223 3.0324 3.0324 3.0437 3.0437 3.0879 3.0879 3.0999 3.0999 6.4332 6.4332 6.4420 6.4420 7.3299 7.3299 7.3547 7.3547 7.6524 7.6524 7.6675 7.6675 7.8956 7.8956 7.9025 7.9025 k = 0.0897 0.0897 0.2703 ( 14002 PWs) bands (ev): -12.2749 -12.2749 -12.2748 -12.2748 -11.7202 -11.7202 -11.7198 -11.7198 -11.6897 -11.6897 -11.6895 -11.6895 -11.6703 -11.6703 -11.6698 -11.6698 -3.0617 -3.0617 -3.0598 -3.0598 -1.4291 -1.4291 -1.4212 -1.4212 -1.1406 -1.1406 -1.0880 -1.0880 -0.8755 -0.8755 -0.7962 -0.7962 -0.7216 -0.7216 -0.6557 -0.6557 -0.1715 -0.1715 -0.1207 -0.1207 -0.1015 -0.1015 -0.0021 -0.0021 0.1927 0.1927 0.2122 0.2122 0.4967 0.4967 0.5460 0.5460 0.7616 0.7616 0.8394 0.8394 0.9866 0.9866 1.0262 1.0262 1.0876 1.0876 1.1364 1.1364 2.5138 2.5138 2.5225 2.5225 2.6074 2.6074 2.6383 2.6383 2.9080 2.9080 2.9299 2.9299 3.0311 3.0311 3.0425 3.0425 3.0804 3.0804 3.0933 3.0933 6.4148 6.4148 6.4228 6.4228 7.3412 7.3412 7.3662 7.3662 7.6209 7.6209 7.6356 7.6356 7.8734 7.8734 7.8856 7.8856 k = 0.0769 0.0769 0.2703 ( 14014 PWs) bands (ev): -12.2790 -12.2790 -12.2789 -12.2789 -11.7183 -11.7183 -11.7180 -11.7180 -11.6880 -11.6880 -11.6878 -11.6878 -11.6692 -11.6692 -11.6688 -11.6688 -3.0646 -3.0646 -3.0629 -3.0629 -1.4119 -1.4119 -1.4057 -1.4057 -1.1484 -1.1484 -1.1017 -1.1017 -0.8672 -0.8672 -0.7927 -0.7927 -0.7263 -0.7263 -0.6597 -0.6597 -0.1653 -0.1653 -0.1198 -0.1198 -0.1031 -0.1031 -0.0101 -0.0101 0.1929 0.1929 0.2120 0.2120 0.5137 0.5137 0.5581 0.5581 0.7680 0.7680 0.8403 0.8403 0.9901 0.9901 1.0272 1.0272 1.0763 1.0763 1.1232 1.1232 2.5133 2.5133 2.5208 2.5208 2.6070 2.6070 2.6344 2.6344 2.9180 2.9180 2.9378 2.9378 3.0295 3.0295 3.0413 3.0413 3.0727 3.0727 3.0865 3.0865 6.3980 6.3980 6.4052 6.4052 7.3549 7.3549 7.3800 7.3800 7.5932 7.5932 7.6078 7.6078 7.8386 7.8386 7.8596 7.8596 k = 0.0641 0.0641 0.2703 ( 14008 PWs) bands (ev): -12.2824 -12.2824 -12.2824 -12.2824 -11.7168 -11.7168 -11.7165 -11.7165 -11.6866 -11.6866 -11.6864 -11.6864 -11.6683 -11.6683 -11.6679 -11.6679 -3.0672 -3.0672 -3.0658 -3.0658 -1.3962 -1.3962 -1.3916 -1.3916 -1.1557 -1.1557 -1.1153 -1.1153 -0.8587 -0.8587 -0.7914 -0.7914 -0.7279 -0.7279 -0.6645 -0.6645 -0.1600 -0.1600 -0.1222 -0.1222 -0.1005 -0.1005 -0.0189 -0.0189 0.1940 0.1940 0.2116 0.2116 0.5303 0.5303 0.5691 0.5691 0.7756 0.7756 0.8408 0.8408 0.9927 0.9927 1.0268 1.0268 1.0671 1.0671 1.1105 1.1105 2.5129 2.5129 2.5192 2.5192 2.6071 2.6071 2.6306 2.6306 2.9283 2.9283 2.9458 2.9458 3.0277 3.0277 3.0399 3.0399 3.0652 3.0652 3.0797 3.0797 6.3833 6.3833 6.3894 6.3894 7.3707 7.3707 7.3956 7.3956 7.5699 7.5699 7.5850 7.5850 7.7906 7.7906 7.8131 7.8131 k = 0.0513 0.0513 0.2703 ( 14020 PWs) bands (ev): -12.2853 -12.2853 -12.2852 -12.2852 -11.7156 -11.7156 -11.7153 -11.7153 -11.6854 -11.6854 -11.6852 -11.6852 -11.6674 -11.6674 -11.6671 -11.6671 -3.0694 -3.0694 -3.0683 -3.0683 -1.3825 -1.3825 -1.3791 -1.3791 -1.1619 -1.1619 -1.1283 -1.1283 -0.8501 -0.8501 -0.7929 -0.7929 -0.7261 -0.7261 -0.6700 -0.6700 -0.1555 -0.1555 -0.1260 -0.1260 -0.0956 -0.0956 -0.0282 -0.0282 0.1956 0.1956 0.2109 0.2109 0.5459 0.5459 0.5781 0.5781 0.7844 0.7844 0.8406 0.8406 0.9944 0.9944 1.0241 1.0241 1.0613 1.0613 1.0988 1.0988 2.5127 2.5127 2.5178 2.5178 2.6077 2.6077 2.6270 2.6270 2.9387 2.9387 2.9537 2.9537 3.0255 3.0255 3.0375 3.0375 3.0587 3.0587 3.0732 3.0732 6.3708 6.3708 6.3758 6.3758 7.3879 7.3879 7.4120 7.4120 7.5523 7.5523 7.5684 7.5684 7.7404 7.7404 7.7626 7.7626 k = 0.0385 0.0385 0.2703 ( 14020 PWs) bands (ev): -12.2875 -12.2875 -12.2875 -12.2875 -11.7146 -11.7146 -11.7144 -11.7144 -11.6845 -11.6845 -11.6843 -11.6843 -11.6667 -11.6667 -11.6665 -11.6665 -3.0711 -3.0711 -3.0703 -3.0703 -1.3712 -1.3712 -1.3687 -1.3687 -1.1665 -1.1665 -1.1403 -1.1403 -0.8416 -0.8416 -0.7970 -0.7970 -0.7213 -0.7213 -0.6763 -0.6763 -0.1516 -0.1516 -0.1300 -0.1300 -0.0895 -0.0895 -0.0379 -0.0379 0.1977 0.1977 0.2099 0.2099 0.5598 0.5598 0.5847 0.5847 0.7940 0.7940 0.8391 0.8391 0.9954 0.9954 1.0190 1.0190 1.0594 1.0594 1.0886 1.0886 2.5127 2.5127 2.5165 2.5165 2.6088 2.6088 2.6235 2.6235 2.9489 2.9489 2.9609 2.9609 3.0230 3.0230 3.0335 3.0335 3.0543 3.0543 3.0672 3.0672 6.3609 6.3609 6.3647 6.3647 7.4054 7.4054 7.4272 7.4272 7.5420 7.5420 7.5596 7.5596 7.6926 7.6926 7.7146 7.7146 k = 0.0256 0.0256 0.2703 ( 14028 PWs) bands (ev): -12.2892 -12.2892 -12.2891 -12.2891 -11.7140 -11.7140 -11.7138 -11.7138 -11.6838 -11.6838 -11.6837 -11.6837 -11.6662 -11.6662 -11.6660 -11.6660 -3.0724 -3.0724 -3.0718 -3.0718 -1.3626 -1.3626 -1.3609 -1.3609 -1.1689 -1.1689 -1.1508 -1.1508 -0.8333 -0.8333 -0.8028 -0.8028 -0.7146 -0.7146 -0.6833 -0.6833 -0.1480 -0.1480 -0.1339 -0.1339 -0.0825 -0.0825 -0.0476 -0.0476 0.2000 0.2000 0.2084 0.2084 0.5714 0.5714 0.5884 0.5884 0.8041 0.8041 0.8358 0.8358 0.9965 0.9965 1.0128 1.0128 1.0604 1.0604 1.0799 1.0799 2.5129 2.5129 2.5154 2.5154 2.6104 2.6104 2.6203 2.6203 2.9582 2.9582 2.9669 2.9669 3.0206 3.0206 3.0281 3.0281 3.0527 3.0527 3.0620 3.0620 6.3539 6.3539 6.3565 6.3565 7.4212 7.4212 7.4382 7.4382 7.5419 7.5419 7.5607 7.5607 7.6490 7.6490 7.6707 7.6707 k = 0.0128 0.0128 0.2703 ( 14022 PWs) bands (ev): -12.2901 -12.2901 -12.2901 -12.2901 -11.7136 -11.7136 -11.7135 -11.7135 -11.6834 -11.6834 -11.6833 -11.6833 -11.6658 -11.6658 -11.6658 -11.6658 -3.0731 -3.0731 -3.0728 -3.0728 -1.3571 -1.3571 -1.3561 -1.3561 -1.1685 -1.1685 -1.1593 -1.1593 -0.8252 -0.8252 -0.8098 -0.8098 -0.7068 -0.7068 -0.6909 -0.6909 -0.1446 -0.1446 -0.1376 -0.1376 -0.0746 -0.0746 -0.0571 -0.0571 0.2023 0.2023 0.2066 0.2066 0.5803 0.5803 0.5889 0.5889 0.8141 0.8141 0.8305 0.8305 0.9985 0.9985 1.0068 1.0068 1.0632 1.0632 1.0729 1.0729 2.5132 2.5132 2.5145 2.5145 2.6124 2.6124 2.6174 2.6174 2.9657 2.9657 2.9704 2.9704 3.0190 3.0190 3.0228 3.0228 3.0530 3.0530 3.0578 3.0578 6.3498 6.3498 6.3511 6.3511 7.4332 7.4332 7.4424 7.4424 7.5538 7.5538 7.5730 7.5730 7.6112 7.6112 7.6319 7.6319 k = 0.0000 0.0000 0.2703 ( 14038 PWs) bands (ev): -12.2904 -12.2904 -12.2904 -12.2904 -11.7134 -11.7134 -11.7134 -11.7134 -11.6832 -11.6832 -11.6832 -11.6832 -11.6657 -11.6657 -11.6657 -11.6657 -3.0732 -3.0732 -3.0732 -3.0732 -1.3549 -1.3549 -1.3549 -1.3549 -1.1653 -1.1653 -1.1653 -1.1653 -0.8173 -0.8173 -0.8173 -0.8173 -0.6988 -0.6988 -0.6988 -0.6988 -0.1411 -0.1411 -0.1411 -0.1411 -0.0661 -0.0661 -0.0661 -0.0661 0.2046 0.2046 0.2046 0.2046 0.5862 0.5862 0.5862 0.5862 0.8231 0.8231 0.8231 0.8231 1.0019 1.0019 1.0019 1.0019 1.0674 1.0674 1.0674 1.0674 2.5137 2.5137 2.5137 2.5137 2.6147 2.6147 2.6147 2.6147 2.9701 2.9701 2.9701 2.9701 3.0194 3.0194 3.0194 3.0194 3.0548 3.0548 3.0548 3.0548 6.3489 6.3489 6.3489 6.3489 7.4404 7.4404 7.4404 7.4404 7.5755 7.5755 7.5755 7.5755 7.6008 7.6008 7.6008 7.6008 k = 0.0000 0.5000-0.0000 ( 14040 PWs) bands (ev): -12.1625 -12.1625 -12.1583 -12.1583 -11.8017 -11.8017 -11.7926 -11.7926 -11.7796 -11.7796 -11.7554 -11.7554 -11.6443 -11.6443 -11.6333 -11.6333 -3.0051 -3.0051 -2.9444 -2.9444 -1.7944 -1.7944 -1.4012 -1.4012 -1.1592 -1.1592 -1.1303 -1.1303 -0.8565 -0.8565 -0.7893 -0.7893 -0.6857 -0.6857 -0.5132 -0.5132 -0.3464 -0.3464 -0.1564 -0.1564 -0.1432 -0.1432 0.0542 0.0542 0.1577 0.1577 0.2547 0.2547 0.3540 0.3540 0.4436 0.4436 0.5342 0.5342 0.7068 0.7068 1.0334 1.0334 1.0860 1.0860 1.1944 1.1944 1.2060 1.2060 2.4920 2.4920 2.5632 2.5632 2.6395 2.6395 2.6999 2.6999 2.8770 2.8770 2.9165 2.9165 2.9812 2.9812 3.0244 3.0244 3.0663 3.0663 3.1139 3.1139 7.0578 7.0578 7.1608 7.1608 7.4438 7.4438 7.6573 7.6573 7.9693 7.9693 8.2531 8.2531 8.4637 8.4637 8.5663 8.5663 k = 0.0000 0.5000 0.0180 ( 14036 PWs) bands (ev): -12.1625 -12.1625 -12.1583 -12.1583 -11.8026 -11.8024 -11.7953 -11.7952 -11.7769 -11.7768 -11.7545 -11.7542 -11.6445 -11.6445 -11.6335 -11.6335 -3.0053 -3.0052 -2.9444 -2.9444 -1.7941 -1.7931 -1.4021 -1.4015 -1.1605 -1.1578 -1.1313 -1.1302 -0.8643 -0.8539 -0.7931 -0.7830 -0.6949 -0.6721 -0.5148 -0.5108 -0.3517 -0.3418 -0.1673 -0.1672 -0.1330 -0.1306 0.0512 0.0572 0.1556 0.1594 0.2528 0.2562 0.3395 0.3679 0.4387 0.4451 0.5258 0.5444 0.7060 0.7102 1.0306 1.0355 1.0828 1.0886 1.1929 1.1950 1.2057 1.2068 2.4875 2.4969 2.5588 2.5673 2.6375 2.6418 2.6972 2.7024 2.8758 2.8783 2.9156 2.9173 2.9801 2.9827 3.0224 3.0261 3.0645 3.0678 3.1125 3.1151 7.0534 7.0566 7.1613 7.1621 7.4424 7.4521 7.6591 7.6595 7.9653 7.9734 8.2532 8.2541 8.4633 8.4664 8.5671 8.5673 k = 0.0000 0.5000 0.0360 ( 14018 PWs) bands (ev): -12.1624 -12.1624 -12.1582 -12.1582 -11.8051 -11.8047 -11.8004 -11.8002 -11.7715 -11.7714 -11.7517 -11.7513 -11.6450 -11.6450 -11.6341 -11.6340 -3.0055 -3.0053 -2.9444 -2.9444 -1.7921 -1.7902 -1.4042 -1.4031 -1.1620 -1.1565 -1.1332 -1.1308 -0.8755 -0.8578 -0.7949 -0.7744 -0.6987 -0.6555 -0.5157 -0.5078 -0.3576 -0.3381 -0.1828 -0.1815 -0.1170 -0.1136 0.0480 0.0599 0.1532 0.1606 0.2509 0.2574 0.3246 0.3808 0.4305 0.4440 0.5198 0.5559 0.7078 0.7162 1.0270 1.0366 1.0791 1.0907 1.1908 1.1948 1.2058 1.2080 2.4833 2.5019 2.5543 2.5712 2.6358 2.6444 2.6943 2.7046 2.8748 2.8798 2.9147 2.9180 2.9792 2.9843 3.0202 3.0275 3.0626 3.0689 3.1110 3.1162 7.0439 7.0498 7.1637 7.1652 7.4477 7.4665 7.6650 7.6657 7.9613 7.9774 8.2543 8.2561 8.4651 8.4712 8.5699 8.5703 k = 0.0000 0.5000 0.0541 ( 14010 PWs) bands (ev): -12.1622 -12.1622 -12.1580 -12.1580 -11.8085 -11.8081 -11.8059 -11.8057 -11.7653 -11.7652 -11.7476 -11.7470 -11.6459 -11.6458 -11.6352 -11.6350 -3.0060 -3.0057 -2.9443 -2.9443 -1.7886 -1.7857 -1.4073 -1.4059 -1.1638 -1.1560 -1.1358 -1.1316 -0.8882 -0.8676 -0.7952 -0.7648 -0.6966 -0.6372 -0.5157 -0.5042 -0.3639 -0.3355 -0.1982 -0.1953 -0.1004 -0.0961 0.0449 0.0627 0.1503 0.1614 0.2489 0.2580 0.3095 0.3923 0.4195 0.4408 0.5161 0.5678 0.7120 0.7243 1.0228 1.0368 1.0752 1.0921 1.1884 1.1940 1.2059 1.2096 2.4795 2.5068 2.5499 2.5747 2.6344 2.6472 2.6913 2.7065 2.8740 2.8813 2.9138 2.9184 2.9785 2.9859 3.0179 3.0285 3.0606 3.0696 3.1095 3.1173 7.0305 7.0382 7.1678 7.1699 7.4588 7.4857 7.6748 7.6759 7.9575 7.9813 8.2564 8.2590 8.4690 8.4779 8.5745 8.5751 k = 0.0000 0.5000 0.0721 ( 14022 PWs) bands (ev): -12.1619 -12.1619 -12.1578 -12.1578 -11.8125 -11.8120 -11.8113 -11.8112 -11.7589 -11.7587 -11.7425 -11.7418 -11.6471 -11.6471 -11.6366 -11.6364 -3.0065 -3.0061 -2.9443 -2.9442 -1.7835 -1.7798 -1.4114 -1.4096 -1.1666 -1.1573 -1.1378 -1.1320 -0.9016 -0.8816 -0.7943 -0.7555 -0.6889 -0.6181 -0.5148 -0.4999 -0.3705 -0.3341 -0.2131 -0.2082 -0.0838 -0.0786 0.0421 0.0658 0.1472 0.1618 0.2468 0.2577 0.2945 0.3996 0.4089 0.4365 0.5148 0.5795 0.7182 0.7342 1.0182 1.0362 1.0711 1.0927 1.1860 1.1927 1.2061 1.2111 2.4762 2.5113 2.5460 2.5778 2.6335 2.6501 2.6882 2.7080 2.8734 2.8829 2.9131 2.9185 2.9778 2.9874 3.0156 3.0292 3.0589 3.0698 3.1079 3.1182 7.0144 7.0229 7.1737 7.1762 7.4746 7.5084 7.6884 7.6900 7.9539 7.9849 8.2595 8.2628 8.4748 8.4862 8.5808 8.5815 k = 0.0000 0.5000 0.0901 ( 14048 PWs) bands (ev): -12.1616 -12.1616 -12.1575 -12.1575 -11.8168 -11.8166 -11.8164 -11.8161 -11.7524 -11.7522 -11.7368 -11.7361 -11.6486 -11.6486 -11.6384 -11.6382 -3.0071 -3.0067 -2.9442 -2.9441 -1.7771 -1.7727 -1.4160 -1.4141 -1.1705 -1.1612 -1.1385 -1.1315 -0.9150 -0.8984 -0.7922 -0.7474 -0.6769 -0.5990 -0.5128 -0.4947 -0.3771 -0.3341 -0.2273 -0.2203 -0.0679 -0.0615 0.0398 0.0693 0.1437 0.1617 0.2448 0.2565 0.2798 0.3895 0.4123 0.4318 0.5159 0.5906 0.7260 0.7453 1.0134 1.0347 1.0668 1.0925 1.1837 1.1912 1.2062 1.2124 2.4735 2.5145 2.5431 2.5805 2.6330 2.6532 2.6850 2.7091 2.8731 2.8846 2.9126 2.9184 2.9769 2.9886 3.0136 3.0296 3.0573 3.0693 3.1065 3.1191 6.9967 7.0054 7.1810 7.1837 7.4935 7.5330 7.7055 7.7077 7.9506 7.9883 8.2634 8.2673 8.4823 8.4959 8.5885 8.5892 k = 0.0000 0.5000 0.1081 ( 14036 PWs) bands (ev): -12.1613 -12.1613 -12.1572 -12.1571 -11.8216 -11.8215 -11.8208 -11.8203 -11.7459 -11.7458 -11.7308 -11.7300 -11.6505 -11.6504 -11.6406 -11.6403 -3.0079 -3.0074 -2.9441 -2.9440 -1.7696 -1.7646 -1.4211 -1.4191 -1.1757 -1.1675 -1.1381 -1.1301 -0.9279 -0.9163 -0.7890 -0.7407 -0.6620 -0.5808 -0.5097 -0.4884 -0.3838 -0.3355 -0.2409 -0.2313 -0.0530 -0.0451 0.0384 0.0738 0.1400 0.1611 0.2427 0.2542 0.2655 0.3742 0.4179 0.4273 0.5192 0.6005 0.7351 0.7571 1.0087 1.0325 1.0625 1.0915 1.1817 1.1895 1.2063 1.2134 2.4713 2.5157 2.5425 2.5827 2.6329 2.6564 2.6817 2.7098 2.8733 2.8863 2.9123 2.9181 2.9757 2.9893 3.0122 3.0296 3.0563 3.0684 3.1053 3.1199 6.9784 6.9869 7.1895 7.1922 7.5143 7.5584 7.7260 7.7288 7.9480 7.9912 8.2682 8.2725 8.4913 8.5065 8.5973 8.5982 k = 0.0000 0.5000 0.1261 ( 14050 PWs) bands (ev): -12.1609 -12.1609 -12.1568 -12.1568 -11.8262 -11.8261 -11.8248 -11.8244 -11.7395 -11.7394 -11.7246 -11.7238 -11.6526 -11.6526 -11.6432 -11.6428 -3.0086 -3.0081 -2.9440 -2.9439 -1.7612 -1.7557 -1.4262 -1.4244 -1.1818 -1.1753 -1.1372 -1.1281 -0.9401 -0.9342 -0.7849 -0.7353 -0.6455 -0.5642 -0.5055 -0.4806 -0.3904 -0.3384 -0.2538 -0.2413 -0.0397 -0.0298 0.0380 0.0793 0.1362 0.1602 0.2406 0.2503 0.2524 0.3582 0.4218 0.4234 0.5248 0.6089 0.7449 0.7690 1.0042 1.0298 1.0582 1.0895 1.1799 1.1878 1.2063 1.2141 2.4697 2.5141 2.5445 2.5845 2.6334 2.6597 2.6783 2.7098 2.8737 2.8881 2.9121 2.9175 2.9740 2.9893 3.0115 3.0292 3.0556 3.0669 3.1044 3.1206 6.9604 6.9682 7.1986 7.2013 7.5361 7.5832 7.7493 7.7528 7.9461 7.9936 8.2736 8.2781 8.5012 8.5175 8.6070 8.6080 k = 0.0000 0.5000 0.1441 ( 14058 PWs) bands (ev): -12.1605 -12.1605 -12.1564 -12.1564 -11.8304 -11.8303 -11.8286 -11.8282 -11.7333 -11.7332 -11.7183 -11.7175 -11.6551 -11.6550 -11.6462 -11.6458 -3.0094 -3.0089 -2.9438 -2.9437 -1.7522 -1.7465 -1.4314 -1.4296 -1.1884 -1.1839 -1.1364 -1.1260 -0.9514 -0.9511 -0.7799 -0.7312 -0.6282 -0.5502 -0.5001 -0.4709 -0.3970 -0.3428 -0.2658 -0.2504 -0.0283 -0.0163 0.0392 0.0860 0.1326 0.1589 0.2383 0.2389 0.2468 0.3420 0.4204 0.4239 0.5323 0.6154 0.7552 0.7804 1.0004 1.0269 1.0541 1.0867 1.1785 1.1861 1.2062 1.2144 2.4687 2.5106 2.5483 2.5857 2.6343 2.6631 2.6750 2.7093 2.8747 2.8900 2.9118 2.9167 2.9720 2.9886 3.0116 3.0285 3.0552 3.0650 3.1041 3.1211 6.9433 6.9503 7.2079 7.2104 7.5580 7.6067 7.7750 7.7790 7.9452 7.9952 8.2794 8.2838 8.5117 8.5284 8.6168 8.6181 k = 0.0000 0.5000 0.1622 ( 14054 PWs) bands (ev): -12.1601 -12.1601 -12.1561 -12.1561 -11.8341 -11.8340 -11.8319 -11.8316 -11.7273 -11.7272 -11.7120 -11.7111 -11.6577 -11.6577 -11.6495 -11.6490 -3.0101 -3.0096 -2.9437 -2.9436 -1.7431 -1.7373 -1.4362 -1.4347 -1.1954 -1.1926 -1.1357 -1.1243 -0.9663 -0.9616 -0.7744 -0.7285 -0.6109 -0.5393 -0.4936 -0.4593 -0.4034 -0.3485 -0.2768 -0.2586 -0.0190 -0.0051 0.0423 0.0934 0.1296 0.1572 0.2278 0.2359 0.2418 0.3259 0.4184 0.4248 0.5411 0.6199 0.7656 0.7909 0.9974 1.0237 1.0504 1.0830 1.1775 1.1845 1.2062 1.2143 2.4684 2.5062 2.5529 2.5863 2.6357 2.6666 2.6717 2.7083 2.8762 2.8919 2.9113 2.9157 2.9700 2.9873 3.0125 3.0275 3.0550 3.0628 3.1044 3.1213 6.9276 6.9336 7.2171 7.2193 7.5793 7.6276 7.8021 7.8064 7.9457 7.9960 8.2855 8.2896 8.5223 8.5387 8.6264 8.6282 k = 0.0000 0.5000 0.1802 ( 14058 PWs) bands (ev): -12.1597 -12.1597 -12.1558 -12.1557 -11.8373 -11.8372 -11.8349 -11.8346 -11.7216 -11.7215 -11.7057 -11.7049 -11.6606 -11.6605 -11.6532 -11.6527 -3.0107 -3.0103 -2.9436 -2.9435 -1.7340 -1.7286 -1.4405 -1.4392 -1.2022 -1.2009 -1.1354 -1.1234 -0.9789 -0.9707 -0.7684 -0.7272 -0.5941 -0.5316 -0.4863 -0.4466 -0.4096 -0.3550 -0.2865 -0.2664 -0.0115 0.0031 0.0479 0.1006 0.1272 0.1548 0.2191 0.2333 0.2366 0.3099 0.4173 0.4248 0.5510 0.6222 0.7758 0.7999 0.9954 1.0205 1.0473 1.0785 1.1768 1.1830 1.2063 1.2139 2.4687 2.5014 2.5578 2.5864 2.6375 2.6677 2.6709 2.7065 2.8782 2.8940 2.9103 2.9145 2.9683 2.9854 3.0139 3.0264 3.0547 3.0605 3.1053 3.1212 6.9138 6.9188 7.2256 7.2275 7.5996 7.6453 7.8295 7.8338 7.9479 7.9957 8.2914 8.2950 8.5324 8.5479 8.6350 8.6376 k = 0.0000 0.5000 0.1982 ( 14066 PWs) bands (ev): -12.1594 -12.1594 -12.1554 -12.1554 -11.8400 -11.8399 -11.8373 -11.8371 -11.7164 -11.7162 -11.6995 -11.6987 -11.6634 -11.6634 -11.6572 -11.6566 -3.0113 -3.0110 -2.9435 -2.9434 -1.7256 -1.7207 -1.4443 -1.4432 -1.2086 -1.2084 -1.1351 -1.1235 -0.9884 -0.9784 -0.7622 -0.7273 -0.5784 -0.5268 -0.4783 -0.4342 -0.4150 -0.3620 -0.2945 -0.2738 -0.0056 0.0083 0.0557 0.1064 0.1260 0.1514 0.2140 0.2307 0.2318 0.2943 0.4170 0.4243 0.5614 0.6222 0.7854 0.8070 0.9946 1.0171 1.0452 1.0735 1.1765 1.1816 1.2065 1.2133 2.4696 2.4965 2.5627 2.5860 2.6397 2.6645 2.6745 2.7043 2.8807 2.8961 2.9086 2.9130 2.9673 2.9831 3.0156 3.0254 3.0542 3.0583 3.1069 3.1208 6.9021 6.9062 7.2332 7.2347 7.6182 7.6589 7.8559 7.8595 7.9521 7.9944 8.2968 8.2998 8.5417 8.5553 8.6417 8.6454 k = 0.0000 0.5000 0.2162 ( 14062 PWs) bands (ev): -12.1591 -12.1591 -12.1552 -12.1552 -11.8421 -11.8421 -11.8393 -11.8391 -11.7117 -11.7116 -11.6934 -11.6926 -11.6663 -11.6662 -11.6615 -11.6609 -3.0118 -3.0115 -2.9434 -2.9433 -1.7183 -1.7143 -1.4472 -1.4464 -1.2147 -1.2142 -1.1347 -1.1247 -0.9948 -0.9850 -0.7560 -0.7287 -0.5641 -0.5246 -0.4700 -0.4282 -0.4147 -0.3691 -0.3003 -0.2811 -0.0008 0.0108 0.0651 0.1093 0.1259 0.1467 0.2135 0.2279 0.2280 0.2791 0.4173 0.4235 0.5720 0.6199 0.7941 0.8119 0.9950 1.0135 1.0446 1.0680 1.1765 1.1804 1.2069 1.2124 2.4711 2.4918 2.5673 2.5849 2.6422 2.6612 2.6784 2.7014 2.8838 2.8982 2.9062 2.9113 2.9672 2.9804 3.0174 3.0245 3.0536 3.0562 3.1088 3.1200 6.8929 6.8959 7.2395 7.2406 7.6348 7.6681 7.8793 7.8818 7.9581 7.9920 8.3014 8.3036 8.5497 8.5608 8.6454 8.6498 k = 0.0000 0.5000 0.2342 ( 14066 PWs) bands (ev): -12.1589 -12.1589 -12.1550 -12.1550 -11.8436 -11.8436 -11.8407 -11.8406 -11.7079 -11.7078 -11.6875 -11.6868 -11.6687 -11.6687 -11.6661 -11.6655 -3.0121 -3.0119 -2.9433 -2.9433 -1.7124 -1.7095 -1.4494 -1.4488 -1.2194 -1.2187 -1.1340 -1.1267 -0.9981 -0.9904 -0.7500 -0.7312 -0.5516 -0.5249 -0.4616 -0.4323 -0.4059 -0.3759 -0.3033 -0.2883 0.0032 0.0115 0.0753 0.1083 0.1271 0.1414 0.2177 0.2253 0.2257 0.2645 0.4180 0.4224 0.5824 0.6154 0.8017 0.8144 0.9965 1.0097 1.0456 1.0624 1.1767 1.1793 1.2074 1.2113 2.4733 2.4872 2.5715 2.5833 2.6450 2.6578 2.6824 2.6981 2.8873 2.9000 2.9035 2.9095 2.9680 2.9776 3.0191 3.0237 3.0530 3.0545 3.1110 3.1188 6.8864 6.8884 7.2442 7.2449 7.6490 7.6726 7.8978 7.8989 7.9655 7.9887 8.3049 8.3064 8.5561 8.5639 8.6459 8.6494 k = 0.0000 0.5000 0.2522 ( 14062 PWs) bands (ev): -12.1588 -12.1588 -12.1549 -12.1549 -11.8445 -11.8445 -11.8415 -11.8415 -11.7053 -11.7052 -11.6819 -11.6811 -11.6713 -11.6707 -11.6702 -11.6702 -3.0123 -3.0122 -2.9433 -2.9432 -1.7084 -1.7069 -1.4506 -1.4503 -1.2222 -1.2217 -1.1328 -1.1289 -0.9988 -0.9946 -0.7443 -0.7348 -0.5412 -0.5277 -0.4535 -0.4387 -0.3969 -0.3825 -0.3032 -0.2948 0.0065 0.0108 0.0856 0.1033 0.1293 0.1365 0.2222 0.2238 0.2277 0.2507 0.4190 0.4213 0.5923 0.6092 0.8079 0.8145 0.9989 1.0058 1.0482 1.0570 1.1772 1.1785 1.2082 1.2102 2.4760 2.4831 2.5753 2.5812 2.6480 2.6544 2.6865 2.6944 2.8911 2.8987 2.9034 2.9075 2.9697 2.9747 3.0206 3.0229 3.0526 3.0533 3.1133 3.1173 6.8826 6.8836 7.2472 7.2475 7.6603 7.6726 7.9096 7.9097 7.9730 7.9846 8.3072 8.3079 8.5608 8.5648 8.6450 8.6466 k = 0.0000 0.5000 0.2703 ( 14076 PWs) bands (ev): -12.1588 -12.1588 -12.1548 -12.1548 -11.8448 -11.8448 -11.8418 -11.8418 -11.7043 -11.7043 -11.6766 -11.6766 -11.6754 -11.6754 -11.6711 -11.6711 -3.0123 -3.0123 -2.9432 -2.9432 -1.7065 -1.7065 -1.4509 -1.4509 -1.2229 -1.2229 -1.1311 -1.1311 -0.9975 -0.9975 -0.7392 -0.7392 -0.5332 -0.5332 -0.4459 -0.4459 -0.3893 -0.3893 -0.3001 -0.3001 0.0090 0.0090 0.0953 0.0953 0.1325 0.1325 0.2227 0.2227 0.2380 0.2380 0.4201 0.4201 0.6013 0.6013 0.8122 0.8122 1.0021 1.0021 1.0521 1.0521 1.1777 1.1777 1.2092 1.2092 2.4793 2.4793 2.5785 2.5785 2.6511 2.6511 2.6905 2.6905 2.8950 2.8950 2.9054 2.9054 2.9720 2.9720 3.0219 3.0219 3.0527 3.0527 3.1154 3.1154 6.8816 6.8816 7.2483 7.2483 7.6683 7.6683 7.9135 7.9135 7.9794 7.9794 8.3082 8.3082 8.5637 8.5637 8.6449 8.6449 k = 0.5000 0.5000-0.0000 ( 14044 PWs) bands (ev): -12.0668 -12.0668 -12.0662 -12.0662 -11.8086 -11.8086 -11.7923 -11.7923 -11.7887 -11.7887 -11.7489 -11.7489 -11.7259 -11.7259 -11.7253 -11.7253 -3.0976 -3.0976 -3.0960 -3.0960 -2.2397 -2.2397 -1.4076 -1.4076 -1.3084 -1.3084 -1.2544 -1.2544 -1.1357 -1.1357 -1.1311 -1.1311 -0.6685 -0.6685 -0.3637 -0.3637 -0.1137 -0.1137 -0.0142 -0.0142 0.0427 0.0427 0.1991 0.1991 0.2483 0.2483 0.3406 0.3406 0.7204 0.7204 0.7453 0.7453 0.7667 0.7667 0.8935 0.8935 0.9113 0.9113 1.0448 1.0448 1.2031 1.2031 1.3307 1.3307 2.5462 2.5462 2.6232 2.6232 2.6643 2.6643 2.7699 2.7699 2.8715 2.8715 2.9986 2.9986 3.0419 3.0419 3.0934 3.0934 3.1304 3.1304 3.2428 3.2428 6.4332 6.4332 6.7554 6.7554 6.7660 6.7660 8.1107 8.1107 8.2805 8.2805 8.2830 8.2830 8.4857 8.4857 8.7641 8.7641 k = 0.5000 0.5000 0.0180 ( 14044 PWs) bands (ev): -12.0668 -12.0668 -12.0662 -12.0662 -11.8086 -11.8086 -11.7929 -11.7929 -11.7881 -11.7881 -11.7490 -11.7490 -11.7259 -11.7259 -11.7253 -11.7253 -3.0975 -3.0975 -3.0959 -3.0959 -2.2383 -2.2383 -1.4078 -1.4078 -1.3187 -1.3187 -1.2532 -1.2532 -1.1656 -1.1656 -1.0920 -1.0920 -0.6739 -0.6739 -0.3597 -0.3597 -0.1127 -0.1127 -0.0132 -0.0132 0.0426 0.0426 0.1989 0.1989 0.2482 0.2482 0.3404 0.3404 0.7204 0.7204 0.7451 0.7451 0.7672 0.7672 0.8920 0.8920 0.9137 0.9137 1.0440 1.0440 1.2021 1.2021 1.3297 1.3297 2.5465 2.5465 2.6230 2.6230 2.6646 2.6646 2.7695 2.7695 2.8721 2.8721 2.9986 2.9986 3.0415 3.0415 3.0938 3.0938 3.1304 3.1304 3.2415 3.2415 6.4370 6.4370 6.7560 6.7560 6.7665 6.7665 8.1034 8.1034 8.2796 8.2796 8.2822 8.2822 8.4874 8.4874 8.7637 8.7637 k = 0.5000 0.5000 0.0360 ( 14060 PWs) bands (ev): -12.0668 -12.0668 -12.0662 -12.0662 -11.8086 -11.8086 -11.7940 -11.7940 -11.7868 -11.7868 -11.7492 -11.7492 -11.7259 -11.7259 -11.7253 -11.7253 -3.0972 -3.0972 -3.0956 -3.0956 -2.2343 -2.2343 -1.4098 -1.4098 -1.3435 -1.3435 -1.2518 -1.2518 -1.1876 -1.1876 -1.0445 -1.0445 -0.6894 -0.6894 -0.3487 -0.3487 -0.1096 -0.1096 -0.0104 -0.0104 0.0429 0.0429 0.1980 0.1980 0.2476 0.2476 0.3396 0.3396 0.7204 0.7204 0.7444 0.7444 0.7685 0.7685 0.8892 0.8892 0.9194 0.9194 1.0418 1.0418 1.1992 1.1992 1.3270 1.3270 2.5472 2.5472 2.6225 2.6225 2.6654 2.6654 2.7683 2.7683 2.8740 2.8740 2.9985 2.9985 3.0403 3.0403 3.0950 3.0950 3.1302 3.1302 3.2374 3.2374 6.4485 6.4485 6.7578 6.7578 6.7681 6.7681 8.0819 8.0819 8.2772 8.2772 8.2796 8.2796 8.4923 8.4923 8.7629 8.7629 k = 0.5000 0.5000 0.0541 ( 14060 PWs) bands (ev): -12.0668 -12.0668 -12.0662 -12.0662 -11.8085 -11.8085 -11.7952 -11.7952 -11.7853 -11.7853 -11.7496 -11.7496 -11.7259 -11.7259 -11.7253 -11.7253 -3.0967 -3.0967 -3.0952 -3.0952 -2.2276 -2.2276 -1.4226 -1.4226 -1.3662 -1.3662 -1.2521 -1.2521 -1.2024 -1.2024 -0.9935 -0.9935 -0.7126 -0.7126 -0.3329 -0.3329 -0.1045 -0.1045 -0.0069 -0.0069 0.0444 0.0444 0.1967 0.1967 0.2467 0.2467 0.3384 0.3384 0.7203 0.7203 0.7436 0.7436 0.7706 0.7706 0.8866 0.8866 0.9264 0.9264 1.0384 1.0384 1.1944 1.1944 1.3224 1.3224 2.5485 2.5485 2.6217 2.6217 2.6667 2.6667 2.7664 2.7664 2.8772 2.8772 2.9983 2.9983 3.0385 3.0385 3.0969 3.0969 3.1300 3.1300 3.2308 3.2308 6.4675 6.4675 6.7608 6.7608 6.7707 6.7707 8.0474 8.0474 8.2731 8.2731 8.2755 8.2755 8.5004 8.5004 8.7619 8.7619 k = 0.5000 0.5000 0.0721 ( 14056 PWs) bands (ev): -12.0667 -12.0667 -12.0662 -12.0662 -11.8084 -11.8084 -11.7964 -11.7964 -11.7836 -11.7836 -11.7501 -11.7501 -11.7259 -11.7259 -11.7253 -11.7253 -3.0961 -3.0961 -3.0946 -3.0946 -2.2182 -2.2182 -1.4562 -1.4562 -1.3717 -1.3717 -1.2545 -1.2545 -1.2130 -1.2130 -0.9408 -0.9408 -0.7412 -0.7412 -0.3152 -0.3152 -0.0976 -0.0976 -0.0043 -0.0043 0.0487 0.0487 0.1948 0.1948 0.2453 0.2453 0.3366 0.3366 0.7203 0.7203 0.7429 0.7429 0.7730 0.7730 0.8852 0.8852 0.9338 0.9338 1.0342 1.0342 1.1880 1.1880 1.3161 1.3161 2.5502 2.5502 2.6206 2.6206 2.6684 2.6684 2.7637 2.7637 2.8816 2.8816 2.9982 2.9982 3.0362 3.0362 3.0992 3.0992 3.1296 3.1296 3.2218 3.2218 6.4938 6.4938 6.7648 6.7648 6.7743 6.7743 8.0014 8.0014 8.2676 8.2676 8.2699 8.2699 8.5115 8.5115 8.7613 8.7613 k = 0.5000 0.5000 0.0901 ( 14056 PWs) bands (ev): -12.0667 -12.0667 -12.0663 -12.0663 -11.8084 -11.8084 -11.7976 -11.7976 -11.7819 -11.7819 -11.7508 -11.7508 -11.7259 -11.7259 -11.7254 -11.7254 -3.0953 -3.0953 -3.0939 -3.0939 -2.2061 -2.2061 -1.5006 -1.5006 -1.3670 -1.3670 -1.2583 -1.2583 -1.2212 -1.2212 -0.8873 -0.8873 -0.7736 -0.7736 -0.2978 -0.2978 -0.0890 -0.0890 -0.0036 -0.0036 0.0569 0.0569 0.1925 0.1925 0.2437 0.2437 0.3341 0.3341 0.7201 0.7201 0.7423 0.7423 0.7757 0.7757 0.8852 0.8852 0.9408 0.9408 1.0298 1.0298 1.1800 1.1800 1.3081 1.3081 2.5524 2.5524 2.6192 2.6192 2.6706 2.6706 2.7604 2.7604 2.8874 2.8874 2.9982 2.9982 3.0336 3.0336 3.1019 3.1019 3.1289 3.1289 3.2108 3.2108 6.5270 6.5270 6.7698 6.7698 6.7786 6.7786 7.9457 7.9457 8.2608 8.2608 8.2629 8.2629 8.5254 8.5254 8.7610 8.7610 k = 0.5000 0.5000 0.1081 ( 14068 PWs) bands (ev): -12.0667 -12.0667 -12.0663 -12.0663 -11.8082 -11.8082 -11.7987 -11.7987 -11.7801 -11.7801 -11.7515 -11.7515 -11.7259 -11.7259 -11.7254 -11.7254 -3.0944 -3.0944 -3.0931 -3.0931 -2.1915 -2.1915 -1.5483 -1.5483 -1.3583 -1.3583 -1.2633 -1.2633 -1.2277 -1.2277 -0.8337 -0.8337 -0.8081 -0.8081 -0.2828 -0.2828 -0.0790 -0.0790 -0.0045 -0.0045 0.0688 0.0688 0.1897 0.1897 0.2417 0.2417 0.3310 0.3310 0.7199 0.7199 0.7418 0.7418 0.7787 0.7787 0.8868 0.8868 0.9465 0.9465 1.0261 1.0261 1.1707 1.1707 1.2985 1.2985 2.5551 2.5551 2.6176 2.6176 2.6731 2.6731 2.7565 2.7565 2.8944 2.8944 2.9981 2.9981 3.0308 3.0308 3.1046 3.1046 3.1278 3.1278 3.1981 3.1981 6.5669 6.5669 6.7756 6.7756 6.7834 6.7834 7.8821 7.8821 8.2530 8.2530 8.2550 8.2550 8.5418 8.5418 8.7609 8.7609 k = 0.5000 0.5000 0.1261 ( 14072 PWs) bands (ev): -12.0667 -12.0667 -12.0663 -12.0663 -11.8081 -11.8081 -11.7998 -11.7998 -11.7783 -11.7783 -11.7524 -11.7524 -11.7259 -11.7259 -11.7254 -11.7254 -3.0935 -3.0935 -3.0923 -3.0923 -2.1742 -2.1742 -1.5968 -1.5968 -1.3478 -1.3478 -1.2690 -1.2690 -1.2325 -1.2325 -0.8443 -0.8443 -0.7802 -0.7802 -0.2719 -0.2719 -0.0678 -0.0678 -0.0057 -0.0057 0.0832 0.0832 0.1866 0.1866 0.2394 0.2394 0.3270 0.3270 0.7197 0.7197 0.7413 0.7413 0.7821 0.7821 0.8896 0.8896 0.9498 0.9498 1.0245 1.0245 1.1607 1.1607 1.2874 1.2874 2.5581 2.5581 2.6157 2.6157 2.6760 2.6760 2.7521 2.7521 2.9028 2.9028 2.9981 2.9981 3.0279 3.0279 3.1073 3.1073 3.1260 3.1260 3.1845 3.1845 6.6130 6.6130 6.7820 6.7820 6.7887 6.7887 7.8120 7.8120 8.2444 8.2444 8.2462 8.2462 8.5604 8.5604 8.7610 8.7610 k = 0.5000 0.5000 0.1441 ( 14088 PWs) bands (ev): -12.0667 -12.0667 -12.0663 -12.0663 -11.8079 -11.8079 -11.8007 -11.8007 -11.7764 -11.7764 -11.7535 -11.7535 -11.7259 -11.7259 -11.7255 -11.7255 -3.0925 -3.0925 -3.0914 -3.0914 -2.1544 -2.1544 -1.6451 -1.6451 -1.3366 -1.3366 -1.2751 -1.2751 -1.2348 -1.2348 -0.8809 -0.8809 -0.7278 -0.7278 -0.2669 -0.2669 -0.0557 -0.0557 -0.0059 -0.0059 0.0990 0.0990 0.1831 0.1831 0.2372 0.2372 0.3222 0.3222 0.7196 0.7196 0.7405 0.7405 0.7864 0.7864 0.8931 0.8931 0.9502 0.9502 1.0256 1.0256 1.1504 1.1504 1.2749 1.2749 2.5614 2.5614 2.6134 2.6134 2.6792 2.6792 2.7473 2.7473 2.9125 2.9125 2.9982 2.9982 3.0250 3.0250 3.1094 3.1094 3.1234 3.1234 3.1709 3.1709 6.6645 6.6645 6.7891 6.7891 6.7940 6.7940 7.7370 7.7370 8.2354 8.2354 8.2371 8.2371 8.5806 8.5806 8.7610 8.7610 k = 0.5000 0.5000 0.1622 ( 14080 PWs) bands (ev): -12.0666 -12.0666 -12.0663 -12.0663 -11.8077 -11.8077 -11.8016 -11.8016 -11.7745 -11.7745 -11.7546 -11.7546 -11.7259 -11.7259 -11.7255 -11.7255 -3.0915 -3.0915 -3.0906 -3.0906 -2.1321 -2.1321 -1.6927 -1.6927 -1.3261 -1.3261 -1.2811 -1.2811 -1.2335 -1.2335 -0.9176 -0.9176 -0.6763 -0.6763 -0.2685 -0.2685 -0.0430 -0.0430 -0.0046 -0.0046 0.1150 0.1150 0.1795 0.1795 0.2352 0.2352 0.3165 0.3165 0.7196 0.7196 0.7394 0.7394 0.7916 0.7916 0.8962 0.8962 0.9488 0.9488 1.0288 1.0288 1.1409 1.1409 1.2613 1.2613 2.5651 2.5651 2.6109 2.6109 2.6827 2.6827 2.7421 2.7421 2.9235 2.9235 2.9985 2.9985 3.0223 3.0223 3.1090 3.1090 3.1205 3.1205 3.1587 3.1587 6.7201 6.7201 6.7974 6.7974 6.7995 6.7995 7.6583 7.6583 8.2265 8.2265 8.2279 8.2279 8.6022 8.6022 8.7605 8.7605 k = 0.5000 0.5000 0.1802 ( 14080 PWs) bands (ev): -12.0666 -12.0666 -12.0663 -12.0663 -11.8075 -11.8075 -11.8025 -11.8025 -11.7727 -11.7727 -11.7559 -11.7559 -11.7259 -11.7259 -11.7255 -11.7255 -3.0906 -3.0906 -3.0898 -3.0898 -2.1073 -2.1073 -1.7393 -1.7393 -1.3177 -1.3177 -1.2869 -1.2869 -1.2271 -1.2271 -0.9541 -0.9541 -0.6263 -0.6263 -0.2772 -0.2772 -0.0303 -0.0303 -0.0016 -0.0016 0.1300 0.1300 0.1759 0.1759 0.2341 0.2341 0.3097 0.3097 0.7199 0.7199 0.7378 0.7378 0.7981 0.7981 0.8964 0.8964 0.9488 0.9488 1.0321 1.0321 1.1337 1.1337 1.2466 1.2466 2.5690 2.5690 2.6081 2.6081 2.6866 2.6866 2.7368 2.7368 2.9357 2.9357 2.9988 2.9988 3.0197 3.0197 3.1019 3.1019 3.1203 3.1203 3.1495 3.1495 6.7727 6.7727 6.8039 6.8039 6.8140 6.8140 7.5770 7.5770 8.2179 8.2179 8.2192 8.2192 8.6243 8.6243 8.7590 8.7590 k = 0.5000 0.5000 0.1982 ( 14060 PWs) bands (ev): -12.0666 -12.0666 -12.0663 -12.0663 -11.8072 -11.8072 -11.8033 -11.8033 -11.7708 -11.7708 -11.7573 -11.7573 -11.7258 -11.7258 -11.7256 -11.7256 -3.0898 -3.0898 -3.0891 -3.0891 -2.0801 -2.0801 -1.7844 -1.7844 -1.3122 -1.3122 -1.2921 -1.2921 -1.2149 -1.2149 -0.9899 -0.9899 -0.5779 -0.5779 -0.2927 -0.2927 -0.0181 -0.0181 0.0026 0.0026 0.1430 0.1430 0.1725 0.1725 0.2347 0.2347 0.3020 0.3020 0.7205 0.7205 0.7358 0.7358 0.8059 0.8059 0.8921 0.8921 0.9527 0.9527 1.0328 1.0328 1.1307 1.1307 1.2312 1.2312 2.5731 2.5731 2.6050 2.6050 2.6907 2.6907 2.7313 2.7313 2.9489 2.9489 2.9993 2.9993 3.0174 3.0174 3.0889 3.0889 3.1222 3.1222 3.1435 3.1435 6.7967 6.7967 6.8082 6.8082 6.8628 6.8628 7.4940 7.4940 8.2102 8.2102 8.2113 8.2113 8.6464 8.6464 8.7561 8.7561 k = 0.5000 0.5000 0.2162 ( 14064 PWs) bands (ev): -12.0665 -12.0665 -12.0664 -12.0664 -11.8069 -11.8069 -11.8040 -11.8040 -11.7690 -11.7690 -11.7587 -11.7587 -11.7258 -11.7258 -11.7256 -11.7256 -3.0891 -3.0891 -3.0886 -3.0886 -2.0505 -2.0505 -1.8281 -1.8281 -1.3093 -1.3093 -1.2967 -1.2967 -1.1971 -1.1971 -1.0248 -1.0248 -0.5316 -0.5316 -0.3142 -0.3142 -0.0072 -0.0072 0.0069 0.0069 0.1528 0.1528 0.1695 0.1695 0.2378 0.2378 0.2932 0.2932 0.7215 0.7215 0.7335 0.7335 0.8150 0.8150 0.8836 0.8836 0.9608 0.9608 1.0291 1.0291 1.1333 1.1333 1.2151 1.2151 2.5774 2.5774 2.6016 2.6016 2.6950 2.6950 2.7257 2.7257 2.9630 2.9630 2.9999 2.9999 3.0157 3.0157 3.0730 3.0730 3.1245 3.1245 3.1395 3.1395 6.8049 6.8049 6.8116 6.8116 6.9306 6.9306 7.4102 7.4102 8.2038 8.2038 8.2046 8.2046 8.6678 8.6678 8.7513 8.7513 k = 0.5000 0.5000 0.2342 ( 14052 PWs) bands (ev): -12.0665 -12.0665 -12.0664 -12.0664 -11.8066 -11.8066 -11.8046 -11.8046 -11.7671 -11.7671 -11.7603 -11.7603 -11.7258 -11.7258 -11.7257 -11.7257 -3.0885 -3.0885 -3.0882 -3.0882 -2.0187 -2.0187 -1.8701 -1.8701 -1.3078 -1.3078 -1.3004 -1.3004 -1.1749 -1.1749 -1.0585 -1.0585 -0.4874 -0.4874 -0.3410 -0.3410 0.0017 0.0017 0.0104 0.0104 0.1590 0.1590 0.1671 0.1671 0.2439 0.2439 0.2836 0.2836 0.7228 0.7228 0.7311 0.7311 0.8253 0.8253 0.8727 0.8727 0.9717 0.9717 1.0210 1.0210 1.1413 1.1413 1.1989 1.1989 2.5817 2.5817 2.5980 2.5980 2.6996 2.6996 2.7203 2.7203 2.9773 2.9773 3.0002 3.0002 3.0150 3.0150 3.0561 3.0561 3.1269 3.1269 3.1365 3.1365 6.8099 6.8099 6.8139 6.8139 7.0042 7.0042 7.3264 7.3264 8.1990 8.1990 8.1995 8.1995 8.6878 8.6878 8.7441 8.7441 k = 0.5000 0.5000 0.2522 ( 14068 PWs) bands (ev): -12.0665 -12.0665 -12.0664 -12.0664 -11.8062 -11.8062 -11.8052 -11.8052 -11.7653 -11.7653 -11.7619 -11.7619 -11.7258 -11.7258 -11.7257 -11.7257 -3.0882 -3.0882 -3.0880 -3.0880 -1.9846 -1.9846 -1.9102 -1.9102 -1.3066 -1.3066 -1.3032 -1.3032 -1.1494 -1.1494 -1.0907 -1.0907 -0.4459 -0.4459 -0.3722 -0.3722 0.0081 0.0081 0.0122 0.0122 0.1623 0.1623 0.1654 0.1654 0.2526 0.2526 0.2733 0.2733 0.7245 0.7245 0.7287 0.7287 0.8365 0.8365 0.8607 0.8607 0.9841 0.9841 1.0099 1.0099 1.1530 1.1530 1.1827 1.1827 2.5859 2.5859 2.5942 2.5942 2.7044 2.7044 2.7148 2.7148 2.9901 2.9901 3.0000 3.0000 3.0170 3.0170 3.0395 3.0395 3.1293 3.1293 3.1340 3.1340 6.8130 6.8130 6.8150 6.8150 7.0814 7.0814 7.2432 7.2432 8.1960 8.1960 8.1963 8.1963 8.7059 8.7059 8.7342 8.7342 k = 0.5000 0.5000 0.2703 ( 14064 PWs) bands (ev): -12.0664 -12.0664 -12.0664 -12.0664 -11.8057 -11.8057 -11.8057 -11.8057 -11.7636 -11.7636 -11.7636 -11.7636 -11.7257 -11.7257 -11.7257 -11.7257 -3.0880 -3.0880 -3.0880 -3.0880 -1.9484 -1.9484 -1.9484 -1.9484 -1.3052 -1.3052 -1.3052 -1.3052 -1.1211 -1.1211 -1.1211 -1.1211 -0.4074 -0.4074 -0.4074 -0.4074 0.0116 0.0116 0.0116 0.0116 0.1641 0.1641 0.1641 0.1641 0.2627 0.2627 0.2627 0.2627 0.7265 0.7265 0.7265 0.7265 0.8484 0.8484 0.8484 0.8484 0.9972 0.9972 0.9972 0.9972 1.1672 1.1672 1.1672 1.1672 2.5901 2.5901 2.5901 2.5901 2.7095 2.7095 2.7095 2.7095 2.9977 2.9977 2.9977 2.9977 3.0253 3.0253 3.0253 3.0253 3.1316 3.1316 3.1316 3.1316 6.8147 6.8147 6.8147 6.8147 7.1613 7.1613 7.1613 7.1613 8.1951 8.1951 8.1951 8.1951 8.7214 8.7214 8.7214 8.7214 Writing output data file AlCuBr4.save init_run : 1.40s CPU 0.82s WALL ( 1 calls) electrons : 1794.54s CPU 1710.17s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.20s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 1794.52s CPU 1710.15s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.32s CPU 0.18s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.42s CPU 0.44s WALL ( 244 calls) cegterg : 1588.96s CPU 1545.11s WALL ( 272 calls) Called by sum_band: Called by *egterg: h_psi : 1035.77s CPU 921.46s WALL ( 5143 calls) s_psi : 15.99s CPU 15.98s WALL ( 5143 calls) g_psi : 0.46s CPU 0.52s WALL ( 4627 calls) cdiaghg : 622.54s CPU 623.85s WALL ( 4871 calls) cegterg:over : 51.96s CPU 52.07s WALL ( 4627 calls) cegterg:upda : 26.39s CPU 26.46s WALL ( 4627 calls) cegterg:last : 16.36s CPU 16.41s WALL ( 760 calls) cdiaghg:chol : 15.99s CPU 16.20s WALL ( 4871 calls) cdiaghg:inve : 13.72s CPU 13.68s WALL ( 4871 calls) cdiaghg:para : 79.29s CPU 79.59s WALL ( 9742 calls) Called by h_psi: h_psi:vloc : 995.63s CPU 881.42s WALL ( 5143 calls) h_psi:vnl : 39.55s CPU 39.48s WALL ( 5143 calls) add_vuspsi : 15.76s CPU 15.88s WALL ( 5143 calls) General routines calbec : 23.75s CPU 23.58s WALL ( 5143 calls) fft : 0.12s CPU 0.06s WALL ( 19 calls) ffts : 0.04s CPU 0.02s WALL ( 4 calls) fftw : 985.93s CPU 872.14s WALL ( 1041764 calls) interpolate : 0.06s CPU 0.03s WALL ( 4 calls) davcio : 0.36s CPU 6.79s WALL ( 488 calls) Parallel routines fft_scatter : 835.12s CPU 786.63s WALL ( 1041787 calls) PWSCF : 33m30.89s CPU 32m28.42s WALL This run was terminated on: 15:52:37 15Mar2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=