Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20: 2:19 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Te2Ir.save/ file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 95 68 19 2875 1720 267 Max 96 69 20 2878 1745 270 Sum 3433 2449 697 103525 62303 9653 bravais-lattice index = 14 lattice parameter (alat) = 11.6165 a.u. unit-cell volume = 1071.4607 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 58.00 number of Kohn-Sham states= 70 kinetic-energy cutoff = 57.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.616524 celldm(2)= 1.000000 celldm(3)= 0.683514 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 0.683514 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 1.463027 ) PseudoPot. # 1 for Te read from file: /users/gautes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ir read from file: /users/gautes/Pseudo/Ir.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: cd4c837ca97213b67411386bdf0d9b77 Pseudo is Ultrasoft + core correction, Zval = 17.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1277 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 Te 6.00 127.60000 Te( 1.00) Ir 17.00 192.21700 Ir( 1.00) 8 Sym. Ops., with inversion, found (note: 8 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [1,1,0] cryst. s( 3) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 3) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,-1,0] cryst. s( 4) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 4) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 inversion cryst. s( 5) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 6) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 6) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inv. 180 deg rotation - cart. axis [1,1,0] 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. 180 deg rotation - cart. axis [1,-1,0] 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_2h (mmm) there are 10 classes and 2 irreducible representations the character table: E -E C2 C2' C2'' i -i s_v s_v' s_v'' -C2 -C2' -C2'' -s_v -s_v' -s_v' G_5+ 2.00 -2.00 0.00 0.00 0.00 2.00 -2.00 0.00 0.00 0.00 G_5- 2.00 -2.00 0.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] C2' -C2' 3 -3 180 deg rotation - cart. axis [1,1,0] C2'' -C2'' 4 -4 180 deg rotation - cart. axis [1,-1,0] i 5 inversion -i -5 inversion E s_v -s_v 6 -6 inv. 180 deg rotation - cart. axis [0,0,1] s_v'-s_v' 7 -7 inv. 180 deg rotation - cart. axis [1,1,0] s_v''-s_v' 8 -8 inv. 180 deg rotation - cart. axis [1,-1,0] Cartesian axes number of k points= 301 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 2) = ( 0.0000000 0.0192308 -0.0000000), wk = 0.0033223 k( 3) = ( 0.0000000 0.0384615 -0.0000000), wk = 0.0033223 k( 4) = ( 0.0000000 0.0576923 -0.0000000), wk = 0.0033223 k( 5) = ( 0.0000000 0.0769231 -0.0000000), wk = 0.0033223 k( 6) = ( 0.0000000 0.0961538 -0.0000000), wk = 0.0033223 k( 7) = ( 0.0000000 0.1153846 -0.0000000), wk = 0.0033223 k( 8) = ( 0.0000000 0.1346154 -0.0000000), wk = 0.0033223 k( 9) = ( 0.0000000 0.1538461 -0.0000000), wk = 0.0033223 k( 10) = ( 0.0000000 0.1730769 -0.0000000), wk = 0.0033223 k( 11) = ( 0.0000000 0.1923077 -0.0000000), wk = 0.0033223 k( 12) = ( 0.0000000 0.2115385 -0.0000000), wk = 0.0033223 k( 13) = ( 0.0000000 0.2307692 -0.0000000), wk = 0.0033223 k( 14) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0033223 k( 15) = ( 0.0000000 0.2692308 -0.0000000), wk = 0.0033223 k( 16) = ( 0.0000000 0.2884615 -0.0000000), wk = 0.0033223 k( 17) = ( 0.0000000 0.3076923 -0.0000000), wk = 0.0033223 k( 18) = ( 0.0000000 0.3269231 -0.0000000), wk = 0.0033223 k( 19) = ( 0.0000000 0.3461538 -0.0000000), wk = 0.0033223 k( 20) = ( 0.0000000 0.3653846 -0.0000000), wk = 0.0033223 k( 21) = ( 0.0000000 0.3846154 -0.0000000), wk = 0.0033223 k( 22) = ( 0.0000000 0.4038462 -0.0000000), wk = 0.0033223 k( 23) = ( 0.0000000 0.4230769 -0.0000000), wk = 0.0033223 k( 24) = ( 0.0000000 0.4423077 -0.0000000), wk = 0.0033223 k( 25) = ( 0.0000000 0.4615385 -0.0000000), wk = 0.0033223 k( 26) = ( 0.0000000 0.4807692 -0.0000000), wk = 0.0033223 k( 27) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033223 k( 28) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033223 k( 29) = ( 0.0192308 0.5000000 -0.0000000), wk = 0.0033223 k( 30) = ( 0.0384615 0.5000000 -0.0000000), wk = 0.0033223 k( 31) = ( 0.0576923 0.5000000 -0.0000000), wk = 0.0033223 k( 32) = ( 0.0769231 0.5000000 -0.0000000), wk = 0.0033223 k( 33) = ( 0.0961538 0.5000000 -0.0000000), wk = 0.0033223 k( 34) = ( 0.1153846 0.5000000 -0.0000000), wk = 0.0033223 k( 35) = ( 0.1346154 0.5000000 -0.0000000), wk = 0.0033223 k( 36) = ( 0.1538461 0.5000000 -0.0000000), wk = 0.0033223 k( 37) = ( 0.1730769 0.5000000 -0.0000000), wk = 0.0033223 k( 38) = ( 0.1923077 0.5000000 -0.0000000), wk = 0.0033223 k( 39) = ( 0.2115385 0.5000000 -0.0000000), wk = 0.0033223 k( 40) = ( 0.2307692 0.5000000 -0.0000000), wk = 0.0033223 k( 41) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0033223 k( 42) = ( 0.2692308 0.5000000 -0.0000000), wk = 0.0033223 k( 43) = ( 0.2884615 0.5000000 -0.0000000), wk = 0.0033223 k( 44) = ( 0.3076923 0.5000000 -0.0000000), wk = 0.0033223 k( 45) = ( 0.3269231 0.5000000 -0.0000000), wk = 0.0033223 k( 46) = ( 0.3461538 0.5000000 -0.0000000), wk = 0.0033223 k( 47) = ( 0.3653846 0.5000000 -0.0000000), wk = 0.0033223 k( 48) = ( 0.3846154 0.5000000 -0.0000000), wk = 0.0033223 k( 49) = ( 0.4038462 0.5000000 -0.0000000), wk = 0.0033223 k( 50) = ( 0.4230769 0.5000000 -0.0000000), wk = 0.0033223 k( 51) = ( 0.4423077 0.5000000 -0.0000000), wk = 0.0033223 k( 52) = ( 0.4615385 0.5000000 -0.0000000), wk = 0.0033223 k( 53) = ( 0.4807692 0.5000000 -0.0000000), wk = 0.0033223 k( 54) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033223 k( 55) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033223 k( 56) = ( 0.4864865 0.4864865 -0.0000000), wk = 0.0033223 k( 57) = ( 0.4729730 0.4729730 -0.0000000), wk = 0.0033223 k( 58) = ( 0.4594595 0.4594595 -0.0000000), wk = 0.0033223 k( 59) = ( 0.4459459 0.4459459 -0.0000000), wk = 0.0033223 k( 60) = ( 0.4324324 0.4324324 -0.0000000), wk = 0.0033223 k( 61) = ( 0.4189189 0.4189189 -0.0000000), wk = 0.0033223 k( 62) = ( 0.4054054 0.4054054 -0.0000000), wk = 0.0033223 k( 63) = ( 0.3918919 0.3918919 -0.0000000), wk = 0.0033223 k( 64) = ( 0.3783784 0.3783784 -0.0000000), wk = 0.0033223 k( 65) = ( 0.3648649 0.3648649 -0.0000000), wk = 0.0033223 k( 66) = ( 0.3513514 0.3513513 -0.0000000), wk = 0.0033223 k( 67) = ( 0.3378378 0.3378378 -0.0000000), wk = 0.0033223 k( 68) = ( 0.3243243 0.3243243 -0.0000000), wk = 0.0033223 k( 69) = ( 0.3108108 0.3108108 -0.0000000), wk = 0.0033223 k( 70) = ( 0.2972973 0.2972973 -0.0000000), wk = 0.0033223 k( 71) = ( 0.2837838 0.2837838 -0.0000000), wk = 0.0033223 k( 72) = ( 0.2702703 0.2702703 -0.0000000), wk = 0.0033223 k( 73) = ( 0.2567568 0.2567568 -0.0000000), wk = 0.0033223 k( 74) = ( 0.2432432 0.2432432 -0.0000000), wk = 0.0033223 k( 75) = ( 0.2297297 0.2297297 -0.0000000), wk = 0.0033223 k( 76) = ( 0.2162162 0.2162162 -0.0000000), wk = 0.0033223 k( 77) = ( 0.2027027 0.2027027 -0.0000000), wk = 0.0033223 k( 78) = ( 0.1891892 0.1891892 -0.0000000), wk = 0.0033223 k( 79) = ( 0.1756757 0.1756757 -0.0000000), wk = 0.0033223 k( 80) = ( 0.1621622 0.1621622 -0.0000000), wk = 0.0033223 k( 81) = ( 0.1486486 0.1486486 -0.0000000), wk = 0.0033223 k( 82) = ( 0.1351351 0.1351351 -0.0000000), wk = 0.0033223 k( 83) = ( 0.1216216 0.1216216 -0.0000000), wk = 0.0033223 k( 84) = ( 0.1081081 0.1081081 -0.0000000), wk = 0.0033223 k( 85) = ( 0.0945946 0.0945946 -0.0000000), wk = 0.0033223 k( 86) = ( 0.0810811 0.0810811 -0.0000000), wk = 0.0033223 k( 87) = ( 0.0675676 0.0675676 -0.0000000), wk = 0.0033223 k( 88) = ( 0.0540540 0.0540540 -0.0000000), wk = 0.0033223 k( 89) = ( 0.0405405 0.0405405 -0.0000000), wk = 0.0033223 k( 90) = ( 0.0270270 0.0270270 -0.0000000), wk = 0.0033223 k( 91) = ( 0.0135135 0.0135135 -0.0000000), wk = 0.0033223 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 93) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 94) = ( 0.0000000 0.0000000 0.0192503), wk = 0.0033223 k( 95) = ( 0.0000000 0.0000000 0.0385007), wk = 0.0033223 k( 96) = ( 0.0000000 0.0000000 0.0577511), wk = 0.0033223 k( 97) = ( 0.0000000 0.0000000 0.0770014), wk = 0.0033223 k( 98) = ( 0.0000000 0.0000000 0.0962518), wk = 0.0033223 k( 99) = ( 0.0000000 0.0000000 0.1155021), wk = 0.0033223 k( 100) = ( 0.0000000 0.0000000 0.1347525), wk = 0.0033223 k( 101) = ( 0.0000000 0.0000000 0.1540028), wk = 0.0033223 k( 102) = ( 0.0000000 0.0000000 0.1732532), wk = 0.0033223 k( 103) = ( 0.0000000 0.0000000 0.1925035), wk = 0.0033223 k( 104) = ( 0.0000000 0.0000000 0.2117539), wk = 0.0033223 k( 105) = ( 0.0000000 0.0000000 0.2310042), wk = 0.0033223 k( 106) = ( 0.0000000 0.0000000 0.2502546), wk = 0.0033223 k( 107) = ( 0.0000000 0.0000000 0.2695050), wk = 0.0033223 k( 108) = ( 0.0000000 0.0000000 0.2887553), wk = 0.0033223 k( 109) = ( 0.0000000 0.0000000 0.3080057), wk = 0.0033223 k( 110) = ( 0.0000000 0.0000000 0.3272560), wk = 0.0033223 k( 111) = ( 0.0000000 0.0000000 0.3465064), wk = 0.0033223 k( 112) = ( 0.0000000 0.0000000 0.3657567), wk = 0.0033223 k( 113) = ( 0.0000000 0.0000000 0.3850071), wk = 0.0033223 k( 114) = ( 0.0000000 0.0000000 0.4042574), wk = 0.0033223 k( 115) = ( 0.0000000 0.0000000 0.4235078), wk = 0.0033223 k( 116) = ( 0.0000000 0.0000000 0.4427581), wk = 0.0033223 k( 117) = ( 0.0000000 0.0000000 0.4620085), wk = 0.0033223 k( 118) = ( 0.0000000 0.0000000 0.4812588), wk = 0.0033223 k( 119) = ( 0.0000000 0.0000000 0.5005092), wk = 0.0033223 k( 120) = ( 0.0000000 0.0000000 0.5197595), wk = 0.0033223 k( 121) = ( 0.0000000 0.0000000 0.5390099), wk = 0.0033223 k( 122) = ( 0.0000000 0.0000000 0.5582603), wk = 0.0033223 k( 123) = ( 0.0000000 0.0000000 0.5775106), wk = 0.0033223 k( 124) = ( 0.0000000 0.0000000 0.5967610), wk = 0.0033223 k( 125) = ( 0.0000000 0.0000000 0.6160113), wk = 0.0033223 k( 126) = ( 0.0000000 0.0000000 0.6352617), wk = 0.0033223 k( 127) = ( 0.0000000 0.0000000 0.6545120), wk = 0.0033223 k( 128) = ( 0.0000000 0.0000000 0.6737624), wk = 0.0033223 k( 129) = ( 0.0000000 0.0000000 0.6930127), wk = 0.0033223 k( 130) = ( 0.0000000 0.0000000 0.7122631), wk = 0.0033223 k( 131) = ( 0.0000000 0.0000000 0.7315134), wk = 0.0033223 k( 132) = ( 0.0000000 0.0000000 0.7315134), wk = 0.0033223 k( 133) = ( 0.0000000 0.0192308 0.7315134), wk = 0.0033223 k( 134) = ( 0.0000000 0.0384615 0.7315134), wk = 0.0033223 k( 135) = ( 0.0000000 0.0576923 0.7315134), wk = 0.0033223 k( 136) = ( 0.0000000 0.0769231 0.7315134), wk = 0.0033223 k( 137) = ( 0.0000000 0.0961538 0.7315134), wk = 0.0033223 k( 138) = ( 0.0000000 0.1153846 0.7315134), wk = 0.0033223 k( 139) = ( 0.0000000 0.1346154 0.7315134), wk = 0.0033223 k( 140) = ( 0.0000000 0.1538461 0.7315134), wk = 0.0033223 k( 141) = ( 0.0000000 0.1730769 0.7315134), wk = 0.0033223 k( 142) = ( 0.0000000 0.1923077 0.7315134), wk = 0.0033223 k( 143) = ( 0.0000000 0.2115385 0.7315134), wk = 0.0033223 k( 144) = ( 0.0000000 0.2307692 0.7315134), wk = 0.0033223 k( 145) = ( 0.0000000 0.2500000 0.7315134), wk = 0.0033223 k( 146) = ( 0.0000000 0.2692308 0.7315134), wk = 0.0033223 k( 147) = ( 0.0000000 0.2884615 0.7315134), wk = 0.0033223 k( 148) = ( 0.0000000 0.3076923 0.7315134), wk = 0.0033223 k( 149) = ( 0.0000000 0.3269231 0.7315134), wk = 0.0033223 k( 150) = ( 0.0000000 0.3461538 0.7315134), wk = 0.0033223 k( 151) = ( 0.0000000 0.3653846 0.7315134), wk = 0.0033223 k( 152) = ( 0.0000000 0.3846154 0.7315134), wk = 0.0033223 k( 153) = ( 0.0000000 0.4038462 0.7315134), wk = 0.0033223 k( 154) = ( 0.0000000 0.4230769 0.7315134), wk = 0.0033223 k( 155) = ( 0.0000000 0.4423077 0.7315134), wk = 0.0033223 k( 156) = ( 0.0000000 0.4615385 0.7315134), wk = 0.0033223 k( 157) = ( 0.0000000 0.4807692 0.7315134), wk = 0.0033223 k( 158) = ( 0.0000000 0.5000000 0.7315134), wk = 0.0033223 k( 159) = ( 0.0000000 0.5000000 0.7315134), wk = 0.0033223 k( 160) = ( 0.0192308 0.5000000 0.7315134), wk = 0.0033223 k( 161) = ( 0.0384615 0.5000000 0.7315134), wk = 0.0033223 k( 162) = ( 0.0576923 0.5000000 0.7315134), wk = 0.0033223 k( 163) = ( 0.0769231 0.5000000 0.7315134), wk = 0.0033223 k( 164) = ( 0.0961538 0.5000000 0.7315134), wk = 0.0033223 k( 165) = ( 0.1153846 0.5000000 0.7315134), wk = 0.0033223 k( 166) = ( 0.1346154 0.5000000 0.7315134), wk = 0.0033223 k( 167) = ( 0.1538461 0.5000000 0.7315134), wk = 0.0033223 k( 168) = ( 0.1730769 0.5000000 0.7315134), wk = 0.0033223 k( 169) = ( 0.1923077 0.5000000 0.7315134), wk = 0.0033223 k( 170) = ( 0.2115385 0.5000000 0.7315134), wk = 0.0033223 k( 171) = ( 0.2307692 0.5000000 0.7315134), wk = 0.0033223 k( 172) = ( 0.2500000 0.5000000 0.7315134), wk = 0.0033223 k( 173) = ( 0.2692308 0.5000000 0.7315134), wk = 0.0033223 k( 174) = ( 0.2884615 0.5000000 0.7315134), wk = 0.0033223 k( 175) = ( 0.3076923 0.5000000 0.7315134), wk = 0.0033223 k( 176) = ( 0.3269231 0.5000000 0.7315134), wk = 0.0033223 k( 177) = ( 0.3461538 0.5000000 0.7315134), wk = 0.0033223 k( 178) = ( 0.3653846 0.5000000 0.7315134), wk = 0.0033223 k( 179) = ( 0.3846154 0.5000000 0.7315134), wk = 0.0033223 k( 180) = ( 0.4038462 0.5000000 0.7315134), wk = 0.0033223 k( 181) = ( 0.4230769 0.5000000 0.7315134), wk = 0.0033223 k( 182) = ( 0.4423077 0.5000000 0.7315134), wk = 0.0033223 k( 183) = ( 0.4615385 0.5000000 0.7315134), wk = 0.0033223 k( 184) = ( 0.4807692 0.5000000 0.7315134), wk = 0.0033223 k( 185) = ( 0.5000000 0.5000000 0.7315134), wk = 0.0033223 k( 186) = ( 0.5000000 0.5000000 0.7315134), wk = 0.0033223 k( 187) = ( 0.4864865 0.4864865 0.7315134), wk = 0.0033223 k( 188) = ( 0.4729730 0.4729730 0.7315134), wk = 0.0033223 k( 189) = ( 0.4594595 0.4594595 0.7315134), wk = 0.0033223 k( 190) = ( 0.4459459 0.4459459 0.7315134), wk = 0.0033223 k( 191) = ( 0.4324324 0.4324324 0.7315134), wk = 0.0033223 k( 192) = ( 0.4189189 0.4189189 0.7315134), wk = 0.0033223 k( 193) = ( 0.4054054 0.4054054 0.7315134), wk = 0.0033223 k( 194) = ( 0.3918919 0.3918919 0.7315134), wk = 0.0033223 k( 195) = ( 0.3783784 0.3783784 0.7315134), wk = 0.0033223 k( 196) = ( 0.3648649 0.3648649 0.7315134), wk = 0.0033223 k( 197) = ( 0.3513514 0.3513513 0.7315134), wk = 0.0033223 k( 198) = ( 0.3378378 0.3378378 0.7315134), wk = 0.0033223 k( 199) = ( 0.3243243 0.3243243 0.7315134), wk = 0.0033223 k( 200) = ( 0.3108108 0.3108108 0.7315134), wk = 0.0033223 k( 201) = ( 0.2972973 0.2972973 0.7315134), wk = 0.0033223 k( 202) = ( 0.2837838 0.2837838 0.7315134), wk = 0.0033223 k( 203) = ( 0.2702703 0.2702703 0.7315134), wk = 0.0033223 k( 204) = ( 0.2567568 0.2567568 0.7315134), wk = 0.0033223 k( 205) = ( 0.2432432 0.2432432 0.7315134), wk = 0.0033223 k( 206) = ( 0.2297297 0.2297297 0.7315134), wk = 0.0033223 k( 207) = ( 0.2162162 0.2162162 0.7315134), wk = 0.0033223 k( 208) = ( 0.2027027 0.2027027 0.7315134), wk = 0.0033223 k( 209) = ( 0.1891892 0.1891892 0.7315134), wk = 0.0033223 k( 210) = ( 0.1756757 0.1756757 0.7315134), wk = 0.0033223 k( 211) = ( 0.1621622 0.1621622 0.7315134), wk = 0.0033223 k( 212) = ( 0.1486486 0.1486486 0.7315134), wk = 0.0033223 k( 213) = ( 0.1351351 0.1351351 0.7315134), wk = 0.0033223 k( 214) = ( 0.1216216 0.1216216 0.7315134), wk = 0.0033223 k( 215) = ( 0.1081081 0.1081081 0.7315134), wk = 0.0033223 k( 216) = ( 0.0945946 0.0945946 0.7315134), wk = 0.0033223 k( 217) = ( 0.0810811 0.0810811 0.7315134), wk = 0.0033223 k( 218) = ( 0.0675676 0.0675676 0.7315134), wk = 0.0033223 k( 219) = ( 0.0540540 0.0540540 0.7315134), wk = 0.0033223 k( 220) = ( 0.0405405 0.0405405 0.7315134), wk = 0.0033223 k( 221) = ( 0.0270270 0.0270270 0.7315134), wk = 0.0033223 k( 222) = ( 0.0135135 0.0135135 0.7315134), wk = 0.0033223 k( 223) = ( 0.0000000 0.0000000 0.7315134), wk = 0.0033223 k( 224) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033223 k( 225) = ( 0.0000000 0.5000000 0.0192503), wk = 0.0033223 k( 226) = ( 0.0000000 0.5000000 0.0385007), wk = 0.0033223 k( 227) = ( 0.0000000 0.5000000 0.0577511), wk = 0.0033223 k( 228) = ( 0.0000000 0.5000000 0.0770014), wk = 0.0033223 k( 229) = ( 0.0000000 0.5000000 0.0962518), wk = 0.0033223 k( 230) = ( 0.0000000 0.5000000 0.1155021), wk = 0.0033223 k( 231) = ( 0.0000000 0.5000000 0.1347525), wk = 0.0033223 k( 232) = ( 0.0000000 0.5000000 0.1540028), wk = 0.0033223 k( 233) = ( 0.0000000 0.5000000 0.1732532), wk = 0.0033223 k( 234) = ( 0.0000000 0.5000000 0.1925035), wk = 0.0033223 k( 235) = ( 0.0000000 0.5000000 0.2117539), wk = 0.0033223 k( 236) = ( 0.0000000 0.5000000 0.2310042), wk = 0.0033223 k( 237) = ( 0.0000000 0.5000000 0.2502546), wk = 0.0033223 k( 238) = ( 0.0000000 0.5000000 0.2695050), wk = 0.0033223 k( 239) = ( 0.0000000 0.5000000 0.2887553), wk = 0.0033223 k( 240) = ( 0.0000000 0.5000000 0.3080057), wk = 0.0033223 k( 241) = ( 0.0000000 0.5000000 0.3272560), wk = 0.0033223 k( 242) = ( 0.0000000 0.5000000 0.3465064), wk = 0.0033223 k( 243) = ( 0.0000000 0.5000000 0.3657567), wk = 0.0033223 k( 244) = ( 0.0000000 0.5000000 0.3850071), wk = 0.0033223 k( 245) = ( 0.0000000 0.5000000 0.4042574), wk = 0.0033223 k( 246) = ( 0.0000000 0.5000000 0.4235078), wk = 0.0033223 k( 247) = ( 0.0000000 0.5000000 0.4427581), wk = 0.0033223 k( 248) = ( 0.0000000 0.5000000 0.4620085), wk = 0.0033223 k( 249) = ( 0.0000000 0.5000000 0.4812588), wk = 0.0033223 k( 250) = ( 0.0000000 0.5000000 0.5005092), wk = 0.0033223 k( 251) = ( 0.0000000 0.5000000 0.5197595), wk = 0.0033223 k( 252) = ( 0.0000000 0.5000000 0.5390099), wk = 0.0033223 k( 253) = ( 0.0000000 0.5000000 0.5582603), wk = 0.0033223 k( 254) = ( 0.0000000 0.5000000 0.5775106), wk = 0.0033223 k( 255) = ( 0.0000000 0.5000000 0.5967610), wk = 0.0033223 k( 256) = ( 0.0000000 0.5000000 0.6160113), wk = 0.0033223 k( 257) = ( 0.0000000 0.5000000 0.6352617), wk = 0.0033223 k( 258) = ( 0.0000000 0.5000000 0.6545120), wk = 0.0033223 k( 259) = ( 0.0000000 0.5000000 0.6737624), wk = 0.0033223 k( 260) = ( 0.0000000 0.5000000 0.6930127), wk = 0.0033223 k( 261) = ( 0.0000000 0.5000000 0.7122631), wk = 0.0033223 k( 262) = ( 0.0000000 0.5000000 0.7315134), wk = 0.0033223 k( 263) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0033223 k( 264) = ( 0.5000000 0.5000000 0.0192503), wk = 0.0033223 k( 265) = ( 0.5000000 0.5000000 0.0385007), wk = 0.0033223 k( 266) = ( 0.5000000 0.5000000 0.0577511), wk = 0.0033223 k( 267) = ( 0.5000000 0.5000000 0.0770014), wk = 0.0033223 k( 268) = ( 0.5000000 0.5000000 0.0962518), wk = 0.0033223 k( 269) = ( 0.5000000 0.5000000 0.1155021), wk = 0.0033223 k( 270) = ( 0.5000000 0.5000000 0.1347525), wk = 0.0033223 k( 271) = ( 0.5000000 0.5000000 0.1540028), wk = 0.0033223 k( 272) = ( 0.5000000 0.5000000 0.1732532), wk = 0.0033223 k( 273) = ( 0.5000000 0.5000000 0.1925035), wk = 0.0033223 k( 274) = ( 0.5000000 0.5000000 0.2117539), wk = 0.0033223 k( 275) = ( 0.5000000 0.5000000 0.2310042), wk = 0.0033223 k( 276) = ( 0.5000000 0.5000000 0.2502546), wk = 0.0033223 k( 277) = ( 0.5000000 0.5000000 0.2695050), wk = 0.0033223 k( 278) = ( 0.5000000 0.5000000 0.2887553), wk = 0.0033223 k( 279) = ( 0.5000000 0.5000000 0.3080057), wk = 0.0033223 k( 280) = ( 0.5000000 0.5000000 0.3272560), wk = 0.0033223 k( 281) = ( 0.5000000 0.5000000 0.3465064), wk = 0.0033223 k( 282) = ( 0.5000000 0.5000000 0.3657567), wk = 0.0033223 k( 283) = ( 0.5000000 0.5000000 0.3850071), wk = 0.0033223 k( 284) = ( 0.5000000 0.5000000 0.4042574), wk = 0.0033223 k( 285) = ( 0.5000000 0.5000000 0.4235078), wk = 0.0033223 k( 286) = ( 0.5000000 0.5000000 0.4427581), wk = 0.0033223 k( 287) = ( 0.5000000 0.5000000 0.4620085), wk = 0.0033223 k( 288) = ( 0.5000000 0.5000000 0.4812588), wk = 0.0033223 k( 289) = ( 0.5000000 0.5000000 0.5005092), wk = 0.0033223 k( 290) = ( 0.5000000 0.5000000 0.5197595), wk = 0.0033223 k( 291) = ( 0.5000000 0.5000000 0.5390099), wk = 0.0033223 k( 292) = ( 0.5000000 0.5000000 0.5582603), wk = 0.0033223 k( 293) = ( 0.5000000 0.5000000 0.5775106), wk = 0.0033223 k( 294) = ( 0.5000000 0.5000000 0.5967610), wk = 0.0033223 k( 295) = ( 0.5000000 0.5000000 0.6160113), wk = 0.0033223 k( 296) = ( 0.5000000 0.5000000 0.6352617), wk = 0.0033223 k( 297) = ( 0.5000000 0.5000000 0.6545120), wk = 0.0033223 k( 298) = ( 0.5000000 0.5000000 0.6737624), wk = 0.0033223 k( 299) = ( 0.5000000 0.5000000 0.6930127), wk = 0.0033223 k( 300) = ( 0.5000000 0.5000000 0.7122631), wk = 0.0033223 k( 301) = ( 0.5000000 0.5000000 0.7315134), wk = 0.0033223 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 2) = ( 0.0000000 0.0192308 0.0000000), wk = 0.0033223 k( 3) = ( 0.0000000 0.0384615 0.0000000), wk = 0.0033223 k( 4) = ( 0.0000000 0.0576923 0.0000000), wk = 0.0033223 k( 5) = ( 0.0000000 0.0769231 0.0000000), wk = 0.0033223 k( 6) = ( 0.0000000 0.0961538 0.0000000), wk = 0.0033223 k( 7) = ( 0.0000000 0.1153846 0.0000000), wk = 0.0033223 k( 8) = ( 0.0000000 0.1346154 0.0000000), wk = 0.0033223 k( 9) = ( 0.0000000 0.1538461 0.0000000), wk = 0.0033223 k( 10) = ( 0.0000000 0.1730769 0.0000000), wk = 0.0033223 k( 11) = ( 0.0000000 0.1923077 -0.0000000), wk = 0.0033223 k( 12) = ( 0.0000000 0.2115385 0.0000000), wk = 0.0033223 k( 13) = ( 0.0000000 0.2307692 -0.0000000), wk = 0.0033223 k( 14) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0033223 k( 15) = ( 0.0000000 0.2692308 0.0000000), wk = 0.0033223 k( 16) = ( 0.0000000 0.2884615 0.0000000), wk = 0.0033223 k( 17) = ( 0.0000000 0.3076923 -0.0000000), wk = 0.0033223 k( 18) = ( 0.0000000 0.3269231 0.0000000), wk = 0.0033223 k( 19) = ( 0.0000000 0.3461538 0.0000000), wk = 0.0033223 k( 20) = ( 0.0000000 0.3653846 0.0000000), wk = 0.0033223 k( 21) = ( 0.0000000 0.3846154 -0.0000000), wk = 0.0033223 k( 22) = ( 0.0000000 0.4038462 -0.0000000), wk = 0.0033223 k( 23) = ( 0.0000000 0.4230769 0.0000000), wk = 0.0033223 k( 24) = ( 0.0000000 0.4423077 0.0000000), wk = 0.0033223 k( 25) = ( 0.0000000 0.4615385 -0.0000000), wk = 0.0033223 k( 26) = ( 0.0000000 0.4807692 0.0000000), wk = 0.0033223 k( 27) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0033223 k( 28) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0033223 k( 29) = ( 0.0192308 0.5000000 0.0000000), wk = 0.0033223 k( 30) = ( 0.0384615 0.5000000 0.0000000), wk = 0.0033223 k( 31) = ( 0.0576923 0.5000000 -0.0000000), wk = 0.0033223 k( 32) = ( 0.0769231 0.5000000 0.0000000), wk = 0.0033223 k( 33) = ( 0.0961538 0.5000000 -0.0000000), wk = 0.0033223 k( 34) = ( 0.1153846 0.5000000 0.0000000), wk = 0.0033223 k( 35) = ( 0.1346154 0.5000000 0.0000000), wk = 0.0033223 k( 36) = ( 0.1538461 0.5000000 -0.0000000), wk = 0.0033223 k( 37) = ( 0.1730769 0.5000000 0.0000000), wk = 0.0033223 k( 38) = ( 0.1923077 0.5000000 -0.0000000), wk = 0.0033223 k( 39) = ( 0.2115385 0.5000000 0.0000000), wk = 0.0033223 k( 40) = ( 0.2307692 0.5000000 0.0000000), wk = 0.0033223 k( 41) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0033223 k( 42) = ( 0.2692308 0.5000000 0.0000000), wk = 0.0033223 k( 43) = ( 0.2884615 0.5000000 0.0000000), wk = 0.0033223 k( 44) = ( 0.3076923 0.5000000 -0.0000000), wk = 0.0033223 k( 45) = ( 0.3269231 0.5000000 0.0000000), wk = 0.0033223 k( 46) = ( 0.3461538 0.5000000 0.0000000), wk = 0.0033223 k( 47) = ( 0.3653846 0.5000000 0.0000000), wk = 0.0033223 k( 48) = ( 0.3846154 0.5000000 0.0000000), wk = 0.0033223 k( 49) = ( 0.4038462 0.5000000 0.0000000), wk = 0.0033223 k( 50) = ( 0.4230769 0.5000000 -0.0000000), wk = 0.0033223 k( 51) = ( 0.4423077 0.5000000 0.0000000), wk = 0.0033223 k( 52) = ( 0.4615385 0.5000000 0.0000000), wk = 0.0033223 k( 53) = ( 0.4807692 0.5000000 0.0000000), wk = 0.0033223 k( 54) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0033223 k( 55) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0033223 k( 56) = ( 0.4864865 0.4864865 0.0000000), wk = 0.0033223 k( 57) = ( 0.4729730 0.4729730 0.0000000), wk = 0.0033223 k( 58) = ( 0.4594595 0.4594595 0.0000000), wk = 0.0033223 k( 59) = ( 0.4459459 0.4459459 0.0000000), wk = 0.0033223 k( 60) = ( 0.4324324 0.4324324 0.0000000), wk = 0.0033223 k( 61) = ( 0.4189189 0.4189189 0.0000000), wk = 0.0033223 k( 62) = ( 0.4054054 0.4054054 -0.0000000), wk = 0.0033223 k( 63) = ( 0.3918919 0.3918919 -0.0000000), wk = 0.0033223 k( 64) = ( 0.3783784 0.3783784 0.0000000), wk = 0.0033223 k( 65) = ( 0.3648649 0.3648649 0.0000000), wk = 0.0033223 k( 66) = ( 0.3513514 0.3513514 -0.0000000), wk = 0.0033223 k( 67) = ( 0.3378378 0.3378378 -0.0000000), wk = 0.0033223 k( 68) = ( 0.3243243 0.3243243 0.0000000), wk = 0.0033223 k( 69) = ( 0.3108108 0.3108108 0.0000000), wk = 0.0033223 k( 70) = ( 0.2972973 0.2972973 -0.0000000), wk = 0.0033223 k( 71) = ( 0.2837838 0.2837838 -0.0000000), wk = 0.0033223 k( 72) = ( 0.2702703 0.2702703 0.0000000), wk = 0.0033223 k( 73) = ( 0.2567568 0.2567568 -0.0000000), wk = 0.0033223 k( 74) = ( 0.2432432 0.2432432 -0.0000000), wk = 0.0033223 k( 75) = ( 0.2297297 0.2297297 0.0000000), wk = 0.0033223 k( 76) = ( 0.2162162 0.2162162 0.0000000), wk = 0.0033223 k( 77) = ( 0.2027027 0.2027027 -0.0000000), wk = 0.0033223 k( 78) = ( 0.1891892 0.1891892 0.0000000), wk = 0.0033223 k( 79) = ( 0.1756757 0.1756757 -0.0000000), wk = 0.0033223 k( 80) = ( 0.1621622 0.1621622 0.0000000), wk = 0.0033223 k( 81) = ( 0.1486486 0.1486486 -0.0000000), wk = 0.0033223 k( 82) = ( 0.1351351 0.1351351 -0.0000000), wk = 0.0033223 k( 83) = ( 0.1216216 0.1216216 -0.0000000), wk = 0.0033223 k( 84) = ( 0.1081081 0.1081081 0.0000000), wk = 0.0033223 k( 85) = ( 0.0945946 0.0945946 -0.0000000), wk = 0.0033223 k( 86) = ( 0.0810811 0.0810811 0.0000000), wk = 0.0033223 k( 87) = ( 0.0675676 0.0675676 -0.0000000), wk = 0.0033223 k( 88) = ( 0.0540540 0.0540540 -0.0000000), wk = 0.0033223 k( 89) = ( 0.0405405 0.0405405 0.0000000), wk = 0.0033223 k( 90) = ( 0.0270270 0.0270270 0.0000000), wk = 0.0033223 k( 91) = ( 0.0135135 0.0135135 0.0000000), wk = 0.0033223 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 93) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 94) = ( 0.0000000 0.0000000 0.0131579), wk = 0.0033223 k( 95) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0033223 k( 96) = ( 0.0000000 0.0000000 0.0394737), wk = 0.0033223 k( 97) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0033223 k( 98) = ( 0.0000000 0.0000000 0.0657895), wk = 0.0033223 k( 99) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0033223 k( 100) = ( 0.0000000 0.0000000 0.0921053), wk = 0.0033223 k( 101) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0033223 k( 102) = ( 0.0000000 0.0000000 0.1184211), wk = 0.0033223 k( 103) = ( 0.0000000 0.0000000 0.1315790), wk = 0.0033223 k( 104) = ( 0.0000000 0.0000000 0.1447368), wk = 0.0033223 k( 105) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0033223 k( 106) = ( 0.0000000 0.0000000 0.1710526), wk = 0.0033223 k( 107) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0033223 k( 108) = ( 0.0000000 0.0000000 0.1973684), wk = 0.0033223 k( 109) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0033223 k( 110) = ( 0.0000000 0.0000000 0.2236842), wk = 0.0033223 k( 111) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0033223 k( 112) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0033223 k( 113) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0033223 k( 114) = ( 0.0000000 0.0000000 0.2763158), wk = 0.0033223 k( 115) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0033223 k( 116) = ( 0.0000000 0.0000000 0.3026316), wk = 0.0033223 k( 117) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0033223 k( 118) = ( 0.0000000 0.0000000 0.3289474), wk = 0.0033223 k( 119) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0033223 k( 120) = ( 0.0000000 0.0000000 0.3552632), wk = 0.0033223 k( 121) = ( 0.0000000 0.0000000 0.3684211), wk = 0.0033223 k( 122) = ( 0.0000000 0.0000000 0.3815789), wk = 0.0033223 k( 123) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0033223 k( 124) = ( 0.0000000 0.0000000 0.4078947), wk = 0.0033223 k( 125) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0033223 k( 126) = ( 0.0000000 0.0000000 0.4342105), wk = 0.0033223 k( 127) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0033223 k( 128) = ( 0.0000000 0.0000000 0.4605263), wk = 0.0033223 k( 129) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0033223 k( 130) = ( 0.0000000 0.0000000 0.4868421), wk = 0.0033223 k( 131) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033223 k( 132) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033223 k( 133) = ( 0.0000000 0.0192308 0.5000000), wk = 0.0033223 k( 134) = ( 0.0000000 0.0384615 0.5000000), wk = 0.0033223 k( 135) = ( 0.0000000 0.0576923 0.5000000), wk = 0.0033223 k( 136) = ( 0.0000000 0.0769231 0.5000000), wk = 0.0033223 k( 137) = ( 0.0000000 0.0961538 0.5000000), wk = 0.0033223 k( 138) = ( 0.0000000 0.1153846 0.5000000), wk = 0.0033223 k( 139) = ( 0.0000000 0.1346154 0.5000000), wk = 0.0033223 k( 140) = ( 0.0000000 0.1538461 0.5000000), wk = 0.0033223 k( 141) = ( 0.0000000 0.1730769 0.5000000), wk = 0.0033223 k( 142) = ( 0.0000000 0.1923077 0.5000000), wk = 0.0033223 k( 143) = ( 0.0000000 0.2115385 0.5000000), wk = 0.0033223 k( 144) = ( 0.0000000 0.2307692 0.5000000), wk = 0.0033223 k( 145) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0033223 k( 146) = ( 0.0000000 0.2692308 0.5000000), wk = 0.0033223 k( 147) = ( 0.0000000 0.2884615 0.5000000), wk = 0.0033223 k( 148) = ( 0.0000000 0.3076923 0.5000000), wk = 0.0033223 k( 149) = ( 0.0000000 0.3269231 0.5000000), wk = 0.0033223 k( 150) = ( 0.0000000 0.3461538 0.5000000), wk = 0.0033223 k( 151) = ( 0.0000000 0.3653846 0.5000000), wk = 0.0033223 k( 152) = ( 0.0000000 0.3846154 0.5000000), wk = 0.0033223 k( 153) = ( 0.0000000 0.4038462 0.5000000), wk = 0.0033223 k( 154) = ( 0.0000000 0.4230769 0.5000000), wk = 0.0033223 k( 155) = ( 0.0000000 0.4423077 0.5000000), wk = 0.0033223 k( 156) = ( 0.0000000 0.4615385 0.5000000), wk = 0.0033223 k( 157) = ( 0.0000000 0.4807692 0.5000000), wk = 0.0033223 k( 158) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0033223 k( 159) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0033223 k( 160) = ( 0.0192308 0.5000000 0.5000000), wk = 0.0033223 k( 161) = ( 0.0384615 0.5000000 0.5000000), wk = 0.0033223 k( 162) = ( 0.0576923 0.5000000 0.5000000), wk = 0.0033223 k( 163) = ( 0.0769231 0.5000000 0.5000000), wk = 0.0033223 k( 164) = ( 0.0961538 0.5000000 0.5000000), wk = 0.0033223 k( 165) = ( 0.1153846 0.5000000 0.5000000), wk = 0.0033223 k( 166) = ( 0.1346154 0.5000000 0.5000000), wk = 0.0033223 k( 167) = ( 0.1538461 0.5000000 0.5000000), wk = 0.0033223 k( 168) = ( 0.1730769 0.5000000 0.5000000), wk = 0.0033223 k( 169) = ( 0.1923077 0.5000000 0.5000000), wk = 0.0033223 k( 170) = ( 0.2115385 0.5000000 0.5000000), wk = 0.0033223 k( 171) = ( 0.2307692 0.5000000 0.5000000), wk = 0.0033223 k( 172) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0033223 k( 173) = ( 0.2692308 0.5000000 0.5000000), wk = 0.0033223 k( 174) = ( 0.2884615 0.5000000 0.5000000), wk = 0.0033223 k( 175) = ( 0.3076923 0.5000000 0.5000000), wk = 0.0033223 k( 176) = ( 0.3269231 0.5000000 0.5000000), wk = 0.0033223 k( 177) = ( 0.3461538 0.5000000 0.5000000), wk = 0.0033223 k( 178) = ( 0.3653846 0.5000000 0.5000000), wk = 0.0033223 k( 179) = ( 0.3846154 0.5000000 0.5000000), wk = 0.0033223 k( 180) = ( 0.4038462 0.5000000 0.5000000), wk = 0.0033223 k( 181) = ( 0.4230769 0.5000000 0.5000000), wk = 0.0033223 k( 182) = ( 0.4423077 0.5000000 0.5000000), wk = 0.0033223 k( 183) = ( 0.4615385 0.5000000 0.5000000), wk = 0.0033223 k( 184) = ( 0.4807692 0.5000000 0.5000000), wk = 0.0033223 k( 185) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 186) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 187) = ( 0.4864865 0.4864865 0.5000000), wk = 0.0033223 k( 188) = ( 0.4729730 0.4729730 0.5000000), wk = 0.0033223 k( 189) = ( 0.4594595 0.4594595 0.5000000), wk = 0.0033223 k( 190) = ( 0.4459459 0.4459459 0.5000000), wk = 0.0033223 k( 191) = ( 0.4324324 0.4324324 0.5000000), wk = 0.0033223 k( 192) = ( 0.4189189 0.4189189 0.5000000), wk = 0.0033223 k( 193) = ( 0.4054054 0.4054054 0.5000000), wk = 0.0033223 k( 194) = ( 0.3918919 0.3918919 0.5000000), wk = 0.0033223 k( 195) = ( 0.3783784 0.3783784 0.5000000), wk = 0.0033223 k( 196) = ( 0.3648649 0.3648649 0.5000000), wk = 0.0033223 k( 197) = ( 0.3513514 0.3513514 0.5000000), wk = 0.0033223 k( 198) = ( 0.3378378 0.3378378 0.5000000), wk = 0.0033223 k( 199) = ( 0.3243243 0.3243243 0.5000000), wk = 0.0033223 k( 200) = ( 0.3108108 0.3108108 0.5000000), wk = 0.0033223 k( 201) = ( 0.2972973 0.2972973 0.5000000), wk = 0.0033223 k( 202) = ( 0.2837838 0.2837838 0.5000000), wk = 0.0033223 k( 203) = ( 0.2702703 0.2702703 0.5000000), wk = 0.0033223 k( 204) = ( 0.2567568 0.2567568 0.5000000), wk = 0.0033223 k( 205) = ( 0.2432432 0.2432432 0.5000000), wk = 0.0033223 k( 206) = ( 0.2297297 0.2297297 0.5000000), wk = 0.0033223 k( 207) = ( 0.2162162 0.2162162 0.5000000), wk = 0.0033223 k( 208) = ( 0.2027027 0.2027027 0.5000000), wk = 0.0033223 k( 209) = ( 0.1891892 0.1891892 0.5000000), wk = 0.0033223 k( 210) = ( 0.1756757 0.1756757 0.5000000), wk = 0.0033223 k( 211) = ( 0.1621622 0.1621622 0.5000000), wk = 0.0033223 k( 212) = ( 0.1486486 0.1486486 0.5000000), wk = 0.0033223 k( 213) = ( 0.1351351 0.1351351 0.5000000), wk = 0.0033223 k( 214) = ( 0.1216216 0.1216216 0.5000000), wk = 0.0033223 k( 215) = ( 0.1081081 0.1081081 0.5000000), wk = 0.0033223 k( 216) = ( 0.0945946 0.0945946 0.5000000), wk = 0.0033223 k( 217) = ( 0.0810811 0.0810811 0.5000000), wk = 0.0033223 k( 218) = ( 0.0675676 0.0675676 0.5000000), wk = 0.0033223 k( 219) = ( 0.0540540 0.0540540 0.5000000), wk = 0.0033223 k( 220) = ( 0.0405405 0.0405405 0.5000000), wk = 0.0033223 k( 221) = ( 0.0270270 0.0270270 0.5000000), wk = 0.0033223 k( 222) = ( 0.0135135 0.0135135 0.5000000), wk = 0.0033223 k( 223) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033223 k( 224) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0033223 k( 225) = ( 0.0000000 0.5000000 0.0131579), wk = 0.0033223 k( 226) = ( 0.0000000 0.5000000 0.0263158), wk = 0.0033223 k( 227) = ( 0.0000000 0.5000000 0.0394737), wk = 0.0033223 k( 228) = ( 0.0000000 0.5000000 0.0526316), wk = 0.0033223 k( 229) = ( 0.0000000 0.5000000 0.0657895), wk = 0.0033223 k( 230) = ( 0.0000000 0.5000000 0.0789474), wk = 0.0033223 k( 231) = ( 0.0000000 0.5000000 0.0921053), wk = 0.0033223 k( 232) = ( 0.0000000 0.5000000 0.1052632), wk = 0.0033223 k( 233) = ( 0.0000000 0.5000000 0.1184210), wk = 0.0033223 k( 234) = ( 0.0000000 0.5000000 0.1315790), wk = 0.0033223 k( 235) = ( 0.0000000 0.5000000 0.1447368), wk = 0.0033223 k( 236) = ( 0.0000000 0.5000000 0.1578947), wk = 0.0033223 k( 237) = ( 0.0000000 0.5000000 0.1710526), wk = 0.0033223 k( 238) = ( 0.0000000 0.5000000 0.1842105), wk = 0.0033223 k( 239) = ( 0.0000000 0.5000000 0.1973684), wk = 0.0033223 k( 240) = ( 0.0000000 0.5000000 0.2105263), wk = 0.0033223 k( 241) = ( 0.0000000 0.5000000 0.2236842), wk = 0.0033223 k( 242) = ( 0.0000000 0.5000000 0.2368421), wk = 0.0033223 k( 243) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0033223 k( 244) = ( 0.0000000 0.5000000 0.2631579), wk = 0.0033223 k( 245) = ( 0.0000000 0.5000000 0.2763158), wk = 0.0033223 k( 246) = ( 0.0000000 0.5000000 0.2894737), wk = 0.0033223 k( 247) = ( 0.0000000 0.5000000 0.3026316), wk = 0.0033223 k( 248) = ( 0.0000000 0.5000000 0.3157895), wk = 0.0033223 k( 249) = ( 0.0000000 0.5000000 0.3289474), wk = 0.0033223 k( 250) = ( 0.0000000 0.5000000 0.3421053), wk = 0.0033223 k( 251) = ( 0.0000000 0.5000000 0.3552632), wk = 0.0033223 k( 252) = ( 0.0000000 0.5000000 0.3684211), wk = 0.0033223 k( 253) = ( 0.0000000 0.5000000 0.3815790), wk = 0.0033223 k( 254) = ( 0.0000000 0.5000000 0.3947368), wk = 0.0033223 k( 255) = ( 0.0000000 0.5000000 0.4078947), wk = 0.0033223 k( 256) = ( 0.0000000 0.5000000 0.4210526), wk = 0.0033223 k( 257) = ( 0.0000000 0.5000000 0.4342105), wk = 0.0033223 k( 258) = ( 0.0000000 0.5000000 0.4473684), wk = 0.0033223 k( 259) = ( 0.0000000 0.5000000 0.4605263), wk = 0.0033223 k( 260) = ( 0.0000000 0.5000000 0.4736842), wk = 0.0033223 k( 261) = ( 0.0000000 0.5000000 0.4868421), wk = 0.0033223 k( 262) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0033223 k( 263) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0033223 k( 264) = ( 0.5000000 0.5000000 0.0131579), wk = 0.0033223 k( 265) = ( 0.5000000 0.5000000 0.0263158), wk = 0.0033223 k( 266) = ( 0.5000000 0.5000000 0.0394737), wk = 0.0033223 k( 267) = ( 0.5000000 0.5000000 0.0526316), wk = 0.0033223 k( 268) = ( 0.5000000 0.5000000 0.0657895), wk = 0.0033223 k( 269) = ( 0.5000000 0.5000000 0.0789474), wk = 0.0033223 k( 270) = ( 0.5000000 0.5000000 0.0921053), wk = 0.0033223 k( 271) = ( 0.5000000 0.5000000 0.1052632), wk = 0.0033223 k( 272) = ( 0.5000000 0.5000000 0.1184210), wk = 0.0033223 k( 273) = ( 0.5000000 0.5000000 0.1315790), wk = 0.0033223 k( 274) = ( 0.5000000 0.5000000 0.1447368), wk = 0.0033223 k( 275) = ( 0.5000000 0.5000000 0.1578947), wk = 0.0033223 k( 276) = ( 0.5000000 0.5000000 0.1710526), wk = 0.0033223 k( 277) = ( 0.5000000 0.5000000 0.1842105), wk = 0.0033223 k( 278) = ( 0.5000000 0.5000000 0.1973684), wk = 0.0033223 k( 279) = ( 0.5000000 0.5000000 0.2105263), wk = 0.0033223 k( 280) = ( 0.5000000 0.5000000 0.2236842), wk = 0.0033223 k( 281) = ( 0.5000000 0.5000000 0.2368421), wk = 0.0033223 k( 282) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0033223 k( 283) = ( 0.5000000 0.5000000 0.2631579), wk = 0.0033223 k( 284) = ( 0.5000000 0.5000000 0.2763158), wk = 0.0033223 k( 285) = ( 0.5000000 0.5000000 0.2894737), wk = 0.0033223 k( 286) = ( 0.5000000 0.5000000 0.3026316), wk = 0.0033223 k( 287) = ( 0.5000000 0.5000000 0.3157895), wk = 0.0033223 k( 288) = ( 0.5000000 0.5000000 0.3289474), wk = 0.0033223 k( 289) = ( 0.5000000 0.5000000 0.3421053), wk = 0.0033223 k( 290) = ( 0.5000000 0.5000000 0.3552632), wk = 0.0033223 k( 291) = ( 0.5000000 0.5000000 0.3684211), wk = 0.0033223 k( 292) = ( 0.5000000 0.5000000 0.3815789), wk = 0.0033223 k( 293) = ( 0.5000000 0.5000000 0.3947368), wk = 0.0033223 k( 294) = ( 0.5000000 0.5000000 0.4078947), wk = 0.0033223 k( 295) = ( 0.5000000 0.5000000 0.4210526), wk = 0.0033223 k( 296) = ( 0.5000000 0.5000000 0.4342105), wk = 0.0033223 k( 297) = ( 0.5000000 0.5000000 0.4473684), wk = 0.0033223 k( 298) = ( 0.5000000 0.5000000 0.4605263), wk = 0.0033223 k( 299) = ( 0.5000000 0.5000000 0.4736842), wk = 0.0033223 k( 300) = ( 0.5000000 0.5000000 0.4868421), wk = 0.0033223 k( 301) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033223 Dense grid: 103525 G-vectors FFT dimensions: ( 72, 72, 45) Smooth grid: 62303 G-vectors FFT dimensions: ( 60, 60, 40) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.47 Mb ( 440, 70) NL pseudopotentials 0.68 Mb ( 220, 204) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2877) G-vector shells 0.01 Mb ( 1300) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.88 Mb ( 440, 280) Each subspace H/S matrix 0.07 Mb ( 70, 70) Each matrix 0.44 Mb ( 204, 2, 70) The potential is recalculated from file : ./Te2Ir.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.1 secs Computing kpt #: 2 total cpu time spent up to now is 4.0 secs Computing kpt #: 3 total cpu time spent up to now is 5.0 secs Computing kpt #: 4 total cpu time spent up to now is 6.0 secs Computing kpt #: 5 total cpu time spent up to now is 6.9 secs Computing kpt #: 6 total cpu time spent up to now is 7.8 secs Computing kpt #: 7 total cpu time spent up to now is 8.7 secs Computing kpt #: 8 total cpu time spent up to now is 9.7 secs Computing kpt #: 9 total cpu time spent up to now is 10.6 secs Computing kpt #: 10 total cpu time spent up to now is 11.6 secs Computing kpt #: 11 total cpu time spent up to now is 12.5 secs Computing kpt #: 12 total cpu time spent up to now is 13.4 secs Computing kpt #: 13 total cpu time spent up to now is 14.3 secs Computing kpt #: 14 total cpu time spent up to now is 15.2 secs Computing kpt #: 15 total cpu time spent up to now is 16.1 secs Computing kpt #: 16 total cpu time spent up to now is 17.0 secs Computing kpt #: 17 total cpu time spent up to now is 18.0 secs Computing kpt #: 18 total cpu time spent up to now is 18.9 secs Computing kpt #: 19 total cpu time spent up to now is 19.8 secs Computing kpt #: 20 total cpu time spent up to now is 20.7 secs Computing kpt #: 21 total cpu time spent up to now is 21.6 secs Computing kpt #: 22 total cpu time spent up to now is 22.5 secs Computing kpt #: 23 total cpu time spent up to now is 23.5 secs Computing kpt #: 24 total cpu time spent up to now is 24.4 secs Computing kpt #: 25 total cpu time spent up to now is 25.4 secs Computing kpt #: 26 total cpu time spent up to now is 26.4 secs Computing kpt #: 27 total cpu time spent up to now is 27.4 secs Computing kpt #: 28 total cpu time spent up to now is 28.5 secs Computing kpt #: 29 total cpu time spent up to now is 29.5 secs Computing kpt #: 30 total cpu time spent up to now is 30.6 secs Computing kpt #: 31 total cpu time spent up to now is 31.6 secs Computing kpt #: 32 total cpu time spent up to now is 32.7 secs Computing kpt #: 33 total cpu time spent up to now is 33.7 secs Computing kpt #: 34 total cpu time spent up to now is 34.7 secs Computing kpt #: 35 total cpu time spent up to now is 35.8 secs Computing kpt #: 36 total cpu time spent up to now is 36.8 secs Computing kpt #: 37 total cpu time spent up to now is 37.9 secs Computing kpt #: 38 total cpu time spent up to now is 39.1 secs Computing kpt #: 39 total cpu time spent up to now is 40.1 secs Computing kpt #: 40 total cpu time spent up to now is 41.2 secs Computing kpt #: 41 total cpu time spent up to now is 42.3 secs Computing kpt #: 42 total cpu time spent up to now is 43.3 secs Computing kpt #: 43 total cpu time spent up to now is 44.5 secs Computing kpt #: 44 total cpu time spent up to now is 45.7 secs Computing kpt #: 45 total cpu time spent up to now is 47.0 secs Computing kpt #: 46 total cpu time spent up to now is 48.2 secs Computing kpt #: 47 total cpu time spent up to now is 49.4 secs Computing kpt #: 48 total cpu time spent up to now is 50.6 secs Computing kpt #: 49 total cpu time spent up to now is 51.6 secs Computing kpt #: 50 total cpu time spent up to now is 52.8 secs Computing kpt #: 51 total cpu time spent up to now is 53.8 secs Computing kpt #: 52 total cpu time spent up to now is 54.8 secs Computing kpt #: 53 total cpu time spent up to now is 55.8 secs Computing kpt #: 54 total cpu time spent up to now is 56.8 secs Computing kpt #: 55 total cpu time spent up to now is 57.8 secs Computing kpt #: 56 total cpu time spent up to now is 58.9 secs Computing kpt #: 57 total cpu time spent up to now is 59.9 secs Computing kpt #: 58 total cpu time spent up to now is 60.9 secs Computing kpt #: 59 total cpu time spent up to now is 61.9 secs Computing kpt #: 60 total cpu time spent up to now is 62.9 secs Computing kpt #: 61 total cpu time spent up to now is 63.9 secs Computing kpt #: 62 total cpu time spent up to now is 64.9 secs Computing kpt #: 63 total cpu time spent up to now is 65.8 secs Computing kpt #: 64 total cpu time spent up to now is 66.8 secs Computing kpt #: 65 total cpu time spent up to now is 67.8 secs Computing kpt #: 66 total cpu time spent up to now is 68.8 secs Computing kpt #: 67 total cpu time spent up to now is 69.7 secs Computing kpt #: 68 total cpu time spent up to now is 70.7 secs Computing kpt #: 69 total cpu time spent up to now is 71.7 secs Computing kpt #: 70 total cpu time spent up to now is 72.6 secs Computing kpt #: 71 total cpu time spent up to now is 73.5 secs Computing kpt #: 72 total cpu time spent up to now is 74.4 secs Computing kpt #: 73 total cpu time spent up to now is 75.4 secs Computing kpt #: 74 total cpu time spent up to now is 76.3 secs Computing kpt #: 75 total cpu time spent up to now is 77.2 secs Computing kpt #: 76 total cpu time spent up to now is 78.1 secs Computing kpt #: 77 total cpu time spent up to now is 79.0 secs Computing kpt #: 78 total cpu time spent up to now is 79.9 secs Computing kpt #: 79 total cpu time spent up to now is 80.8 secs Computing kpt #: 80 total cpu time spent up to now is 81.8 secs Computing kpt #: 81 total cpu time spent up to now is 82.7 secs Computing kpt #: 82 total cpu time spent up to now is 83.6 secs Computing kpt #: 83 total cpu time spent up to now is 84.6 secs Computing kpt #: 84 total cpu time spent up to now is 85.5 secs Computing kpt #: 85 total cpu time spent up to now is 86.6 secs Computing kpt #: 86 total cpu time spent up to now is 87.9 secs Computing kpt #: 87 total cpu time spent up to now is 88.9 secs Computing kpt #: 88 total cpu time spent up to now is 89.9 secs Computing kpt #: 89 total cpu time spent up to now is 90.9 secs Computing kpt #: 90 total cpu time spent up to now is 91.8 secs Computing kpt #: 91 total cpu time spent up to now is 92.8 secs Computing kpt #: 92 total cpu time spent up to now is 93.7 secs Computing kpt #: 93 total cpu time spent up to now is 94.6 secs Computing kpt #: 94 total cpu time spent up to now is 95.5 secs Computing kpt #: 95 total cpu time spent up to now is 96.4 secs Computing kpt #: 96 total cpu time spent up to now is 97.3 secs Computing kpt #: 97 total cpu time spent up to now is 98.2 secs Computing kpt #: 98 total cpu time spent up to now is 99.1 secs Computing kpt #: 99 total cpu time spent up to now is 100.0 secs Computing kpt #: 100 total cpu time spent up to now is 100.8 secs Computing kpt #: 101 total cpu time spent up to now is 101.7 secs Computing kpt #: 102 total cpu time spent up to now is 102.6 secs Computing kpt #: 103 total cpu time spent up to now is 103.4 secs Computing kpt #: 104 total cpu time spent up to now is 104.3 secs Computing kpt #: 105 total cpu time spent up to now is 105.1 secs Computing kpt #: 106 total cpu time spent up to now is 105.9 secs Computing kpt #: 107 total cpu time spent up to now is 106.8 secs Computing kpt #: 108 total cpu time spent up to now is 107.6 secs Computing kpt #: 109 total cpu time spent up to now is 108.4 secs Computing kpt #: 110 total cpu time spent up to now is 109.2 secs Computing kpt #: 111 total cpu time spent up to now is 110.0 secs Computing kpt #: 112 total cpu time spent up to now is 110.9 secs Computing kpt #: 113 total cpu time spent up to now is 111.7 secs Computing kpt #: 114 total cpu time spent up to now is 112.5 secs Computing kpt #: 115 total cpu time spent up to now is 113.3 secs Computing kpt #: 116 total cpu time spent up to now is 114.1 secs Computing kpt #: 117 total cpu time spent up to now is 115.0 secs Computing kpt #: 118 total cpu time spent up to now is 115.8 secs Computing kpt #: 119 total cpu time spent up to now is 116.6 secs Computing kpt #: 120 total cpu time spent up to now is 117.4 secs Computing kpt #: 121 total cpu time spent up to now is 118.3 secs Computing kpt #: 122 total cpu time spent up to now is 119.1 secs Computing kpt #: 123 total cpu time spent up to now is 119.9 secs Computing kpt #: 124 total cpu time spent up to now is 120.8 secs Computing kpt #: 125 total cpu time spent up to now is 121.6 secs Computing kpt #: 126 total cpu time spent up to now is 122.5 secs Computing kpt #: 127 total cpu time spent up to now is 123.4 secs Computing kpt #: 128 total cpu time spent up to now is 124.3 secs Computing kpt #: 129 total cpu time spent up to now is 125.2 secs Computing kpt #: 130 total cpu time spent up to now is 126.1 secs Computing kpt #: 131 total cpu time spent up to now is 126.9 secs Computing kpt #: 132 total cpu time spent up to now is 127.8 secs Computing kpt #: 133 total cpu time spent up to now is 128.7 secs Computing kpt #: 134 total cpu time spent up to now is 129.7 secs Computing kpt #: 135 total cpu time spent up to now is 130.6 secs Computing kpt #: 136 total cpu time spent up to now is 131.5 secs Computing kpt #: 137 total cpu time spent up to now is 132.4 secs Computing kpt #: 138 total cpu time spent up to now is 133.3 secs Computing kpt #: 139 total cpu time spent up to now is 134.3 secs Computing kpt #: 140 total cpu time spent up to now is 135.1 secs Computing kpt #: 141 total cpu time spent up to now is 136.0 secs Computing kpt #: 142 total cpu time spent up to now is 136.9 secs Computing kpt #: 143 total cpu time spent up to now is 137.8 secs Computing kpt #: 144 total cpu time spent up to now is 138.7 secs Computing kpt #: 145 total cpu time spent up to now is 139.6 secs Computing kpt #: 146 total cpu time spent up to now is 140.5 secs Computing kpt #: 147 total cpu time spent up to now is 141.4 secs Computing kpt #: 148 total cpu time spent up to now is 142.3 secs Computing kpt #: 149 total cpu time spent up to now is 143.2 secs Computing kpt #: 150 total cpu time spent up to now is 144.1 secs Computing kpt #: 151 total cpu time spent up to now is 145.0 secs Computing kpt #: 152 total cpu time spent up to now is 146.0 secs Computing kpt #: 153 total cpu time spent up to now is 146.9 secs Computing kpt #: 154 total cpu time spent up to now is 148.0 secs Computing kpt #: 155 total cpu time spent up to now is 149.0 secs Computing kpt #: 156 total cpu time spent up to now is 150.1 secs Computing kpt #: 157 total cpu time spent up to now is 151.4 secs Computing kpt #: 158 total cpu time spent up to now is 152.9 secs Computing kpt #: 159 total cpu time spent up to now is 154.3 secs Computing kpt #: 160 total cpu time spent up to now is 155.6 secs Computing kpt #: 161 total cpu time spent up to now is 156.9 secs Computing kpt #: 162 total cpu time spent up to now is 158.1 secs Computing kpt #: 163 total cpu time spent up to now is 159.3 secs Computing kpt #: 164 total cpu time spent up to now is 160.4 secs Computing kpt #: 165 total cpu time spent up to now is 161.5 secs Computing kpt #: 166 total cpu time spent up to now is 162.6 secs Computing kpt #: 167 total cpu time spent up to now is 163.7 secs Computing kpt #: 168 total cpu time spent up to now is 164.8 secs Computing kpt #: 169 total cpu time spent up to now is 165.9 secs Computing kpt #: 170 total cpu time spent up to now is 166.9 secs Computing kpt #: 171 total cpu time spent up to now is 168.0 secs Computing kpt #: 172 total cpu time spent up to now is 169.0 secs Computing kpt #: 173 total cpu time spent up to now is 169.9 secs Computing kpt #: 174 total cpu time spent up to now is 170.8 secs Computing kpt #: 175 total cpu time spent up to now is 171.8 secs Computing kpt #: 176 total cpu time spent up to now is 172.7 secs Computing kpt #: 177 total cpu time spent up to now is 173.6 secs Computing kpt #: 178 total cpu time spent up to now is 174.6 secs Computing kpt #: 179 total cpu time spent up to now is 175.5 secs Computing kpt #: 180 total cpu time spent up to now is 176.4 secs Computing kpt #: 181 total cpu time spent up to now is 177.4 secs Computing kpt #: 182 total cpu time spent up to now is 178.3 secs Computing kpt #: 183 total cpu time spent up to now is 179.3 secs Computing kpt #: 184 total cpu time spent up to now is 180.2 secs Computing kpt #: 185 total cpu time spent up to now is 181.1 secs Computing kpt #: 186 total cpu time spent up to now is 182.0 secs Computing kpt #: 187 total cpu time spent up to now is 182.9 secs Computing kpt #: 188 total cpu time spent up to now is 183.9 secs Computing kpt #: 189 total cpu time spent up to now is 184.9 secs Computing kpt #: 190 total cpu time spent up to now is 185.8 secs Computing kpt #: 191 total cpu time spent up to now is 186.8 secs Computing kpt #: 192 total cpu time spent up to now is 187.7 secs Computing kpt #: 193 total cpu time spent up to now is 188.7 secs Computing kpt #: 194 total cpu time spent up to now is 189.7 secs Computing kpt #: 195 total cpu time spent up to now is 190.6 secs Computing kpt #: 196 total cpu time spent up to now is 191.6 secs Computing kpt #: 197 total cpu time spent up to now is 192.5 secs Computing kpt #: 198 total cpu time spent up to now is 193.5 secs Computing kpt #: 199 total cpu time spent up to now is 194.5 secs Computing kpt #: 200 total cpu time spent up to now is 195.4 secs Computing kpt #: 201 total cpu time spent up to now is 196.3 secs Computing kpt #: 202 total cpu time spent up to now is 197.3 secs Computing kpt #: 203 total cpu time spent up to now is 198.2 secs Computing kpt #: 204 total cpu time spent up to now is 199.1 secs Computing kpt #: 205 total cpu time spent up to now is 200.0 secs Computing kpt #: 206 total cpu time spent up to now is 200.9 secs Computing kpt #: 207 total cpu time spent up to now is 201.8 secs Computing kpt #: 208 total cpu time spent up to now is 202.8 secs Computing kpt #: 209 total cpu time spent up to now is 203.7 secs Computing kpt #: 210 total cpu time spent up to now is 204.6 secs Computing kpt #: 211 total cpu time spent up to now is 205.5 secs Computing kpt #: 212 total cpu time spent up to now is 206.4 secs Computing kpt #: 213 total cpu time spent up to now is 207.3 secs Computing kpt #: 214 total cpu time spent up to now is 208.2 secs Computing kpt #: 215 total cpu time spent up to now is 209.1 secs Computing kpt #: 216 total cpu time spent up to now is 210.0 secs Computing kpt #: 217 total cpu time spent up to now is 210.9 secs Computing kpt #: 218 total cpu time spent up to now is 211.9 secs Computing kpt #: 219 total cpu time spent up to now is 212.8 secs Computing kpt #: 220 total cpu time spent up to now is 213.7 secs Computing kpt #: 221 total cpu time spent up to now is 214.7 secs Computing kpt #: 222 total cpu time spent up to now is 215.6 secs Computing kpt #: 223 total cpu time spent up to now is 216.4 secs Computing kpt #: 224 total cpu time spent up to now is 217.6 secs Computing kpt #: 225 total cpu time spent up to now is 218.6 secs Computing kpt #: 226 total cpu time spent up to now is 219.7 secs Computing kpt #: 227 total cpu time spent up to now is 220.7 secs Computing kpt #: 228 total cpu time spent up to now is 221.6 secs Computing kpt #: 229 total cpu time spent up to now is 222.6 secs Computing kpt #: 230 total cpu time spent up to now is 223.6 secs Computing kpt #: 231 total cpu time spent up to now is 224.6 secs Computing kpt #: 232 total cpu time spent up to now is 225.6 secs Computing kpt #: 233 total cpu time spent up to now is 226.5 secs Computing kpt #: 234 total cpu time spent up to now is 227.5 secs Computing kpt #: 235 total cpu time spent up to now is 228.5 secs Computing kpt #: 236 total cpu time spent up to now is 229.4 secs Computing kpt #: 237 total cpu time spent up to now is 230.4 secs Computing kpt #: 238 total cpu time spent up to now is 231.3 secs Computing kpt #: 239 total cpu time spent up to now is 232.2 secs Computing kpt #: 240 total cpu time spent up to now is 233.2 secs Computing kpt #: 241 total cpu time spent up to now is 234.1 secs Computing kpt #: 242 total cpu time spent up to now is 235.0 secs Computing kpt #: 243 total cpu time spent up to now is 236.1 secs Computing kpt #: 244 total cpu time spent up to now is 237.0 secs Computing kpt #: 245 total cpu time spent up to now is 238.1 secs Computing kpt #: 246 total cpu time spent up to now is 239.2 secs Computing kpt #: 247 total cpu time spent up to now is 240.3 secs Computing kpt #: 248 total cpu time spent up to now is 241.4 secs Computing kpt #: 249 total cpu time spent up to now is 242.5 secs Computing kpt #: 250 total cpu time spent up to now is 243.6 secs Computing kpt #: 251 total cpu time spent up to now is 247.0 secs Computing kpt #: 252 total cpu time spent up to now is 248.2 secs Computing kpt #: 253 total cpu time spent up to now is 249.5 secs Computing kpt #: 254 total cpu time spent up to now is 250.7 secs Computing kpt #: 255 total cpu time spent up to now is 252.0 secs Computing kpt #: 256 total cpu time spent up to now is 253.2 secs Computing kpt #: 257 total cpu time spent up to now is 254.4 secs Computing kpt #: 258 total cpu time spent up to now is 255.7 secs Computing kpt #: 259 total cpu time spent up to now is 257.2 secs Computing kpt #: 260 total cpu time spent up to now is 258.5 secs Computing kpt #: 261 total cpu time spent up to now is 259.9 secs Computing kpt #: 262 total cpu time spent up to now is 261.4 secs Computing kpt #: 263 total cpu time spent up to now is 262.4 secs Computing kpt #: 264 total cpu time spent up to now is 263.4 secs Computing kpt #: 265 total cpu time spent up to now is 264.4 secs Computing kpt #: 266 total cpu time spent up to now is 265.6 secs Computing kpt #: 267 total cpu time spent up to now is 266.8 secs Computing kpt #: 268 total cpu time spent up to now is 268.0 secs Computing kpt #: 269 total cpu time spent up to now is 269.1 secs Computing kpt #: 270 total cpu time spent up to now is 270.3 secs Computing kpt #: 271 total cpu time spent up to now is 271.5 secs Computing kpt #: 272 total cpu time spent up to now is 272.7 secs Computing kpt #: 273 total cpu time spent up to now is 273.8 secs Computing kpt #: 274 total cpu time spent up to now is 275.0 secs Computing kpt #: 275 total cpu time spent up to now is 276.2 secs Computing kpt #: 276 total cpu time spent up to now is 277.1 secs Computing kpt #: 277 total cpu time spent up to now is 277.9 secs Computing kpt #: 278 total cpu time spent up to now is 278.8 secs Computing kpt #: 279 total cpu time spent up to now is 279.7 secs Computing kpt #: 280 total cpu time spent up to now is 280.6 secs Computing kpt #: 281 total cpu time spent up to now is 281.5 secs Computing kpt #: 282 total cpu time spent up to now is 282.3 secs Computing kpt #: 283 total cpu time spent up to now is 283.2 secs Computing kpt #: 284 total cpu time spent up to now is 284.1 secs Computing kpt #: 285 total cpu time spent up to now is 285.0 secs Computing kpt #: 286 total cpu time spent up to now is 285.9 secs Computing kpt #: 287 total cpu time spent up to now is 286.7 secs Computing kpt #: 288 total cpu time spent up to now is 287.6 secs Computing kpt #: 289 total cpu time spent up to now is 288.5 secs Computing kpt #: 290 total cpu time spent up to now is 289.4 secs Computing kpt #: 291 total cpu time spent up to now is 290.2 secs Computing kpt #: 292 total cpu time spent up to now is 291.1 secs Computing kpt #: 293 total cpu time spent up to now is 292.1 secs Computing kpt #: 294 total cpu time spent up to now is 293.2 secs Computing kpt #: 295 total cpu time spent up to now is 294.1 secs Computing kpt #: 296 total cpu time spent up to now is 295.0 secs Computing kpt #: 297 total cpu time spent up to now is 295.9 secs Computing kpt #: 298 total cpu time spent up to now is 296.7 secs Computing kpt #: 299 total cpu time spent up to now is 297.6 secs Computing kpt #: 300 total cpu time spent up to now is 298.5 secs Computing kpt #: 301 total cpu time spent up to now is 299.4 secs ethr = 1.72E-08, avg # of iterations = 19.0 total cpu time spent up to now is 299.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 7779 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.6370 -3.6370 -1.6781 -1.6781 -1.3464 -1.3464 -1.2484 -1.2484 2.5601 2.5601 3.9829 3.9829 4.4625 4.4625 4.9207 4.9207 5.0274 5.0274 6.1155 6.1155 6.5330 6.5330 6.6094 6.6094 6.7225 6.7225 6.9621 6.9621 7.0236 7.0236 7.3123 7.3123 7.4672 7.4672 8.9082 8.9082 9.0357 9.0357 9.3982 9.3982 10.2724 10.2724 10.3578 10.3578 10.7384 10.7384 11.6331 11.6331 12.3995 12.3995 12.6427 12.6427 13.6400 13.6400 k = 0.0000 0.0192-0.0000 ( 7795 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6316 -35.6316 -35.6306 -35.6306 -3.6358 -3.6358 -1.6816 -1.6816 -1.3458 -1.3458 -1.2484 -1.2484 2.5638 2.5638 3.9835 3.9835 4.4645 4.4645 4.9209 4.9209 5.0274 5.0274 6.1129 6.1129 6.5176 6.5176 6.6105 6.6105 6.7274 6.7274 6.9679 6.9679 7.0247 7.0247 7.3132 7.3132 7.4690 7.4690 8.8956 8.8956 9.0450 9.0450 9.3976 9.3976 10.2706 10.2706 10.3548 10.3548 10.7335 10.7335 11.6427 11.6427 12.3979 12.3979 12.6398 12.6398 13.6299 13.6299 k = 0.0000 0.0385-0.0000 ( 7797 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7322 -35.7322 -35.7313 -35.7313 -35.6316 -35.6316 -35.6306 -35.6306 -3.6322 -3.6322 -1.6921 -1.6921 -1.3440 -1.3440 -1.2484 -1.2484 2.5750 2.5750 3.9855 3.9855 4.4705 4.4705 4.9215 4.9215 5.0275 5.0275 6.1050 6.1050 6.4827 6.4827 6.6035 6.6035 6.7434 6.7434 6.9830 6.9830 7.0286 7.0286 7.3160 7.3160 7.4745 7.4745 8.8654 8.8654 9.0657 9.0657 9.3959 9.3959 10.2641 10.2641 10.3457 10.3457 10.7213 10.7213 11.6701 11.6701 12.3929 12.3929 12.6317 12.6317 13.6064 13.6064 k = 0.0000 0.0577-0.0000 ( 7794 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7322 -35.7322 -35.7313 -35.7313 -35.6316 -35.6316 -35.6306 -35.6306 -3.6263 -3.6263 -1.7093 -1.7093 -1.3413 -1.3413 -1.2485 -1.2485 2.5935 2.5935 3.9888 3.9888 4.4805 4.4805 4.9225 4.9225 5.0276 5.0276 6.0918 6.0918 6.4394 6.4394 6.5838 6.5838 6.7674 6.7674 7.0000 7.0000 7.0385 7.0385 7.3211 7.3211 7.4834 7.4834 8.8269 8.8269 9.0884 9.0884 9.3929 9.3929 10.2495 10.2495 10.3303 10.3303 10.7085 10.7085 11.7124 11.7124 12.3845 12.3845 12.6190 12.6190 13.5778 13.5778 k = 0.0000 0.0769-0.0000 ( 7776 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.6180 -3.6180 -1.7326 -1.7326 -1.3379 -1.3379 -1.2486 -1.2486 2.6191 2.6191 3.9933 3.9933 4.4945 4.4945 4.9239 4.9239 5.0277 5.0277 6.0734 6.0734 6.3920 6.3920 6.5566 6.5566 6.7931 6.7931 7.0104 7.0104 7.0592 7.0592 7.3292 7.3292 7.4959 7.4959 8.7848 8.7848 9.1091 9.1091 9.3889 9.3889 10.2228 10.2228 10.3085 10.3085 10.7032 10.7032 11.7662 11.7662 12.3728 12.3728 12.6028 12.6028 13.5473 13.5473 k = 0.0000 0.0962-0.0000 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.6073 -3.6073 -1.7614 -1.7614 -1.3341 -1.3341 -1.2488 -1.2488 2.6513 2.6513 3.9990 3.9990 4.5127 4.5127 4.9257 4.9257 5.0277 5.0277 6.0499 6.0499 6.3421 6.3421 6.5267 6.5267 6.8162 6.8162 7.0139 7.0139 7.0882 7.0882 7.3409 7.3409 7.5115 7.5115 8.7411 8.7411 9.1259 9.1259 9.3836 9.3836 10.1815 10.1815 10.2802 10.2802 10.7117 10.7117 11.8282 11.8282 12.3578 12.3578 12.5845 12.5845 13.5160 13.5160 k = 0.0000 0.1154-0.0000 ( 7770 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.5943 -3.5943 -1.7953 -1.7953 -1.3301 -1.3301 -1.2490 -1.2490 2.6897 2.6897 4.0057 4.0057 4.5349 4.5349 4.9279 4.9279 5.0278 5.0278 6.0215 6.0215 6.2907 6.2907 6.4969 6.4969 6.8342 6.8342 7.0130 7.0130 7.1213 7.1213 7.3567 7.3567 7.5298 7.5298 8.6972 8.6972 9.1380 9.1380 9.3771 9.3771 10.1259 10.1259 10.2462 10.2462 10.7358 10.7358 11.8957 11.8957 12.3401 12.3401 12.5653 12.5653 13.4842 13.4842 k = 0.0000 0.1346-0.0000 ( 7774 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.5790 -3.5790 -1.8336 -1.8336 -1.3262 -1.3262 -1.2493 -1.2493 2.7338 2.7338 4.0133 4.0133 4.5614 4.5614 4.9305 4.9305 5.0279 5.0279 5.9885 5.9885 6.2384 6.2384 6.4687 6.4687 6.8460 6.8460 7.0083 7.0083 7.1564 7.1564 7.3772 7.3772 7.5504 7.5504 8.6542 8.6542 9.1453 9.1453 9.3695 9.3695 10.0588 10.0588 10.2073 10.2073 10.7744 10.7744 11.9666 11.9666 12.3208 12.3208 12.5461 12.5461 13.4518 13.4518 k = 0.0000 0.1538-0.0000 ( 7776 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.5614 -3.5614 -1.8758 -1.8758 -1.3223 -1.3223 -1.2498 -1.2498 2.7830 2.7830 4.0216 4.0216 4.5920 4.5920 4.9334 4.9334 5.0279 5.0279 5.9514 5.9514 6.1858 6.1858 6.4430 6.4430 6.8512 6.8512 6.9996 6.9996 7.1924 7.1924 7.4025 7.4025 7.5725 7.5725 8.6130 8.6130 9.1475 9.1475 9.3606 9.3606 9.9839 9.9839 10.1643 10.1643 10.8250 10.8250 12.0378 12.0378 12.3026 12.3026 12.5277 12.5277 13.4186 13.4186 k = 0.0000 0.1731-0.0000 ( 7780 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.5414 -3.5414 -1.9216 -1.9216 -1.3186 -1.3186 -1.2503 -1.2503 2.8368 2.8368 4.0305 4.0305 4.6270 4.6270 4.9366 4.9366 5.0278 5.0278 5.9107 5.9107 6.1333 6.1333 6.4202 6.4202 6.8502 6.8502 6.9869 6.9869 7.2285 7.2285 7.4323 7.4323 7.5955 7.5955 8.5742 8.5742 9.1449 9.1449 9.3503 9.3503 9.9047 9.9047 10.1177 10.1177 10.8850 10.8850 12.1031 12.1031 12.2912 12.2912 12.5109 12.5109 13.3846 13.3846 k = 0.0000 0.1923-0.0000 ( 7782 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7321 -35.7321 -35.7313 -35.7313 -35.6315 -35.6315 -35.6307 -35.6307 -3.5192 -3.5192 -1.9703 -1.9703 -1.3151 -1.3151 -1.2509 -1.2509 2.8945 2.8945 4.0396 4.0396 4.6662 4.6662 4.9403 4.9403 5.0276 5.0276 5.8672 5.8672 6.0815 6.0815 6.4004 6.4004 6.8434 6.8434 6.9700 6.9700 7.2635 7.2635 7.4663 7.4663 7.6187 7.6187 8.5387 8.5387 9.1375 9.1375 9.3387 9.3387 9.8241 9.8241 10.0680 10.0680 10.9525 10.9525 12.1477 12.1477 12.3005 12.3005 12.4973 12.4973 13.3498 13.3498 k = 0.0000 0.2115-0.0000 ( 7786 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7313 -35.7313 -35.6315 -35.6315 -35.6307 -35.6307 -3.4947 -3.4947 -2.0216 -2.0216 -1.3117 -1.3117 -1.2516 -1.2516 2.9555 2.9555 4.0487 4.0487 4.7096 4.7096 4.9444 4.9444 5.0273 5.0273 5.8218 5.8218 6.0304 6.0304 6.3834 6.3834 6.8314 6.8314 6.9491 6.9491 7.2968 7.2968 7.5036 7.5036 7.6420 7.6420 8.5072 8.5072 9.1256 9.1256 9.3254 9.3254 9.7443 9.7443 10.0160 10.0160 11.0260 11.0260 12.1588 12.1588 12.3387 12.3387 12.4920 12.4920 13.3142 13.3142 k = 0.0000 0.2308-0.0000 ( 7786 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7313 -35.7313 -35.6315 -35.6315 -35.6307 -35.6307 -3.4679 -3.4679 -2.0751 -2.0751 -1.3086 -1.3086 -1.2524 -1.2524 3.0191 3.0191 4.0574 4.0574 4.7571 4.7571 4.9492 4.9492 5.0268 5.0268 5.7755 5.7755 5.9802 5.9802 6.3693 6.3693 6.8147 6.8147 6.9239 6.9239 7.3277 7.3277 7.5422 7.5422 7.6660 7.6660 8.4804 8.4804 9.1096 9.1096 9.3104 9.3104 9.6673 9.6673 9.9621 9.9621 11.1041 11.1041 12.1501 12.1501 12.3763 12.3763 12.5106 12.5106 13.2782 13.2782 k = 0.0000 0.2500-0.0000 ( 7790 PWs) bands (ev): -82.3030 -82.3030 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7313 -35.7313 -35.6315 -35.6315 -35.6307 -35.6307 -3.4390 -3.4390 -2.1304 -2.1304 -1.3055 -1.3055 -1.2534 -1.2534 3.0848 3.0848 4.0653 4.0653 4.8081 4.8081 4.9552 4.9552 5.0262 5.0262 5.7291 5.7291 5.9311 5.9311 6.3578 6.3578 6.7939 6.7939 6.8947 6.8947 7.3561 7.3561 7.5787 7.5787 7.6928 7.6928 8.4589 8.4589 9.0899 9.0899 9.2932 9.2932 9.5947 9.5947 9.9069 9.9069 11.1858 11.1858 12.1361 12.1361 12.3852 12.3852 12.5663 12.5663 13.2425 13.2425 k = 0.0000 0.2692-0.0000 ( 7782 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7313 -35.7313 -35.6315 -35.6315 -35.6307 -35.6307 -3.4079 -3.4079 -2.1871 -2.1871 -1.3027 -1.3027 -1.2544 -1.2544 3.1518 3.1518 4.0720 4.0720 4.8607 4.8607 4.9641 4.9641 5.0253 5.0253 5.6838 5.6838 5.8831 5.8831 6.3488 6.3488 6.7690 6.7690 6.8616 6.8616 7.3819 7.3819 7.6084 7.6084 7.7262 7.7262 8.4431 8.4431 9.0671 9.0671 9.2731 9.2731 9.5281 9.5281 9.8512 9.8512 11.2702 11.2702 12.1221 12.1221 12.3760 12.3760 12.6414 12.6414 13.2089 13.2089 k = 0.0000 0.2885-0.0000 ( 7782 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7313 -35.7313 -35.6315 -35.6315 -35.6307 -35.6307 -3.3746 -3.3746 -2.2450 -2.2450 -1.2999 -1.2999 -1.2556 -1.2556 3.2197 3.2197 4.0771 4.0771 4.9084 4.9084 4.9823 4.9823 5.0244 5.0244 5.6406 5.6406 5.8362 5.8362 6.3418 6.3418 6.7397 6.7397 6.8254 6.8254 7.4054 7.4054 7.6279 7.6279 7.7684 7.7684 8.4332 8.4332 9.0419 9.0419 9.2490 9.2490 9.4693 9.4693 9.7954 9.7954 11.3565 11.3565 12.1105 12.1105 12.3601 12.3601 12.7186 12.7186 13.1809 13.1809 k = 0.0000 0.3077-0.0000 ( 7778 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6307 -35.6307 -3.3393 -3.3393 -2.3037 -2.3037 -1.2973 -1.2973 -1.2569 -1.2569 3.2878 3.2878 4.0798 4.0798 4.9373 4.9373 5.0188 5.0188 5.0279 5.0279 5.6005 5.6005 5.7907 5.7907 6.3364 6.3364 6.7053 6.7053 6.7876 6.7876 7.4266 7.4266 7.6379 7.6379 7.8182 7.8182 8.4289 8.4289 9.0149 9.0149 9.2196 9.2196 9.4203 9.4203 9.7401 9.7401 11.4440 11.4440 12.1021 12.1021 12.3414 12.3414 12.7848 12.7848 13.1663 13.1663 k = 0.0000 0.3269-0.0000 ( 7774 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6307 -35.6307 -3.3019 -3.3019 -2.3629 -2.3629 -1.2947 -1.2947 -1.2583 -1.2583 3.3556 3.3556 4.0798 4.0798 4.9501 4.9501 5.0205 5.0205 5.0858 5.0858 5.5646 5.5646 5.7465 5.7465 6.3320 6.3320 6.6646 6.6646 6.7502 6.7502 7.4458 7.4458 7.6410 7.6410 7.8730 7.8730 8.4296 8.4296 8.9870 8.9870 9.1841 9.1841 9.3818 9.3818 9.6860 9.6860 11.5319 11.5319 12.0976 12.0976 12.3210 12.3210 12.8249 12.8249 13.1777 13.1777 k = 0.0000 0.3462-0.0000 ( 7762 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1739 -49.1739 -49.1732 -49.1732 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6307 -35.6307 -3.2625 -3.2625 -2.4224 -2.4224 -1.2922 -1.2922 -1.2597 -1.2597 3.4227 3.4227 4.0764 4.0764 4.9576 4.9576 5.0186 5.0186 5.1554 5.1554 5.5341 5.5341 5.7041 5.7041 6.3272 6.3272 6.6179 6.6179 6.7148 6.7148 7.4632 7.4632 7.6391 7.6391 7.9309 7.9309 8.4343 8.4343 8.9589 8.9589 9.1434 9.1434 9.3535 9.3535 9.6337 9.6337 11.6194 11.6194 12.0974 12.0974 12.2996 12.2996 12.8293 12.8293 13.2233 13.2233 k = 0.0000 0.3654-0.0000 ( 7768 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1739 -49.1739 -49.1732 -49.1732 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6307 -35.6307 -3.2211 -3.2211 -2.4819 -2.4819 -1.2898 -1.2898 -1.2613 -1.2613 3.4886 3.4886 4.0690 4.0690 4.9632 4.9632 5.0163 5.0163 5.2288 5.2288 5.5108 5.5108 5.6635 5.6635 6.3192 6.3192 6.5678 6.5678 6.6818 6.6818 7.4790 7.4790 7.6338 7.6338 7.9904 7.9904 8.4416 8.4416 8.9314 8.9314 9.0997 9.0997 9.3335 9.3335 9.5836 9.5836 11.7056 11.7056 12.1020 12.1020 12.2775 12.2775 12.8046 12.8046 13.2948 13.2948 k = 0.0000 0.3846-0.0000 ( 7790 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -3.1779 -3.1779 -2.5412 -2.5412 -1.2875 -1.2875 -1.2629 -1.2629 3.5528 3.5528 4.0572 4.0572 4.9680 4.9680 5.0136 5.0136 5.3012 5.3012 5.4980 5.4980 5.6252 5.6252 6.3027 6.3027 6.5208 6.5208 6.6509 6.6509 7.4935 7.4935 7.6262 7.6262 8.0507 8.0507 8.4496 8.4496 8.9053 8.9053 9.0553 9.0553 9.3200 9.3200 9.5364 9.5364 11.7890 11.7890 12.1121 12.1121 12.2548 12.2548 12.7622 12.7622 13.3789 13.3789 k = 0.0000 0.4038-0.0000 ( 7798 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -3.1328 -3.1328 -2.6000 -2.6000 -1.2852 -1.2852 -1.2647 -1.2647 3.6150 3.6150 4.0407 4.0407 4.9724 4.9724 5.0106 5.0106 5.3628 5.3628 5.5047 5.5047 5.5903 5.5903 6.2700 6.2700 6.4859 6.4859 6.6217 6.6217 7.5068 7.5068 7.6171 7.6171 8.1109 8.1109 8.4560 8.4560 8.8817 8.8817 9.0122 9.0122 9.3119 9.3119 9.4927 9.4927 11.8678 11.8678 12.1291 12.1291 12.2318 12.2318 12.7096 12.7096 13.4667 13.4667 k = 0.0000 0.4231-0.0000 ( 7800 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -3.0859 -3.0859 -2.6584 -2.6584 -1.2829 -1.2829 -1.2665 -1.2665 3.6747 3.6747 4.0190 4.0190 4.9766 4.9766 5.0073 5.0073 5.3980 5.3980 5.5337 5.5337 5.5712 5.5712 6.2167 6.2167 6.4686 6.4686 6.5942 6.5942 7.5193 7.5193 7.6071 7.6071 8.1702 8.1702 8.4581 8.4581 8.8622 8.8622 8.9719 8.9719 9.3085 9.3085 9.4530 9.4530 11.9387 11.9387 12.1554 12.1554 12.2087 12.2087 12.6504 12.6504 13.5525 13.5525 k = 0.0000 0.4423-0.0000 ( 7802 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -3.0374 -3.0374 -2.7159 -2.7159 -1.2807 -1.2807 -1.2683 -1.2683 3.7316 3.7316 3.9921 3.9921 4.9807 4.9807 5.0039 5.0039 5.4126 5.4126 5.5183 5.5183 5.6285 5.6285 6.1468 6.1468 6.4659 6.4659 6.5682 6.5682 7.5311 7.5311 7.5966 7.5966 8.2277 8.2277 8.4528 8.4528 8.8487 8.8487 8.9356 8.9356 9.3097 9.3097 9.4177 9.4177 11.9979 11.9979 12.1814 12.1814 12.1983 12.1983 12.5866 12.5866 13.6323 13.6323 k = 0.0000 0.4615-0.0000 ( 7810 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.9872 -2.9872 -2.7725 -2.7725 -1.2785 -1.2785 -1.2702 -1.2702 3.7853 3.7853 3.9601 3.9601 4.9847 4.9847 5.0002 5.0002 5.4226 5.4226 5.4926 5.4926 5.7116 5.7116 6.0663 6.0663 6.4727 6.4727 6.5440 6.5440 7.5425 7.5425 7.5860 7.5860 8.2822 8.2822 8.4378 8.4378 8.8432 8.8432 8.9040 8.9040 9.3154 9.3154 9.3872 9.3872 12.0439 12.0439 12.1596 12.1596 12.2489 12.2489 12.5194 12.5194 13.7028 13.7028 k = 0.0000 0.4808-0.0000 ( 7810 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.9356 -2.9356 -2.8281 -2.8281 -1.2764 -1.2764 -1.2722 -1.2722 3.8354 3.8354 3.9232 3.9232 4.9887 4.9887 4.9965 4.9965 5.4344 5.4344 5.4694 5.4694 5.8004 5.8004 5.9800 5.9800 6.4853 6.4853 6.5218 6.5218 7.5535 7.5535 7.5752 7.5752 8.3323 8.3323 8.4120 8.4120 8.8465 8.8465 8.8780 8.8780 9.3259 9.3259 9.3617 9.3617 12.0794 12.0794 12.1350 12.1350 12.3118 12.3118 12.4501 12.4501 13.7615 13.7615 k = 0.0000 0.5000-0.0000 ( 7832 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6308 -35.6308 -2.8825 -2.8825 -2.8825 -2.8825 -1.2743 -1.2743 -1.2742 -1.2742 3.8814 3.8814 3.8815 3.8815 4.9925 4.9925 4.9927 4.9927 5.4497 5.4497 5.4500 5.4500 5.8905 5.8905 5.8907 5.8907 6.5019 6.5019 6.5022 6.5022 7.5642 7.5642 7.5646 7.5646 8.3762 8.3762 8.3763 8.3763 8.8584 8.8584 8.8585 8.8585 9.3412 9.3412 9.3413 9.3413 12.1087 12.1087 12.1089 12.1089 12.3800 12.3800 12.3802 12.3802 13.8067 13.8067 k = 0.0000 0.5000-0.0000 ( 7832 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6308 -35.6308 -2.8825 -2.8825 -2.8825 -2.8825 -1.2743 -1.2743 -1.2742 -1.2742 3.8814 3.8814 3.8815 3.8815 4.9925 4.9925 4.9927 4.9927 5.4497 5.4497 5.4500 5.4500 5.8905 5.8905 5.8907 5.8907 6.5019 6.5019 6.5022 6.5022 7.5642 7.5642 7.5646 7.5646 8.3762 8.3762 8.3763 8.3763 8.8584 8.8584 8.8585 8.8585 9.3412 9.3412 9.3413 9.3413 12.1087 12.1087 12.1089 12.1089 12.3800 12.3800 12.3802 12.3802 13.8067 13.8067 k = 0.0192 0.5000-0.0000 ( 7812 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8820 -2.8820 -2.8819 -2.8819 -1.2752 -1.2752 -1.2751 -1.2751 3.8791 3.8791 3.8792 3.8792 4.9921 4.9921 4.9924 4.9924 5.4522 5.4522 5.4524 5.4524 5.8941 5.8941 5.8943 5.8943 6.5033 6.5033 6.5036 6.5036 7.5642 7.5642 7.5646 7.5646 8.3734 8.3734 8.3735 8.3735 8.8501 8.8501 8.8502 8.8502 9.3503 9.3503 9.3504 9.3504 12.1081 12.1081 12.1083 12.1083 12.3736 12.3736 12.3738 12.3738 13.8081 13.8081 k = 0.0385 0.5000-0.0000 ( 7808 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8804 -2.8804 -2.8804 -2.8804 -1.2778 -1.2778 -1.2778 -1.2778 3.8723 3.8723 3.8724 3.8724 4.9911 4.9911 4.9914 4.9914 5.4593 5.4593 5.4596 5.4596 5.9047 5.9047 5.9049 5.9049 6.5076 6.5076 6.5079 6.5079 7.5642 7.5642 7.5646 7.5646 8.3650 8.3650 8.3651 8.3651 8.8269 8.8269 8.8271 8.8271 9.3757 9.3757 9.3759 9.3759 12.1059 12.1059 12.1061 12.1061 12.3550 12.3550 12.3551 12.3551 13.8123 13.8123 k = 0.0577 0.5000-0.0000 ( 7814 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8778 -2.8778 -2.8777 -2.8777 -1.2821 -1.2821 -1.2821 -1.2821 3.8612 3.8612 3.8613 3.8613 4.9894 4.9894 4.9897 4.9897 5.4709 5.4709 5.4711 5.4711 5.9223 5.9223 5.9224 5.9224 6.5146 6.5146 6.5149 6.5149 7.5641 7.5641 7.5644 7.5644 8.3510 8.3510 8.3511 8.3511 8.7934 8.7934 8.7935 8.7935 9.4133 9.4133 9.4134 9.4134 12.1009 12.1009 12.1011 12.1011 12.3257 12.3257 12.3259 12.3259 13.8192 13.8192 k = 0.0769 0.5000-0.0000 ( 7816 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8741 -2.8741 -2.8741 -2.8741 -1.2882 -1.2882 -1.2881 -1.2881 3.8463 3.8463 3.8464 3.8464 4.9870 4.9870 4.9873 4.9873 5.4866 5.4866 5.4868 5.4868 5.9466 5.9466 5.9468 5.9468 6.5245 6.5245 6.5247 6.5247 7.5638 7.5638 7.5641 7.5641 8.3315 8.3315 8.3316 8.3316 8.7539 8.7539 8.7540 8.7540 9.4587 9.4587 9.4588 9.4588 12.0902 12.0902 12.0904 12.0904 12.2894 12.2894 12.2895 12.2895 13.8287 13.8287 k = 0.0962 0.5000-0.0000 ( 7806 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8695 -2.8695 -2.8695 -2.8695 -1.2958 -1.2958 -1.2958 -1.2958 3.8281 3.8281 3.8282 3.8282 4.9841 4.9841 4.9844 4.9844 5.5058 5.5058 5.5060 5.5060 5.9773 5.9773 5.9775 5.9775 6.5370 6.5370 6.5373 6.5373 7.5630 7.5630 7.5634 7.5634 8.3067 8.3067 8.3069 8.3069 8.7118 8.7118 8.7119 8.7119 9.5089 9.5089 9.5090 9.5090 12.0680 12.0680 12.0681 12.0681 12.2528 12.2528 12.2529 12.2529 13.8408 13.8408 k = 0.1154 0.5000-0.0000 ( 7810 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8640 -2.8640 -2.8639 -2.8639 -1.3049 -1.3049 -1.3049 -1.3049 3.8072 3.8072 3.8072 3.8072 4.9806 4.9806 4.9809 4.9809 5.5283 5.5283 5.5284 5.5284 6.0140 6.0140 6.0141 6.0141 6.5522 6.5522 6.5525 6.5525 7.5616 7.5616 7.5619 7.5619 8.2771 8.2771 8.2772 8.2772 8.6696 8.6696 8.6697 8.6697 9.5616 9.5616 9.5617 9.5617 12.0265 12.0265 12.0267 12.0267 12.2246 12.2246 12.2247 12.2247 13.8552 13.8552 k = 0.1346 0.5000-0.0000 ( 7816 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8575 -2.8575 -2.8575 -2.8575 -1.3155 -1.3155 -1.3154 -1.3154 3.7842 3.7842 3.7842 3.7842 4.9767 4.9767 4.9769 4.9769 5.5534 5.5534 5.5536 5.5536 6.0560 6.0560 6.0561 6.0561 6.5700 6.5700 6.5702 6.5702 7.5590 7.5590 7.5593 7.5593 8.2434 8.2434 8.2435 8.2435 8.6289 8.6289 8.6290 8.6290 9.6154 9.6154 9.6155 9.6155 11.9631 11.9631 11.9632 11.9632 12.2087 12.2087 12.2088 12.2088 13.8720 13.8720 k = 0.1538 0.5000-0.0000 ( 7812 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8502 -2.8502 -2.8502 -2.8502 -1.3273 -1.3273 -1.3273 -1.3273 3.7596 3.7596 3.7596 3.7596 4.9723 4.9723 4.9726 4.9726 5.5810 5.5810 5.5811 5.5811 6.1024 6.1024 6.1025 6.1025 6.5902 6.5902 6.5905 6.5905 7.5548 7.5548 7.5551 7.5551 8.2064 8.2064 8.2065 8.2065 8.5906 8.5906 8.5907 8.5907 9.6692 9.6692 9.6693 9.6693 11.8817 11.8817 11.8818 11.8818 12.2022 12.2022 12.2024 12.2024 13.8908 13.8909 k = 0.1731 0.5000-0.0000 ( 7814 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8422 -2.8422 -2.8422 -2.8422 -1.3403 -1.3403 -1.3402 -1.3402 3.7341 3.7341 3.7341 3.7341 4.9676 4.9676 4.9679 4.9679 5.6107 5.6107 5.6108 5.6108 6.1525 6.1525 6.1526 6.1526 6.6128 6.6128 6.6131 6.6131 7.5484 7.5484 7.5487 7.5487 8.1675 8.1675 8.1676 8.1676 8.5556 8.5556 8.5557 8.5557 9.7223 9.7223 9.7225 9.7225 11.7874 11.7874 11.7875 11.7875 12.2013 12.2013 12.2015 12.2015 13.9116 13.9116 k = 0.1923 0.5000-0.0000 ( 7806 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8335 -2.8335 -2.8335 -2.8335 -1.3542 -1.3542 -1.3542 -1.3542 3.7081 3.7081 3.7081 3.7081 4.9627 4.9627 4.9630 4.9630 5.6423 5.6423 5.6424 5.6424 6.2052 6.2052 6.2052 6.2052 6.6377 6.6377 6.6379 6.6379 7.5391 7.5391 7.5394 7.5394 8.1278 8.1278 8.1279 8.1279 8.5246 8.5246 8.5247 8.5247 9.7742 9.7742 9.7744 9.7744 11.6837 11.6837 11.6839 11.6839 12.2036 12.2036 12.2037 12.2037 13.9341 13.9341 k = 0.2115 0.5000-0.0000 ( 7816 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8242 -2.8242 -2.8242 -2.8242 -1.3690 -1.3690 -1.3689 -1.3689 3.6820 3.6820 3.6821 3.6821 4.9576 4.9576 4.9579 4.9579 5.6756 5.6756 5.6757 5.6757 6.2593 6.2593 6.2593 6.2593 6.6647 6.6647 6.6649 6.6649 7.5260 7.5260 7.5263 7.5263 8.0887 8.0887 8.0888 8.0888 8.4981 8.4981 8.4982 8.4982 9.8244 9.8244 9.8245 9.8245 11.5730 11.5730 11.5732 11.5732 12.2077 12.2077 12.2079 12.2079 13.9583 13.9583 k = 0.2308 0.5000-0.0000 ( 7812 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8145 -2.8145 -2.8145 -2.8145 -1.3843 -1.3843 -1.3843 -1.3843 3.6564 3.6564 3.6565 3.6565 4.9525 4.9525 4.9527 4.9527 5.7105 5.7105 5.7106 5.7106 6.3136 6.3136 6.3137 6.3137 6.6937 6.6937 6.6939 6.6939 7.5088 7.5088 7.5090 7.5090 8.0509 8.0509 8.0510 8.0510 8.4772 8.4772 8.4773 8.4773 9.8725 9.8725 9.8726 9.8726 11.4572 11.4572 11.4573 11.4573 12.2130 12.2130 12.2132 12.2132 13.9840 13.9840 k = 0.2500 0.5000-0.0000 ( 7800 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8044 -2.8044 -2.8044 -2.8044 -1.4001 -1.4001 -1.4001 -1.4001 3.6315 3.6315 3.6315 3.6315 4.9473 4.9473 4.9476 4.9476 5.7469 5.7469 5.7471 5.7471 6.3671 6.3671 6.3671 6.3671 6.7243 6.7243 6.7246 6.7246 7.4870 7.4870 7.4872 7.4872 8.0150 8.0150 8.0150 8.0150 8.4628 8.4628 8.4629 8.4629 9.9181 9.9181 9.9182 9.9182 11.3376 11.3376 11.3378 11.3378 12.2190 12.2190 12.2191 12.2191 14.0111 14.0111 k = 0.2692 0.5000-0.0000 ( 7806 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7941 -2.7941 -2.7941 -2.7941 -1.4161 -1.4161 -1.4161 -1.4161 3.6075 3.6075 3.6076 3.6076 4.9422 4.9422 4.9425 4.9425 5.7846 5.7846 5.7848 5.7848 6.4185 6.4185 6.4185 6.4185 6.7563 6.7563 6.7565 6.7565 7.4609 7.4609 7.4611 7.4611 7.9806 7.9806 7.9807 7.9807 8.4562 8.4562 8.4563 8.4563 9.9608 9.9608 9.9609 9.9609 11.2157 11.2157 11.2159 11.2159 12.2254 12.2254 12.2255 12.2255 14.0395 14.0395 k = 0.2885 0.5000-0.0000 ( 7810 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7838 -2.7838 -2.7837 -2.7837 -1.4321 -1.4321 -1.4320 -1.4320 3.5848 3.5848 3.5849 3.5849 4.9373 4.9373 4.9376 4.9376 5.8235 5.8235 5.8236 5.8236 6.4668 6.4668 6.4668 6.4668 6.7889 6.7889 6.7892 6.7892 7.4316 7.4316 7.4318 7.4318 7.9473 7.9473 7.9474 7.9474 8.4584 8.4584 8.4585 8.4585 10.0003 10.0003 10.0005 10.0005 11.0927 11.0927 11.0929 11.0929 12.2319 12.2319 12.2320 12.2320 14.0694 14.0694 k = 0.3077 0.5000-0.0000 ( 7810 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7735 -2.7735 -2.7735 -2.7735 -1.4478 -1.4478 -1.4477 -1.4477 3.5636 3.5636 3.5636 3.5636 4.9326 4.9326 4.9329 4.9329 5.8631 5.8631 5.8633 5.8633 6.5111 6.5111 6.5112 6.5112 6.8214 6.8214 6.8216 6.8216 7.4004 7.4004 7.4006 7.4006 7.9142 7.9142 7.9143 7.9143 8.4701 8.4701 8.4701 8.4701 10.0362 10.0362 10.0363 10.0363 10.9702 10.9702 10.9703 10.9703 12.2384 12.2384 12.2385 12.2385 14.1005 14.1005 k = 0.3269 0.5000-0.0000 ( 7814 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7635 -2.7635 -2.7634 -2.7634 -1.4630 -1.4630 -1.4629 -1.4629 3.5439 3.5439 3.5440 3.5440 4.9282 4.9282 4.9284 4.9284 5.9034 5.9034 5.9036 5.9036 6.5508 6.5508 6.5508 6.5508 6.8523 6.8523 6.8525 6.8525 7.3696 7.3696 7.3698 7.3698 7.8807 7.8807 7.8808 7.8808 8.4914 8.4914 8.4915 8.4915 10.0678 10.0678 10.0679 10.0679 10.8495 10.8495 10.8497 10.8497 12.2448 12.2448 12.2449 12.2449 14.1331 14.1331 k = 0.3462 0.5000-0.0000 ( 7822 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7538 -2.7538 -2.7538 -2.7538 -1.4774 -1.4774 -1.4774 -1.4774 3.5260 3.5260 3.5261 3.5261 4.9241 4.9241 4.9243 4.9243 5.9437 5.9437 5.9439 5.9439 6.5851 6.5851 6.5852 6.5852 6.8800 6.8800 6.8802 6.8802 7.3418 7.3418 7.3420 7.3420 7.8464 7.8464 7.8464 7.8464 8.5219 8.5219 8.5219 8.5219 10.0941 10.0941 10.0942 10.0942 10.7329 10.7329 10.7331 10.7331 12.2508 12.2508 12.2509 12.2509 14.1671 14.1671 k = 0.3654 0.5000-0.0000 ( 7804 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7448 -2.7448 -2.7448 -2.7448 -1.4909 -1.4909 -1.4908 -1.4908 3.5100 3.5100 3.5101 3.5101 4.9204 4.9204 4.9206 4.9206 5.9837 5.9837 5.9839 5.9839 6.6139 6.6139 6.6139 6.6139 6.9026 6.9026 6.9028 6.9028 7.3197 7.3197 7.3199 7.3199 7.8113 7.8113 7.8113 7.8113 8.5604 8.5604 8.5604 8.5604 10.1137 10.1137 10.1139 10.1139 10.6232 10.6232 10.6233 10.6233 12.2564 12.2564 12.2565 12.2565 14.2028 14.2028 k = 0.3846 0.5000-0.0000 ( 7804 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7365 -2.7365 -2.7365 -2.7365 -1.5031 -1.5031 -1.5031 -1.5031 3.4960 3.4960 3.4961 3.4961 4.9170 4.9170 4.9173 4.9173 6.0226 6.0226 6.0228 6.0228 6.6367 6.6367 6.6367 6.6367 6.9184 6.9184 6.9185 6.9185 7.3061 7.3061 7.3062 7.3062 7.7758 7.7758 7.7758 7.7758 8.6051 8.6051 8.6051 8.6051 10.1241 10.1241 10.1242 10.1242 10.5246 10.5246 10.5247 10.5247 12.2615 12.2615 12.2616 12.2616 14.2401 14.2401 k = 0.4038 0.5000-0.0000 ( 7792 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7292 -2.7292 -2.7292 -2.7292 -1.5139 -1.5139 -1.5139 -1.5139 3.4840 3.4840 3.4841 3.4841 4.9142 4.9142 4.9144 4.9144 6.0595 6.0595 6.0597 6.0597 6.6534 6.6534 6.6534 6.6534 6.9268 6.9268 6.9270 6.9270 7.3021 7.3021 7.3022 7.3022 7.7406 7.7406 7.7406 7.7406 8.6536 8.6536 8.6536 8.6536 10.1208 10.1208 10.1209 10.1209 10.4434 10.4434 10.4435 10.4435 12.2659 12.2659 12.2661 12.2661 14.2792 14.2792 k = 0.4231 0.5000-0.0000 ( 7796 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7230 -2.7230 -2.7229 -2.7229 -1.5231 -1.5231 -1.5231 -1.5231 3.4741 3.4741 3.4742 3.4742 4.9118 4.9118 4.9120 4.9120 6.0932 6.0932 6.0935 6.0935 6.6641 6.6641 6.6641 6.6641 6.9292 6.9292 6.9293 6.9293 7.3070 7.3070 7.3071 7.3071 7.7067 7.7067 7.7068 7.7068 8.7028 8.7028 8.7028 8.7028 10.1001 10.1001 10.1002 10.1002 10.3862 10.3862 10.3864 10.3864 12.2697 12.2697 12.2698 12.2698 14.3201 14.3201 k = 0.4423 0.5000-0.0000 ( 7800 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7179 -2.7179 -2.7179 -2.7179 -1.5304 -1.5304 -1.5304 -1.5304 3.4663 3.4663 3.4665 3.4665 4.9099 4.9099 4.9101 4.9101 6.1222 6.1222 6.1225 6.1225 6.6696 6.6696 6.6696 6.6696 6.9278 6.9278 6.9279 6.9279 7.3181 7.3181 7.3182 7.3182 7.6758 7.6758 7.6759 7.6759 8.7488 8.7488 8.7488 8.7488 10.0647 10.0647 10.0648 10.0648 10.3539 10.3539 10.3541 10.3541 12.2727 12.2727 12.2728 12.2728 14.3628 14.3628 k = 0.4615 0.5000-0.0000 ( 7806 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7143 -2.7143 -2.7142 -2.7142 -1.5358 -1.5358 -1.5358 -1.5358 3.4608 3.4608 3.4609 3.4609 4.9085 4.9085 4.9088 4.9088 6.1449 6.1449 6.1451 6.1451 6.6713 6.6713 6.6713 6.6713 6.9252 6.9252 6.9254 6.9254 7.3312 7.3312 7.3313 7.3313 7.6501 7.6501 7.6502 7.6502 8.7869 8.7869 8.7869 8.7869 10.0262 10.0262 10.0263 10.0263 10.3390 10.3390 10.3392 10.3392 12.2749 12.2749 12.2750 12.2750 14.4070 14.4070 k = 0.4808 0.5000-0.0000 ( 7794 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7120 -2.7120 -2.7120 -2.7120 -1.5390 -1.5390 -1.5390 -1.5390 3.4575 3.4575 3.4576 3.4576 4.9077 4.9077 4.9080 4.9080 6.1594 6.1594 6.1597 6.1597 6.6711 6.6711 6.6711 6.6711 6.9232 6.9232 6.9233 6.9233 7.3419 7.3419 7.3420 7.3420 7.6326 7.6326 7.6326 7.6326 8.8124 8.8124 8.8124 8.8124 9.9975 9.9975 9.9976 9.9976 10.3331 10.3331 10.3333 10.3333 12.2762 12.2762 12.2763 12.2763 14.4510 14.4510 k = 0.5000 0.5000-0.0000 ( 7792 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7113 -2.7113 -2.7112 -2.7112 -1.5401 -1.5401 -1.5401 -1.5401 3.4564 3.4564 3.4565 3.4565 4.9074 4.9074 4.9077 4.9077 6.1644 6.1644 6.1647 6.1647 6.6708 6.6708 6.6708 6.6708 6.9225 6.9225 6.9226 6.9226 7.3460 7.3460 7.3461 7.3461 7.6263 7.6263 7.6263 7.6263 8.8214 8.8214 8.8214 8.8214 9.9870 9.9870 9.9872 9.9872 10.3316 10.3316 10.3318 10.3318 12.2766 12.2766 12.2767 12.2767 14.4796 14.4796 k = 0.5000 0.5000-0.0000 ( 7792 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7113 -2.7113 -2.7112 -2.7112 -1.5401 -1.5401 -1.5401 -1.5401 3.4564 3.4564 3.4565 3.4565 4.9074 4.9074 4.9077 4.9077 6.1644 6.1644 6.1647 6.1647 6.6708 6.6708 6.6708 6.6708 6.9225 6.9225 6.9226 6.9226 7.3460 7.3460 7.3461 7.3461 7.6263 7.6263 7.6263 7.6263 8.8214 8.8214 8.8214 8.8214 9.9870 9.9870 9.9872 9.9872 10.3316 10.3316 10.3318 10.3318 12.2766 12.2766 12.2767 12.2767 14.4796 14.4796 k = 0.4865 0.4865-0.0000 ( 7794 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7140 -2.7140 -2.7099 -2.7099 -1.5397 -1.5397 -1.5383 -1.5383 3.4560 3.4560 3.4590 3.4590 4.9077 4.9077 4.9079 4.9079 6.1552 6.1552 6.1640 6.1640 6.6661 6.6661 6.6760 6.6760 6.9198 6.9198 6.9267 6.9267 7.3379 7.3379 7.3462 7.3462 7.6266 7.6266 7.6383 7.6383 8.8037 8.8037 8.8215 8.8215 9.9875 9.9875 10.0072 10.0072 10.3314 10.3314 10.3349 10.3349 12.2754 12.2754 12.2771 12.2771 14.4319 14.4319 k = 0.4730 0.4730-0.0000 ( 7792 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7223 -2.7223 -2.7060 -2.7060 -1.5385 -1.5385 -1.5332 -1.5332 3.4550 3.4550 3.4666 3.4666 4.9080 4.9080 4.9093 4.9093 6.1286 6.1286 6.1626 6.1626 6.6523 6.6523 6.6903 6.6903 6.9116 6.9116 6.9388 6.9388 7.3176 7.3176 7.3467 7.3467 7.6276 7.6276 7.6703 7.6703 8.7552 8.7552 8.8216 8.8216 9.9888 9.9888 10.0604 10.0604 10.3305 10.3305 10.3476 10.3476 12.2718 12.2718 12.2781 12.2781 14.3669 14.3669 k = 0.4595 0.4595-0.0000 ( 7804 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7358 -2.7358 -2.6995 -2.6995 -1.5366 -1.5366 -1.5248 -1.5248 3.4533 3.4533 3.4792 3.4792 4.9083 4.9083 4.9116 4.9116 6.0882 6.0882 6.1601 6.1601 6.6299 6.6299 6.7100 6.7100 6.8979 6.8979 6.9572 6.9572 7.2928 7.2928 7.3478 7.3478 7.6290 7.6290 7.7152 7.7152 8.6859 8.6859 8.8221 8.8221 9.9909 9.9909 10.1260 10.1260 10.3292 10.3292 10.3803 10.3803 12.2659 12.2659 12.2797 12.2797 14.3030 14.3030 k = 0.4459 0.4459-0.0000 ( 7808 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7542 -2.7542 -2.6905 -2.6905 -1.5338 -1.5338 -1.5135 -1.5135 3.4508 3.4508 3.4967 3.4967 4.9088 4.9088 4.9148 4.9148 6.0379 6.0379 6.1564 6.1564 6.5991 6.5991 6.7316 6.7316 6.8791 6.8791 6.9798 6.9798 7.2700 7.2700 7.3499 7.3499 7.6308 7.6308 7.7677 7.7677 8.6063 8.6063 8.8232 8.8232 9.9936 9.9936 10.1762 10.1762 10.3275 10.3275 10.4505 10.4505 12.2578 12.2578 12.2821 12.2821 14.2413 14.2413 k = 0.4324 0.4324-0.0000 ( 7824 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7770 -2.7770 -2.6788 -2.6788 -1.5303 -1.5303 -1.4998 -1.4998 3.4475 3.4475 3.5190 3.5190 4.9094 4.9094 4.9188 4.9188 5.9806 5.9806 6.1513 6.1513 6.5602 6.5602 6.7525 6.7525 6.8551 6.8551 7.0038 7.0038 7.2534 7.2534 7.3537 7.3537 7.6329 7.6329 7.8243 7.8243 8.5245 8.5245 8.8251 8.8251 9.9969 9.9969 10.1998 10.1998 10.3258 10.3258 10.5616 10.5616 12.2477 12.2477 12.2851 12.2851 14.1815 14.1815 k = 0.4189 0.4189-0.0000 ( 7816 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8036 -2.8036 -2.6647 -2.6647 -1.5260 -1.5260 -1.4843 -1.4843 3.4434 3.4434 3.5459 3.5459 4.9101 4.9101 4.9236 4.9236 5.9188 5.9188 6.1441 6.1441 6.5138 6.5138 6.7710 6.7710 6.8266 6.8266 7.0267 7.0267 7.2457 7.2457 7.3598 7.3598 7.6349 7.6349 7.8829 7.8829 8.4462 8.4462 8.8285 8.8285 10.0007 10.0007 10.2062 10.2062 10.3242 10.3242 10.6989 10.6989 12.2358 12.2358 12.2889 12.2889 14.1232 14.1232 k = 0.4054 0.4054-0.0000 ( 7814 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8336 -2.8336 -2.6481 -2.6481 -1.5210 -1.5210 -1.4672 -1.4672 3.4383 3.4383 3.5771 3.5771 4.9110 4.9110 4.9291 4.9291 5.8537 5.8537 6.1338 6.1338 6.4609 6.4609 6.7833 6.7833 6.7976 6.7976 7.0470 7.0470 7.2468 7.2468 7.3694 7.3694 7.6367 7.6367 7.9415 7.9415 8.3757 8.3757 8.8337 8.8337 10.0045 10.0045 10.2041 10.2041 10.3228 10.3228 10.8499 10.8499 12.2224 12.2224 12.2934 12.2934 14.0656 14.0656 k = 0.3919 0.3919-0.0000 ( 7816 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6308 -35.6308 -2.8663 -2.8663 -2.6290 -2.6290 -1.5154 -1.5154 -1.4492 -1.4492 3.4321 3.4321 3.6124 3.6124 4.9119 4.9119 4.9352 4.9352 5.7867 5.7867 6.1187 6.1187 6.4040 6.4040 6.7568 6.7568 6.8015 6.8015 7.0648 7.0648 7.2543 7.2543 7.3830 7.3830 7.6382 7.6382 7.9975 7.9975 8.3170 8.3170 8.8413 8.8413 10.0083 10.0083 10.1977 10.1977 10.3218 10.3218 11.0079 11.0079 12.2077 12.2077 12.2986 12.2986 14.0077 14.0077 k = 0.3784 0.3784-0.0000 ( 7808 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.9012 -2.9012 -2.6075 -2.6075 -1.5090 -1.5090 -1.4307 -1.4307 3.4248 3.4248 3.6513 3.6513 4.9129 4.9129 4.9418 4.9418 5.7184 5.7184 6.0954 6.0954 6.3473 6.3473 6.7208 6.7208 6.8106 6.8106 7.0814 7.0814 7.2646 7.2646 7.4011 7.4011 7.6394 7.6394 8.0457 8.0457 8.2756 8.2756 8.8520 8.8520 10.0117 10.0117 10.1893 10.1893 10.3213 10.3213 11.1690 11.1690 12.1922 12.1922 12.3047 12.3047 13.9482 13.9482 k = 0.3649 0.3649-0.0000 ( 7800 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.9378 -2.9378 -2.5837 -2.5837 -1.5021 -1.5021 -1.4121 -1.4121 3.4162 3.4162 3.6933 3.6933 4.9140 4.9140 4.9488 4.9488 5.6496 5.6496 6.0592 6.0592 6.2970 6.2970 6.6846 6.6846 6.8173 6.8173 7.0976 7.0976 7.2751 7.2751 7.4223 7.4223 7.6405 7.6405 8.0760 8.0760 8.2617 8.2617 8.8661 8.8661 10.0142 10.0142 10.1800 10.1800 10.3215 10.3215 11.3303 11.3303 12.1762 12.1762 12.3116 12.3116 13.8855 13.8855 k = 0.3514 0.3514-0.0000 ( 7798 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.9757 -2.9757 -2.5577 -2.5577 -1.4946 -1.4946 -1.3937 -1.3937 3.4060 3.4060 3.7379 3.7379 4.9150 4.9150 4.9561 4.9561 5.5806 5.5806 6.0068 6.0068 6.2584 6.2584 6.6497 6.6497 6.8217 6.8217 7.1137 7.1137 7.2848 7.2848 7.4446 7.4446 7.6418 7.6418 8.0809 8.0809 8.2824 8.2824 8.8841 8.8841 10.0157 10.0157 10.1709 10.1709 10.3225 10.3225 11.4899 11.4899 12.1601 12.1601 12.3194 12.3194 13.8177 13.8177 k = 0.3378 0.3378-0.0000 ( 7796 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -3.0145 -3.0145 -2.5295 -2.5295 -1.4866 -1.4866 -1.3758 -1.3758 3.3942 3.3942 3.7844 3.7844 4.9161 4.9161 4.9636 4.9636 5.5119 5.5119 5.9402 5.9402 6.2316 6.2316 6.6171 6.6171 6.8244 6.8244 7.1292 7.1292 7.2937 7.2937 7.4650 7.4650 7.6441 7.6441 8.0712 8.0712 8.3266 8.3266 8.9061 8.9061 10.0158 10.0158 10.1626 10.1626 10.3245 10.3245 11.6460 11.6460 12.1445 12.1445 12.3283 12.3283 13.7437 13.7437 k = 0.3243 0.3243-0.0000 ( 7796 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -3.0538 -3.0538 -2.4992 -2.4992 -1.4781 -1.4781 -1.3586 -1.3586 3.3803 3.3803 3.8318 3.8318 4.9171 4.9171 4.9711 4.9711 5.4438 5.4438 5.8652 5.8652 6.2133 6.2133 6.5873 6.5873 6.8256 6.8256 7.1432 7.1432 7.3023 7.3023 7.4810 7.4810 7.6485 7.6485 8.0595 8.0595 8.3810 8.3810 8.9323 8.9323 10.0144 10.0144 10.1553 10.1553 10.3279 10.3279 11.7969 11.7969 12.1299 12.1299 12.3386 12.3386 13.6629 13.6629 k = 0.3108 0.3108-0.0000 ( 7800 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6308 -35.6308 -3.0933 -3.0933 -2.4669 -2.4669 -1.4692 -1.4692 -1.3424 -1.3424 3.3643 3.3643 3.8792 3.8792 4.9180 4.9180 4.9784 4.9784 5.3767 5.3767 5.7876 5.7876 6.2002 6.2002 6.5610 6.5610 6.8258 6.8258 7.1549 7.1549 7.3109 7.3109 7.4907 7.4907 7.6555 7.6555 8.0515 8.0515 8.4396 8.4396 8.9622 8.9622 10.0117 10.0117 10.1493 10.1493 10.3328 10.3328 11.9403 11.9403 12.1172 12.1172 12.3509 12.3509 13.5758 13.5758 k = 0.2973 0.2973-0.0000 ( 7802 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6308 -35.6308 -3.1327 -3.1327 -2.4327 -2.4327 -1.4599 -1.4599 -1.3273 -1.3273 3.3457 3.3457 3.9252 3.9252 4.9187 4.9187 4.9855 4.9855 5.3109 5.3109 5.7124 5.7124 6.1901 6.1901 6.5384 6.5384 6.8253 6.8253 7.1638 7.1638 7.3193 7.3193 7.4937 7.4937 7.6649 7.6649 8.0491 8.0491 8.5001 8.5001 8.9953 8.9953 10.0081 10.0081 10.1444 10.1444 10.3393 10.3393 12.0665 12.0665 12.1138 12.1138 12.3668 12.3668 13.4834 13.4834 k = 0.2838 0.2838-0.0000 ( 7806 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6307 -35.6307 -3.1716 -3.1716 -2.3968 -2.3968 -1.4503 -1.4503 -1.3133 -1.3133 3.3243 3.3243 3.9684 3.9684 4.9192 4.9192 4.9921 4.9921 5.2467 5.2467 5.6434 5.6434 6.1820 6.1820 6.5197 6.5197 6.8241 6.8241 7.1696 7.1696 7.3272 7.3272 7.4908 7.4908 7.6751 7.6751 8.0533 8.0533 8.5614 8.5614 9.0309 9.0309 10.0044 10.0044 10.1403 10.1403 10.3477 10.3477 12.0894 12.0894 12.2010 12.2010 12.3912 12.3912 13.3871 13.3871 k = 0.2703 0.2703-0.0000 ( 7798 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6307 -35.6307 -3.2100 -3.2100 -2.3593 -2.3593 -1.4406 -1.4406 -1.3006 -1.3006 3.2997 3.2997 4.0073 4.0073 4.9192 4.9192 4.9982 4.9982 5.1845 5.1845 5.5840 5.5840 6.1754 6.1754 6.5048 6.5048 6.8225 6.8225 7.1723 7.1723 7.3343 7.3343 7.4832 7.4832 7.6844 7.6844 8.0646 8.0646 8.6230 8.6230 9.0681 9.0681 10.0012 10.0012 10.1369 10.1369 10.3578 10.3578 12.0840 12.0840 12.2891 12.2891 12.4382 12.4382 13.2880 13.2880 k = 0.2568 0.2568-0.0000 ( 7794 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6307 -35.6307 -3.2475 -3.2475 -2.3203 -2.3203 -1.4307 -1.4307 -1.2893 -1.2893 3.2717 3.2717 4.0403 4.0403 4.9184 4.9184 5.0032 5.0032 5.1251 5.1251 5.5369 5.5369 6.1701 6.1701 6.4938 6.4938 6.8206 6.8206 7.1722 7.1722 7.3400 7.3400 7.4721 7.4721 7.6911 7.6911 8.0831 8.0831 8.6843 8.6843 9.1060 9.1060 9.9994 9.9994 10.1339 10.1339 10.3695 10.3695 12.0803 12.0803 12.3374 12.3374 12.5184 12.5184 13.1876 13.1876 k = 0.2432 0.2432-0.0000 ( 7796 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6307 -35.6307 -3.2840 -3.2840 -2.2801 -2.2801 -1.4207 -1.4207 -1.2793 -1.2793 3.2401 3.2401 4.0661 4.0661 4.9159 4.9159 5.0065 5.0065 5.0704 5.0704 5.5045 5.5045 6.1662 6.1662 6.4864 6.4864 6.8184 6.8184 7.1696 7.1696 7.3442 7.3442 7.4583 7.4583 7.6943 7.6943 8.1088 8.1088 8.7447 8.7447 9.1434 9.1434 9.9998 9.9998 10.1315 10.1315 10.3828 10.3828 12.0797 12.0797 12.3631 12.3631 12.6131 12.6131 13.0869 13.0869 k = 0.2297 0.2297-0.0000 ( 7784 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6307 -35.6307 -3.3193 -3.3193 -2.2387 -2.2387 -1.4108 -1.4108 -1.2706 -1.2706 3.2046 3.2046 4.0840 4.0840 4.9093 4.9093 5.0008 5.0008 5.0300 5.0300 5.4882 5.4882 6.1638 6.1638 6.4824 6.4824 6.8159 6.8159 7.1648 7.1648 7.3467 7.3467 7.4424 7.4424 7.6936 7.6936 8.1411 8.1411 8.8037 8.8037 9.1795 9.1795 10.0029 10.0029 10.1297 10.1297 10.3974 10.3974 12.0826 12.0826 12.3813 12.3813 12.7062 12.7062 12.9878 12.9878 k = 0.2162 0.2162-0.0000 ( 7786 PWs) bands (ev): -82.3030 -82.3030 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6307 -35.6307 -3.3533 -3.3533 -2.1965 -2.1965 -1.4010 -1.4010 -1.2633 -1.2633 3.1654 3.1654 4.0939 4.0939 4.8925 4.8925 4.9736 4.9736 5.0225 5.0225 5.4885 5.4885 6.1630 6.1630 6.4815 6.4815 6.8132 6.8132 7.1580 7.1580 7.3475 7.3475 7.4244 7.4244 7.6891 7.6891 8.1791 8.1791 8.8606 8.8606 9.2133 9.2133 10.0095 10.0095 10.1289 10.1289 10.4130 10.4130 12.0890 12.0890 12.3967 12.3967 12.7853 12.7853 12.8983 12.8983 k = 0.2027 0.2027-0.0000 ( 7782 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7321 -35.7321 -35.7313 -35.7313 -35.6315 -35.6315 -35.6307 -35.6307 -3.3858 -3.3858 -2.1536 -2.1536 -1.3915 -1.3915 -1.2573 -1.2573 3.1225 3.1225 4.0964 4.0964 4.8602 4.8602 4.9548 4.9548 5.0234 5.0234 5.5047 5.5047 6.1640 6.1640 6.4834 6.4834 6.8103 6.8103 7.1496 7.1496 7.3465 7.3465 7.4051 7.4051 7.6813 7.6813 8.2218 8.2218 8.9147 8.9147 9.2440 9.2440 10.0201 10.0201 10.1292 10.1292 10.4296 10.4296 12.0990 12.0990 12.4109 12.4109 12.7676 12.7676 12.9011 12.9011 k = 0.1892 0.1892-0.0000 ( 7798 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7313 -35.7313 -35.6315 -35.6315 -35.6307 -35.6307 -3.4166 -3.4166 -2.1103 -2.1103 -1.3822 -1.3822 -1.2526 -1.2526 3.0763 3.0763 4.0929 4.0929 4.8184 4.8184 4.9464 4.9464 5.0250 5.0250 5.5354 5.5354 6.1671 6.1671 6.4879 6.4879 6.8073 6.8073 7.1398 7.1398 7.3428 7.3428 7.3852 7.3852 7.6706 7.6706 8.2683 8.2683 8.9650 8.9650 9.2711 9.2711 10.0350 10.0350 10.1311 10.1311 10.4469 10.4469 12.1122 12.1122 12.4241 12.4241 12.6788 12.6788 12.9710 12.9710 k = 0.1757 0.1757-0.0000 ( 7792 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7313 -35.7313 -35.6315 -35.6315 -35.6307 -35.6307 -3.4458 -3.4458 -2.0669 -2.0669 -1.3735 -1.3735 -1.2491 -1.2491 3.0274 3.0274 4.0850 4.0850 4.7746 4.7746 4.9422 4.9422 5.0262 5.0262 5.5782 5.5782 6.1722 6.1722 6.4946 6.4946 6.8040 6.8040 7.1291 7.1291 7.3337 7.3337 7.3680 7.3680 7.6573 7.6573 8.3175 8.3175 9.0108 9.0108 9.2943 9.2943 10.0542 10.0542 10.1350 10.1350 10.4648 10.4648 12.1277 12.1277 12.4350 12.4350 12.5888 12.5888 13.0411 13.0411 k = 0.1622 0.1622-0.0000 ( 7790 PWs) bands (ev): -82.3030 -82.3030 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7321 -35.7321 -35.7313 -35.7313 -35.6315 -35.6315 -35.6307 -35.6307 -3.4732 -3.4732 -2.0236 -2.0236 -1.3654 -1.3654 -1.2467 -1.2467 2.9766 2.9766 4.0743 4.0743 4.7317 4.7317 4.9395 4.9395 5.0271 5.0271 5.6307 5.6307 6.1796 6.1796 6.5032 6.5032 6.8005 6.8005 7.1176 7.1176 7.3152 7.3152 7.3575 7.3575 7.6420 7.6420 8.3688 8.3688 9.0511 9.0511 9.3136 9.3136 10.0775 10.0775 10.1410 10.1410 10.4834 10.4834 12.1439 12.1439 12.4349 12.4349 12.5131 12.5131 13.1070 13.1070 k = 0.1486 0.1486-0.0000 ( 7802 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6307 -35.6307 -3.4986 -3.4986 -1.9808 -1.9808 -1.3580 -1.3580 -1.2452 -1.2452 2.9248 2.9248 4.0622 4.0622 4.6909 4.6909 4.9372 4.9372 5.0277 5.0277 5.6901 5.6901 6.1894 6.1894 6.5135 6.5135 6.7968 6.7968 7.1056 7.1056 7.2894 7.2894 7.3518 7.3518 7.6247 7.6247 8.4214 8.4214 9.0850 9.0850 9.3294 9.3294 10.1045 10.1045 10.1495 10.1495 10.5028 10.5028 12.1566 12.1566 12.3900 12.3900 12.4899 12.4899 13.1688 13.1688 k = 0.1351 0.1351-0.0000 ( 7790 PWs) bands (ev): -82.3030 -82.3030 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.5221 -3.5221 -1.9389 -1.9389 -1.3515 -1.3515 -1.2447 -1.2447 2.8729 2.8729 4.0496 4.0496 4.6528 4.6528 4.9351 4.9351 5.0280 5.0280 5.7539 5.7539 6.2021 6.2021 6.5252 6.5252 6.7929 6.7929 7.0936 7.0936 7.2597 7.2597 7.3477 7.3477 7.6062 7.6062 8.4747 8.4747 9.1117 9.1117 9.3423 9.3423 10.1343 10.1343 10.1603 10.1603 10.5231 10.5231 12.1549 12.1549 12.3321 12.3321 12.4984 12.4984 13.2270 13.2270 k = 0.1216 0.1216-0.0000 ( 7785 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.5436 -3.5436 -1.8982 -1.8982 -1.3462 -1.3462 -1.2448 -1.2448 2.8221 2.8221 4.0375 4.0375 4.6177 4.6177 4.9331 4.9331 5.0281 5.0281 5.8193 5.8193 6.2182 6.2182 6.5379 6.5379 6.7887 6.7887 7.0817 7.0817 7.2275 7.2275 7.3439 7.3439 7.5866 7.5866 8.5281 8.5281 9.1305 9.1305 9.3529 9.3529 10.1659 10.1659 10.1733 10.1733 10.5447 10.5447 12.1202 12.1202 12.3049 12.3049 12.5128 12.5128 13.2821 13.2821 k = 0.1081 0.1081-0.0000 ( 7781 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.5629 -3.5629 -1.8592 -1.8592 -1.3421 -1.3421 -1.2454 -1.2454 2.7733 2.7733 4.0261 4.0261 4.5859 4.5859 4.9310 4.9310 5.0281 5.0281 5.8833 5.8833 6.2386 6.2386 6.5512 6.5512 6.7840 6.7840 7.0702 7.0702 7.1933 7.1933 7.3402 7.3402 7.5666 7.5666 8.5813 8.5813 9.1411 9.1411 9.3621 9.3621 10.1878 10.1878 10.1984 10.1984 10.5677 10.5677 12.0561 12.0561 12.3082 12.3082 12.5294 12.5294 13.3348 13.3348 k = 0.0946 0.0946-0.0000 ( 7781 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.5801 -3.5801 -1.8224 -1.8224 -1.3394 -1.3394 -1.2462 -1.2462 2.7276 2.7276 4.0160 4.0160 4.5574 4.5574 4.9290 4.9290 5.0280 5.0280 5.9428 5.9428 6.2646 6.2646 6.5647 6.5647 6.7789 6.7789 7.0593 7.0593 7.1576 7.1576 7.3363 7.3363 7.5467 7.5467 8.6338 8.6338 9.1436 9.1436 9.3702 9.3702 10.2034 10.2034 10.2302 10.2302 10.5923 10.5923 11.9815 11.9815 12.3235 12.3235 12.5474 12.5474 13.3854 13.3854 k = 0.0811 0.0811-0.0000 ( 7779 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.5951 -3.5951 -1.7882 -1.7882 -1.3383 -1.3383 -1.2470 -1.2470 2.6859 2.6859 4.0071 4.0071 4.5326 4.5326 4.9271 4.9271 5.0279 5.0279 5.9946 5.9946 6.2977 6.2977 6.5779 6.5779 6.7730 6.7730 7.0491 7.0491 7.1213 7.1213 7.3322 7.3322 7.5277 7.5277 8.6851 8.6851 9.1386 9.1386 9.3774 9.3774 10.2190 10.2190 10.2605 10.2605 10.6185 10.6185 11.9060 11.9060 12.3415 12.3415 12.5662 12.5662 13.4342 13.4342 k = 0.0676 0.0676-0.0000 ( 7777 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.6078 -3.6078 -1.7574 -1.7574 -1.3385 -1.3385 -1.2477 -1.2477 2.6491 2.6491 3.9996 3.9996 4.5113 4.5113 4.9253 4.9253 5.0278 5.0278 6.0365 6.0365 6.3382 6.3382 6.5901 6.5901 6.7662 6.7662 7.0394 7.0394 7.0854 7.0854 7.3278 7.3278 7.5104 7.5104 8.7347 8.7347 9.1270 9.1270 9.3837 9.3837 10.2339 10.2339 10.2881 10.2881 10.6458 10.6458 11.8341 11.8341 12.3586 12.3586 12.5852 12.5852 13.4811 13.4811 k = 0.0541 0.0541-0.0000 ( 7781 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.6183 -3.6183 -1.7305 -1.7305 -1.3399 -1.3399 -1.2481 -1.2481 2.6179 2.6179 3.9935 3.9935 4.4938 4.4938 4.9237 4.9237 5.0277 5.0277 6.0680 6.0680 6.3847 6.3847 6.6006 6.6006 6.7580 6.7580 7.0284 7.0284 7.0534 7.0534 7.3233 7.3233 7.4953 7.4953 8.7821 8.7821 9.1099 9.1099 9.3889 9.3889 10.2470 10.2470 10.3120 10.3120 10.6730 10.6730 11.7688 11.7688 12.3732 12.3732 12.6033 12.6033 13.5257 13.5257 k = 0.0405 0.0405-0.0000 ( 7783 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.6264 -3.6264 -1.7084 -1.7084 -1.3420 -1.3420 -1.2483 -1.2483 2.5930 2.5930 3.9888 3.9888 4.4802 4.4802 4.9224 4.9224 5.0276 5.0276 6.0902 6.0902 6.4337 6.4337 6.6084 6.6084 6.7481 6.7481 7.0085 7.0085 7.0351 7.0351 7.3191 7.3191 7.4832 7.4832 8.8262 8.8262 9.0887 9.0887 9.3930 9.3930 10.2578 10.2578 10.3315 10.3315 10.6983 10.6983 11.7131 11.7131 12.3848 12.3848 12.6192 12.6192 13.5670 13.5670 k = 0.0270 0.0270-0.0000 ( 7789 PWs) bands (ev): -82.3030 -82.3030 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6316 -35.6316 -35.6306 -35.6306 -3.6323 -3.6323 -1.6919 -1.6919 -1.3442 -1.3442 -1.2484 -1.2484 2.5748 2.5748 3.9855 3.9855 4.4704 4.4704 4.9214 4.9214 5.0275 5.0275 6.1047 6.1047 6.4804 6.4804 6.6123 6.6123 6.7369 6.7369 6.9847 6.9847 7.0280 7.0280 7.3156 7.3156 7.4744 7.4744 8.8654 8.8654 9.0656 9.0656 9.3959 9.3959 10.2658 10.2658 10.3460 10.3460 10.7193 10.7193 11.6700 11.6700 12.3930 12.3930 12.6318 12.6318 13.6031 13.6031 k = 0.0135 0.0135-0.0000 ( 7795 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6316 -35.6316 -35.6306 -35.6306 -3.6358 -3.6358 -1.6816 -1.6816 -1.3458 -1.3458 -1.2484 -1.2484 2.5638 2.5638 3.9835 3.9835 4.4645 4.4645 4.9208 4.9208 5.0274 5.0274 6.1129 6.1129 6.5174 6.5174 6.6114 6.6114 6.7268 6.7268 6.9680 6.9680 7.0247 7.0247 7.3132 7.3132 7.4690 7.4690 8.8957 8.8957 9.0449 9.0449 9.3976 9.3976 10.2707 10.2707 10.3548 10.3548 10.7334 10.7334 11.6426 11.6426 12.3979 12.3979 12.6399 12.6399 13.6297 13.6297 k = 0.0000 0.0000 0.0000 ( 7779 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.6370 -3.6370 -1.6781 -1.6781 -1.3464 -1.3464 -1.2484 -1.2484 2.5601 2.5601 3.9829 3.9829 4.4625 4.4625 4.9207 4.9207 5.0274 5.0274 6.1155 6.1155 6.5330 6.5330 6.6094 6.6094 6.7225 6.7225 6.9621 6.9621 7.0236 7.0236 7.3123 7.3123 7.4672 7.4672 8.9082 8.9082 9.0357 9.0357 9.3982 9.3982 10.2724 10.2724 10.3578 10.3578 10.7384 10.7384 11.6331 11.6331 12.3995 12.3995 12.6427 12.6427 13.6400 13.6400 k = 0.0000 0.0000 0.0000 ( 7779 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.6370 -3.6370 -1.6781 -1.6781 -1.3464 -1.3464 -1.2484 -1.2484 2.5601 2.5601 3.9829 3.9829 4.4625 4.4625 4.9207 4.9207 5.0274 5.0274 6.1155 6.1155 6.5330 6.5330 6.6094 6.6094 6.7225 6.7225 6.9621 6.9621 7.0236 7.0236 7.3123 7.3123 7.4672 7.4672 8.9082 8.9082 9.0357 9.0357 9.3982 9.3982 10.2724 10.2724 10.3578 10.3578 10.7384 10.7384 11.6331 11.6331 12.3995 12.3995 12.6427 12.6427 13.6400 13.6400 k = 0.0000 0.0000 0.0193 ( 7795 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6316 -35.6316 -35.6306 -35.6306 -3.6357 -3.6357 -1.6776 -1.6776 -1.3464 -1.3464 -1.2485 -1.2485 2.5608 2.5608 3.9837 3.9837 4.4637 4.4637 4.9202 4.9202 5.0264 5.0264 6.1121 6.1121 6.5344 6.5344 6.6109 6.6109 6.7092 6.7092 6.9621 6.9621 7.0332 7.0332 7.3102 7.3102 7.4691 7.4691 8.9028 8.9028 9.0404 9.0404 9.3976 9.3976 10.2670 10.2670 10.3535 10.3535 10.7369 10.7369 11.6357 11.6357 12.3857 12.3857 12.6263 12.6263 13.6297 13.6297 k = 0.0000 0.0000 0.0385 ( 7795 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6316 -35.6316 -35.6306 -35.6306 -3.6318 -3.6318 -1.6764 -1.6764 -1.3464 -1.3464 -1.2488 -1.2488 2.5631 2.5631 3.9861 3.9861 4.4672 4.4672 4.9188 4.9188 5.0232 5.0232 6.1014 6.1014 6.5385 6.5385 6.6152 6.6152 6.6754 6.6754 6.9621 6.9621 7.0569 7.0569 7.3037 7.3037 7.4748 7.4748 8.8867 8.8867 9.0543 9.0543 9.3956 9.3956 10.2513 10.2513 10.3406 10.3406 10.7323 10.7323 11.6428 11.6428 12.3468 12.3468 12.5808 12.5808 13.6026 13.6026 k = 0.0000 0.0000 0.0578 ( 7763 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6315 -35.6315 -35.6306 -35.6306 -3.6253 -3.6253 -1.6743 -1.6743 -1.3464 -1.3464 -1.2494 -1.2494 2.5670 2.5670 3.9901 3.9901 4.4730 4.4730 4.9167 4.9167 5.0182 5.0182 6.0822 6.0822 6.5450 6.5450 6.6155 6.6155 6.6387 6.6387 6.9623 6.9623 7.0857 7.0857 7.2930 7.2930 7.4839 7.4839 8.8599 8.8599 9.0771 9.0771 9.3922 9.3922 10.2269 10.2269 10.3194 10.3194 10.7245 10.7245 11.6530 11.6530 12.2886 12.2886 12.5142 12.5142 13.5618 13.5618 k = 0.0000 0.0000 0.0770 ( 7763 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7322 -35.7322 -35.7313 -35.7313 -35.6316 -35.6316 -35.6306 -35.6306 -3.6163 -3.6163 -1.6715 -1.6715 -1.3464 -1.3464 -1.2502 -1.2502 2.5723 2.5723 3.9958 3.9958 4.4812 4.4812 4.9139 4.9139 5.0114 5.0114 6.0526 6.0526 6.5537 6.5537 6.5779 6.5779 6.6414 6.6414 6.9626 6.9626 7.1136 7.1136 7.2779 7.2779 7.4957 7.4957 8.8226 8.8226 9.1081 9.1081 9.3876 9.3876 10.1956 10.1956 10.2904 10.2904 10.7131 10.7131 11.6640 11.6640 12.2182 12.2182 12.4346 12.4346 13.5081 13.5081 k = 0.0000 0.0000 0.0963 ( 7763 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7323 -35.7323 -35.7314 -35.7314 -35.6316 -35.6316 -35.6306 -35.6306 -3.6047 -3.6047 -1.6679 -1.6679 -1.3464 -1.3464 -1.2512 -1.2512 2.5792 2.5792 4.0029 4.0029 4.4916 4.4916 4.9105 4.9105 5.0031 5.0031 6.0113 6.0113 6.5347 6.5347 6.5640 6.5640 6.6568 6.6568 6.9632 6.9632 7.1379 7.1379 7.2585 7.2585 7.5095 7.5095 8.7753 8.7753 9.1466 9.1466 9.3816 9.3816 10.1597 10.1597 10.2539 10.2539 10.6979 10.6979 11.6730 11.6730 12.1419 12.1419 12.3489 12.3489 13.4431 13.4431 k = 0.0000 0.0000 0.1155 ( 7763 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7323 -35.7323 -35.7314 -35.7314 -35.6316 -35.6316 -35.6306 -35.6306 -3.5906 -3.5906 -1.6638 -1.6638 -1.3464 -1.3464 -1.2524 -1.2524 2.5876 2.5876 4.0116 4.0116 4.5044 4.5044 4.9068 4.9068 4.9937 4.9937 5.9577 5.9577 6.4968 6.4968 6.5753 6.5753 6.6769 6.6769 6.9643 6.9643 7.1575 7.1575 7.2346 7.2346 7.5243 7.5243 8.7185 8.7185 9.1915 9.1915 9.3744 9.3744 10.1211 10.1211 10.2106 10.2106 10.6784 10.6784 11.6768 11.6768 12.0655 12.0655 12.2618 12.2618 13.3695 13.3695 k = 0.0000 0.0000 0.1348 ( 7763 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7324 -35.7324 -35.7315 -35.7315 -35.6316 -35.6316 -35.6306 -35.6306 -3.5740 -3.5740 -1.6591 -1.6591 -1.3464 -1.3464 -1.2539 -1.2539 2.5975 2.5975 4.0217 4.0217 4.5193 4.5193 4.9030 4.9030 4.9834 4.9834 5.8928 5.8928 6.4657 6.4657 6.5868 6.5868 6.7008 6.7008 6.9657 6.9657 7.1726 7.1726 7.2064 7.2064 7.5388 7.5388 8.6533 8.6533 9.2417 9.2417 9.3659 9.3659 10.0813 10.0813 10.1613 10.1613 10.6545 10.6545 11.6718 11.6718 11.9938 11.9938 12.1764 12.1764 13.2905 13.2905 k = 0.0000 0.0000 0.1540 ( 7783 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7324 -35.7324 -35.7316 -35.7316 -35.6316 -35.6316 -35.6307 -35.6307 -3.5548 -3.5548 -1.6541 -1.6541 -1.3463 -1.3463 -1.2556 -1.2556 2.6088 2.6088 4.0332 4.0332 4.5365 4.5365 4.8992 4.8992 4.9725 4.9725 5.8187 5.8187 6.4403 6.4403 6.5977 6.5977 6.7284 6.7284 6.9674 6.9674 7.1743 7.1743 7.1836 7.1836 7.5523 7.5523 8.5809 8.5809 9.2960 9.2960 9.3562 9.3562 10.0414 10.0414 10.1064 10.1064 10.6259 10.6259 11.6544 11.6544 11.9310 11.9310 12.0949 12.0949 13.2095 13.2095 k = 0.0000 0.0000 0.1733 ( 7775 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7325 -35.7325 -35.7316 -35.7316 -35.6316 -35.6316 -35.6307 -35.6307 -3.5332 -3.5332 -1.6487 -1.6487 -1.3463 -1.3463 -1.2574 -1.2574 2.6217 2.6217 4.0460 4.0460 4.5557 4.5557 4.8959 4.8959 4.9616 4.9616 5.7379 5.7379 6.4195 6.4195 6.6070 6.6070 6.7592 6.7592 6.9683 6.9683 7.1396 7.1396 7.1912 7.1912 7.5642 7.5642 8.5030 8.5030 9.3454 9.3454 9.3531 9.3531 10.0020 10.0020 10.0470 10.0470 10.5926 10.5926 11.6229 11.6229 11.8793 11.8793 12.0188 12.0188 13.1295 13.1295 k = 0.0000 0.0000 0.1925 ( 7791 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1733 -49.1733 -35.7326 -35.7326 -35.7317 -35.7317 -35.6316 -35.6316 -35.6307 -35.6307 -3.5092 -3.5092 -1.6432 -1.6432 -1.3463 -1.3463 -1.2595 -1.2595 2.6360 2.6360 4.0601 4.0601 4.5770 4.5770 4.8932 4.8932 4.9507 4.9507 5.6528 5.6528 6.4017 6.4017 6.6135 6.6135 6.7927 6.7927 6.9654 6.9654 7.1053 7.1053 7.1957 7.1957 7.5739 7.5739 8.4214 8.4214 9.3333 9.3333 9.4116 9.4116 9.9635 9.9635 9.9836 9.9836 10.5549 10.5549 11.5791 11.5791 11.8364 11.8364 11.9487 11.9487 13.0533 13.0533 k = 0.0000 0.0000 0.2118 ( 7763 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7327 -35.7327 -35.7318 -35.7318 -35.6316 -35.6316 -35.6307 -35.6307 -3.4828 -3.4828 -1.6378 -1.6378 -1.3462 -1.3462 -1.2617 -1.2617 2.6517 2.6517 4.0752 4.0752 4.6002 4.6002 4.8914 4.8914 4.9404 4.9404 5.5654 5.5654 6.3858 6.3858 6.6161 6.6161 6.8284 6.8284 6.9514 6.9514 7.0790 7.0790 7.1976 7.1976 7.5814 7.5814 8.3378 8.3378 9.3202 9.3202 9.4704 9.4704 9.9172 9.9172 9.9259 9.9259 10.5130 10.5130 11.5280 11.5280 11.7974 11.7974 11.8851 11.8851 12.9833 12.9833 k = 0.0000 0.0000 0.2310 ( 7763 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7327 -35.7327 -35.7319 -35.7319 -35.6316 -35.6316 -35.6307 -35.6307 -3.4540 -3.4540 -1.6326 -1.6326 -1.3462 -1.3462 -1.2641 -1.2641 2.6690 2.6690 4.0914 4.0914 4.6252 4.6252 4.8909 4.8909 4.9307 4.9307 5.4774 5.4774 6.3709 6.3709 6.6135 6.6135 6.8658 6.8658 6.9185 6.9185 7.0690 7.0690 7.1972 7.1972 7.5864 7.5864 8.2540 8.2540 9.3060 9.3060 9.5281 9.5281 9.8486 9.8486 9.8895 9.8895 10.4679 10.4679 11.4744 11.4744 11.7574 11.7574 11.8277 11.8277 12.9213 12.9213 k = 0.0000 0.0000 0.2503 ( 7747 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1732 -49.1732 -35.7328 -35.7328 -35.7320 -35.7320 -35.6316 -35.6316 -35.6307 -35.6307 -3.4229 -3.4229 -1.6278 -1.6278 -1.3462 -1.3462 -1.2667 -1.2667 2.6877 2.6877 4.1086 4.1086 4.6516 4.6516 4.8921 4.8921 4.9219 4.9219 5.3900 5.3900 6.3565 6.3565 6.6037 6.6037 6.8695 6.8695 6.9040 6.9040 7.0734 7.0734 7.1947 7.1947 7.5891 7.5891 8.1717 8.1717 9.2909 9.2909 9.5832 9.5832 9.7794 9.7794 9.8542 9.8542 10.4204 10.4204 11.4212 11.4212 11.7134 11.7134 11.7761 11.7761 12.8683 12.8683 k = 0.0000 0.0000 0.2695 ( 7759 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7329 -35.7329 -35.7321 -35.7321 -35.6316 -35.6316 -35.6308 -35.6308 -3.3896 -3.3896 -1.6237 -1.6237 -1.3461 -1.3461 -1.2694 -1.2694 2.7079 2.7079 4.1264 4.1264 4.6792 4.6792 4.8954 4.8954 4.9143 4.9143 5.3043 5.3043 6.3422 6.3422 6.5838 6.5838 6.8130 6.8130 6.9425 6.9425 7.0860 7.0860 7.1901 7.1901 7.5896 7.5896 8.0924 8.0924 9.2749 9.2749 9.6301 9.6301 9.7146 9.7146 9.8204 9.8204 10.3718 10.3718 11.3699 11.3699 11.6643 11.6643 11.7296 11.7296 12.8250 12.8250 k = 0.0000 0.0000 0.2888 ( 7759 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7330 -35.7330 -35.7322 -35.7322 -35.6316 -35.6316 -35.6308 -35.6308 -3.3541 -3.3541 -1.6204 -1.6204 -1.3461 -1.3461 -1.2723 -1.2723 2.7296 2.7296 4.1449 4.1449 4.7073 4.7073 4.9015 4.9015 4.9080 4.9080 5.2212 5.2212 6.3277 6.3277 6.5489 6.5489 6.7573 6.7573 6.9804 6.9804 7.1028 7.1028 7.1839 7.1839 7.5881 7.5881 8.0170 8.0170 9.2581 9.2581 9.6192 9.6192 9.7041 9.7041 9.7882 9.7882 10.3233 10.3233 11.3208 11.3208 11.6106 11.6106 11.6875 11.6875 12.7910 12.7910 k = 0.0000 0.0000 0.3080 ( 7759 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1740 -49.1740 -49.1733 -49.1733 -35.7331 -35.7331 -35.7323 -35.7323 -35.6317 -35.6317 -35.6308 -35.6308 -3.3164 -3.3164 -1.6181 -1.6181 -1.3462 -1.3462 -1.2753 -1.2753 2.7529 2.7529 4.1639 4.1639 4.7354 4.7354 4.9032 4.9032 4.9111 4.9111 5.1412 5.1412 6.3129 6.3129 6.4938 6.4938 6.7097 6.7097 7.0166 7.0166 7.1218 7.1218 7.1763 7.1763 7.5846 7.5846 7.9463 7.9463 9.2409 9.2409 9.5544 9.5544 9.7435 9.7435 9.7582 9.7582 10.2764 10.2764 11.2735 11.2735 11.5536 11.5536 11.6487 11.6487 12.7659 12.7659 k = 0.0000 0.0000 0.3273 ( 7775 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1734 -49.1734 -35.7333 -35.7333 -35.7324 -35.7324 -35.6317 -35.6317 -35.6308 -35.6308 -3.2767 -3.2767 -1.6171 -1.6171 -1.3462 -1.3462 -1.2784 -1.2784 2.7778 2.7778 4.1833 4.1833 4.7623 4.7623 4.9000 4.9000 4.9252 4.9252 5.0651 5.0651 6.2975 6.2975 6.4181 6.4181 6.6718 6.6718 7.0490 7.0490 7.1415 7.1415 7.1687 7.1687 7.5795 7.5795 7.8808 7.8808 9.2232 9.2232 9.4856 9.4856 9.7305 9.7305 9.7829 9.7829 10.2330 10.2330 11.2271 11.2271 11.4950 11.4950 11.6125 11.6125 12.7486 12.7486 k = 0.0000 0.0000 0.3465 ( 7763 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1733 -49.1733 -35.7334 -35.7334 -35.7325 -35.7325 -35.6317 -35.6317 -35.6309 -35.6309 -3.2351 -3.2351 -1.6176 -1.6176 -1.3463 -1.3463 -1.2816 -1.2816 2.8044 2.8044 4.2028 4.2028 4.7872 4.7872 4.8985 4.8985 4.9447 4.9447 4.9933 4.9933 6.2817 6.2817 6.3263 6.3263 6.6405 6.6405 7.0734 7.0734 7.1611 7.1611 7.1647 7.1647 7.5728 7.5728 7.8206 7.8206 9.2055 9.2055 9.4177 9.4177 9.7059 9.7059 9.8168 9.8168 10.1949 10.1949 11.1806 11.1806 11.4370 11.4370 11.5781 11.5781 12.7382 12.7382 k = 0.0000 0.0000 0.3658 ( 7763 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1734 -49.1734 -35.7335 -35.7335 -35.7326 -35.7326 -35.6317 -35.6317 -35.6309 -35.6309 -3.1915 -3.1915 -1.6198 -1.6198 -1.3465 -1.3465 -1.2849 -1.2849 2.8327 2.8327 4.2222 4.2222 4.8095 4.8095 4.8985 4.8985 4.9262 4.9262 4.9703 4.9703 6.2235 6.2235 6.2654 6.2654 6.6120 6.6120 7.0822 7.0822 7.1709 7.1709 7.1798 7.1798 7.5650 7.5650 7.7656 7.7656 9.1878 9.1878 9.3519 9.3519 9.6846 9.6846 9.8433 9.8433 10.1641 10.1641 11.1325 11.1325 11.3817 11.3817 11.5446 11.5446 12.7337 12.7337 k = 0.0000 0.0000 0.3850 ( 7751 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1734 -49.1734 -35.7335 -35.7335 -35.7327 -35.7327 -35.6317 -35.6317 -35.6309 -35.6309 -3.1461 -3.1461 -1.6240 -1.6240 -1.3467 -1.3467 -1.2883 -1.2883 2.8630 2.8630 4.2414 4.2414 4.8290 4.8290 4.8637 4.8637 4.9007 4.9007 5.0018 5.0018 6.1133 6.1133 6.2485 6.2485 6.5842 6.5842 7.0739 7.0739 7.1883 7.1883 7.1969 7.1969 7.5563 7.5563 7.7155 7.7155 9.1703 9.1703 9.2890 9.2890 9.6671 9.6671 9.8609 9.8609 10.1428 10.1428 11.0818 11.0818 11.3308 11.3308 11.5114 11.5114 12.7343 12.7343 k = 0.0000 0.0000 0.4043 ( 7755 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1734 -49.1734 -35.7337 -35.7337 -35.7329 -35.7329 -35.6317 -35.6317 -35.6309 -35.6309 -3.0990 -3.0990 -1.6304 -1.6304 -1.3469 -1.3469 -1.2917 -1.2917 2.8952 2.8952 4.2602 4.2602 4.8066 4.8066 4.8465 4.8465 4.9044 4.9044 5.0382 5.0382 5.9982 5.9982 6.2310 6.2310 6.5558 6.5558 7.0548 7.0548 7.2097 7.2097 7.2121 7.2121 7.5469 7.5469 7.6701 7.6701 9.1533 9.1533 9.2297 9.2297 9.6537 9.6537 9.8692 9.8692 10.1320 10.1320 11.0283 11.0283 11.2849 11.2849 11.4781 11.4781 12.7393 12.7393 k = 0.0000 0.0000 0.4235 ( 7775 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1734 -49.1734 -35.7338 -35.7338 -35.7330 -35.7330 -35.6317 -35.6317 -35.6310 -35.6310 -3.0502 -3.0502 -1.6391 -1.6391 -1.3472 -1.3472 -1.2951 -1.2951 2.9297 2.9297 4.2784 4.2784 4.7547 4.7547 4.8628 4.8628 4.9098 4.9098 5.0784 5.0784 5.8802 5.8802 6.2130 6.2130 6.5265 6.5265 7.0291 7.0291 7.2250 7.2250 7.2303 7.2303 7.5373 7.5373 7.6290 7.6290 9.1366 9.1366 9.1744 9.1744 9.6450 9.6450 9.8697 9.8697 10.1307 10.1307 10.9724 10.9724 11.2439 11.2439 11.4441 11.4441 12.7481 12.7481 k = 0.0000 0.0000 0.4428 ( 7771 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1734 -49.1734 -35.7339 -35.7339 -35.7331 -35.7331 -35.6317 -35.6317 -35.6310 -35.6310 -3.0000 -3.0000 -1.6505 -1.6505 -1.3475 -1.3475 -1.2986 -1.2986 2.9665 2.9665 4.2957 4.2957 4.7081 4.7081 4.8783 4.8783 4.9170 4.9170 5.1211 5.1211 5.7611 5.7611 6.1946 6.1946 6.4960 6.4960 6.9985 6.9985 7.2355 7.2355 7.2478 7.2478 7.5279 7.5279 7.5920 7.5920 9.1205 9.1205 9.1235 9.1235 9.6410 9.6410 9.8655 9.8655 10.1365 10.1365 10.9152 10.9152 11.2071 11.2071 11.4091 11.4091 12.7604 12.7604 k = 0.0000 0.0000 0.4620 ( 7771 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1734 -49.1734 -35.7340 -35.7340 -35.7332 -35.7332 -35.6318 -35.6318 -35.6310 -35.6310 -2.9484 -2.9484 -1.6645 -1.6645 -1.3479 -1.3479 -1.3020 -1.3020 3.0058 3.0058 4.3119 4.3119 4.6668 4.6668 4.8935 4.8935 4.9257 4.9257 5.1642 5.1642 5.6436 5.6436 6.1757 6.1757 6.4645 6.4645 6.9634 6.9634 7.2436 7.2436 7.2613 7.2613 7.5190 7.5190 7.5589 7.5589 9.0775 9.0775 9.1046 9.1046 9.6420 9.6420 9.8597 9.8597 10.1465 10.1465 10.8578 10.8578 11.1734 11.1734 11.3731 11.3731 12.7758 12.7758 k = 0.0000 0.0000 0.4813 ( 7767 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7341 -35.7341 -35.7333 -35.7333 -35.6318 -35.6318 -35.6310 -35.6310 -2.8955 -2.8955 -1.6815 -1.6815 -1.3482 -1.3482 -1.3054 -1.3054 3.0479 3.0479 4.3267 4.3267 4.6306 4.6306 4.9086 4.9086 4.9359 4.9359 5.2032 5.2032 5.5329 5.5329 6.1565 6.1565 6.4321 6.4321 6.9243 6.9243 7.2492 7.2492 7.2704 7.2704 7.5111 7.5111 7.5294 7.5294 9.0364 9.0364 9.0890 9.0890 9.6481 9.6481 9.8548 9.8548 10.1585 10.1585 10.8014 10.8014 11.1419 11.1419 11.3358 11.3358 12.7941 12.7941 k = 0.0000 0.0000 0.5005 ( 7767 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7342 -35.7342 -35.7334 -35.7334 -35.6318 -35.6318 -35.6310 -35.6310 -2.8414 -2.8414 -1.7015 -1.7015 -1.3484 -1.3484 -1.3088 -1.3088 3.0930 3.0930 4.3397 4.3397 4.5994 4.5994 4.9231 4.9231 4.9475 4.9475 5.2229 5.2229 5.4450 5.4450 6.1372 6.1372 6.3991 6.3991 6.8813 6.8813 7.2525 7.2525 7.2749 7.2749 7.5034 7.5034 7.5041 7.5041 9.0005 9.0005 9.0734 9.0734 9.6591 9.6591 9.8523 9.8523 10.1711 10.1711 10.7466 10.7466 11.1119 11.1119 11.2973 11.2973 12.8152 12.8152 k = 0.0000 0.0000 0.5198 ( 7775 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7342 -35.7342 -35.7335 -35.7335 -35.6318 -35.6318 -35.6311 -35.6311 -2.7864 -2.7864 -1.7246 -1.7246 -1.3486 -1.3486 -1.3122 -1.3122 3.1412 3.1412 4.3506 4.3506 4.5730 4.5730 4.9362 4.9362 4.9601 4.9601 5.1880 5.1880 5.4166 5.4166 6.1178 6.1178 6.3657 6.3657 6.8347 6.8347 7.2536 7.2536 7.2752 7.2752 7.4811 7.4811 7.4980 7.4980 8.9696 8.9696 9.0579 9.0579 9.6748 9.6748 9.8530 9.8530 10.1835 10.1835 10.6942 10.6942 11.0830 11.0830 11.2577 11.2577 12.8389 12.8389 k = 0.0000 0.0000 0.5390 ( 7775 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7343 -35.7343 -35.7336 -35.7336 -35.6318 -35.6318 -35.6311 -35.6311 -2.7306 -2.7306 -1.7508 -1.7508 -1.3487 -1.3487 -1.3154 -1.3154 3.1927 3.1927 4.3588 4.3588 4.5510 4.5510 4.9442 4.9442 4.9736 4.9736 5.1070 5.1070 5.4436 5.4436 6.0986 6.0986 6.3326 6.3326 6.7846 6.7846 7.2526 7.2526 7.2721 7.2721 7.4622 7.4622 7.4927 7.4927 8.9438 8.9438 9.0422 9.0422 9.6948 9.6948 9.8570 9.8570 10.1956 10.1956 10.6445 10.6445 11.0549 11.0549 11.2174 11.2174 12.8653 12.8653 k = 0.0000 0.0000 0.5583 ( 7799 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7344 -35.7344 -35.7337 -35.7337 -35.6318 -35.6318 -35.6311 -35.6311 -2.6741 -2.6741 -1.7801 -1.7801 -1.3487 -1.3487 -1.3186 -1.3186 3.2477 3.2477 4.3635 4.3635 4.5332 4.5332 4.9280 4.9280 4.9877 4.9877 5.0348 5.0348 5.4909 5.4909 6.0797 6.0797 6.3002 6.3002 6.7315 6.7315 7.2499 7.2499 7.2663 7.2663 7.4468 7.4468 7.4876 7.4876 8.9227 8.9227 9.0264 9.0264 9.7183 9.7183 9.8641 9.8641 10.2070 10.2070 10.5978 10.5978 11.0277 11.0277 11.1765 11.1765 12.8944 12.8944 k = 0.0000 0.0000 0.5775 ( 7803 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7345 -35.7345 -35.7338 -35.7338 -35.6318 -35.6318 -35.6311 -35.6311 -2.6172 -2.6172 -1.8126 -1.8126 -1.3486 -1.3486 -1.3217 -1.3217 3.3064 3.3064 4.3632 4.3632 4.5192 4.5192 4.8564 4.8564 5.0021 5.0021 5.0170 5.0170 5.5452 5.5452 6.0614 6.0614 6.2691 6.2691 6.6757 6.6757 7.2456 7.2456 7.2587 7.2587 7.4349 7.4349 7.4825 7.4825 8.9063 8.9063 9.0107 9.0107 9.7448 9.7448 9.8739 9.8739 10.2179 10.2179 10.5542 10.5542 11.0015 11.0015 11.1357 11.1357 12.9261 12.9261 k = 0.0000 0.0000 0.5968 ( 7787 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7345 -35.7345 -35.7339 -35.7339 -35.6318 -35.6318 -35.6311 -35.6311 -2.5599 -2.5599 -1.8480 -1.8480 -1.3483 -1.3483 -1.3246 -1.3246 3.3688 3.3688 4.3554 4.3554 4.5086 4.5086 4.7654 4.7654 5.0163 5.0163 5.0237 5.0237 5.6026 5.6026 6.0440 6.0440 6.2402 6.2402 6.6176 6.6176 7.2403 7.2403 7.2503 7.2503 7.4263 7.4263 7.4772 7.4772 8.8941 8.8941 8.9950 8.9950 9.7732 9.7732 9.8856 9.8856 10.2285 10.2285 10.5139 10.5139 10.9768 10.9768 11.0955 11.0955 12.9606 12.9606 k = 0.0000 0.0000 0.6160 ( 7783 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7346 -35.7346 -35.7339 -35.7339 -35.6318 -35.6318 -35.6312 -35.6312 -2.5025 -2.5025 -1.8864 -1.8864 -1.3478 -1.3478 -1.3274 -1.3274 3.4351 3.4351 4.3360 4.3360 4.5010 4.5010 4.6805 4.6805 5.0301 5.0301 5.0349 5.0349 5.6612 5.6612 6.0277 6.0277 6.2144 6.2144 6.5579 6.5579 7.2343 7.2343 7.2416 7.2416 7.4208 7.4208 7.4715 7.4715 8.8859 8.8859 8.9795 8.9795 9.8026 9.8026 9.8983 9.8983 10.2390 10.2390 10.4768 10.4768 10.9541 10.9541 11.0567 11.0567 12.9979 12.9979 k = 0.0000 0.0000 0.6353 ( 7787 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7346 -35.7346 -35.7340 -35.7340 -35.6318 -35.6318 -35.6312 -35.6312 -2.4452 -2.4452 -1.9276 -1.9276 -1.3471 -1.3471 -1.3301 -1.3301 3.5053 3.5053 4.2992 4.2992 4.4961 4.4961 4.6120 4.6120 5.0428 5.0428 5.0464 5.0464 5.7196 5.7196 6.0125 6.0125 6.1928 6.1928 6.4972 6.4972 7.2283 7.2283 7.2334 7.2334 7.4180 7.4180 7.4653 7.4653 8.8813 8.8813 8.9643 8.9643 9.8317 9.8317 9.9110 9.9110 10.2496 10.2496 10.4429 10.4429 10.9340 10.9340 11.0201 11.0201 13.0383 13.0383 k = 0.0000 0.0000 0.6545 ( 7775 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7340 -35.7340 -35.6318 -35.6318 -35.6312 -35.6312 -2.3882 -2.3882 -1.9713 -1.9713 -1.3463 -1.3463 -1.3326 -1.3326 3.5792 3.5792 4.2419 4.2419 4.4935 4.4935 4.5648 4.5648 5.0542 5.0542 5.0569 5.0569 5.7762 5.7762 5.9986 5.9986 6.1772 6.1772 6.4363 6.4363 7.2226 7.2226 7.2261 7.2261 7.4176 7.4176 7.4588 7.4588 8.8800 8.8800 8.9497 8.9497 9.8594 9.8594 9.9225 9.9225 10.2607 10.2607 10.4120 10.4120 10.9174 10.9174 10.9866 10.9866 13.0817 13.0817 k = 0.0000 0.0000 0.6738 ( 7792 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.3318 -2.3318 -2.0174 -2.0174 -1.3453 -1.3453 -1.3350 -1.3350 3.6569 3.6569 4.1678 4.1678 4.4927 4.4927 4.5359 4.5359 5.0636 5.0636 5.0657 5.0657 5.8290 5.8290 5.9856 5.9856 6.1697 6.1697 6.3764 6.3764 7.2177 7.2177 7.2200 7.2200 7.4191 7.4191 7.4520 7.4520 8.8817 8.8817 8.9358 8.9358 9.8844 9.8844 9.9316 9.9316 10.2725 10.2725 10.3842 10.3842 10.9052 10.9052 10.9572 10.9572 13.1284 13.1284 k = 0.0000 0.0000 0.6930 ( 7792 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.2761 -2.2761 -2.0657 -2.0657 -1.3440 -1.3440 -1.3372 -1.3372 3.7380 3.7380 4.0842 4.0842 4.4938 4.4938 4.5186 4.5186 5.0708 5.0708 5.0722 5.0722 5.8753 5.8753 5.9728 5.9728 6.1733 6.1733 6.3190 6.3190 7.2140 7.2140 7.2154 7.2154 7.4223 7.4223 7.4452 7.4452 8.8859 8.8859 8.9229 8.9229 9.9056 9.9056 9.9369 9.9369 10.2858 10.2858 10.3593 10.3593 10.8981 10.8981 10.9329 10.9329 13.1785 13.1785 k = 0.0000 0.0000 0.7123 ( 7792 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.2214 -2.2214 -2.1159 -2.1159 -1.3426 -1.3426 -1.3392 -1.3392 3.8221 3.8221 3.9967 3.9967 4.4965 4.4965 4.5080 4.5080 5.0754 5.0754 5.0761 5.0761 5.9123 5.9123 5.9583 5.9583 6.1906 6.1906 6.2665 6.2665 7.2118 7.2118 7.2124 7.2124 7.4268 7.4268 7.4385 7.4385 8.8924 8.8924 8.9112 8.9112 9.9218 9.9218 9.9375 9.9375 10.3007 10.3007 10.3371 10.3371 10.8971 10.8971 10.9145 10.9145 13.2321 13.2321 k = 0.0000 0.0000 0.7315 ( 7812 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1737 -49.1737 -35.7348 -35.7348 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1679 -2.1679 -2.1679 -2.1679 -1.3410 -1.3410 -1.3410 -1.3410 3.9087 3.9087 3.9088 3.9088 4.5009 4.5009 4.5012 4.5012 5.0771 5.0771 5.0772 5.0772 5.9391 5.9391 5.9394 5.9394 6.2223 6.2223 6.2225 6.2225 7.2112 7.2112 7.2113 7.2113 7.4322 7.4322 7.4325 7.4325 8.9008 8.9008 8.9011 8.9011 9.9324 9.9324 9.9326 9.9326 10.3176 10.3176 10.3178 10.3178 10.9023 10.9023 10.9025 10.9025 13.2895 13.2896 k = 0.0000 0.0000 0.7315 ( 7812 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1737 -49.1737 -35.7348 -35.7348 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1679 -2.1679 -2.1679 -2.1679 -1.3410 -1.3410 -1.3410 -1.3410 3.9087 3.9087 3.9088 3.9088 4.5009 4.5009 4.5012 4.5012 5.0771 5.0771 5.0772 5.0772 5.9391 5.9391 5.9394 5.9394 6.2223 6.2223 6.2225 6.2225 7.2112 7.2112 7.2113 7.2113 7.4322 7.4322 7.4325 7.4325 8.9008 8.9008 8.9011 8.9011 9.9324 9.9324 9.9326 9.9326 10.3176 10.3176 10.3178 10.3178 10.9023 10.9023 10.9025 10.9025 13.2895 13.2896 k = 0.0000 0.0192 0.7315 ( 7794 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1683 -2.1683 -2.1662 -2.1662 -1.3429 -1.3429 -1.3406 -1.3406 3.9038 3.9038 3.9110 3.9110 4.5003 4.5003 4.5010 4.5010 5.0678 5.0678 5.0915 5.0915 5.9367 5.9367 5.9423 5.9423 6.2188 6.2188 6.2297 6.2297 7.1934 7.1934 7.2236 7.2236 7.4255 7.4255 7.4386 7.4386 8.8889 8.8889 8.9130 8.9130 9.9242 9.9242 9.9399 9.9399 10.2952 10.2952 10.3120 10.3120 10.9069 10.9069 10.9326 10.9326 13.2906 13.2906 k = 0.0000 0.0385 0.7315 ( 7774 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1674 -2.1674 -2.1632 -2.1632 -1.3465 -1.3465 -1.3419 -1.3419 3.8962 3.8962 3.9105 3.9105 4.4992 4.4992 4.5001 4.5001 5.0638 5.0638 5.1100 5.1100 5.9341 5.9341 5.9464 5.9464 6.2186 6.2186 6.2409 6.2409 7.1705 7.1705 7.2300 7.2300 7.4183 7.4183 7.4441 7.4441 8.8772 8.8772 8.9248 8.9248 9.9147 9.9147 9.9462 9.9462 10.2520 10.2520 10.2789 10.2789 10.9450 10.9450 10.9902 10.9902 13.3031 13.3031 k = 0.0000 0.0577 0.7315 ( 7770 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1651 -2.1651 -2.1589 -2.1589 -1.3516 -1.3516 -1.3448 -1.3448 3.8861 3.8861 3.9071 3.9071 4.4982 4.4982 4.4985 4.4985 5.0653 5.0653 5.1318 5.1318 5.9308 5.9308 5.9516 5.9516 6.2219 6.2219 6.2562 6.2562 7.1431 7.1431 7.2301 7.2301 7.4112 7.4112 7.4488 7.4488 8.8661 8.8661 8.9359 8.9359 9.9036 9.9036 9.9514 9.9514 10.1975 10.1975 10.2266 10.2266 11.0086 11.0086 11.0663 11.0663 13.3271 13.3271 k = 0.0000 0.0769 0.7315 ( 7776 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1616 -2.1616 -2.1534 -2.1534 -1.3583 -1.3583 -1.3493 -1.3493 3.8735 3.8735 3.9008 3.9008 4.4967 4.4967 4.4982 4.4982 5.0722 5.0722 5.1559 5.1559 5.9261 5.9261 5.9579 5.9579 6.2289 6.2289 6.2756 6.2756 7.1114 7.1114 7.2237 7.2237 7.4043 7.4043 7.4528 7.4528 8.8555 8.8555 8.9459 8.9459 9.8905 9.8905 9.9553 9.9553 10.1391 10.1391 10.1638 10.1638 11.0893 11.0893 11.1543 11.1543 13.3622 13.3622 k = 0.0000 0.0962 0.7315 ( 7776 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1568 -2.1568 -2.1465 -2.1465 -1.3664 -1.3664 -1.3553 -1.3553 3.8586 3.8586 3.8916 3.8916 4.4956 4.4956 4.4995 4.4995 5.0839 5.0839 5.1813 5.1813 5.9195 5.9195 5.9651 5.9651 6.2398 6.2398 6.2992 6.2992 7.0761 7.0761 7.2109 7.2109 7.3978 7.3978 7.4563 7.4563 8.8457 8.8457 8.9545 8.9545 9.8741 9.8741 9.9566 9.9566 10.0817 10.0817 10.0974 10.0974 11.1812 11.1812 11.2503 11.2503 13.4080 13.4080 k = 0.0000 0.1154 0.7315 ( 7784 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1507 -2.1507 -2.1384 -2.1384 -1.3761 -1.3761 -1.3630 -1.3630 3.8415 3.8415 3.8796 3.8796 4.4959 4.4959 4.5028 4.5028 5.0998 5.0998 5.2071 5.2071 5.9109 5.9109 5.9725 5.9725 6.2553 6.2553 6.3267 6.3267 7.0375 7.0375 7.1922 7.1922 7.3917 7.3917 7.4593 7.4593 8.8365 8.8365 8.9613 8.9613 9.8530 9.8530 9.9506 9.9506 10.0296 10.0296 10.0357 10.0357 11.2810 11.2810 11.3522 11.3522 13.4643 13.4643 k = 0.0000 0.1346 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1434 -2.1434 -2.1290 -2.1290 -1.3871 -1.3871 -1.3721 -1.3721 3.8226 3.8226 3.8648 3.8648 4.4984 4.4984 4.5083 4.5083 5.1193 5.1193 5.2328 5.2328 5.9000 5.9000 5.9796 5.9796 6.2757 6.2757 6.3575 6.3575 6.9962 6.9962 7.1683 7.1683 7.3857 7.3857 7.4622 7.4622 8.8279 8.8279 8.9661 8.9661 9.8252 9.8252 9.9195 9.9195 9.9861 9.9861 9.9985 9.9985 11.3866 11.3866 11.4586 11.4586 13.5304 13.5304 k = 0.0000 0.1538 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1349 -2.1349 -2.1184 -2.1184 -1.3995 -1.3995 -1.3827 -1.3827 3.8021 3.8021 3.8476 3.8476 4.5035 4.5035 4.5164 4.5164 5.1418 5.1418 5.2576 5.2576 5.8868 5.8868 5.9856 5.9856 6.3013 6.3013 6.3909 6.3909 6.9527 6.9527 7.1399 7.1399 7.3795 7.3795 7.4651 7.4651 8.8197 8.8197 8.9687 8.9687 9.7900 9.7900 9.8614 9.8614 9.9528 9.9528 9.9890 9.9890 11.4966 11.4966 11.5685 11.5685 13.6058 13.6058 k = 0.0000 0.1731 0.7315 ( 7784 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.1252 -2.1252 -2.1066 -2.1066 -1.4131 -1.4131 -1.3948 -1.3948 3.7804 3.7804 3.8284 3.8284 4.5115 4.5115 4.5269 4.5269 5.1666 5.1666 5.2813 5.2813 5.8713 5.8713 5.9902 5.9902 6.3319 6.3319 6.4262 6.4262 6.9076 6.9076 7.1080 7.1080 7.3730 7.3730 7.4683 7.4683 8.8118 8.8118 8.9691 8.9691 9.7492 9.7492 9.7970 9.7970 9.9282 9.9282 9.9875 9.9875 11.6102 11.6102 11.6814 11.6814 13.6900 13.6900 k = 0.0000 0.1923 0.7315 ( 7780 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.1143 -2.1143 -2.0937 -2.0937 -1.4279 -1.4279 -1.4082 -1.4082 3.7579 3.7579 3.8075 3.8075 4.5227 4.5227 4.5400 4.5400 5.1933 5.1933 5.3034 5.3034 5.8537 5.8537 5.9934 5.9934 6.3674 6.3674 6.4623 6.4623 6.8616 6.8616 7.0733 7.0733 7.3661 7.3661 7.4722 7.4722 8.8040 8.8040 8.9674 8.9674 9.7059 9.7059 9.7331 9.7331 9.9098 9.9098 9.9877 9.9877 11.7267 11.7267 11.7968 11.7968 13.7822 13.7822 k = 0.0000 0.2115 0.7315 ( 7780 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.1024 -2.1024 -2.0797 -2.0797 -1.4439 -1.4439 -1.4229 -1.4229 3.7349 3.7349 3.7855 3.7855 4.5370 4.5370 4.5555 4.5555 5.2213 5.2213 5.3238 5.3238 5.8342 5.8342 5.9951 5.9951 6.4068 6.4068 6.4977 6.4977 6.8156 6.8156 7.0366 7.0366 7.3587 7.3587 7.4769 7.4769 8.7963 8.7963 8.9638 8.9638 9.6624 9.6624 9.6716 9.6716 9.8953 9.8953 9.9882 9.9882 11.8456 11.8456 11.9142 11.9142 13.8817 13.8817 k = 0.0000 0.2308 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6311 -35.6311 -2.0895 -2.0895 -2.0646 -2.0646 -1.4608 -1.4608 -1.4388 -1.4388 3.7118 3.7118 3.7629 3.7629 4.5542 4.5542 4.5732 4.5732 5.2503 5.2503 5.3422 5.3422 5.8130 5.8130 5.9956 5.9956 6.4494 6.4494 6.5305 6.5305 6.7713 6.7713 6.9986 6.9986 7.3509 7.3509 7.4828 7.4828 8.7885 8.7885 8.9588 8.9588 9.6131 9.6131 9.6200 9.6200 9.8832 9.8832 9.9886 9.9886 11.9663 11.9663 12.0332 12.0332 13.9877 13.9877 k = 0.0000 0.2500 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6311 -35.6311 -2.0755 -2.0755 -2.0485 -2.0485 -1.4787 -1.4787 -1.4558 -1.4558 3.6890 3.6890 3.7401 3.7401 4.5743 4.5743 4.5929 4.5929 5.2796 5.2796 5.3585 5.3585 5.7906 5.7906 5.9954 5.9954 6.4939 6.4939 6.5564 6.5564 6.7324 6.7324 6.9602 6.9602 7.3428 7.3428 7.4901 7.4901 8.7806 8.7806 8.9529 8.9529 9.5580 9.5580 9.5790 9.5790 9.8729 9.8729 9.9889 9.9889 12.0884 12.0884 12.1532 12.1532 14.0994 14.0994 k = 0.0000 0.2692 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6311 -35.6311 -2.0607 -2.0607 -2.0315 -2.0315 -1.4974 -1.4974 -1.4739 -1.4739 3.6668 3.6668 3.7175 3.7175 4.5969 4.5969 4.6143 4.6143 5.3087 5.3087 5.3724 5.3724 5.7676 5.7676 5.9947 5.9947 6.5393 6.5393 6.5667 6.5667 6.7073 6.7073 6.9221 6.9221 7.3344 7.3344 7.4990 7.4990 8.7727 8.7727 8.9467 8.9467 9.5066 9.5066 9.5396 9.5396 9.8639 9.8639 9.9888 9.9888 12.2111 12.2111 12.2738 12.2738 14.2158 14.2158 k = 0.0000 0.2885 0.7315 ( 7762 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -2.0450 -2.0450 -2.0136 -2.0136 -1.5168 -1.5168 -1.4930 -1.4930 3.6454 3.6454 3.6956 3.6956 4.6217 4.6217 4.6371 4.6371 5.3368 5.3368 5.3838 5.3838 5.7447 5.7447 5.9942 5.9942 6.5518 6.5518 6.5840 6.5840 6.7051 6.7051 6.8853 6.8853 7.3259 7.3259 7.5095 7.5095 8.7649 8.7649 8.9408 8.9408 9.4590 9.4590 9.5017 9.5017 9.8560 9.8560 9.9886 9.9886 12.3340 12.3340 12.3942 12.3942 14.3357 14.3357 k = 0.0000 0.3077 0.7315 ( 7770 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -2.0286 -2.0286 -1.9949 -1.9949 -1.5367 -1.5367 -1.5129 -1.5129 3.6251 3.6251 3.6746 3.6746 4.6484 4.6484 4.6608 4.6608 5.3627 5.3627 5.3925 5.3925 5.7232 5.7232 5.9940 5.9940 6.5179 6.5179 6.6258 6.6258 6.7196 6.7196 6.8518 6.8518 7.3174 7.3174 7.5216 7.5216 8.7572 8.7572 8.9358 8.9358 9.4151 9.4151 9.4651 9.4651 9.8490 9.8490 9.9881 9.9881 12.4561 12.4561 12.5135 12.5135 14.4580 14.4580 k = 0.0000 0.3269 0.7315 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -2.0116 -2.0116 -1.9754 -1.9754 -1.5570 -1.5570 -1.5335 -1.5335 3.6062 3.6062 3.6549 3.6549 4.6765 4.6765 4.6852 4.6852 5.3848 5.3848 5.3985 5.3985 5.7049 5.7049 5.9947 5.9947 6.4760 6.4760 6.6609 6.6609 6.7396 6.7396 6.8248 6.8248 7.3091 7.3091 7.5352 7.5352 8.7497 8.7497 8.9323 8.9323 9.3750 9.3750 9.4296 9.4296 9.8430 9.8430 9.9874 9.9874 12.5765 12.5765 12.6309 12.6309 14.5808 14.5808 k = 0.0000 0.3462 0.7315 ( 7762 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9941 -1.9941 -1.9554 -1.9554 -1.5776 -1.5776 -1.5547 -1.5547 3.5888 3.5888 3.6367 3.6367 4.7057 4.7057 4.7097 4.7097 5.4010 5.4010 5.4018 5.4018 5.6919 5.6919 5.9964 5.9964 6.4317 6.4317 6.6814 6.6814 6.7596 6.7596 6.8119 6.8119 7.3013 7.3013 7.5497 7.5497 8.7428 8.7428 8.9306 8.9306 9.3388 9.3388 9.3951 9.3951 9.8377 9.8377 9.9866 9.9866 12.6940 12.6940 12.7451 12.7451 14.7023 14.7023 k = 0.0000 0.3654 0.7315 ( 7754 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9764 -1.9764 -1.9349 -1.9349 -1.5981 -1.5981 -1.5763 -1.5763 3.5730 3.5730 3.6203 3.6203 4.7339 4.7339 4.7353 4.7353 5.4025 5.4025 5.4093 5.4093 5.6865 5.6865 5.9991 5.9991 6.3873 6.3873 6.6802 6.6802 6.7779 6.7779 6.8198 6.8198 7.2940 7.2940 7.5648 7.5648 8.7364 8.7364 8.9312 8.9312 9.3064 9.3064 9.3616 9.3616 9.8333 9.8333 9.9857 9.9857 12.8071 12.8071 12.8544 12.8544 14.8197 14.8197 k = 0.0000 0.3846 0.7315 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9586 -1.9586 -1.9141 -1.9141 -1.6183 -1.6183 -1.5980 -1.5980 3.5591 3.5591 3.6057 3.6057 4.7571 4.7571 4.7647 4.7647 5.4010 5.4010 5.4088 5.4088 5.6898 5.6898 6.0029 6.0029 6.3441 6.3441 6.6642 6.6642 6.7936 6.7936 6.8416 6.8416 7.2874 7.2874 7.5799 7.5799 8.7308 8.7308 8.9341 8.9341 9.2780 9.2780 9.3294 9.3294 9.8295 9.8295 9.9847 9.9847 12.9138 12.9138 12.9572 12.9572 14.9297 14.9297 k = 0.0000 0.4038 0.7315 ( 7752 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9412 -1.9412 -1.8933 -1.8933 -1.6379 -1.6379 -1.6197 -1.6197 3.5472 3.5472 3.5931 3.5931 4.7787 4.7787 4.7931 4.7931 5.3977 5.3977 5.4005 5.4005 5.7008 5.7008 6.0074 6.0074 6.3032 6.3032 6.6434 6.6434 6.8066 6.8066 6.8668 6.8668 7.2817 7.2817 7.5941 7.5941 8.7260 8.7260 8.9392 8.9392 9.2536 9.2536 9.2990 9.2990 9.8264 9.8264 9.9839 9.9839 13.0120 13.0120 13.0511 13.0511 15.0282 15.0282 k = 0.0000 0.4231 0.7315 ( 7754 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9247 -1.9247 -1.8729 -1.8729 -1.6562 -1.6562 -1.6409 -1.6409 3.5373 3.5373 3.5827 3.5827 4.7978 4.7978 4.8194 4.8194 5.3874 5.3874 5.3934 5.3934 5.7168 5.7168 6.0122 6.0122 6.2658 6.2658 6.6232 6.6232 6.8169 6.8169 6.8904 6.8904 7.2770 7.2770 7.6069 7.6069 8.7221 8.7221 8.9460 8.9460 9.2333 9.2333 9.2709 9.2709 9.8240 9.8240 9.9830 9.9830 13.0988 13.0988 13.1337 13.1337 15.1112 15.1112 k = 0.0000 0.4423 0.7315 ( 7754 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9098 -1.9098 -1.8536 -1.8536 -1.6725 -1.6725 -1.6608 -1.6608 3.5295 3.5295 3.5745 3.5745 4.8139 4.8139 4.8423 4.8423 5.3727 5.3727 5.3889 5.3889 5.7344 5.7344 6.0168 6.0168 6.2333 6.2333 6.6059 6.6059 6.8247 6.8247 6.9099 6.9099 7.2733 7.2733 7.6176 7.6176 8.7191 8.7191 8.9538 8.9538 9.2173 9.2173 9.2464 9.2464 9.8221 9.8221 9.9824 9.9824 13.1713 13.1713 13.2021 13.2021 15.1758 15.1758 k = 0.0000 0.4615 0.7315 ( 7746 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.8976 -1.8976 -1.8366 -1.8366 -1.6857 -1.6857 -1.6782 -1.6782 3.5240 3.5240 3.5686 3.5686 4.8260 4.8260 4.8604 4.8604 5.3595 5.3595 5.3849 5.3849 5.7503 5.7503 6.0206 6.0206 6.2077 6.2077 6.5927 6.5927 6.8301 6.8301 6.9245 6.9245 7.2707 7.2707 7.6257 7.6257 8.7170 8.7170 8.9612 8.9612 9.2057 9.2057 9.2269 9.2269 9.8208 9.8208 9.9819 9.9819 13.2262 13.2262 13.2536 13.2536 15.2210 15.2210 k = 0.0000 0.4808 0.7315 ( 7752 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.8894 -1.8894 -1.8242 -1.8242 -1.6945 -1.6945 -1.6909 -1.6909 3.5206 3.5206 3.5651 3.5651 4.8336 4.8336 4.8720 4.8720 5.3505 5.3505 5.3821 5.3821 5.7615 5.7615 6.0231 6.0231 6.1911 6.1911 6.5844 6.5844 6.8333 6.8333 6.9334 6.9334 7.2691 7.2691 7.6307 7.6307 8.7157 8.7157 8.9667 8.9667 9.1987 9.1987 9.2141 9.2141 9.8200 9.8200 9.9815 9.9815 13.2605 13.2605 13.2857 13.2857 15.2477 15.2477 k = 0.0000 0.5000 0.7315 ( 7756 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.8865 -1.8865 -1.8195 -1.8195 -1.6977 -1.6977 -1.6957 -1.6957 3.5195 3.5195 3.5639 3.5639 4.8362 4.8362 4.8761 4.8761 5.3472 5.3472 5.3811 5.3811 5.7655 5.7655 6.0240 6.0240 6.1853 6.1853 6.5816 6.5816 6.8343 6.8343 6.9364 6.9364 7.2686 7.2686 7.6324 7.6324 8.7153 8.7153 8.9687 8.9687 9.1963 9.1963 9.2096 9.2096 9.8198 9.8198 9.9814 9.9814 13.2722 13.2722 13.2966 13.2966 15.2566 15.2566 k = 0.0000 0.5000 0.7315 ( 7756 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.8865 -1.8865 -1.8195 -1.8195 -1.6977 -1.6977 -1.6957 -1.6957 3.5195 3.5195 3.5639 3.5639 4.8362 4.8362 4.8761 4.8761 5.3472 5.3472 5.3811 5.3811 5.7655 5.7655 6.0240 6.0240 6.1853 6.1853 6.5816 6.5816 6.8343 6.8343 6.9364 6.9364 7.2686 7.2686 7.6324 7.6324 8.7153 8.7153 8.9687 8.9687 9.1963 9.1963 9.2096 9.2096 9.8198 9.8198 9.9814 9.9814 13.2722 13.2722 13.2966 13.2966 15.2566 15.2566 k = 0.0192 0.5000 0.7315 ( 7752 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.8870 -1.8870 -1.8207 -1.8207 -1.6961 -1.6961 -1.6948 -1.6948 3.5180 3.5180 3.5625 3.5625 4.8308 4.8308 4.8711 4.8711 5.3523 5.3523 5.3806 5.3806 5.7683 5.7683 6.0032 6.0032 6.2071 6.2071 6.5822 6.5822 6.8378 6.8378 6.9377 6.9377 7.2694 7.2694 7.6329 7.6329 8.7161 8.7161 8.9695 8.9695 9.1999 9.1999 9.2133 9.2133 9.8201 9.8201 9.9811 9.9811 13.2682 13.2682 13.2915 13.2915 15.2305 15.2305 k = 0.0385 0.5000 0.7315 ( 7744 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.8887 -1.8887 -1.8242 -1.8242 -1.6919 -1.6919 -1.6917 -1.6917 3.5135 3.5135 3.5584 3.5584 4.8154 4.8154 4.8567 4.8567 5.3668 5.3668 5.3788 5.3788 5.7765 5.7765 5.9587 5.9587 6.2544 6.2544 6.5843 6.5843 6.8480 6.8480 6.9417 6.9417 7.2720 7.2720 7.6346 7.6346 8.7186 8.7186 8.9721 8.9721 9.2106 9.2106 9.2244 9.2244 9.8213 9.8213 9.9801 9.9801 13.2565 13.2565 13.2763 13.2763 15.1637 15.1637 k = 0.0577 0.5000 0.7315 ( 7736 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.8914 -1.8914 -1.8295 -1.8295 -1.6872 -1.6872 -1.6850 -1.6850 3.5062 3.5062 3.5516 3.5516 4.7920 4.7920 4.8341 4.8341 5.3751 5.3751 5.3882 5.3882 5.7896 5.7896 5.9079 5.9079 6.3099 6.3099 6.5882 6.5882 6.8642 6.8642 6.9487 6.9487 7.2763 7.2763 7.6373 7.6373 8.7230 8.7230 8.9766 8.9766 9.2280 9.2280 9.2426 9.2426 9.8232 9.8232 9.9784 9.9784 13.2371 13.2371 13.2514 13.2514 15.0737 15.0737 k = 0.0769 0.5000 0.7315 ( 7748 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.8949 -1.8949 -1.8361 -1.8361 -1.6809 -1.6809 -1.6763 -1.6763 3.4960 3.4960 3.5422 3.5422 4.7628 4.7628 4.8050 4.8050 5.3689 5.3689 5.4138 5.4138 5.8064 5.8064 5.8572 5.8572 6.3673 6.3673 6.5944 6.5944 6.8854 6.8854 6.9587 6.9587 7.2823 7.2823 7.6413 7.6413 8.7295 8.7295 8.9836 8.9836 9.2518 9.2518 9.2676 9.2676 9.8259 9.8259 9.9760 9.9760 13.2103 13.2103 13.2169 13.2169 14.9714 14.9714 k = 0.0962 0.5000 0.7315 ( 7752 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.8990 -1.8990 -1.8435 -1.8435 -1.6733 -1.6733 -1.6664 -1.6664 3.4831 3.4831 3.5301 3.5301 4.7300 4.7300 4.7715 4.7715 5.3600 5.3600 5.4402 5.4402 5.8097 5.8097 5.8260 5.8260 6.4239 6.4239 6.6033 6.6033 6.9108 6.9108 6.9723 6.9723 7.2899 7.2899 7.6465 7.6465 8.7384 8.7384 8.9934 8.9934 9.2816 9.2816 9.2991 9.2991 9.8295 9.8295 9.9729 9.9729 13.1736 13.1736 13.1764 13.1764 14.8625 14.8625 k = 0.1154 0.5000 0.7315 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9036 -1.9036 -1.8514 -1.8514 -1.6645 -1.6645 -1.6554 -1.6554 3.4677 3.4677 3.5155 3.5155 4.6954 4.6954 4.7350 4.7350 5.3482 5.3482 5.4637 5.4637 5.7685 5.7685 5.8469 5.8469 6.4780 6.4780 6.6151 6.6151 6.9391 6.9391 6.9900 6.9900 7.2993 7.2993 7.6531 7.6531 8.7501 8.7501 9.0064 9.0064 9.3169 9.3169 9.3366 9.3366 9.8341 9.8341 9.9692 9.9692 13.1219 13.1219 13.1357 13.1357 14.7499 14.7499 k = 0.1346 0.5000 0.7315 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9085 -1.9085 -1.8594 -1.8594 -1.6548 -1.6548 -1.6438 -1.6438 3.4499 3.4499 3.4986 3.4986 4.6601 4.6601 4.6970 4.6970 5.3339 5.3339 5.4794 5.4794 5.7376 5.7376 5.8681 5.8681 6.5282 6.5282 6.6296 6.6296 6.9696 6.9696 7.0120 7.0120 7.3104 7.3104 7.6612 7.6612 8.7648 8.7648 9.0227 9.0227 9.3575 9.3575 9.3798 9.3798 9.8399 9.8399 9.9648 9.9648 13.0625 13.0625 13.0886 13.0886 14.6357 14.6357 k = 0.1538 0.5000 0.7315 ( 7776 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9134 -1.9134 -1.8675 -1.8675 -1.6444 -1.6444 -1.6319 -1.6319 3.4302 3.4302 3.4795 3.4795 4.6251 4.6251 4.6587 4.6587 5.3175 5.3175 5.4821 5.4821 5.7215 5.7215 5.8886 5.8886 6.5735 6.5735 6.6465 6.6465 7.0014 7.0014 7.0384 7.0384 7.3235 7.3235 7.6707 7.6707 8.7828 8.7828 9.0425 9.0425 9.4032 9.4032 9.4280 9.4280 9.8471 9.8471 9.9597 9.9597 12.9960 12.9960 13.0354 13.0354 14.5212 14.5212 k = 0.1731 0.5000 0.7315 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9184 -1.9184 -1.8755 -1.8755 -1.6335 -1.6335 -1.6197 -1.6197 3.4086 3.4086 3.4585 3.4585 4.5910 4.5910 4.6209 4.6209 5.2996 5.2996 5.4695 5.4695 5.7221 5.7221 5.9078 5.9078 6.6133 6.6133 6.6653 6.6653 7.0338 7.0338 7.0690 7.0690 7.3387 7.3387 7.6819 7.6819 8.8041 8.8041 9.0658 9.0658 9.4538 9.4538 9.4806 9.4806 9.8560 9.8560 9.9541 9.9541 12.9231 12.9231 12.9764 12.9764 14.4078 14.4078 k = 0.1923 0.5000 0.7315 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9233 -1.9233 -1.8833 -1.8833 -1.6222 -1.6222 -1.6074 -1.6074 3.3856 3.3856 3.4357 3.4357 4.5583 4.5583 4.5843 4.5843 5.2807 5.2807 5.4453 5.4453 5.7354 5.7354 5.9253 5.9253 6.6474 6.6474 6.6852 6.6852 7.0660 7.0660 7.1027 7.1027 7.3566 7.3566 7.6947 7.6947 8.8289 8.8289 9.0925 9.0925 9.5091 9.5091 9.5368 9.5368 9.8674 9.8674 9.9478 9.9478 12.8442 12.8442 12.9119 12.9119 14.2963 14.2963 k = 0.2115 0.5000 0.7315 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9280 -1.9280 -1.8908 -1.8908 -1.6107 -1.6107 -1.5953 -1.5953 3.3616 3.3616 3.4115 3.4115 4.5272 4.5272 4.5494 4.5494 5.2612 5.2612 5.4147 5.4147 5.7560 5.7560 5.9409 5.9409 6.6761 6.6761 6.7055 6.7055 7.0975 7.0975 7.1379 7.1379 7.3777 7.3777 7.7090 7.7090 8.8571 8.8571 9.1223 9.1223 9.5689 9.5689 9.5952 9.5952 9.8823 9.8823 9.9412 9.9412 12.7599 12.7599 12.8418 12.8418 14.1878 14.1878 k = 0.2308 0.5000 0.7315 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9324 -1.9324 -1.8980 -1.8980 -1.5991 -1.5991 -1.5833 -1.5833 3.3369 3.3369 3.3862 3.3862 4.4981 4.4981 4.5164 4.5164 5.2415 5.2415 5.3816 5.3816 5.7796 5.7796 5.9547 5.9547 6.7002 6.7002 6.7256 6.7256 7.1279 7.1279 7.1725 7.1725 7.4027 7.4027 7.7246 7.7246 8.8885 8.8885 9.1549 9.1549 9.6326 9.6326 9.6534 9.6534 9.9028 9.9028 9.9346 9.9346 12.6705 12.6705 12.7663 12.7663 14.0833 14.0833 k = 0.2500 0.5000 0.7315 ( 7768 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9366 -1.9366 -1.9048 -1.9048 -1.5875 -1.5875 -1.5717 -1.5717 3.3119 3.3119 3.3602 3.3602 4.4708 4.4708 4.4857 4.4857 5.2221 5.2221 5.3482 5.3482 5.8042 5.8042 5.9666 5.9666 6.7204 6.7204 6.7447 6.7447 7.1566 7.1566 7.2044 7.2044 7.4322 7.4322 7.7414 7.7414 8.9231 8.9231 9.1899 9.1899 9.6992 9.6992 9.7075 9.7075 9.9290 9.9290 9.9325 9.9325 12.5763 12.5763 12.6853 12.6853 13.9772 13.9772 k = 0.2692 0.5000 0.7315 ( 7768 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6319 -35.6319 -35.6311 -35.6311 -1.9405 -1.9405 -1.9113 -1.9113 -1.5762 -1.5762 -1.5606 -1.5606 3.2870 3.2870 3.3338 3.3338 4.4457 4.4457 4.4574 4.4574 5.2033 5.2033 5.3157 5.3157 5.8283 5.8283 5.9769 5.9769 6.7374 6.7374 6.7624 6.7624 7.1835 7.1835 7.2324 7.2324 7.4664 7.4664 7.7590 7.7590 8.9605 8.9605 9.2268 9.2268 9.7528 9.7528 9.7654 9.7654 9.9279 9.9279 9.9759 9.9759 12.4778 12.4778 12.5987 12.5987 13.8768 13.8768 k = 0.2885 0.5000 0.7315 ( 7768 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -1.9440 -1.9440 -1.9174 -1.9174 -1.5652 -1.5652 -1.5500 -1.5500 3.2627 3.2627 3.3075 3.3075 4.4226 4.4226 4.4315 4.4315 5.1854 5.1854 5.2847 5.2847 5.8515 5.8515 5.9856 5.9856 6.7520 6.7520 6.7784 6.7784 7.2082 7.2082 7.2559 7.2559 7.5043 7.5043 7.7769 7.7769 9.0003 9.0003 9.2650 9.2650 9.7862 9.7862 9.8193 9.8193 9.9429 9.9429 10.0355 10.0355 12.3751 12.3751 12.5064 12.5064 13.7849 13.7849 k = 0.3077 0.5000 0.7315 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -1.9471 -1.9471 -1.9230 -1.9230 -1.5546 -1.5546 -1.5400 -1.5400 3.2393 3.2393 3.2817 3.2817 4.4015 4.4015 4.4080 4.4080 5.1686 5.1686 5.2558 5.2558 5.8732 5.8732 5.9929 5.9929 6.7647 6.7647 6.7925 6.7925 7.2305 7.2305 7.2751 7.2751 7.5447 7.5447 7.7948 7.7948 9.0422 9.0422 9.3037 9.3037 9.8092 9.8092 9.8419 9.8419 9.9929 9.9929 10.1095 10.1095 12.2686 12.2686 12.4085 12.4085 13.7022 13.7022 k = 0.3269 0.5000 0.7315 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9499 -1.9499 -1.9282 -1.9282 -1.5445 -1.5445 -1.5308 -1.5308 3.2173 3.2173 3.2568 3.2568 4.3825 4.3825 4.3871 4.3871 5.1532 5.1532 5.2290 5.2290 5.8932 5.8932 5.9988 5.9988 6.7759 6.7759 6.8046 6.8046 7.2506 7.2506 7.2908 7.2908 7.5862 7.5862 7.8119 7.8119 9.0857 9.0857 9.3422 9.3422 9.8245 9.8245 9.8411 9.8411 10.0703 10.0703 10.1946 10.1946 12.1585 12.1585 12.3052 12.3052 13.6293 13.6293 k = 0.3462 0.5000 0.7315 ( 7756 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9522 -1.9522 -1.9330 -1.9330 -1.5351 -1.5351 -1.5224 -1.5224 3.1968 3.1968 3.2330 3.2330 4.3655 4.3655 4.3685 4.3685 5.1394 5.1394 5.2046 5.2046 5.9116 5.9116 6.0035 6.0035 6.7858 6.7858 6.8146 6.8146 7.2683 7.2683 7.3034 7.3034 7.6273 7.6273 7.8277 7.8277 9.1303 9.1303 9.3795 9.3795 9.8316 9.8316 9.8344 9.8344 10.1601 10.1601 10.2878 10.2878 12.0452 12.0452 12.1968 12.1968 13.5663 13.5663 k = 0.3654 0.5000 0.7315 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9542 -1.9542 -1.9374 -1.9374 -1.5264 -1.5264 -1.5149 -1.5149 3.1784 3.1784 3.2109 3.2109 4.3506 4.3506 4.3523 4.3523 5.1272 5.1272 5.1827 5.1827 5.9283 5.9283 6.0070 6.0070 6.7947 6.7947 6.8226 6.8226 7.2837 7.2837 7.3136 7.3136 7.6669 7.6669 7.8418 7.8418 9.1756 9.1756 9.4145 9.4145 9.8190 9.8190 9.8402 9.8402 10.2571 10.2571 10.3874 10.3874 11.9292 11.9292 12.0838 12.0838 13.5131 13.5131 k = 0.3846 0.5000 0.7315 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9557 -1.9557 -1.9414 -1.9414 -1.5185 -1.5185 -1.5084 -1.5084 3.1622 3.1622 3.1907 3.1907 4.3376 4.3376 4.3384 4.3384 5.1168 5.1168 5.1632 5.1632 5.9432 5.9432 6.0094 6.0094 6.8027 6.8027 6.8287 6.8287 7.2970 7.2970 7.3218 7.3218 7.7042 7.7042 7.8535 7.8535 9.2210 9.2210 9.4457 9.4457 9.8057 9.8057 9.8424 9.8424 10.3594 10.3594 10.4920 10.4920 11.8111 11.8111 11.9670 11.9670 13.4694 13.4694 k = 0.4038 0.5000 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9568 -1.9568 -1.9449 -1.9449 -1.5116 -1.5116 -1.5029 -1.5029 3.1484 3.1484 3.1726 3.1726 4.3265 4.3265 4.3268 4.3268 5.1084 5.1084 5.1462 5.1462 5.9564 5.9564 6.0106 6.0106 6.8099 6.8099 6.8331 6.8331 7.3081 7.3081 7.3281 7.3281 7.7384 7.7384 7.8623 7.8623 9.2658 9.2658 9.4713 9.4713 9.7934 9.7934 9.8413 9.8413 10.4660 10.4660 10.6007 10.6007 11.6915 11.6915 11.8473 11.8473 13.4344 13.4344 k = 0.4231 0.5000 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9575 -1.9575 -1.9480 -1.9480 -1.5056 -1.5056 -1.4985 -1.4985 3.1374 3.1374 3.1571 3.1571 4.3174 4.3174 4.3175 4.3175 5.1020 5.1020 5.1317 5.1317 5.9681 5.9681 6.0108 6.0108 6.8163 6.8163 6.8359 6.8359 7.3173 7.3173 7.3328 7.3328 7.7692 7.7692 7.8679 7.8679 9.3096 9.3096 9.4892 9.4892 9.7842 9.7842 9.8371 9.8371 10.5761 10.5761 10.7123 10.7123 11.5714 11.5714 11.7256 11.7256 13.4076 13.4076 k = 0.4423 0.5000 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9578 -1.9578 -1.9507 -1.9507 -1.5007 -1.5007 -1.4953 -1.4953 3.1292 3.1292 3.1441 3.1441 4.3102 4.3102 4.3104 4.3104 5.0977 5.0977 5.1196 5.1196 5.9782 5.9782 6.0098 6.0098 6.8219 6.8219 6.8373 6.8373 7.3248 7.3248 7.3361 7.3361 7.7961 7.7961 7.8699 7.8699 9.3514 9.3514 9.4970 9.4970 9.7798 9.7798 9.8301 9.8301 10.6886 10.6886 10.8250 10.8250 11.4527 11.4527 11.6030 11.6030 13.3879 13.3879 k = 0.4615 0.5000 0.7315 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9577 -1.9577 -1.9529 -1.9529 -1.4969 -1.4969 -1.4932 -1.4932 3.1240 3.1240 3.1341 3.1341 4.3051 4.3051 4.3053 4.3053 5.0956 5.0956 5.1101 5.1101 5.9868 5.9868 6.0077 6.0077 6.8268 6.8268 6.8374 6.8374 7.3305 7.3305 7.3378 7.3378 7.8190 7.8190 7.8681 7.8681 9.3906 9.3906 9.4937 9.4937 9.7814 9.7814 9.8207 9.8207 10.8021 10.8021 10.9341 10.9341 11.3399 11.3399 11.4815 11.4815 13.3748 13.3748 k = 0.4808 0.5000 0.7315 ( 7744 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9571 -1.9571 -1.9548 -1.9548 -1.4942 -1.4942 -1.4923 -1.4923 3.1219 3.1219 3.1269 3.1269 4.3021 4.3021 4.3022 4.3022 5.0957 5.0957 5.1029 5.1029 5.9940 5.9940 6.0044 6.0044 6.8309 6.8309 6.8362 6.8362 7.3346 7.3346 7.3382 7.3382 7.8377 7.8377 7.8622 7.8622 9.4260 9.4260 9.4795 9.4795 9.7881 9.7881 9.8097 9.8097 10.9129 10.9129 11.0190 11.0190 11.2538 11.2538 11.3648 11.3648 13.3675 13.3675 k = 0.5000 0.5000 0.7315 ( 7744 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9562 -1.9562 -1.9561 -1.9561 -1.4927 -1.4927 -1.4926 -1.4926 3.1228 3.1228 3.1229 3.1229 4.3011 4.3011 4.3012 4.3012 5.0980 5.0980 5.0983 5.0983 5.9997 5.9997 5.9999 5.9999 6.8339 6.8339 6.8342 6.8342 7.3369 7.3369 7.3373 7.3373 7.8519 7.8519 7.8522 7.8522 9.4562 9.4562 9.4563 9.4563 9.7983 9.7983 9.7983 9.7983 11.0064 11.0064 11.0066 11.0066 11.2675 11.2675 11.2676 11.2676 13.3658 13.3658 k = 0.5000 0.5000 0.7315 ( 7744 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9562 -1.9562 -1.9561 -1.9561 -1.4927 -1.4927 -1.4926 -1.4926 3.1228 3.1228 3.1229 3.1229 4.3011 4.3011 4.3012 4.3012 5.0980 5.0980 5.0983 5.0983 5.9997 5.9997 5.9999 5.9999 6.8339 6.8339 6.8342 6.8342 7.3369 7.3369 7.3373 7.3373 7.8519 7.8519 7.8522 7.8522 9.4562 9.4562 9.4563 9.4563 9.7983 9.7983 9.7983 9.7983 11.0064 11.0064 11.0066 11.0066 11.2675 11.2675 11.2676 11.2676 13.3658 13.3658 k = 0.4865 0.4865 0.7315 ( 7752 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9573 -1.9573 -1.9546 -1.9546 -1.4945 -1.4945 -1.4920 -1.4920 3.1215 3.1215 3.1273 3.1273 4.3019 4.3019 4.3024 4.3024 5.0957 5.0957 5.1030 5.1030 5.9940 5.9940 6.0044 6.0044 6.8307 6.8307 6.8364 6.8364 7.3346 7.3346 7.3382 7.3382 7.8378 7.8378 7.8621 7.8621 9.4262 9.4262 9.4795 9.4795 9.7876 9.7876 9.8102 9.8102 10.9025 10.9025 11.0448 11.0448 11.2268 11.2268 11.3764 11.3764 13.3641 13.3641 k = 0.4730 0.4730 0.7315 ( 7756 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9587 -1.9587 -1.9519 -1.9519 -1.4988 -1.4988 -1.4912 -1.4912 3.1215 3.1215 3.1364 3.1364 4.3043 4.3043 4.3059 4.3059 5.0947 5.0947 5.1109 5.1109 5.9867 5.9867 6.0079 6.0079 6.8258 6.8258 6.8384 6.8384 7.3305 7.3305 7.3379 7.3379 7.8191 7.8191 7.8682 7.8682 9.3907 9.3907 9.4947 9.4947 9.7766 9.7766 9.8248 9.8248 10.7607 10.7607 11.0514 11.0514 11.2153 11.2153 11.5299 11.5299 13.3597 13.3597 k = 0.4595 0.4595 0.7315 ( 7776 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9608 -1.9608 -1.9478 -1.9478 -1.5059 -1.5059 -1.4898 -1.4898 3.1222 3.1222 3.1510 3.1510 4.3084 4.3084 4.3115 4.3115 5.0947 5.0947 5.1226 5.1226 5.9776 5.9776 6.0105 6.0105 6.8189 6.8189 6.8404 6.8404 7.3249 7.3249 7.3360 7.3360 7.7960 7.7960 7.8703 7.8703 9.3513 9.3513 9.5014 9.5014 9.7642 9.7642 9.8426 9.8426 10.6110 10.6110 11.0495 11.0495 11.2092 11.2092 11.6981 11.6981 13.3541 13.3541 k = 0.4459 0.4459 0.7315 ( 7768 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9636 -1.9636 -1.9421 -1.9421 -1.5156 -1.5156 -1.4880 -1.4880 3.1235 3.1235 3.1709 3.1709 4.3140 4.3140 4.3190 4.3190 5.0952 5.0952 5.1385 5.1385 5.9667 5.9667 6.0125 6.0125 6.8099 6.8099 6.8428 6.8428 7.3175 7.3175 7.3326 7.3326 7.7686 7.7686 7.8687 7.8687 9.3093 9.3093 9.4999 9.4999 9.7504 9.7504 9.8633 9.8633 10.4635 10.4635 11.0441 11.0441 11.2035 11.2035 11.8698 11.8698 13.3497 13.3497 k = 0.4324 0.4324 0.7315 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9671 -1.9671 -1.9350 -1.9350 -1.5278 -1.5278 -1.4857 -1.4857 3.1256 3.1256 3.1959 3.1959 4.3213 4.3213 4.3280 4.3280 5.0962 5.0962 5.1589 5.1589 5.9537 5.9537 6.0139 6.0139 6.7986 6.7986 6.8455 6.8455 7.3083 7.3083 7.3275 7.3275 7.7370 7.7370 7.8636 7.8636 9.2657 9.2657 9.4908 9.4908 9.7353 9.7353 9.8856 9.8856 10.3221 10.3221 11.0362 11.0362 11.1974 11.1974 12.0385 12.0385 13.3501 13.3501 k = 0.4189 0.4189 0.7315 ( 7756 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9713 -1.9713 -1.9264 -1.9264 -1.5423 -1.5423 -1.4829 -1.4829 3.1284 3.1284 3.2258 3.2258 4.3302 4.3302 4.3381 4.3381 5.0974 5.0974 5.1840 5.1840 5.9386 5.9386 6.0150 6.0150 6.7850 6.7850 6.8485 6.8485 7.2969 7.2969 7.3204 7.3204 7.7019 7.7019 7.8550 7.8550 9.2215 9.2215 9.4753 9.4753 9.7195 9.7195 9.9075 9.9075 10.1895 10.1895 11.0263 11.0263 11.1905 11.1905 12.1983 12.1983 13.3607 13.3607 k = 0.4054 0.4054 0.7315 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9763 -1.9763 -1.9165 -1.9165 -1.5588 -1.5588 -1.4797 -1.4797 3.1324 3.1324 3.2602 3.2602 4.3407 4.3407 4.3488 4.3488 5.0987 5.0987 5.2140 5.2140 5.9214 5.9214 6.0156 6.0156 6.7692 6.7692 6.8518 6.8518 7.2827 7.2827 7.3112 7.3112 7.6642 7.6642 7.8430 7.8430 9.1775 9.1775 9.4542 9.4542 9.7037 9.7037 9.9241 9.9241 10.0711 10.0711 11.0145 11.0145 11.1828 11.1828 12.3416 12.3416 13.3884 13.3884 k = 0.3919 0.3919 0.7315 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9818 -1.9818 -1.9054 -1.9054 -1.5769 -1.5769 -1.4760 -1.4760 3.1375 3.1375 3.2985 3.2985 4.3528 4.3528 4.3597 4.3597 5.0998 5.0998 5.2490 5.2490 5.9019 5.9019 6.0161 6.0161 6.7513 6.7513 6.8553 6.8553 7.2644 7.2644 7.2998 7.2998 7.6254 7.6254 7.8278 7.8278 9.1344 9.1344 9.4283 9.4283 9.6885 9.6885 9.9049 9.9049 9.9976 9.9976 11.0010 11.0010 11.1743 11.1743 12.4599 12.4599 13.4413 13.4413 k = 0.3784 0.3784 0.7315 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9880 -1.9880 -1.8934 -1.8934 -1.5963 -1.5963 -1.4719 -1.4719 3.1441 3.1441 3.3402 3.3402 4.3665 4.3665 4.3704 4.3704 5.1006 5.1006 5.2890 5.2890 5.8806 5.8806 6.0163 6.0163 6.7313 6.7313 6.8587 6.8587 7.2403 7.2403 7.2867 7.2867 7.5873 7.5873 7.8095 7.8095 9.0928 9.0928 9.3980 9.3980 9.6742 9.6742 9.8223 9.8223 9.9974 9.9974 10.9857 10.9857 11.1651 11.1651 12.5466 12.5466 13.5259 13.5259 k = 0.3649 0.3649 0.7315 ( 7780 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -1.9947 -1.9947 -1.8807 -1.8807 -1.6165 -1.6165 -1.4674 -1.4674 3.1523 3.1523 3.3849 3.3849 4.3806 4.3806 4.3818 4.3818 5.1006 5.1006 5.3338 5.3338 5.8575 5.8575 6.0164 6.0164 6.7096 6.7096 6.8620 6.8620 7.2081 7.2081 7.2725 7.2725 7.5519 7.5519 7.7881 7.7881 9.0531 9.0531 9.3640 9.3640 9.6591 9.6591 9.7367 9.7367 10.0125 10.0125 10.9688 10.9688 11.1553 11.1553 12.6005 12.6005 13.6426 13.6426 k = 0.3514 0.3514 0.7315 ( 7776 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.0019 -2.0019 -1.8680 -1.8680 -1.6367 -1.6367 -1.4625 -1.4625 3.1624 3.1624 3.4317 3.4317 4.3902 4.3902 4.3986 4.3986 5.0995 5.0995 5.3832 5.3832 5.8335 5.8335 6.0163 6.0163 6.6863 6.6863 6.8647 6.8647 7.1660 7.1660 7.2580 7.2580 7.5212 7.5212 7.7641 7.7641 9.0160 9.0160 9.3266 9.3266 9.6290 9.6290 9.6775 9.6775 10.0283 10.0283 10.9503 10.9503 11.1448 11.1448 12.6265 12.6265 13.7858 13.7858 k = 0.3378 0.3378 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.0096 -2.0096 -1.8560 -1.8560 -1.6559 -1.6559 -1.4573 -1.4573 3.1743 3.1743 3.4802 3.4802 4.3988 4.3988 4.4170 4.4170 5.0966 5.0966 5.4367 5.4367 5.8092 5.8092 6.0162 6.0162 6.6616 6.6616 6.8667 6.8667 7.1136 7.1136 7.2437 7.2437 7.4958 7.4958 7.7378 7.7378 8.9817 8.9817 9.2866 9.2866 9.5713 9.5713 9.6596 9.6596 10.0426 10.0426 10.9303 10.9303 11.1337 11.1337 12.6320 12.6320 13.9470 13.9470 k = 0.3243 0.3243 0.7315 ( 7780 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.0176 -2.0176 -1.8462 -1.8462 -1.6726 -1.6726 -1.4518 -1.4518 3.1883 3.1883 3.5296 3.5296 4.4066 4.4066 4.4369 4.4369 5.0912 5.0912 5.4935 5.4935 5.7861 5.7861 6.0161 6.0161 6.6359 6.6359 6.8672 6.8672 7.0519 7.0519 7.2298 7.2298 7.4754 7.4754 7.7096 7.7096 8.9505 8.9505 9.2452 9.2452 9.5152 9.5152 9.6538 9.6538 10.0547 10.0547 10.9088 10.9088 11.1221 11.1221 12.6232 12.6232 14.1188 14.1188 k = 0.3108 0.3108 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6311 -35.6311 -2.0260 -2.0260 -1.8408 -1.8408 -1.6844 -1.6844 -1.4460 -1.4460 3.2045 3.2045 3.5793 3.5793 4.4133 4.4133 4.4583 4.4583 5.0826 5.0826 5.5518 5.5518 5.7663 5.7663 6.0159 6.0159 6.6093 6.6093 6.8658 6.8658 6.9827 6.9827 7.2168 7.2168 7.4591 7.4591 7.6801 7.6801 8.9226 8.9226 9.2042 9.2042 9.4673 9.4673 9.6525 9.6525 10.0644 10.0644 10.8860 10.8860 11.1101 11.1101 12.6049 12.6049 14.2378 14.2378 k = 0.2973 0.2973 0.7315 ( 7768 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -2.0346 -2.0346 -1.8420 -1.8420 -1.6889 -1.6889 -1.4400 -1.4400 3.2230 3.2230 3.6285 3.6285 4.4191 4.4191 4.4811 4.4811 5.0697 5.0697 5.6077 5.6077 5.7545 5.7545 6.0157 6.0157 6.5821 6.5821 6.8606 6.8606 6.9092 6.9092 7.2051 7.2051 7.4459 7.4459 7.6502 7.6502 8.8981 8.8981 9.1654 9.1654 9.4271 9.4271 9.6543 9.6543 10.0717 10.0717 10.8619 10.8619 11.0977 11.0977 12.5798 12.5798 14.2951 14.2951 k = 0.2838 0.2838 0.7315 ( 7762 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -2.0434 -2.0434 -1.8508 -1.8508 -1.6851 -1.6851 -1.4338 -1.4338 3.2438 3.2438 3.6766 3.6766 4.4240 4.4240 4.5054 4.5054 5.0517 5.0517 5.6499 5.6499 5.7623 5.7623 6.0156 6.0156 6.5547 6.5547 6.8222 6.8222 6.8617 6.8617 7.1949 7.1949 7.4348 7.4348 7.6207 7.6207 8.8769 8.8769 9.1303 9.1303 9.3938 9.3938 9.6590 9.6590 10.0766 10.0766 10.8365 10.8365 11.0850 11.0850 12.5498 12.5498 14.3385 14.3385 k = 0.2703 0.2703 0.7315 ( 7770 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6312 -35.6312 -2.0524 -2.0524 -1.8660 -1.8660 -1.6740 -1.6740 -1.4275 -1.4275 3.2670 3.2670 3.7228 3.7228 4.4281 4.4281 4.5310 4.5310 5.0281 5.0281 5.6666 5.6666 5.8010 5.8010 6.0155 6.0155 6.5274 6.5274 6.7435 6.7435 6.8489 6.8489 7.1867 7.1867 7.4251 7.4251 7.5924 7.5924 8.8589 8.8589 9.0999 9.0999 9.3663 9.3663 9.6662 9.6662 10.0792 10.0792 10.8099 10.8099 11.0721 11.0721 12.5158 12.5158 14.3658 14.3658 k = 0.2568 0.2568 0.7315 ( 7778 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.0614 -2.0614 -1.8853 -1.8853 -1.6580 -1.6580 -1.4211 -1.4211 3.2925 3.2925 3.7667 3.7667 4.4315 4.4315 4.5579 4.5579 4.9987 4.9987 5.6698 5.6698 5.8575 5.8575 6.0157 6.0157 6.5006 6.5006 6.6628 6.6628 6.8340 6.8340 7.1808 7.1808 7.4164 7.4164 7.5662 7.5662 8.8440 8.8440 9.0749 9.0749 9.3443 9.3443 9.6757 9.6757 10.0796 10.0796 10.7823 10.7823 11.0591 11.0591 12.4785 12.4785 14.3750 14.3750 k = 0.2432 0.2432 0.7315 ( 7780 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.0704 -2.0704 -1.9069 -1.9069 -1.6388 -1.6388 -1.4146 -1.4146 3.3203 3.3203 3.8075 3.8075 4.4343 4.4343 4.5860 4.5860 4.9640 4.9640 5.6715 5.6715 5.9162 5.9162 6.0166 6.0166 6.4749 6.4749 6.5851 6.5851 6.8148 6.8148 7.1774 7.1774 7.4083 7.4083 7.5429 7.5429 8.8319 8.8319 9.0553 9.0553 9.3277 9.3277 9.6872 9.6872 10.0780 10.0780 10.7537 10.7537 11.0460 11.0460 12.4378 12.4378 14.3653 14.3653 k = 0.2297 0.2297 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6311 -35.6311 -2.0793 -2.0793 -1.9295 -1.9295 -1.6176 -1.6176 -1.4082 -1.4082 3.3505 3.3505 3.8449 3.8449 4.4366 4.4366 4.6153 4.6153 4.9248 4.9248 5.6754 5.6754 5.9660 5.9660 6.0200 6.0200 6.4506 6.4506 6.5158 6.5158 6.7909 6.7909 7.1763 7.1763 7.4009 7.4009 7.5230 7.5230 8.8224 8.8224 9.0409 9.0409 9.3168 9.3168 9.7004 9.7004 10.0746 10.0746 10.7242 10.7242 11.0329 11.0329 12.3938 12.3938 14.3371 14.3371 k = 0.2162 0.2162 0.7315 ( 7774 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6311 -35.6311 -2.0881 -2.0881 -1.9525 -1.9525 -1.5952 -1.5952 -1.4017 -1.4017 3.3829 3.3829 3.8782 3.8782 4.4386 4.4386 4.6455 4.6455 4.8823 4.8823 5.6814 5.6814 5.9925 5.9925 6.0309 6.0309 6.4233 6.4233 6.4684 6.4684 6.7628 6.7628 7.1775 7.1775 7.3941 7.3941 7.5065 7.5065 8.8151 8.8151 9.0309 9.0309 9.3123 9.3123 9.7152 9.7152 10.0696 10.0696 10.6940 10.6940 11.0200 11.0200 12.3459 12.3459 14.2917 14.2917 k = 0.2027 0.2027 0.7315 ( 7770 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6319 -35.6319 -35.6311 -35.6311 -2.0968 -2.0968 -1.9753 -1.9753 -1.5721 -1.5721 -1.3954 -1.3954 3.4173 3.4173 3.9070 3.9070 4.4404 4.4404 4.6763 4.6763 4.8383 4.8383 5.6884 5.6884 5.9955 5.9955 6.0386 6.0386 6.3879 6.3879 6.4589 6.4589 6.7311 6.7311 7.1805 7.1805 7.3883 7.3883 7.4933 7.4933 8.8100 8.8100 9.0243 9.0243 9.3152 9.3152 9.7312 9.7312 10.0632 10.0632 10.6631 10.6631 11.0073 11.0073 12.2938 12.2938 14.2313 14.2313 k = 0.1892 0.1892 0.7315 ( 7770 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6311 -35.6311 -2.1051 -2.1051 -1.9975 -1.9975 -1.5487 -1.5487 -1.3892 -1.3892 3.4538 3.4538 3.9312 3.9312 4.4421 4.4421 4.7067 4.7067 4.7950 4.7950 5.6937 5.6937 5.9841 5.9841 6.0307 6.0307 6.3563 6.3563 6.4791 6.4791 6.6977 6.6977 7.1851 7.1851 7.3838 7.3838 7.4831 7.4831 8.8068 8.8068 9.0198 9.0198 9.3267 9.3267 9.7482 9.7482 10.0557 10.0557 10.6318 10.6318 10.9949 10.9949 12.2364 12.2364 14.1587 14.1587 k = 0.1757 0.1757 0.7315 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6311 -35.6311 -2.1132 -2.1132 -2.0189 -2.0189 -1.5254 -1.5254 -1.3832 -1.3832 3.4920 3.4920 3.9503 3.9503 4.4438 4.4438 4.7270 4.7270 4.7633 4.7633 5.6930 5.6930 5.9550 5.9550 6.0214 6.0214 6.3303 6.3303 6.5158 6.5158 6.6675 6.6675 7.1908 7.1908 7.3807 7.3807 7.4753 7.4753 8.8053 8.8053 9.0161 9.0161 9.3479 9.3479 9.7660 9.7660 10.0473 10.0473 10.6003 10.6003 10.9829 10.9829 12.1731 12.1731 14.0769 14.0769 k = 0.1622 0.1622 0.7315 ( 7776 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.1209 -2.1209 -2.0394 -2.0394 -1.5025 -1.5025 -1.3774 -1.3774 3.5317 3.5317 3.9642 3.9642 4.4457 4.4457 4.7005 4.7005 4.7812 4.7812 5.6796 5.6796 5.9196 5.9196 6.0162 6.0162 6.3076 6.3076 6.5433 6.5433 6.6580 6.6580 7.1973 7.1973 7.3791 7.3791 7.4695 7.4695 8.8055 8.8055 9.0123 9.0123 9.3796 9.3796 9.7843 9.7843 10.0382 10.0382 10.5687 10.5687 10.9714 10.9714 12.1027 12.1027 13.9889 13.9889 k = 0.1486 0.1486 0.7315 ( 7784 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.1282 -2.1282 -2.0586 -2.0586 -1.4802 -1.4802 -1.3719 -1.3719 3.5725 3.5725 3.9729 3.9729 4.4478 4.4478 4.6637 4.6637 4.8127 4.8127 5.6468 5.6468 5.8943 5.8943 6.0123 6.0123 6.2875 6.2875 6.5312 6.5312 6.6934 6.6934 7.2042 7.2042 7.3790 7.3790 7.4651 7.4651 8.8072 8.8072 9.0076 9.0076 9.4223 9.4223 9.8029 9.8029 10.0286 10.0286 10.5373 10.5373 10.9605 10.9605 12.0244 12.0244 13.8974 13.8974 k = 0.1351 0.1351 0.7315 ( 7786 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.1350 -2.1350 -2.0765 -2.0765 -1.4588 -1.4588 -1.3667 -1.3667 3.6142 3.6142 3.9766 3.9766 4.4504 4.4504 4.6297 4.6297 4.8455 4.8455 5.5948 5.5948 5.8841 5.8841 6.0082 6.0082 6.2700 6.2700 6.4972 6.4972 6.7530 6.7530 7.2112 7.2112 7.3803 7.3803 7.4620 7.4620 8.8104 8.8104 9.0019 9.0019 9.4757 9.4757 9.8217 9.8217 10.0187 10.0187 10.5065 10.5065 10.9502 10.9502 11.9375 11.9375 13.8046 13.8046 k = 0.1216 0.1216 0.7315 ( 7802 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.1413 -2.1413 -2.0930 -2.0930 -1.4386 -1.4386 -1.3619 -1.3619 3.6562 3.6562 3.9757 3.9757 4.4536 4.4536 4.5999 4.5999 4.8782 4.8782 5.5307 5.5307 5.8844 5.8844 6.0032 6.0032 6.2550 6.2550 6.4577 6.4577 6.8182 6.8182 7.2179 7.2179 7.3826 7.3826 7.4598 7.4598 8.8149 8.8149 8.9950 8.9950 9.5392 9.5392 9.8405 9.8405 10.0089 10.0089 10.4766 10.4766 10.9407 10.9407 11.8415 11.8415 13.7128 13.7128 k = 0.1081 0.1081 0.7315 ( 7802 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.1470 -2.1470 -2.1080 -2.1080 -1.4198 -1.4198 -1.3574 -1.3574 3.6978 3.6978 3.9709 3.9709 4.4575 4.4575 4.5748 4.5748 4.9103 4.9103 5.4615 5.4615 5.8901 5.8901 5.9970 5.9970 6.2429 6.2429 6.4176 6.4176 6.8831 6.8831 7.2241 7.2241 7.3858 7.3858 7.4581 7.4581 8.8207 8.8207 8.9872 8.9872 9.6118 9.6118 9.8596 9.8596 9.9993 9.9993 10.4479 10.4479 10.9319 10.9319 11.7365 11.7365 13.6244 13.6244 k = 0.0946 0.0946 0.7315 ( 7804 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6319 -35.6319 -35.6312 -35.6312 -2.1522 -2.1522 -2.1214 -2.1214 -1.4026 -1.4026 -1.3534 -1.3534 3.7384 3.7384 3.9631 3.9631 4.4623 4.4623 4.5542 4.5542 4.9411 4.9411 5.3915 5.3915 5.8980 5.8980 5.9895 5.9895 6.2334 6.2334 6.3790 6.3790 6.9451 6.9451 7.2295 7.2295 7.3898 7.3898 7.4567 7.4567 8.8278 8.8278 8.9784 8.9784 9.6913 9.6913 9.8798 9.8798 9.9902 9.9902 10.4210 10.4210 10.9241 10.9241 11.6235 11.6235 13.5429 13.5429 k = 0.0811 0.0811 0.7315 ( 7790 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7348 -35.7348 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1567 -2.1567 -2.1332 -2.1332 -1.3872 -1.3872 -1.3499 -1.3499 3.7771 3.7771 3.9534 3.9534 4.4679 4.4679 4.5379 4.5379 4.9701 4.9701 5.3237 5.3237 5.9064 5.9064 5.9810 5.9810 6.2264 6.2264 6.3430 6.3430 7.0026 7.0026 7.2338 7.2338 7.3944 7.3944 7.4553 7.4553 8.8359 8.8359 8.9689 8.9689 9.7727 9.7727 9.9044 9.9044 9.9822 9.9822 10.3963 10.3963 10.9171 10.9171 11.5038 11.5038 13.4711 13.4711 k = 0.0676 0.0676 0.7315 ( 7790 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1605 -2.1605 -2.1432 -2.1432 -1.3738 -1.3738 -1.3469 -1.3469 3.8127 3.8127 3.9429 3.9429 4.4744 4.4744 4.5253 4.5253 4.9966 4.9966 5.2605 5.2605 5.9146 5.9146 5.9719 5.9719 6.2216 6.2216 6.3106 6.3106 7.0544 7.0544 7.2366 7.2366 7.3996 7.3996 7.4536 7.4536 8.8451 8.8451 8.9586 8.9586 9.8413 9.8413 9.9419 9.9419 9.9797 9.9797 10.3743 10.3743 10.9112 10.9112 11.3798 11.3798 13.4109 13.4109 k = 0.0541 0.0541 0.7315 ( 7784 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1637 -2.1637 -2.1515 -2.1515 -1.3626 -1.3626 -1.3443 -1.3443 3.8443 3.8443 3.9327 3.9327 4.4815 4.4815 4.5159 4.5159 5.0199 5.0199 5.2039 5.2039 5.9219 5.9219 5.9627 5.9627 6.2186 6.2186 6.2826 6.2826 7.0997 7.0997 7.2376 7.2376 7.4054 7.4054 7.4512 7.4512 8.8551 8.8551 8.9478 8.9478 9.8802 9.8802 9.9583 9.9583 10.0313 10.0313 10.3555 10.3555 10.9062 10.9062 11.2547 11.2547 13.3629 13.3629 k = 0.0405 0.0405 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1661 -2.1661 -2.1581 -2.1581 -1.3537 -1.3537 -1.3424 -1.3424 3.8705 3.8705 3.9238 3.9238 4.4886 4.4886 4.5092 4.5092 5.0395 5.0395 5.1559 5.1559 5.9282 5.9282 5.9544 5.9544 6.2172 6.2172 6.2597 6.2597 7.1380 7.1380 7.2362 7.2362 7.4118 7.4118 7.4480 7.4480 8.8659 8.8659 8.9366 8.9366 9.9006 9.9006 9.9532 9.9532 10.1222 10.1222 10.3403 10.3403 10.9024 10.9024 11.1332 11.1332 13.3270 13.3270 k = 0.0270 0.0270 0.7315 ( 7772 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1677 -2.1677 -2.1630 -2.1630 -1.3472 -1.3472 -1.3411 -1.3411 3.8902 3.8902 3.9167 3.9167 4.4949 4.4949 4.5047 4.5047 5.0549 5.0549 5.1184 5.1184 5.9330 5.9330 5.9475 5.9475 6.2171 6.2171 6.2421 6.2421 7.1691 7.1691 7.2318 7.2318 7.4186 7.4186 7.4438 7.4438 8.8773 8.8773 8.9249 8.9249 9.9140 9.9140 9.9467 9.9467 10.2135 10.2135 10.3291 10.3291 10.8997 10.8997 11.0234 11.0234 13.3030 13.3030 k = 0.0135 0.0135 0.7315 ( 7792 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1683 -2.1683 -2.1662 -2.1662 -1.3430 -1.3430 -1.3405 -1.3405 3.9028 3.9028 3.9120 3.9120 4.4993 4.4993 4.5021 4.5021 5.0665 5.0665 5.0927 5.0927 5.9365 5.9365 5.9425 5.9425 6.2186 6.2186 6.2299 6.2299 7.1933 7.1933 7.2238 7.2238 7.4256 7.4256 7.4385 7.4385 8.8890 8.8890 8.9130 8.9130 9.9242 9.9242 9.9399 9.9399 10.2862 10.2862 10.3222 10.3222 10.8984 10.8984 10.9398 10.9398 13.2905 13.2905 k = 0.0000 0.0000 0.7315 ( 7812 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1737 -49.1737 -35.7348 -35.7348 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -2.1679 -2.1679 -2.1679 -2.1679 -1.3410 -1.3410 -1.3410 -1.3410 3.9087 3.9087 3.9088 3.9088 4.5009 4.5009 4.5012 4.5012 5.0771 5.0771 5.0772 5.0772 5.9391 5.9391 5.9394 5.9394 6.2223 6.2223 6.2225 6.2225 7.2112 7.2112 7.2113 7.2113 7.4322 7.4322 7.4325 7.4325 8.9008 8.9008 8.9011 8.9011 9.9324 9.9324 9.9326 9.9326 10.3176 10.3176 10.3178 10.3178 10.9023 10.9023 10.9025 10.9025 13.2895 13.2895 k = 0.0000 0.5000-0.0000 ( 7832 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6315 -35.6315 -35.6308 -35.6308 -2.8825 -2.8825 -2.8825 -2.8825 -1.2743 -1.2743 -1.2742 -1.2742 3.8814 3.8814 3.8815 3.8815 4.9925 4.9925 4.9927 4.9927 5.4497 5.4497 5.4500 5.4500 5.8905 5.8905 5.8907 5.8907 6.5019 6.5019 6.5022 6.5022 7.5642 7.5642 7.5646 7.5646 8.3762 8.3762 8.3763 8.3763 8.8584 8.8584 8.8585 8.8585 9.3412 9.3412 9.3413 9.3413 12.1087 12.1087 12.1089 12.1089 12.3800 12.3800 12.3802 12.3802 13.8067 13.8067 k = 0.0000 0.5000 0.0193 ( 7814 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8817 -2.8817 -2.8810 -2.8810 -1.2756 -1.2756 -1.2735 -1.2735 3.8820 3.8820 3.8836 3.8836 4.9888 4.9888 4.9939 4.9939 5.4440 5.4440 5.4581 5.4581 5.8814 5.8814 5.8986 5.8986 6.4838 6.4838 6.5112 6.5112 7.5609 7.5609 7.5614 7.5614 8.3571 8.3571 8.3933 8.3933 8.8493 8.8493 8.8797 8.8797 9.3410 9.3410 9.3417 9.3417 12.0762 12.0762 12.1154 12.1154 12.3668 12.3668 12.4008 12.4008 13.8108 13.8108 k = 0.0000 0.5000 0.0385 ( 7806 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.8787 -2.8787 -2.8773 -2.8773 -1.2773 -1.2773 -1.2732 -1.2732 3.8852 3.8852 3.8884 3.8884 4.9828 4.9828 4.9928 4.9928 5.4406 5.4406 5.4687 5.4687 5.8708 5.8708 5.9055 5.9055 6.4572 6.4572 6.5115 6.5115 7.5511 7.5511 7.5518 7.5518 8.3385 8.3385 8.4060 8.4060 8.8542 8.8542 8.9097 8.9097 9.3415 9.3415 9.3418 9.3418 12.0254 12.0254 12.0911 12.0911 12.3667 12.3667 12.4211 12.4211 13.8251 13.8251 k = 0.0000 0.5000 0.0578 ( 7804 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7315 -35.7315 -35.6314 -35.6314 -35.6308 -35.6308 -2.8734 -2.8734 -2.8714 -2.8714 -1.2796 -1.2796 -1.2733 -1.2733 3.8910 3.8910 3.8958 3.8958 4.9748 4.9748 4.9894 4.9894 5.4393 5.4393 5.4812 5.4812 5.8579 5.8579 5.9105 5.9105 6.4234 6.4234 6.5036 6.5036 7.5357 7.5357 7.5365 7.5365 8.3222 8.3222 8.4131 8.4131 8.8731 8.8731 8.9445 8.9445 9.3413 9.3413 9.3439 9.3439 11.9615 11.9615 12.0400 12.0400 12.3775 12.3775 12.4373 12.4373 13.8485 13.8485 k = 0.0000 0.5000 0.0770 ( 7810 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7321 -35.7321 -35.7315 -35.7315 -35.6314 -35.6314 -35.6308 -35.6308 -2.8660 -2.8660 -2.8633 -2.8633 -1.2823 -1.2823 -1.2740 -1.2740 3.8994 3.8994 3.9059 3.9059 4.9651 4.9651 4.9840 4.9840 5.4397 5.4397 5.4956 5.4956 5.8417 5.8417 5.9124 5.9124 6.3847 6.3847 6.4891 6.4891 7.5156 7.5156 7.5163 7.5163 8.3094 8.3094 8.4149 8.4149 8.9040 8.9040 8.9803 8.9803 9.3402 9.3402 9.3494 9.3494 11.8875 11.8875 11.9706 11.9706 12.3932 12.3932 12.4483 12.4483 13.8795 13.8795 k = 0.0000 0.5000 0.0963 ( 7810 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7322 -35.7322 -35.7315 -35.7315 -35.6315 -35.6315 -35.6308 -35.6308 -2.8563 -2.8563 -2.8529 -2.8529 -1.2856 -1.2856 -1.2753 -1.2753 3.9103 3.9103 3.9186 3.9186 4.9541 4.9541 4.9769 4.9769 5.4413 5.4413 5.5113 5.5113 5.8207 5.8207 5.9092 5.9092 6.3443 6.3443 6.4700 6.4700 7.4921 7.4921 7.4923 7.4923 8.3002 8.3002 8.4128 8.4128 8.9431 8.9431 9.0130 9.0130 9.3388 9.3388 9.3597 9.3597 11.8056 11.8056 11.8892 11.8892 12.4099 12.4099 12.4548 12.4548 13.9164 13.9164 k = 0.0000 0.5000 0.1155 ( 7810 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7322 -35.7322 -35.7316 -35.7316 -35.6315 -35.6315 -35.6308 -35.6308 -2.8445 -2.8445 -2.8404 -2.8404 -1.2893 -1.2893 -1.2770 -1.2770 3.9238 3.9238 3.9339 3.9339 4.9422 4.9422 4.9687 4.9687 5.4433 5.4433 5.5280 5.5280 5.7932 5.7932 5.8978 5.8978 6.3066 6.3066 6.4488 6.4488 7.4652 7.4652 7.4664 7.4664 8.2942 8.2942 8.4079 8.4079 8.9865 8.9865 9.0391 9.0391 9.3373 9.3373 9.3762 9.3762 11.7173 11.7173 11.7998 11.7998 12.4263 12.4263 12.4578 12.4578 13.9582 13.9582 k = 0.0000 0.5000 0.1348 ( 7802 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7323 -35.7323 -35.7316 -35.7316 -35.6315 -35.6315 -35.6308 -35.6308 -2.8306 -2.8306 -2.8257 -2.8257 -1.2935 -1.2935 -1.2793 -1.2793 3.9397 3.9397 3.9517 3.9517 4.9298 4.9298 4.9598 4.9598 5.4446 5.4446 5.5454 5.5454 5.7578 5.7578 5.8750 5.8750 6.2766 6.2766 6.4284 6.4284 7.4361 7.4361 7.4393 7.4393 8.2909 8.2909 8.4011 8.4011 9.0305 9.0305 9.0565 9.0565 9.3367 9.3367 9.3996 9.3996 11.6240 11.6240 11.7050 11.7050 12.4421 12.4421 12.4589 12.4589 14.0037 14.0037 k = 0.0000 0.5000 0.1540 ( 7798 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7323 -35.7323 -35.7317 -35.7317 -35.6315 -35.6315 -35.6308 -35.6308 -2.8145 -2.8145 -2.8089 -2.8089 -1.2982 -1.2982 -1.2821 -1.2821 3.9580 3.9580 3.9721 3.9721 4.9170 4.9170 4.9506 4.9506 5.4436 5.4436 5.5629 5.5629 5.7136 5.7136 5.8396 5.8396 6.2576 6.2576 6.4110 6.4110 7.4057 7.4057 7.4114 7.4114 8.2893 8.2893 8.3926 8.3926 9.0647 9.0647 9.0710 9.0710 9.3384 9.3384 9.4287 9.4287 11.5270 11.5270 11.6067 11.6067 12.4577 12.4577 12.4594 12.4594 14.0525 14.0525 k = 0.0000 0.5000 0.1733 ( 7802 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7324 -35.7324 -35.7318 -35.7318 -35.6315 -35.6315 -35.6308 -35.6308 -2.7965 -2.7965 -2.7901 -2.7901 -1.3033 -1.3033 -1.2854 -1.2854 3.9787 3.9787 3.9950 3.9950 4.9041 4.9041 4.9415 4.9415 5.4376 5.4376 5.5786 5.5786 5.6616 5.6616 5.7940 5.7940 6.2506 6.2506 6.3982 6.3982 7.3747 7.3747 7.3835 7.3835 8.2885 8.2885 8.3823 8.3823 9.0649 9.0649 9.1041 9.1041 9.3448 9.3448 9.4612 9.4612 11.4272 11.4272 11.5061 11.5061 12.4605 12.4605 12.4734 12.4734 14.1039 14.1039 k = 0.0000 0.5000 0.1925 ( 7802 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7325 -35.7325 -35.7318 -35.7318 -35.6315 -35.6315 -35.6308 -35.6308 -2.7764 -2.7764 -2.7693 -2.7693 -1.3090 -1.3090 -1.2894 -1.2894 4.0015 4.0015 4.0203 4.0203 4.8912 4.8912 4.9329 4.9329 5.4226 5.4226 5.5741 5.5741 5.6209 5.6209 5.7448 5.7448 6.2536 6.2536 6.3908 6.3908 7.3434 7.3434 7.3558 7.3558 8.2877 8.2877 8.3701 8.3701 9.0588 9.0588 9.1261 9.1261 9.3584 9.3584 9.4948 9.4948 11.3255 11.3255 11.4043 11.4043 12.4635 12.4635 12.4898 12.4898 14.1579 14.1579 k = 0.0000 0.5000 0.2118 ( 7810 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1734 -49.1734 -35.7326 -35.7326 -35.7319 -35.7319 -35.6315 -35.6315 -35.6309 -35.6309 -2.7544 -2.7544 -2.7465 -2.7465 -1.3153 -1.3153 -1.2939 -1.2939 4.0263 4.0263 4.0479 4.0479 4.8782 4.8782 4.9250 4.9250 5.3931 5.3931 5.5138 5.5138 5.6282 5.6282 5.7007 5.7007 6.2642 6.2642 6.3886 6.3886 7.3123 7.3123 7.3286 7.3286 8.2860 8.2860 8.3556 8.3556 9.0479 9.0479 9.1353 9.1353 9.3801 9.3801 9.5272 9.5272 11.2226 11.2226 11.3020 11.3020 12.4691 12.4691 12.5076 12.5076 14.2141 14.2141 k = 0.0000 0.5000 0.2310 ( 7822 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1734 -49.1734 -35.7327 -35.7327 -35.7320 -35.7320 -35.6316 -35.6316 -35.6309 -35.6309 -2.7305 -2.7305 -2.7218 -2.7218 -1.3220 -1.3220 -1.2991 -1.2991 4.0530 4.0530 4.0777 4.0777 4.8649 4.8649 4.9180 4.9180 5.3447 5.3447 5.4374 5.4374 5.6455 5.6455 5.6691 5.6691 6.2800 6.2800 6.3910 6.3910 7.2815 7.2815 7.3022 7.3022 8.2826 8.2826 8.3382 8.3382 9.0335 9.0335 9.1330 9.1330 9.4084 9.4084 9.5570 9.5570 11.1191 11.1191 11.1998 11.1998 12.4781 12.4781 12.5270 12.5270 14.2725 14.2725 k = 0.0000 0.5000 0.2503 ( 7822 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1734 -49.1734 -35.7328 -35.7328 -35.7321 -35.7321 -35.6316 -35.6316 -35.6309 -35.6309 -2.7049 -2.7049 -2.6953 -2.6953 -1.3293 -1.3293 -1.3049 -1.3049 4.0814 4.0814 4.1097 4.1097 4.8508 4.8508 4.9120 4.9120 5.2786 5.2786 5.3560 5.3560 5.6513 5.6513 5.6640 5.6640 6.2992 6.2992 6.3969 6.3969 7.2513 7.2513 7.2768 7.2768 8.2768 8.2768 8.3176 8.3176 9.0165 9.0165 9.1218 9.1218 9.4406 9.4406 9.5834 9.5834 11.0156 11.0156 11.0979 11.0979 12.4910 12.4910 12.5486 12.5486 14.3328 14.3328 k = 0.0000 0.5000 0.2695 ( 7826 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1735 -49.1735 -35.7329 -35.7329 -35.7322 -35.7322 -35.6316 -35.6316 -35.6309 -35.6309 -2.6775 -2.6775 -2.6670 -2.6670 -1.3371 -1.3371 -1.3113 -1.3113 4.1111 4.1111 4.1437 4.1437 4.8347 4.8347 4.9067 4.9067 5.2003 5.2003 5.2732 5.2732 5.6440 5.6440 5.6828 5.6828 6.3206 6.3206 6.4054 6.4054 7.2219 7.2219 7.2526 7.2526 8.2680 8.2680 8.2935 8.2935 8.9975 8.9975 9.1043 9.1043 9.4743 9.4743 9.6060 9.6060 10.9123 10.9123 10.9969 10.9969 12.5081 12.5081 12.5724 12.5724 14.3949 14.3949 k = 0.0000 0.5000 0.2888 ( 7806 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1734 -49.1734 -35.7330 -35.7330 -35.7323 -35.7323 -35.6316 -35.6316 -35.6309 -35.6309 -2.6485 -2.6485 -2.6371 -2.6371 -1.3456 -1.3456 -1.3184 -1.3184 4.1418 4.1418 4.1795 4.1795 4.8147 4.8147 4.9008 4.9008 5.1168 5.1168 5.1930 5.1930 5.6434 5.6434 5.7016 5.7016 6.3433 6.3433 6.4155 6.4155 7.1933 7.1933 7.2299 7.2299 8.2556 8.2556 8.2655 8.2655 8.9772 8.9772 9.0824 9.0824 9.5083 9.5083 9.6250 9.6250 10.8098 10.8098 10.8968 10.8968 12.5296 12.5296 12.5987 12.5987 14.4587 14.4587 k = 0.0000 0.5000 0.3080 ( 7810 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1735 -49.1735 -35.7331 -35.7331 -35.7324 -35.7324 -35.6316 -35.6316 -35.6309 -35.6309 -2.6180 -2.6180 -2.6056 -2.6056 -1.3546 -1.3546 -1.3262 -1.3262 4.1729 4.1729 4.2170 4.2170 4.7870 4.7870 4.8900 4.8900 5.0367 5.0367 5.1203 5.1203 5.6467 5.6467 5.7202 5.7202 6.3664 6.3664 6.4263 6.4263 7.1657 7.1657 7.2086 7.2086 8.2334 8.2334 8.2393 8.2393 8.9559 8.9559 9.0576 9.0576 9.5416 9.5416 9.6406 9.6406 10.7082 10.7082 10.7980 10.7980 12.5554 12.5554 12.6274 12.6274 14.5239 14.5239 k = 0.0000 0.5000 0.3273 ( 7814 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7332 -35.7332 -35.7325 -35.7325 -35.6317 -35.6317 -35.6309 -35.6309 -2.5860 -2.5860 -2.5726 -2.5726 -1.3642 -1.3642 -1.3348 -1.3348 4.2034 4.2034 4.2559 4.2559 4.7474 4.7474 4.8591 4.8591 4.9783 4.9783 5.0609 5.0609 5.6525 5.6525 5.7384 5.7384 6.3893 6.3893 6.4369 6.4369 7.1391 7.1391 7.1892 7.1892 8.1971 8.1971 8.2187 8.2187 8.9339 8.9339 9.0309 9.0309 9.5739 9.5739 9.6535 9.6535 10.6078 10.6078 10.7004 10.7004 12.5852 12.5852 12.6583 12.6583 14.5903 14.5903 k = 0.0000 0.5000 0.3465 ( 7814 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7333 -35.7333 -35.7326 -35.7326 -35.6317 -35.6317 -35.6310 -35.6310 -2.5527 -2.5527 -2.5383 -2.5383 -1.3744 -1.3744 -1.3441 -1.3441 4.2319 4.2319 4.2956 4.2956 4.6930 4.6930 4.7961 4.7961 4.9568 4.9568 5.0189 5.0189 5.6596 5.6596 5.7562 5.7562 6.4115 6.4115 6.4467 6.4467 7.1137 7.1137 7.1718 7.1718 8.1566 8.1566 8.1939 8.1939 8.9113 8.9113 9.0033 9.0033 9.6051 9.6051 9.6641 9.6641 10.5089 10.5089 10.6043 10.6043 12.6188 12.6188 12.6914 12.6914 14.6578 14.6578 k = 0.0000 0.5000 0.3658 ( 7796 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1735 -49.1735 -35.7334 -35.7334 -35.7327 -35.7327 -35.6317 -35.6317 -35.6310 -35.6310 -2.5182 -2.5182 -2.5027 -2.5027 -1.3853 -1.3853 -1.3542 -1.3542 4.2559 4.2559 4.3353 4.3353 4.6259 4.6259 4.7210 4.7210 4.9560 4.9560 4.9937 4.9937 5.6676 5.6676 5.7735 5.7735 6.4325 6.4325 6.4551 6.4551 7.0896 7.0896 7.1565 7.1565 8.1119 8.1119 8.1648 8.1648 8.8886 8.8886 8.9757 8.9757 9.6351 9.6351 9.6733 9.6733 10.4118 10.4118 10.5099 10.5099 12.6556 12.6556 12.7264 12.7264 14.7262 14.7262 k = 0.0000 0.5000 0.3850 ( 7800 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7335 -35.7335 -35.7328 -35.7328 -35.6317 -35.6317 -35.6310 -35.6310 -2.4826 -2.4826 -2.4660 -2.4660 -1.3969 -1.3969 -1.3651 -1.3651 4.2705 4.2705 4.3724 4.3724 4.5531 4.5531 4.6513 4.6513 4.9636 4.9636 4.9816 4.9816 5.6761 5.6761 5.7900 5.7900 6.4517 6.4517 6.4617 6.4617 7.0669 7.0669 7.1433 7.1433 8.0633 8.0633 8.1318 8.1318 8.8658 8.8658 8.9488 8.9488 9.6637 9.6637 9.6815 9.6815 10.3165 10.3165 10.4173 10.4173 12.6953 12.6953 12.7630 12.7630 14.7952 14.7952 k = 0.0000 0.5000 0.4043 ( 7792 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7336 -35.7336 -35.7329 -35.7329 -35.6317 -35.6317 -35.6310 -35.6310 -2.4461 -2.4461 -2.4282 -2.4282 -1.4092 -1.4092 -1.3768 -1.3768 4.2679 4.2679 4.3921 4.3921 4.4934 4.4934 4.5988 4.5988 4.9762 4.9762 4.9787 4.9787 5.6848 5.6848 5.8055 5.8055 6.4663 6.4663 6.4685 6.4685 7.0458 7.0458 7.1322 7.1322 8.0112 8.0112 8.0952 8.0952 8.8432 8.8432 8.9234 8.9234 9.6892 9.6892 9.6908 9.6908 10.2235 10.2235 10.3268 10.3268 12.7372 12.7372 12.8009 12.8009 14.8647 14.8647 k = 0.0000 0.5000 0.4235 ( 7782 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7337 -35.7337 -35.7330 -35.7330 -35.6317 -35.6317 -35.6310 -35.6310 -2.4087 -2.4087 -2.3896 -2.3896 -1.4223 -1.4223 -1.3895 -1.3895 4.2407 4.2407 4.3504 4.3504 4.4937 4.4937 4.5723 4.5723 4.9828 4.9828 4.9929 4.9929 5.6938 5.6938 5.8199 5.8199 6.4688 6.4688 6.4826 6.4826 7.0264 7.0264 7.1230 7.1230 7.9559 7.9559 8.0556 8.0556 8.8211 8.8211 8.9002 8.9002 9.6966 9.6966 9.7161 9.7161 10.1329 10.1329 10.2388 10.2388 12.7809 12.7809 12.8396 12.8396 14.9345 14.9345 k = 0.0000 0.5000 0.4428 ( 7774 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1735 -49.1735 -35.7338 -35.7338 -35.7331 -35.7331 -35.6317 -35.6317 -35.6310 -35.6310 -2.3707 -2.3707 -2.3502 -2.3502 -1.4361 -1.4361 -1.4031 -1.4031 4.1907 4.1907 4.2754 4.2754 4.5275 4.5275 4.5706 4.5706 4.9922 4.9922 5.0131 5.0131 5.7030 5.7030 5.8329 5.8329 6.4693 6.4693 6.4932 6.4932 7.0091 7.0091 7.1152 7.1152 7.8980 7.8980 8.0135 8.0135 8.8000 8.8000 8.8796 8.8796 9.7039 9.7039 9.7392 9.7392 10.0453 10.0453 10.1539 10.1539 12.8259 12.8259 12.8789 12.8789 15.0041 15.0041 k = 0.0000 0.5000 0.4620 ( 7770 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7340 -35.7340 -35.7332 -35.7332 -35.6318 -35.6318 -35.6310 -35.6310 -2.3321 -2.3321 -2.3102 -2.3102 -1.4507 -1.4507 -1.4177 -1.4177 4.1271 4.1271 4.1960 4.1960 4.5667 4.5667 4.5849 4.5849 5.0063 5.0063 5.0365 5.0365 5.7125 5.7125 5.8442 5.8442 6.4684 6.4684 6.4999 6.4999 6.9939 6.9939 7.1083 7.1083 7.8381 7.8381 7.9699 7.9699 8.7800 8.7800 8.8621 8.8621 9.7105 9.7105 9.7587 9.7587 9.9612 9.9612 10.0734 10.0734 12.8716 12.8716 12.9184 12.9184 15.0732 15.0732 k = 0.0000 0.5000 0.4813 ( 7762 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1735 -49.1735 -35.7340 -35.7340 -35.7333 -35.7333 -35.6318 -35.6318 -35.6310 -35.6310 -2.2932 -2.2932 -2.2698 -2.2698 -1.4662 -1.4662 -1.4333 -1.4333 4.0580 4.0580 4.1177 4.1177 4.6063 4.6063 4.6072 4.6072 5.0247 5.0247 5.0630 5.0630 5.7225 5.7225 5.8534 5.8534 6.4664 6.4664 6.5022 6.5022 6.9811 6.9811 7.1015 7.1015 7.7770 7.7770 7.9256 7.9256 8.7616 8.7616 8.8481 8.8481 9.7150 9.7150 9.7718 9.7718 9.8825 9.8825 10.0002 10.0002 12.9174 12.9174 12.9577 12.9577 15.1410 15.1410 k = 0.0000 0.5000 0.5005 ( 7774 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7342 -35.7342 -35.7334 -35.7334 -35.6318 -35.6318 -35.6310 -35.6310 -2.2541 -2.2541 -2.2291 -2.2291 -1.4825 -1.4825 -1.4500 -1.4500 3.9881 3.9881 4.0424 4.0424 4.6330 4.6330 4.6446 4.6446 5.0470 5.0470 5.0919 5.0919 5.7333 5.7333 5.8602 5.8602 6.4643 6.4643 6.4998 6.4998 6.9707 6.9707 7.0939 7.0939 7.7155 7.7155 7.8816 7.8816 8.7452 8.7452 8.8379 8.8379 9.7116 9.7116 9.7709 9.7709 9.8151 9.8151 9.9420 9.9420 12.9629 12.9629 12.9964 12.9964 15.2063 15.2063 k = 0.0000 0.5000 0.5198 ( 7770 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7342 -35.7342 -35.7335 -35.7335 -35.6318 -35.6318 -35.6310 -35.6310 -2.2151 -2.2151 -2.1882 -2.1882 -1.4997 -1.4997 -1.4677 -1.4677 3.9200 3.9200 3.9709 3.9709 4.6598 4.6598 4.6809 4.6809 5.0731 5.0731 5.1227 5.1227 5.7453 5.7453 5.8642 5.8642 6.4628 6.4628 6.4923 6.4923 6.9627 6.9627 7.0845 7.0845 7.6545 7.6545 7.8390 7.8390 8.7311 8.7311 8.8317 8.8317 9.6812 9.6812 9.7437 9.7437 9.7781 9.7781 9.9114 9.9114 13.0076 13.0076 13.0341 13.0341 15.2527 15.2528 k = 0.0000 0.5000 0.5390 ( 7750 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7343 -35.7343 -35.7336 -35.7336 -35.6318 -35.6318 -35.6310 -35.6310 -2.1761 -2.1761 -2.1474 -2.1474 -1.5177 -1.5177 -1.4866 -1.4866 3.8552 3.8552 3.9040 3.9040 4.6864 4.6864 4.7145 4.7145 5.1025 5.1025 5.1547 5.1547 5.7590 5.7590 5.8651 5.8651 6.4628 6.4628 6.4797 6.4797 6.9567 6.9567 7.0724 7.0724 7.5951 7.5951 7.7990 7.7990 8.7195 8.7195 8.8296 8.8296 9.6231 9.6231 9.6915 9.6915 9.7724 9.7724 9.9067 9.9067 13.0508 13.0508 13.0704 13.0704 15.2628 15.2628 k = 0.0000 0.5000 0.5583 ( 7754 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7344 -35.7344 -35.7337 -35.7337 -35.6318 -35.6318 -35.6310 -35.6310 -2.1376 -2.1376 -2.1069 -2.1069 -1.5367 -1.5367 -1.5066 -1.5066 3.7947 3.7947 3.8420 3.8420 4.7119 4.7119 4.7452 4.7452 5.1348 5.1348 5.1868 5.1868 5.7749 5.7749 5.8626 5.8626 6.4620 6.4620 6.4652 6.4652 6.9524 6.9524 7.0566 7.0566 7.5380 7.5380 7.7626 7.7626 8.7106 8.7106 8.8318 8.8318 9.5588 9.5588 9.6287 9.6287 9.7766 9.7766 9.9139 9.9139 13.0922 13.0922 13.1049 13.1049 15.2640 15.2640 k = 0.0000 0.5000 0.5775 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7345 -35.7345 -35.7337 -35.7337 -35.6319 -35.6319 -35.6311 -35.6311 -2.0997 -2.0997 -2.0667 -2.0667 -1.5564 -1.5564 -1.5277 -1.5277 3.7392 3.7392 3.7856 3.7856 4.7358 4.7358 4.7727 4.7727 5.1694 5.1694 5.2181 5.2181 5.7938 5.7938 5.8567 5.8567 6.4394 6.4394 6.4704 6.4704 6.9494 6.9494 7.0367 7.0367 7.4844 7.4844 7.7306 7.7306 8.7044 8.7044 8.8382 8.8382 9.4959 9.4959 9.5634 9.5634 9.7833 9.7833 9.9248 9.9248 13.1311 13.1311 13.1372 13.1372 15.2615 15.2615 k = 0.0000 0.5000 0.5968 ( 7758 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7345 -35.7345 -35.7338 -35.7338 -35.6319 -35.6319 -35.6311 -35.6311 -2.0627 -2.0627 -2.0272 -2.0272 -1.5769 -1.5769 -1.5499 -1.5499 3.6892 3.6892 3.7349 3.7349 4.7577 4.7577 4.7969 4.7969 5.2052 5.2052 5.2475 5.2475 5.8162 5.8162 5.8474 5.8474 6.4123 6.4123 6.4792 6.4792 6.9472 6.9472 7.0124 7.0124 7.4353 7.4353 7.7036 7.7036 8.7011 8.7011 8.8487 8.8487 9.4367 9.4367 9.4990 9.4990 9.7906 9.7906 9.9365 9.9365 13.1668 13.1668 13.1671 13.1671 15.2581 15.2581 k = 0.0000 0.5000 0.6160 ( 7758 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7346 -35.7346 -35.7339 -35.7339 -35.6319 -35.6319 -35.6311 -35.6311 -2.0270 -2.0270 -1.9885 -1.9885 -1.5980 -1.5980 -1.5732 -1.5732 3.6451 3.6451 3.6904 3.6904 4.7775 4.7775 4.8179 4.8179 5.2414 5.2414 5.2739 5.2739 5.8353 5.8353 5.8425 5.8425 6.3810 6.3810 6.4914 6.4914 6.9452 6.9452 6.9842 6.9842 7.3915 7.3915 7.6816 7.6816 8.7002 8.7002 8.8631 8.8631 9.3822 9.3822 9.4370 9.4370 9.7976 9.7976 9.9476 9.9476 13.1935 13.1935 13.1995 13.1995 15.2554 15.2554 k = 0.0000 0.5000 0.6353 ( 7754 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7339 -35.7339 -35.6319 -35.6319 -35.6311 -35.6311 -1.9928 -1.9928 -1.9510 -1.9510 -1.6194 -1.6194 -1.5974 -1.5974 3.6072 3.6072 3.6522 3.6522 4.7947 4.7947 4.8356 4.8356 5.2766 5.2766 5.2967 5.2967 5.8210 5.8210 5.8730 5.8730 6.3460 6.3460 6.5069 6.5069 6.9434 6.9434 6.9531 6.9531 7.3539 7.3539 7.6645 7.6645 8.7015 8.7015 8.8809 8.8809 9.3335 9.3335 9.3782 9.3782 9.8039 9.8039 9.9575 9.9575 13.2167 13.2167 13.2280 13.2280 15.2539 15.2539 k = 0.0000 0.5000 0.6545 ( 7744 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7339 -35.7339 -35.6319 -35.6319 -35.6311 -35.6311 -1.9610 -1.9610 -1.9150 -1.9150 -1.6406 -1.6406 -1.6223 -1.6223 3.5759 3.5759 3.6207 3.6207 4.8093 4.8093 4.8502 4.8502 5.3094 5.3094 5.3152 5.3152 5.8056 5.8056 5.9070 5.9070 6.3082 6.3082 6.5250 6.5250 6.9206 6.9206 6.9415 6.9415 7.3230 7.3230 7.6518 7.6518 8.7044 8.7044 8.9015 8.9015 9.2913 9.2913 9.3239 9.3239 9.8094 9.8094 9.9659 9.9659 13.2363 13.2363 13.2521 13.2521 15.2536 15.2536 k = 0.0000 0.5000 0.6738 ( 7740 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9324 -1.9324 -1.8814 -1.8814 -1.6608 -1.6608 -1.6472 -1.6472 3.5513 3.5513 3.5959 3.5959 4.8209 4.8209 4.8615 4.8615 5.3295 5.3295 5.3383 5.3383 5.7905 5.7905 5.9436 5.9436 6.2690 6.2690 6.5444 6.5444 6.8889 6.8889 6.9396 6.9396 7.2990 7.2990 7.6428 7.6428 8.7081 8.7081 8.9237 8.9237 9.2568 9.2568 9.2754 9.2754 9.8139 9.8139 9.9726 9.9726 13.2518 13.2518 13.2713 13.2713 15.2542 15.2542 k = 0.0000 0.5000 0.6930 ( 7734 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.9087 -1.9087 -1.8515 -1.8515 -1.6784 -1.6784 -1.6707 -1.6707 3.5337 3.5337 3.5782 3.5782 4.8294 4.8294 4.8696 4.8696 5.3394 5.3394 5.3611 5.3611 5.7776 5.7776 5.9800 5.9800 6.2307 6.2307 6.5627 6.5627 6.8612 6.8612 6.9380 6.9380 7.2821 7.2821 7.6368 7.6368 8.7117 8.7117 8.9452 8.9452 9.2310 9.2310 9.2350 9.2350 9.8171 9.8171 9.9775 9.9775 13.2631 13.2631 13.2853 13.2853 15.2553 15.2553 k = 0.0000 0.5000 0.7123 ( 7752 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.8924 -1.8924 -1.8287 -1.8287 -1.6910 -1.6910 -1.6897 -1.6897 3.5230 3.5230 3.5675 3.5675 4.8345 4.8345 4.8745 4.8745 5.3453 5.3453 5.3760 5.3760 5.7687 5.7687 6.0107 6.0107 6.1990 6.1990 6.5764 6.5764 6.8415 6.8415 6.9368 6.9368 7.2719 7.2719 7.6335 7.6335 8.7144 8.7144 8.9621 8.9621 9.2067 9.2067 9.2151 9.2151 9.8191 9.8191 9.9804 9.9804 13.2699 13.2699 13.2937 13.2937 15.2562 15.2562 k = 0.0000 0.5000 0.7315 ( 7756 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7348 -35.7348 -35.7340 -35.7340 -35.6319 -35.6319 -35.6311 -35.6311 -1.8865 -1.8865 -1.8195 -1.8195 -1.6977 -1.6977 -1.6957 -1.6957 3.5195 3.5195 3.5639 3.5639 4.8362 4.8362 4.8761 4.8761 5.3472 5.3472 5.3811 5.3811 5.7655 5.7655 6.0240 6.0240 6.1853 6.1853 6.5816 6.5816 6.8343 6.8343 6.9364 6.9364 7.2686 7.2686 7.6324 7.6324 8.7153 8.7153 8.9687 8.9687 9.1963 9.1963 9.2096 9.2096 9.8198 9.8198 9.9814 9.9814 13.2722 13.2722 13.2966 13.2966 15.2566 15.2566 k = 0.5000 0.5000-0.0000 ( 7792 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7113 -2.7113 -2.7112 -2.7112 -1.5401 -1.5401 -1.5401 -1.5401 3.4564 3.4564 3.4565 3.4565 4.9074 4.9074 4.9077 4.9077 6.1644 6.1644 6.1647 6.1647 6.6708 6.6708 6.6708 6.6708 6.9225 6.9225 6.9226 6.9226 7.3460 7.3460 7.3461 7.3461 7.6263 7.6263 7.6263 7.6263 8.8214 8.8214 8.8214 8.8214 9.9870 9.9870 9.9872 9.9872 10.3316 10.3316 10.3318 10.3318 12.2766 12.2766 12.2767 12.2767 14.4796 14.4796 k = 0.5000 0.5000 0.0193 ( 7792 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7102 -2.7102 -2.7102 -2.7102 -1.5400 -1.5400 -1.5400 -1.5400 3.4567 3.4567 3.4569 3.4569 4.9050 4.9050 4.9053 4.9053 6.1645 6.1645 6.1648 6.1648 6.6702 6.6702 6.6702 6.6702 6.9266 6.9266 6.9268 6.9268 7.3344 7.3344 7.3345 7.3345 7.6309 7.6309 7.6310 7.6310 8.8178 8.8178 8.8178 8.8178 9.9928 9.9928 9.9930 9.9930 10.3327 10.3327 10.3328 10.3328 12.2714 12.2714 12.2715 12.2715 14.4887 14.4887 k = 0.5000 0.5000 0.0385 ( 7800 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7314 -35.7314 -35.6314 -35.6314 -35.6308 -35.6308 -2.7070 -2.7070 -2.7070 -2.7070 -1.5398 -1.5398 -1.5397 -1.5397 3.4579 3.4579 3.4580 3.4580 4.8978 4.8978 4.8980 4.8980 6.1650 6.1650 6.1653 6.1653 6.6684 6.6684 6.6684 6.6684 6.9391 6.9391 6.9392 6.9392 7.3023 7.3023 7.3024 7.3024 7.6426 7.6426 7.6426 7.6426 8.8071 8.8071 8.8072 8.8072 10.0093 10.0093 10.0094 10.0094 10.3362 10.3362 10.3364 10.3364 12.2563 12.2563 12.2564 12.2564 14.5139 14.5139 k = 0.5000 0.5000 0.0578 ( 7800 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7315 -35.7315 -35.6314 -35.6314 -35.6308 -35.6308 -2.7017 -2.7017 -2.7017 -2.7017 -1.5393 -1.5393 -1.5393 -1.5393 3.4598 3.4598 3.4600 3.4600 4.8861 4.8861 4.8863 4.8863 6.1656 6.1656 6.1659 6.1659 6.6649 6.6649 6.6649 6.6649 6.9597 6.9597 6.9598 6.9598 7.2549 7.2549 7.2550 7.2550 7.6572 7.6572 7.6572 7.6572 8.7905 8.7905 8.7905 8.7905 10.0337 10.0337 10.0338 10.0338 10.3435 10.3435 10.3437 10.3437 12.2321 12.2321 12.2322 12.2322 14.5379 14.5379 k = 0.5000 0.5000 0.0770 ( 7792 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7321 -35.7321 -35.7315 -35.7315 -35.6314 -35.6314 -35.6308 -35.6308 -2.6943 -2.6943 -2.6943 -2.6943 -1.5387 -1.5387 -1.5387 -1.5387 3.4625 3.4625 3.4626 3.4626 4.8702 4.8702 4.8705 4.8705 6.1665 6.1665 6.1668 6.1668 6.6591 6.6591 6.6591 6.6591 6.9875 6.9875 6.9875 6.9875 7.1975 7.1975 7.1976 7.1976 7.6715 7.6715 7.6716 7.6716 8.7689 8.7689 8.7689 8.7689 10.0616 10.0616 10.0617 10.0617 10.3568 10.3568 10.3570 10.3570 12.2005 12.2005 12.2006 12.2006 14.5476 14.5477 k = 0.5000 0.5000 0.0963 ( 7792 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7322 -35.7322 -35.7315 -35.7315 -35.6314 -35.6314 -35.6308 -35.6308 -2.6849 -2.6849 -2.6849 -2.6849 -1.5380 -1.5380 -1.5379 -1.5379 3.4657 3.4657 3.4659 3.4659 4.8507 4.8507 4.8509 4.8509 6.1673 6.1673 6.1676 6.1676 6.6501 6.6501 6.6502 6.6502 7.0186 7.0186 7.0187 7.0187 7.1373 7.1373 7.1373 7.1373 7.6838 7.6838 7.6839 7.6839 8.7436 8.7436 8.7436 8.7436 10.0877 10.0877 10.0878 10.0878 10.3791 10.3791 10.3792 10.3792 12.1631 12.1631 12.1632 12.1632 14.5552 14.5552 k = 0.5000 0.5000 0.1155 ( 7796 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1733 -49.1733 -35.7322 -35.7322 -35.7316 -35.7316 -35.6315 -35.6315 -35.6308 -35.6308 -2.6734 -2.6734 -2.6734 -2.6734 -1.5370 -1.5370 -1.5370 -1.5370 3.4696 3.4696 3.4697 3.4697 4.8281 4.8281 4.8283 4.8283 6.1679 6.1679 6.1682 6.1682 6.6369 6.6369 6.6370 6.6370 7.0246 7.0246 7.0249 7.0249 7.1053 7.1053 7.1054 7.1054 7.6934 7.6934 7.6935 7.6935 8.7157 8.7157 8.7157 8.7157 10.1071 10.1071 10.1072 10.1072 10.4126 10.4126 10.4128 10.4128 12.1217 12.1217 12.1218 12.1218 14.5617 14.5618 k = 0.5000 0.5000 0.1348 ( 7808 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7323 -35.7323 -35.7316 -35.7316 -35.6315 -35.6315 -35.6308 -35.6308 -2.6600 -2.6600 -2.6600 -2.6600 -1.5359 -1.5359 -1.5359 -1.5359 3.4738 3.4738 3.4739 3.4739 4.8029 4.8029 4.8031 4.8031 6.1678 6.1678 6.1681 6.1681 6.6179 6.6179 6.6179 6.6179 6.9716 6.9716 6.9718 6.9718 7.1389 7.1389 7.1390 7.1390 7.7003 7.7003 7.7004 7.7004 8.6861 8.6861 8.6861 8.6861 10.1177 10.1177 10.1178 10.1178 10.4576 10.4576 10.4578 10.4578 12.0779 12.0779 12.0780 12.0780 14.5662 14.5662 k = 0.5000 0.5000 0.1540 ( 7800 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7323 -35.7323 -35.7317 -35.7317 -35.6315 -35.6315 -35.6308 -35.6308 -2.6446 -2.6446 -2.6446 -2.6446 -1.5347 -1.5347 -1.5347 -1.5347 3.4784 3.4784 3.4785 3.4785 4.7757 4.7757 4.7759 4.7759 6.1663 6.1663 6.1665 6.1665 6.5906 6.5906 6.5907 6.5907 6.9084 6.9084 6.9086 6.9086 7.1926 7.1926 7.1927 7.1927 7.7045 7.7045 7.7046 7.7046 8.6553 8.6553 8.6553 8.6553 10.1197 10.1197 10.1198 10.1198 10.5117 10.5117 10.5118 10.5118 12.0332 12.0332 12.0333 12.0333 14.5671 14.5671 k = 0.5000 0.5000 0.1733 ( 7824 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1734 -49.1734 -35.7324 -35.7324 -35.7318 -35.7318 -35.6315 -35.6315 -35.6309 -35.6309 -2.6274 -2.6274 -2.6273 -2.6273 -1.5334 -1.5334 -1.5333 -1.5333 3.4830 3.4830 3.4831 3.4831 4.7472 4.7472 4.7473 4.7473 6.1621 6.1621 6.1624 6.1624 6.5531 6.5531 6.5532 6.5532 6.8515 6.8515 6.8517 6.8517 7.2536 7.2536 7.2536 7.2536 7.7065 7.7065 7.7066 7.7066 8.6240 8.6240 8.6240 8.6240 10.1148 10.1148 10.1149 10.1149 10.5714 10.5714 10.5715 10.5715 11.9886 11.9886 11.9887 11.9887 14.5627 14.5627 k = 0.5000 0.5000 0.1925 ( 7800 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1740 -49.1740 -49.1734 -49.1734 -35.7325 -35.7325 -35.7319 -35.7319 -35.6315 -35.6315 -35.6309 -35.6309 -2.6083 -2.6083 -2.6083 -2.6083 -1.5319 -1.5319 -1.5319 -1.5319 3.4877 3.4877 3.4878 3.4878 4.7177 4.7177 4.7179 4.7179 6.1535 6.1535 6.1538 6.1538 6.5054 6.5054 6.5055 6.5055 6.8058 6.8058 6.8060 6.8060 7.3189 7.3189 7.3190 7.3190 7.7069 7.7069 7.7070 7.7070 8.5925 8.5925 8.5926 8.5926 10.1047 10.1047 10.1049 10.1049 10.6337 10.6337 10.6339 10.6339 11.9452 11.9452 11.9454 11.9454 14.5515 14.5515 k = 0.5000 0.5000 0.2118 ( 7824 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1734 -49.1734 -35.7326 -35.7326 -35.7320 -35.7320 -35.6315 -35.6315 -35.6309 -35.6309 -2.5876 -2.5876 -2.5875 -2.5875 -1.5303 -1.5303 -1.5303 -1.5303 3.4921 3.4921 3.4922 3.4922 4.6877 4.6877 4.6879 4.6879 6.1371 6.1371 6.1373 6.1373 6.4519 6.4519 6.4521 6.4521 6.7715 6.7715 6.7716 6.7716 7.3867 7.3867 7.3868 7.3868 7.7068 7.7068 7.7069 7.7069 8.5614 8.5614 8.5614 8.5614 10.0906 10.0906 10.0907 10.0907 10.6962 10.6962 10.6963 10.6963 11.9037 11.9037 11.9038 11.9038 14.5320 14.5320 k = 0.5000 0.5000 0.2310 ( 7836 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1735 -49.1735 -35.7327 -35.7327 -35.7321 -35.7321 -35.6316 -35.6316 -35.6309 -35.6309 -2.5652 -2.5652 -2.5652 -2.5652 -1.5286 -1.5286 -1.5286 -1.5286 3.4960 3.4960 3.4961 3.4961 4.6577 4.6577 4.6579 4.6579 6.1083 6.1083 6.1085 6.1085 6.4009 6.4009 6.4011 6.4011 6.7462 6.7462 6.7463 6.7463 7.4541 7.4541 7.4542 7.4542 7.7079 7.7079 7.7080 7.7080 8.5311 8.5311 8.5311 8.5311 10.0733 10.0733 10.0735 10.0735 10.7570 10.7570 10.7572 10.7572 11.8645 11.8645 11.8646 11.8646 14.5032 14.5032 k = 0.5000 0.5000 0.2503 ( 7836 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1742 -49.1742 -49.1735 -49.1735 -35.7328 -35.7328 -35.7322 -35.7322 -35.6316 -35.6316 -35.6309 -35.6309 -2.5413 -2.5413 -2.5413 -2.5413 -1.5269 -1.5269 -1.5268 -1.5268 3.4992 3.4992 3.4993 3.4993 4.6280 4.6280 4.6281 4.6281 6.0632 6.0632 6.0635 6.0635 6.3600 6.3600 6.3601 6.3601 6.7272 6.7272 6.7274 6.7274 7.5162 7.5162 7.5163 7.5163 7.7145 7.7145 7.7146 7.7146 8.5023 8.5023 8.5024 8.5024 10.0535 10.0535 10.0537 10.0537 10.8148 10.8148 10.8150 10.8150 11.8280 11.8280 11.8281 11.8281 14.4649 14.4649 k = 0.5000 0.5000 0.2695 ( 7816 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1735 -49.1735 -35.7329 -35.7329 -35.7322 -35.7322 -35.6316 -35.6316 -35.6309 -35.6309 -2.5160 -2.5160 -2.5159 -2.5159 -1.5250 -1.5250 -1.5250 -1.5250 3.5014 3.5014 3.5015 3.5015 4.5989 4.5989 4.5990 4.5990 6.0023 6.0023 6.0025 6.0025 6.3316 6.3316 6.3317 6.3317 6.7128 6.7128 6.7130 6.7130 7.5637 7.5637 7.5638 7.5638 7.7350 7.7350 7.7350 7.7350 8.4761 8.4761 8.4762 8.4762 10.0317 10.0317 10.0318 10.0318 10.8687 10.8687 10.8688 10.8688 11.7943 11.7943 11.7944 11.7944 14.4176 14.4176 k = 0.5000 0.5000 0.2888 ( 7824 PWs) bands (ev): -82.3030 -82.3030 -82.3023 -82.3023 -49.1741 -49.1741 -49.1735 -49.1735 -35.7330 -35.7330 -35.7323 -35.7323 -35.6316 -35.6316 -35.6310 -35.6310 -2.4893 -2.4893 -2.4893 -2.4893 -1.5231 -1.5231 -1.5231 -1.5231 3.5022 3.5022 3.5023 3.5023 4.5707 4.5707 4.5708 4.5708 5.9302 5.9302 5.9304 5.9304 6.3128 6.3128 6.3129 6.3129 6.7018 6.7018 6.7020 6.7020 7.5879 7.5879 7.5881 7.5881 7.7763 7.7763 7.7763 7.7763 8.4537 8.4537 8.4538 8.4538 10.0080 10.0080 10.0082 10.0082 10.9177 10.9177 10.9178 10.9178 11.7634 11.7634 11.7636 11.7636 14.3623 14.3623 k = 0.5000 0.5000 0.3080 ( 7804 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1734 -49.1734 -35.7331 -35.7331 -35.7324 -35.7324 -35.6316 -35.6316 -35.6310 -35.6310 -2.4615 -2.4615 -2.4615 -2.4615 -1.5212 -1.5212 -1.5212 -1.5212 3.5014 3.5014 3.5015 3.5015 4.5435 4.5435 4.5436 4.5436 5.8523 5.8523 5.8525 5.8525 6.2996 6.2996 6.2997 6.2997 6.6938 6.6938 6.6939 6.6939 7.5929 7.5929 7.5931 7.5931 7.8324 7.8324 7.8324 7.8324 8.4373 8.4373 8.4374 8.4374 9.9830 9.9830 9.9831 9.9831 10.9616 10.9616 10.9617 10.9617 11.7353 11.7353 11.7355 11.7355 14.3005 14.3006 k = 0.5000 0.5000 0.3273 ( 7804 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1735 -49.1735 -35.7332 -35.7332 -35.7325 -35.7325 -35.6316 -35.6316 -35.6310 -35.6310 -2.4327 -2.4327 -2.4327 -2.4327 -1.5193 -1.5193 -1.5192 -1.5192 3.4987 3.4987 3.4988 3.4988 4.5176 4.5176 4.5177 4.5177 5.7728 5.7728 5.7729 5.7729 6.2889 6.2889 6.2890 6.2890 6.6884 6.6884 6.6885 6.6885 7.5876 7.5876 7.5878 7.5878 7.8913 7.8913 7.8913 7.8913 8.4299 8.4299 8.4300 8.4300 9.9568 9.9568 9.9569 9.9569 10.9999 10.9999 11.0000 11.0000 11.7097 11.7097 11.7099 11.7099 14.2341 14.2341 k = 0.5000 0.5000 0.3465 ( 7784 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1734 -49.1734 -35.7333 -35.7333 -35.7326 -35.7326 -35.6316 -35.6316 -35.6310 -35.6310 -2.4030 -2.4030 -2.4030 -2.4030 -1.5173 -1.5173 -1.5173 -1.5173 3.4938 3.4938 3.4939 3.4939 4.4931 4.4931 4.4932 4.4932 5.6943 5.6943 5.6944 5.6944 6.2788 6.2788 6.2789 6.2789 6.6856 6.6856 6.6857 6.6857 7.5772 7.5772 7.5774 7.5774 7.9439 7.9439 7.9439 7.9439 8.4355 8.4355 8.4357 8.4357 9.9296 9.9296 9.9297 9.9297 11.0326 11.0326 11.0327 11.0327 11.6863 11.6863 11.6865 11.6865 14.1645 14.1646 k = 0.5000 0.5000 0.3658 ( 7800 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1741 -49.1741 -49.1735 -49.1735 -35.7334 -35.7334 -35.7328 -35.7328 -35.6316 -35.6316 -35.6310 -35.6310 -2.3727 -2.3727 -2.3727 -2.3727 -1.5153 -1.5153 -1.5153 -1.5153 3.4863 3.4863 3.4864 3.4864 4.4701 4.4701 4.4701 4.4701 5.6186 5.6186 5.6188 5.6188 6.2680 6.2680 6.2681 6.2681 6.6852 6.6852 6.6854 6.6854 7.5637 7.5637 7.5639 7.5639 7.9837 7.9837 7.9837 7.9837 8.4584 8.4584 8.4585 8.4585 9.9017 9.9017 9.9018 9.9018 11.0596 11.0596 11.0597 11.0597 11.6647 11.6647 11.6648 11.6648 14.0936 14.0937 k = 0.5000 0.5000 0.3850 ( 7800 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7335 -35.7335 -35.7329 -35.7329 -35.6317 -35.6317 -35.6310 -35.6310 -2.3418 -2.3418 -2.3418 -2.3418 -1.5134 -1.5134 -1.5134 -1.5134 3.4761 3.4761 3.4762 3.4762 4.4486 4.4486 4.4487 4.4487 5.5472 5.5472 5.5474 5.5474 6.2559 6.2559 6.2560 6.2560 6.6874 6.6874 6.6875 6.6875 7.5484 7.5484 7.5487 7.5487 8.0077 8.0077 8.0078 8.0078 8.5005 8.5005 8.5006 8.5006 9.8734 9.8734 9.8735 9.8735 11.0811 11.0811 11.0813 11.0813 11.6445 11.6445 11.6446 11.6446 14.0227 14.0228 k = 0.5000 0.5000 0.4043 ( 7792 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7336 -35.7336 -35.7330 -35.7330 -35.6317 -35.6317 -35.6310 -35.6310 -2.3106 -2.3106 -2.3106 -2.3106 -1.5115 -1.5115 -1.5114 -1.5114 3.4631 3.4631 3.4631 3.4631 4.4288 4.4288 4.4289 4.4289 5.4808 5.4808 5.4810 5.4810 6.2423 6.2423 6.2424 6.2424 6.6917 6.6917 6.6919 6.6919 7.5320 7.5320 7.5323 7.5323 8.0171 8.0171 8.0172 8.0172 8.5598 8.5598 8.5599 8.5599 9.8449 9.8449 9.8450 9.8450 11.0974 11.0974 11.0976 11.0976 11.6251 11.6251 11.6252 11.6252 13.9531 13.9531 k = 0.5000 0.5000 0.4235 ( 7792 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7337 -35.7337 -35.7331 -35.7331 -35.6317 -35.6317 -35.6311 -35.6311 -2.2793 -2.2793 -2.2793 -2.2793 -1.5096 -1.5096 -1.5096 -1.5096 3.4471 3.4471 3.4471 3.4471 4.4107 4.4107 4.4107 4.4107 5.4200 5.4200 5.4202 5.4202 6.2271 6.2271 6.2272 6.2272 6.6981 6.6981 6.6983 6.6983 7.5149 7.5149 7.5151 7.5151 8.0157 8.0157 8.0158 8.0158 8.6321 8.6321 8.6322 8.6322 9.8165 9.8165 9.8166 9.8166 11.1088 11.1088 11.1089 11.1089 11.6061 11.6061 11.6062 11.6062 13.8857 13.8857 k = 0.5000 0.5000 0.4428 ( 7816 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7338 -35.7338 -35.7332 -35.7332 -35.6317 -35.6317 -35.6311 -35.6311 -2.2481 -2.2481 -2.2481 -2.2481 -1.5078 -1.5078 -1.5077 -1.5077 3.4282 3.4282 3.4282 3.4282 4.3942 4.3942 4.3942 4.3942 5.3653 5.3653 5.3655 5.3655 6.2103 6.2103 6.2104 6.2104 6.7063 6.7063 6.7065 6.7065 7.4974 7.4974 7.4977 7.4977 8.0072 8.0072 8.0074 8.0074 8.7129 8.7129 8.7129 8.7129 9.7884 9.7884 9.7885 9.7885 11.1156 11.1156 11.1158 11.1158 11.5869 11.5869 11.5871 11.5871 13.8213 13.8213 k = 0.5000 0.5000 0.4620 ( 7808 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7339 -35.7339 -35.7333 -35.7333 -35.6317 -35.6317 -35.6311 -35.6311 -2.2172 -2.2172 -2.2172 -2.2172 -1.5060 -1.5060 -1.5060 -1.5060 3.4066 3.4066 3.4067 3.4067 4.3794 4.3794 4.3794 4.3794 5.3168 5.3168 5.3170 5.3170 6.1924 6.1924 6.1925 6.1925 6.7158 6.7158 6.7161 6.7161 7.4800 7.4800 7.4802 7.4802 7.9948 7.9948 7.9950 7.9950 8.7988 8.7988 8.7989 8.7989 9.7610 9.7610 9.7611 9.7611 11.1184 11.1184 11.1186 11.1186 11.5671 11.5671 11.5673 11.5673 13.7606 13.7606 k = 0.5000 0.5000 0.4813 ( 7816 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7341 -35.7341 -35.7334 -35.7334 -35.6318 -35.6318 -35.6311 -35.6311 -2.1869 -2.1869 -2.1869 -2.1869 -1.5043 -1.5043 -1.5043 -1.5043 3.3827 3.3827 3.3828 3.3828 4.3661 4.3661 4.3661 4.3661 5.2744 5.2744 5.2746 5.2746 6.1735 6.1735 6.1736 6.1736 6.7265 6.7265 6.7267 6.7267 7.4627 7.4627 7.4630 7.4630 7.9802 7.9802 7.9804 7.9804 8.8874 8.8874 8.8874 8.8874 9.7347 9.7347 9.7348 9.7348 11.1176 11.1176 11.1178 11.1178 11.5463 11.5463 11.5465 11.5465 13.7039 13.7040 k = 0.5000 0.5000 0.5005 ( 7808 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7341 -35.7341 -35.7335 -35.7335 -35.6318 -35.6318 -35.6311 -35.6311 -2.1574 -2.1574 -2.1574 -2.1574 -1.5027 -1.5027 -1.5027 -1.5027 3.3569 3.3569 3.3570 3.3570 4.3544 4.3544 4.3544 4.3544 5.2380 5.2380 5.2382 5.2382 6.1540 6.1540 6.1541 6.1541 6.7379 6.7379 6.7381 6.7381 7.4460 7.4460 7.4463 7.4463 7.9648 7.9648 7.9650 7.9650 8.9767 8.9767 8.9767 8.9767 9.7099 9.7099 9.7100 9.7100 11.1137 11.1137 11.1139 11.1139 11.5242 11.5242 11.5243 11.5243 13.6516 13.6516 k = 0.5000 0.5000 0.5198 ( 7808 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7342 -35.7342 -35.7336 -35.7336 -35.6318 -35.6318 -35.6311 -35.6311 -2.1290 -2.1290 -2.1290 -2.1290 -1.5012 -1.5012 -1.5012 -1.5012 3.3297 3.3297 3.3298 3.3298 4.3441 4.3441 4.3442 4.3442 5.2072 5.2072 5.2074 5.2074 6.1343 6.1343 6.1345 6.1345 6.7497 6.7497 6.7500 6.7500 7.4300 7.4300 7.4303 7.4303 7.9492 7.9492 7.9494 7.9494 9.0650 9.0650 9.0650 9.0650 9.6871 9.6871 9.6872 9.6872 11.1073 11.1073 11.1074 11.1074 11.5006 11.5006 11.5007 11.5007 13.6038 13.6039 k = 0.5000 0.5000 0.5390 ( 7816 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7343 -35.7343 -35.7337 -35.7337 -35.6318 -35.6318 -35.6312 -35.6312 -2.1020 -2.1020 -2.1020 -2.1020 -1.4998 -1.4998 -1.4998 -1.4998 3.3018 3.3018 3.3019 3.3019 4.3353 4.3353 4.3353 4.3353 5.1816 5.1816 5.1818 5.1818 6.1148 6.1148 6.1150 6.1150 6.7616 6.7616 6.7619 6.7619 7.4148 7.4148 7.4151 7.4151 7.9340 7.9340 7.9343 7.9343 9.1506 9.1506 9.1506 9.1506 9.6672 9.6672 9.6673 9.6673 11.0987 11.0987 11.0989 11.0989 11.4754 11.4754 11.4755 11.4755 13.5607 13.5607 k = 0.5000 0.5000 0.5583 ( 7792 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7344 -35.7344 -35.7337 -35.7337 -35.6318 -35.6318 -35.6312 -35.6312 -2.0765 -2.0765 -2.0765 -2.0765 -1.4985 -1.4985 -1.4985 -1.4985 3.2739 3.2739 3.2740 3.2740 4.3277 4.3277 4.3278 4.3278 5.1606 5.1606 5.1609 5.1609 6.0959 6.0959 6.0960 6.0960 6.7733 6.7733 6.7736 6.7736 7.4008 7.4008 7.4011 7.4011 7.9197 7.9197 7.9199 7.9199 9.2316 9.2316 9.2316 9.2316 9.6513 9.6513 9.6514 9.6514 11.0886 11.0886 11.0888 11.0888 11.4489 11.4489 11.4490 11.4490 13.5221 13.5222 k = 0.5000 0.5000 0.5775 ( 7792 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7344 -35.7344 -35.7338 -35.7338 -35.6318 -35.6318 -35.6312 -35.6312 -2.0529 -2.0529 -2.0529 -2.0529 -1.4973 -1.4973 -1.4973 -1.4973 3.2466 3.2466 3.2466 3.2466 4.3213 4.3213 4.3214 4.3214 5.1438 5.1438 5.1440 5.1440 6.0778 6.0778 6.0780 6.0780 6.7846 6.7846 6.7849 6.7849 7.3878 7.3878 7.3882 7.3882 7.9063 7.9063 7.9065 7.9065 9.3049 9.3049 9.3050 9.3050 9.6414 9.6414 9.6415 9.6415 11.0774 11.0774 11.0776 11.0776 11.4213 11.4213 11.4214 11.4214 13.4881 13.4882 k = 0.5000 0.5000 0.5968 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7345 -35.7345 -35.7339 -35.7339 -35.6318 -35.6318 -35.6311 -35.6311 -2.0314 -2.0314 -2.0313 -2.0313 -1.4962 -1.4962 -1.4962 -1.4962 3.2206 3.2206 3.2207 3.2207 4.3160 4.3160 4.3161 4.3161 5.1305 5.1305 5.1308 5.1308 6.0610 6.0610 6.0612 6.0612 6.7952 6.7952 6.7955 6.7955 7.3762 7.3762 7.3766 7.3766 7.8941 7.8941 7.8943 7.8943 9.3667 9.3667 9.3667 9.3667 9.6407 9.6407 9.6408 9.6408 11.0655 11.0655 11.0657 11.0657 11.3932 11.3932 11.3934 11.3934 13.4586 13.4586 k = 0.5000 0.5000 0.6160 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7346 -35.7346 -35.7339 -35.7339 -35.6318 -35.6318 -35.6312 -35.6312 -2.0121 -2.0121 -2.0121 -2.0121 -1.4953 -1.4953 -1.4953 -1.4953 3.1966 3.1966 3.1967 3.1967 4.3117 4.3117 4.3117 4.3117 5.1202 5.1202 5.1205 5.1205 6.0457 6.0457 6.0459 6.0459 6.8048 6.8048 6.8051 6.8051 7.3660 7.3660 7.3663 7.3663 7.8832 7.8832 7.8835 7.8835 9.4120 9.4120 9.4121 9.4121 9.6527 9.6527 9.6528 9.6528 11.0534 11.0534 11.0536 11.0536 11.3656 11.3656 11.3657 11.3657 13.4334 13.4335 k = 0.5000 0.5000 0.6353 ( 7784 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1743 -49.1743 -49.1736 -49.1736 -35.7346 -35.7346 -35.7340 -35.7340 -35.6318 -35.6318 -35.6312 -35.6312 -1.9955 -1.9955 -1.9955 -1.9955 -1.4945 -1.4945 -1.4945 -1.4945 3.1752 3.1752 3.1753 3.1753 4.3082 4.3082 4.3083 4.3083 5.1125 5.1125 5.1127 5.1127 6.0322 6.0322 6.0324 6.0324 6.8133 6.8133 6.8136 6.8136 7.3572 7.3572 7.3575 7.3575 7.8738 7.8738 7.8741 7.8741 9.4389 9.4389 9.4390 9.4390 9.6783 9.6783 9.6783 9.6783 11.0416 11.0416 11.0417 11.0417 11.3392 11.3392 11.3394 11.3394 13.4124 13.4124 k = 0.5000 0.5000 0.6545 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7346 -35.7346 -35.7340 -35.7340 -35.6318 -35.6318 -35.6312 -35.6312 -1.9816 -1.9816 -1.9815 -1.9815 -1.4938 -1.4938 -1.4938 -1.4938 3.1570 3.1570 3.1571 3.1571 4.3055 4.3055 4.3056 4.3056 5.1067 5.1067 5.1070 5.1070 6.0208 6.0208 6.0210 6.0210 6.8205 6.8205 6.8209 6.8209 7.3499 7.3499 7.3503 7.3503 7.8661 7.8661 7.8663 7.8663 9.4515 9.4515 9.4516 9.4516 9.7119 9.7119 9.7119 9.7119 11.0305 11.0305 11.0307 11.0307 11.3155 11.3155 11.3156 11.3156 13.3954 13.3954 k = 0.5000 0.5000 0.6738 ( 7760 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7340 -35.7340 -35.6318 -35.6318 -35.6312 -35.6312 -1.9706 -1.9706 -1.9705 -1.9705 -1.4933 -1.4933 -1.4933 -1.4933 3.1423 3.1423 3.1424 3.1424 4.3035 4.3035 4.3036 4.3036 5.1027 5.1027 5.1030 5.1030 6.0117 6.0117 6.0119 6.0119 6.8263 6.8263 6.8266 6.8266 7.3443 7.3443 7.3446 7.3446 7.8599 7.8599 7.8602 7.8602 9.4559 9.4559 9.4560 9.4560 9.7458 9.7458 9.7458 9.7458 11.0208 11.0208 11.0210 11.0210 11.2954 11.2954 11.2956 11.2956 13.3824 13.3824 k = 0.5000 0.5000 0.6930 ( 7764 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1736 -49.1736 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9626 -1.9626 -1.9626 -1.9626 -1.4930 -1.4930 -1.4929 -1.4929 3.1316 3.1316 3.1317 3.1317 4.3021 4.3021 4.3022 4.3022 5.1000 5.1000 5.1003 5.1003 6.0051 6.0051 6.0053 6.0053 6.8305 6.8305 6.8308 6.8308 7.3402 7.3402 7.3405 7.3405 7.8555 7.8555 7.8558 7.8558 9.4567 9.4567 9.4568 9.4568 9.7738 9.7738 9.7738 9.7738 11.0131 11.0131 11.0133 11.0133 11.2802 11.2802 11.2803 11.2803 13.3731 13.3731 k = 0.5000 0.5000 0.7123 ( 7748 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9578 -1.9578 -1.9578 -1.9578 -1.4927 -1.4927 -1.4927 -1.4927 3.1250 3.1250 3.1251 3.1251 4.3013 4.3013 4.3014 4.3014 5.0985 5.0985 5.0988 5.0988 6.0011 6.0011 6.0013 6.0013 6.8330 6.8330 6.8334 6.8334 7.3377 7.3377 7.3381 7.3381 7.8528 7.8528 7.8531 7.8531 9.4564 9.4564 9.4565 9.4565 9.7920 9.7920 9.7920 9.7920 11.0082 11.0082 11.0084 11.0084 11.2707 11.2707 11.2709 11.2709 13.3676 13.3676 k = 0.5000 0.5000 0.7315 ( 7744 PWs) bands (ev): -82.3029 -82.3029 -82.3022 -82.3022 -49.1742 -49.1742 -49.1735 -49.1735 -35.7347 -35.7347 -35.7341 -35.7341 -35.6318 -35.6318 -35.6312 -35.6312 -1.9562 -1.9562 -1.9561 -1.9561 -1.4927 -1.4927 -1.4926 -1.4926 3.1228 3.1228 3.1229 3.1229 4.3011 4.3011 4.3012 4.3012 5.0980 5.0980 5.0983 5.0983 5.9997 5.9997 5.9999 5.9999 6.8339 6.8339 6.8342 6.8342 7.3369 7.3369 7.3373 7.3373 7.8519 7.8519 7.8522 7.8522 9.4562 9.4562 9.4563 9.4563 9.7983 9.7983 9.7983 9.7983 11.0064 11.0064 11.0066 11.0066 11.2675 11.2675 11.2676 11.2676 13.3658 13.3658 Writing output data file Te2Ir.save init_run : 0.34s CPU 0.53s WALL ( 1 calls) electrons : 293.86s CPU 297.26s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.10s WALL ( 1 calls) Called by electrons: c_bands : 293.85s CPU 297.25s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.11s CPU 0.15s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.12s WALL ( 301 calls) cegterg : 268.02s CPU 270.56s WALL ( 368 calls) Called by sum_band: Called by *egterg: h_psi : 175.76s CPU 177.53s WALL ( 6380 calls) s_psi : 10.75s CPU 10.91s WALL ( 6380 calls) g_psi : 0.36s CPU 0.46s WALL ( 5711 calls) cdiaghg : 65.80s CPU 66.50s WALL ( 6012 calls) cegterg:over : 13.16s CPU 13.11s WALL ( 5711 calls) cegterg:upda : 11.55s CPU 11.60s WALL ( 5711 calls) cegterg:last : 6.32s CPU 6.31s WALL ( 970 calls) cdiaghg:chol : 3.96s CPU 3.86s WALL ( 6012 calls) cdiaghg:inve : 2.72s CPU 2.74s WALL ( 6012 calls) cdiaghg:para : 4.58s CPU 4.59s WALL ( 12024 calls) Called by h_psi: h_psi:vloc : 152.87s CPU 154.33s WALL ( 6380 calls) h_psi:vnl : 22.42s CPU 22.68s WALL ( 6380 calls) add_vuspsi : 12.18s CPU 12.22s WALL ( 6380 calls) General routines calbec : 10.20s CPU 10.44s WALL ( 6380 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 143.93s CPU 145.07s WALL ( 856208 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.30s CPU 0.43s WALL ( 602 calls) Parallel routines fft_scatter : 47.74s CPU 48.03s WALL ( 856231 calls) PWSCF : 5m21.67s CPU 5m39.68s WALL This run was terminated on: 20: 7:59 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=