Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18:53:25 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: ./TiGeSb.save/ file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 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 34 34 9 2034 2034 307 Max 35 35 10 2045 2045 322 Sum 1237 1237 357 73373 73373 11403 bravais-lattice index = 14 lattice parameter (alat) = 6.9961 a.u. unit-cell volume = 759.7227 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 42.00 number of Kohn-Sham states= 50 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.996144 celldm(2)= 1.000000 celldm(3)= 2.218600 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 2.218600 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.450735 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Sb read from file: /users/gautes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Ti read from file: /users/gautes/Pseudo/Ti.rel-pbe-oncvpsp.UPF MD5 check sum: 490816c065db03488b8f3a1c39de4952 Pseudo is Norm-conserving, Zval = 12.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 600 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 atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) Sb 5.00 121.76000 Sb( 1.00) Ti 12.00 47.86700 Ti( 1.00) 16 Sym. Ops., with inversion, found (12 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) f =( 0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) f =( -0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 9 inversion cryst. s( 9) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 9) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(10) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(10) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) f =( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) f =( -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) double point group D_4h(4/mmm) there are 14 classes and 4 irreducible representations the character table: E -E 2C4 -2C4 C2 2C2' 2C2'' i -i 2S4 -2S4 s_h -C2 -2C2' -2C2' -s_h G_6+ 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 2.00 -2.00 1.41 -1.41 0.00 G_7+ 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 2.00 -2.00 -1.41 1.41 0.00 G_6- 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 -2.00 2.00 -1.41 1.41 0.00 G_7- 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 -2.00 2.00 1.41 -1.41 0.00 2s_v 2s_d -2s_v -2s_d G_6+ 0.00 0.00 G_7+ 0.00 0.00 G_6- 0.00 0.00 G_7- 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C4 7 8 90 deg rotation - cart. axis [0,0,-1] -2C4 -7 -8 90 deg rotation - cart. axis [0,0,-1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 2C2'-2C2' 3 -3 4 -4 180 deg rotation - cart. axis [0,1,0] 2C2''-2C2' 5 -5 6 -6 180 deg rotation - cart. axis [1,1,0] i 9 inversion -i -9 inversion E 2S4 15 16 inv. 90 deg rotation - cart. axis [0,0,-1] -2S4 -15 -16 inv. 90 deg rotation - cart. axis [0,0,-1] E s_h -s_h 10 -10 inv. 180 deg rotation - cart. axis [0,0,1] 2s_v-2s_v 11 -11 12 -12 inv. 180 deg rotation - cart. axis [0,1,0] 2s_d-2s_d 13 -13 14 -14 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 363 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 2) = ( 0.0000000 0.0116279 -0.0000000), wk = 0.0027548 k( 3) = ( 0.0000000 0.0232558 -0.0000000), wk = 0.0027548 k( 4) = ( 0.0000000 0.0348837 -0.0000000), wk = 0.0027548 k( 5) = ( 0.0000000 0.0465116 -0.0000000), wk = 0.0027548 k( 6) = ( 0.0000000 0.0581395 -0.0000000), wk = 0.0027548 k( 7) = ( 0.0000000 0.0697674 -0.0000000), wk = 0.0027548 k( 8) = ( 0.0000000 0.0813954 -0.0000000), wk = 0.0027548 k( 9) = ( 0.0000000 0.0930233 -0.0000000), wk = 0.0027548 k( 10) = ( 0.0000000 0.1046512 -0.0000000), wk = 0.0027548 k( 11) = ( 0.0000000 0.1162791 -0.0000000), wk = 0.0027548 k( 12) = ( 0.0000000 0.1279070 -0.0000000), wk = 0.0027548 k( 13) = ( 0.0000000 0.1395349 -0.0000000), wk = 0.0027548 k( 14) = ( 0.0000000 0.1511628 -0.0000000), wk = 0.0027548 k( 15) = ( 0.0000000 0.1627907 -0.0000000), wk = 0.0027548 k( 16) = ( 0.0000000 0.1744186 -0.0000000), wk = 0.0027548 k( 17) = ( 0.0000000 0.1860465 -0.0000000), wk = 0.0027548 k( 18) = ( 0.0000000 0.1976744 -0.0000000), wk = 0.0027548 k( 19) = ( 0.0000000 0.2093023 -0.0000000), wk = 0.0027548 k( 20) = ( 0.0000000 0.2209302 -0.0000000), wk = 0.0027548 k( 21) = ( 0.0000000 0.2325581 -0.0000000), wk = 0.0027548 k( 22) = ( 0.0000000 0.2441860 -0.0000000), wk = 0.0027548 k( 23) = ( 0.0000000 0.2558140 -0.0000000), wk = 0.0027548 k( 24) = ( 0.0000000 0.2674419 -0.0000000), wk = 0.0027548 k( 25) = ( 0.0000000 0.2790698 -0.0000000), wk = 0.0027548 k( 26) = ( 0.0000000 0.2906977 -0.0000000), wk = 0.0027548 k( 27) = ( 0.0000000 0.3023256 -0.0000000), wk = 0.0027548 k( 28) = ( 0.0000000 0.3139535 -0.0000000), wk = 0.0027548 k( 29) = ( 0.0000000 0.3255814 -0.0000000), wk = 0.0027548 k( 30) = ( 0.0000000 0.3372093 -0.0000000), wk = 0.0027548 k( 31) = ( 0.0000000 0.3488372 -0.0000000), wk = 0.0027548 k( 32) = ( 0.0000000 0.3604651 -0.0000000), wk = 0.0027548 k( 33) = ( 0.0000000 0.3720930 -0.0000000), wk = 0.0027548 k( 34) = ( 0.0000000 0.3837209 -0.0000000), wk = 0.0027548 k( 35) = ( 0.0000000 0.3953488 -0.0000000), wk = 0.0027548 k( 36) = ( 0.0000000 0.4069767 -0.0000000), wk = 0.0027548 k( 37) = ( 0.0000000 0.4186047 -0.0000000), wk = 0.0027548 k( 38) = ( 0.0000000 0.4302326 -0.0000000), wk = 0.0027548 k( 39) = ( 0.0000000 0.4418605 -0.0000000), wk = 0.0027548 k( 40) = ( 0.0000000 0.4534884 -0.0000000), wk = 0.0027548 k( 41) = ( 0.0000000 0.4651163 -0.0000000), wk = 0.0027548 k( 42) = ( 0.0000000 0.4767442 -0.0000000), wk = 0.0027548 k( 43) = ( 0.0000000 0.4883721 -0.0000000), wk = 0.0027548 k( 44) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 45) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 46) = ( 0.0116279 0.5000000 -0.0000000), wk = 0.0027548 k( 47) = ( 0.0232558 0.5000000 -0.0000000), wk = 0.0027548 k( 48) = ( 0.0348837 0.5000000 -0.0000000), wk = 0.0027548 k( 49) = ( 0.0465116 0.5000000 -0.0000000), wk = 0.0027548 k( 50) = ( 0.0581395 0.5000000 -0.0000000), wk = 0.0027548 k( 51) = ( 0.0697674 0.5000000 -0.0000000), wk = 0.0027548 k( 52) = ( 0.0813954 0.5000000 -0.0000000), wk = 0.0027548 k( 53) = ( 0.0930233 0.5000000 -0.0000000), wk = 0.0027548 k( 54) = ( 0.1046512 0.5000000 -0.0000000), wk = 0.0027548 k( 55) = ( 0.1162791 0.5000000 -0.0000000), wk = 0.0027548 k( 56) = ( 0.1279070 0.5000000 -0.0000000), wk = 0.0027548 k( 57) = ( 0.1395349 0.5000000 -0.0000000), wk = 0.0027548 k( 58) = ( 0.1511628 0.5000000 -0.0000000), wk = 0.0027548 k( 59) = ( 0.1627907 0.5000000 -0.0000000), wk = 0.0027548 k( 60) = ( 0.1744186 0.5000000 -0.0000000), wk = 0.0027548 k( 61) = ( 0.1860465 0.5000000 -0.0000000), wk = 0.0027548 k( 62) = ( 0.1976744 0.5000000 -0.0000000), wk = 0.0027548 k( 63) = ( 0.2093023 0.5000000 -0.0000000), wk = 0.0027548 k( 64) = ( 0.2209302 0.5000000 -0.0000000), wk = 0.0027548 k( 65) = ( 0.2325581 0.5000000 -0.0000000), wk = 0.0027548 k( 66) = ( 0.2441860 0.5000000 -0.0000000), wk = 0.0027548 k( 67) = ( 0.2558140 0.5000000 -0.0000000), wk = 0.0027548 k( 68) = ( 0.2674419 0.5000000 -0.0000000), wk = 0.0027548 k( 69) = ( 0.2790698 0.5000000 -0.0000000), wk = 0.0027548 k( 70) = ( 0.2906977 0.5000000 -0.0000000), wk = 0.0027548 k( 71) = ( 0.3023256 0.5000000 -0.0000000), wk = 0.0027548 k( 72) = ( 0.3139535 0.5000000 -0.0000000), wk = 0.0027548 k( 73) = ( 0.3255814 0.5000000 -0.0000000), wk = 0.0027548 k( 74) = ( 0.3372093 0.5000000 -0.0000000), wk = 0.0027548 k( 75) = ( 0.3488372 0.5000000 -0.0000000), wk = 0.0027548 k( 76) = ( 0.3604651 0.5000000 -0.0000000), wk = 0.0027548 k( 77) = ( 0.3720930 0.5000000 -0.0000000), wk = 0.0027548 k( 78) = ( 0.3837209 0.5000000 -0.0000000), wk = 0.0027548 k( 79) = ( 0.3953488 0.5000000 -0.0000000), wk = 0.0027548 k( 80) = ( 0.4069767 0.5000000 -0.0000000), wk = 0.0027548 k( 81) = ( 0.4186047 0.5000000 -0.0000000), wk = 0.0027548 k( 82) = ( 0.4302326 0.5000000 -0.0000000), wk = 0.0027548 k( 83) = ( 0.4418605 0.5000000 -0.0000000), wk = 0.0027548 k( 84) = ( 0.4534884 0.5000000 -0.0000000), wk = 0.0027548 k( 85) = ( 0.4651163 0.5000000 -0.0000000), wk = 0.0027548 k( 86) = ( 0.4767442 0.5000000 -0.0000000), wk = 0.0027548 k( 87) = ( 0.4883721 0.5000000 -0.0000000), wk = 0.0027548 k( 88) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 89) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 90) = ( 0.4918033 0.4918033 -0.0000000), wk = 0.0027548 k( 91) = ( 0.4836066 0.4836066 -0.0000000), wk = 0.0027548 k( 92) = ( 0.4754098 0.4754098 -0.0000000), wk = 0.0027548 k( 93) = ( 0.4672131 0.4672131 -0.0000000), wk = 0.0027548 k( 94) = ( 0.4590164 0.4590164 -0.0000000), wk = 0.0027548 k( 95) = ( 0.4508197 0.4508197 -0.0000000), wk = 0.0027548 k( 96) = ( 0.4426230 0.4426229 -0.0000000), wk = 0.0027548 k( 97) = ( 0.4344262 0.4344262 -0.0000000), wk = 0.0027548 k( 98) = ( 0.4262295 0.4262295 -0.0000000), wk = 0.0027548 k( 99) = ( 0.4180328 0.4180328 -0.0000000), wk = 0.0027548 k( 100) = ( 0.4098361 0.4098361 -0.0000000), wk = 0.0027548 k( 101) = ( 0.4016393 0.4016393 -0.0000000), wk = 0.0027548 k( 102) = ( 0.3934426 0.3934426 -0.0000000), wk = 0.0027548 k( 103) = ( 0.3852459 0.3852459 -0.0000000), wk = 0.0027548 k( 104) = ( 0.3770492 0.3770492 -0.0000000), wk = 0.0027548 k( 105) = ( 0.3688525 0.3688525 -0.0000000), wk = 0.0027548 k( 106) = ( 0.3606557 0.3606557 -0.0000000), wk = 0.0027548 k( 107) = ( 0.3524590 0.3524590 -0.0000000), wk = 0.0027548 k( 108) = ( 0.3442623 0.3442623 -0.0000000), wk = 0.0027548 k( 109) = ( 0.3360656 0.3360656 -0.0000000), wk = 0.0027548 k( 110) = ( 0.3278688 0.3278688 -0.0000000), wk = 0.0027548 k( 111) = ( 0.3196721 0.3196721 -0.0000000), wk = 0.0027548 k( 112) = ( 0.3114754 0.3114754 -0.0000000), wk = 0.0027548 k( 113) = ( 0.3032787 0.3032787 -0.0000000), wk = 0.0027548 k( 114) = ( 0.2950820 0.2950820 -0.0000000), wk = 0.0027548 k( 115) = ( 0.2868852 0.2868852 -0.0000000), wk = 0.0027548 k( 116) = ( 0.2786885 0.2786885 -0.0000000), wk = 0.0027548 k( 117) = ( 0.2704918 0.2704918 -0.0000000), wk = 0.0027548 k( 118) = ( 0.2622951 0.2622951 -0.0000000), wk = 0.0027548 k( 119) = ( 0.2540984 0.2540984 -0.0000000), wk = 0.0027548 k( 120) = ( 0.2459016 0.2459016 -0.0000000), wk = 0.0027548 k( 121) = ( 0.2377049 0.2377049 -0.0000000), wk = 0.0027548 k( 122) = ( 0.2295082 0.2295082 -0.0000000), wk = 0.0027548 k( 123) = ( 0.2213115 0.2213115 -0.0000000), wk = 0.0027548 k( 124) = ( 0.2131147 0.2131147 -0.0000000), wk = 0.0027548 k( 125) = ( 0.2049180 0.2049180 -0.0000000), wk = 0.0027548 k( 126) = ( 0.1967213 0.1967213 -0.0000000), wk = 0.0027548 k( 127) = ( 0.1885246 0.1885246 -0.0000000), wk = 0.0027548 k( 128) = ( 0.1803279 0.1803279 -0.0000000), wk = 0.0027548 k( 129) = ( 0.1721312 0.1721311 -0.0000000), wk = 0.0027548 k( 130) = ( 0.1639344 0.1639344 -0.0000000), wk = 0.0027548 k( 131) = ( 0.1557377 0.1557377 -0.0000000), wk = 0.0027548 k( 132) = ( 0.1475410 0.1475410 -0.0000000), wk = 0.0027548 k( 133) = ( 0.1393443 0.1393443 -0.0000000), wk = 0.0027548 k( 134) = ( 0.1311475 0.1311475 -0.0000000), wk = 0.0027548 k( 135) = ( 0.1229508 0.1229508 -0.0000000), wk = 0.0027548 k( 136) = ( 0.1147541 0.1147541 -0.0000000), wk = 0.0027548 k( 137) = ( 0.1065574 0.1065574 -0.0000000), wk = 0.0027548 k( 138) = ( 0.0983607 0.0983607 -0.0000000), wk = 0.0027548 k( 139) = ( 0.0901639 0.0901639 -0.0000000), wk = 0.0027548 k( 140) = ( 0.0819672 0.0819672 -0.0000000), wk = 0.0027548 k( 141) = ( 0.0737705 0.0737705 -0.0000000), wk = 0.0027548 k( 142) = ( 0.0655738 0.0655738 -0.0000000), wk = 0.0027548 k( 143) = ( 0.0573770 0.0573770 -0.0000000), wk = 0.0027548 k( 144) = ( 0.0491803 0.0491803 -0.0000000), wk = 0.0027548 k( 145) = ( 0.0409836 0.0409836 -0.0000000), wk = 0.0027548 k( 146) = ( 0.0327869 0.0327869 -0.0000000), wk = 0.0027548 k( 147) = ( 0.0245902 0.0245902 -0.0000000), wk = 0.0027548 k( 148) = ( 0.0163934 0.0163934 -0.0000000), wk = 0.0027548 k( 149) = ( 0.0081967 0.0081967 -0.0000000), wk = 0.0027548 k( 150) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 151) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 152) = ( 0.0000000 0.0000000 0.0112684), wk = 0.0027548 k( 153) = ( 0.0000000 0.0000000 0.0225367), wk = 0.0027548 k( 154) = ( 0.0000000 0.0000000 0.0338051), wk = 0.0027548 k( 155) = ( 0.0000000 0.0000000 0.0450735), wk = 0.0027548 k( 156) = ( 0.0000000 0.0000000 0.0563418), wk = 0.0027548 k( 157) = ( 0.0000000 0.0000000 0.0676102), wk = 0.0027548 k( 158) = ( 0.0000000 0.0000000 0.0788786), wk = 0.0027548 k( 159) = ( 0.0000000 0.0000000 0.0901469), wk = 0.0027548 k( 160) = ( 0.0000000 0.0000000 0.1014153), wk = 0.0027548 k( 161) = ( 0.0000000 0.0000000 0.1126837), wk = 0.0027548 k( 162) = ( 0.0000000 0.0000000 0.1239521), wk = 0.0027548 k( 163) = ( 0.0000000 0.0000000 0.1352204), wk = 0.0027548 k( 164) = ( 0.0000000 0.0000000 0.1464888), wk = 0.0027548 k( 165) = ( 0.0000000 0.0000000 0.1577572), wk = 0.0027548 k( 166) = ( 0.0000000 0.0000000 0.1690255), wk = 0.0027548 k( 167) = ( 0.0000000 0.0000000 0.1802939), wk = 0.0027548 k( 168) = ( 0.0000000 0.0000000 0.1915623), wk = 0.0027548 k( 169) = ( 0.0000000 0.0000000 0.2028306), wk = 0.0027548 k( 170) = ( 0.0000000 0.0000000 0.2140990), wk = 0.0027548 k( 171) = ( 0.0000000 0.0000000 0.2253674), wk = 0.0027548 k( 172) = ( 0.0000000 0.0000000 0.2253674), wk = 0.0027548 k( 173) = ( 0.0000000 0.0116279 0.2253674), wk = 0.0027548 k( 174) = ( 0.0000000 0.0232558 0.2253674), wk = 0.0027548 k( 175) = ( 0.0000000 0.0348837 0.2253674), wk = 0.0027548 k( 176) = ( 0.0000000 0.0465116 0.2253674), wk = 0.0027548 k( 177) = ( 0.0000000 0.0581395 0.2253674), wk = 0.0027548 k( 178) = ( 0.0000000 0.0697674 0.2253674), wk = 0.0027548 k( 179) = ( 0.0000000 0.0813954 0.2253674), wk = 0.0027548 k( 180) = ( 0.0000000 0.0930233 0.2253674), wk = 0.0027548 k( 181) = ( 0.0000000 0.1046512 0.2253674), wk = 0.0027548 k( 182) = ( 0.0000000 0.1162791 0.2253674), wk = 0.0027548 k( 183) = ( 0.0000000 0.1279070 0.2253674), wk = 0.0027548 k( 184) = ( 0.0000000 0.1395349 0.2253674), wk = 0.0027548 k( 185) = ( 0.0000000 0.1511628 0.2253674), wk = 0.0027548 k( 186) = ( 0.0000000 0.1627907 0.2253674), wk = 0.0027548 k( 187) = ( 0.0000000 0.1744186 0.2253674), wk = 0.0027548 k( 188) = ( 0.0000000 0.1860465 0.2253674), wk = 0.0027548 k( 189) = ( 0.0000000 0.1976744 0.2253674), wk = 0.0027548 k( 190) = ( 0.0000000 0.2093023 0.2253674), wk = 0.0027548 k( 191) = ( 0.0000000 0.2209302 0.2253674), wk = 0.0027548 k( 192) = ( 0.0000000 0.2325581 0.2253674), wk = 0.0027548 k( 193) = ( 0.0000000 0.2441860 0.2253674), wk = 0.0027548 k( 194) = ( 0.0000000 0.2558140 0.2253674), wk = 0.0027548 k( 195) = ( 0.0000000 0.2674419 0.2253674), wk = 0.0027548 k( 196) = ( 0.0000000 0.2790698 0.2253674), wk = 0.0027548 k( 197) = ( 0.0000000 0.2906977 0.2253674), wk = 0.0027548 k( 198) = ( 0.0000000 0.3023256 0.2253674), wk = 0.0027548 k( 199) = ( 0.0000000 0.3139535 0.2253674), wk = 0.0027548 k( 200) = ( 0.0000000 0.3255814 0.2253674), wk = 0.0027548 k( 201) = ( 0.0000000 0.3372093 0.2253674), wk = 0.0027548 k( 202) = ( 0.0000000 0.3488372 0.2253674), wk = 0.0027548 k( 203) = ( 0.0000000 0.3604651 0.2253674), wk = 0.0027548 k( 204) = ( 0.0000000 0.3720930 0.2253674), wk = 0.0027548 k( 205) = ( 0.0000000 0.3837209 0.2253674), wk = 0.0027548 k( 206) = ( 0.0000000 0.3953488 0.2253674), wk = 0.0027548 k( 207) = ( 0.0000000 0.4069767 0.2253674), wk = 0.0027548 k( 208) = ( 0.0000000 0.4186047 0.2253674), wk = 0.0027548 k( 209) = ( 0.0000000 0.4302326 0.2253674), wk = 0.0027548 k( 210) = ( 0.0000000 0.4418605 0.2253674), wk = 0.0027548 k( 211) = ( 0.0000000 0.4534884 0.2253674), wk = 0.0027548 k( 212) = ( 0.0000000 0.4651163 0.2253674), wk = 0.0027548 k( 213) = ( 0.0000000 0.4767442 0.2253674), wk = 0.0027548 k( 214) = ( 0.0000000 0.4883721 0.2253674), wk = 0.0027548 k( 215) = ( 0.0000000 0.5000000 0.2253674), wk = 0.0027548 k( 216) = ( 0.0000000 0.5000000 0.2253674), wk = 0.0027548 k( 217) = ( 0.0116279 0.5000000 0.2253674), wk = 0.0027548 k( 218) = ( 0.0232558 0.5000000 0.2253674), wk = 0.0027548 k( 219) = ( 0.0348837 0.5000000 0.2253674), wk = 0.0027548 k( 220) = ( 0.0465116 0.5000000 0.2253674), wk = 0.0027548 k( 221) = ( 0.0581395 0.5000000 0.2253674), wk = 0.0027548 k( 222) = ( 0.0697674 0.5000000 0.2253674), wk = 0.0027548 k( 223) = ( 0.0813954 0.5000000 0.2253674), wk = 0.0027548 k( 224) = ( 0.0930233 0.5000000 0.2253674), wk = 0.0027548 k( 225) = ( 0.1046512 0.5000000 0.2253674), wk = 0.0027548 k( 226) = ( 0.1162791 0.5000000 0.2253674), wk = 0.0027548 k( 227) = ( 0.1279070 0.5000000 0.2253674), wk = 0.0027548 k( 228) = ( 0.1395349 0.5000000 0.2253674), wk = 0.0027548 k( 229) = ( 0.1511628 0.5000000 0.2253674), wk = 0.0027548 k( 230) = ( 0.1627907 0.5000000 0.2253674), wk = 0.0027548 k( 231) = ( 0.1744186 0.5000000 0.2253674), wk = 0.0027548 k( 232) = ( 0.1860465 0.5000000 0.2253674), wk = 0.0027548 k( 233) = ( 0.1976744 0.5000000 0.2253674), wk = 0.0027548 k( 234) = ( 0.2093023 0.5000000 0.2253674), wk = 0.0027548 k( 235) = ( 0.2209302 0.5000000 0.2253674), wk = 0.0027548 k( 236) = ( 0.2325581 0.5000000 0.2253674), wk = 0.0027548 k( 237) = ( 0.2441860 0.5000000 0.2253674), wk = 0.0027548 k( 238) = ( 0.2558140 0.5000000 0.2253674), wk = 0.0027548 k( 239) = ( 0.2674419 0.5000000 0.2253674), wk = 0.0027548 k( 240) = ( 0.2790698 0.5000000 0.2253674), wk = 0.0027548 k( 241) = ( 0.2906977 0.5000000 0.2253674), wk = 0.0027548 k( 242) = ( 0.3023256 0.5000000 0.2253674), wk = 0.0027548 k( 243) = ( 0.3139535 0.5000000 0.2253674), wk = 0.0027548 k( 244) = ( 0.3255814 0.5000000 0.2253674), wk = 0.0027548 k( 245) = ( 0.3372093 0.5000000 0.2253674), wk = 0.0027548 k( 246) = ( 0.3488372 0.5000000 0.2253674), wk = 0.0027548 k( 247) = ( 0.3604651 0.5000000 0.2253674), wk = 0.0027548 k( 248) = ( 0.3720930 0.5000000 0.2253674), wk = 0.0027548 k( 249) = ( 0.3837209 0.5000000 0.2253674), wk = 0.0027548 k( 250) = ( 0.3953488 0.5000000 0.2253674), wk = 0.0027548 k( 251) = ( 0.4069767 0.5000000 0.2253674), wk = 0.0027548 k( 252) = ( 0.4186047 0.5000000 0.2253674), wk = 0.0027548 k( 253) = ( 0.4302326 0.5000000 0.2253674), wk = 0.0027548 k( 254) = ( 0.4418605 0.5000000 0.2253674), wk = 0.0027548 k( 255) = ( 0.4534884 0.5000000 0.2253674), wk = 0.0027548 k( 256) = ( 0.4651163 0.5000000 0.2253674), wk = 0.0027548 k( 257) = ( 0.4767442 0.5000000 0.2253674), wk = 0.0027548 k( 258) = ( 0.4883721 0.5000000 0.2253674), wk = 0.0027548 k( 259) = ( 0.5000000 0.5000000 0.2253674), wk = 0.0027548 k( 260) = ( 0.5000000 0.5000000 0.2253674), wk = 0.0027548 k( 261) = ( 0.4918033 0.4918033 0.2253674), wk = 0.0027548 k( 262) = ( 0.4836066 0.4836066 0.2253674), wk = 0.0027548 k( 263) = ( 0.4754098 0.4754098 0.2253674), wk = 0.0027548 k( 264) = ( 0.4672131 0.4672131 0.2253674), wk = 0.0027548 k( 265) = ( 0.4590164 0.4590164 0.2253674), wk = 0.0027548 k( 266) = ( 0.4508197 0.4508197 0.2253674), wk = 0.0027548 k( 267) = ( 0.4426230 0.4426229 0.2253674), wk = 0.0027548 k( 268) = ( 0.4344262 0.4344262 0.2253674), wk = 0.0027548 k( 269) = ( 0.4262295 0.4262295 0.2253674), wk = 0.0027548 k( 270) = ( 0.4180328 0.4180328 0.2253674), wk = 0.0027548 k( 271) = ( 0.4098361 0.4098361 0.2253674), wk = 0.0027548 k( 272) = ( 0.4016393 0.4016393 0.2253674), wk = 0.0027548 k( 273) = ( 0.3934426 0.3934426 0.2253674), wk = 0.0027548 k( 274) = ( 0.3852459 0.3852459 0.2253674), wk = 0.0027548 k( 275) = ( 0.3770492 0.3770492 0.2253674), wk = 0.0027548 k( 276) = ( 0.3688525 0.3688525 0.2253674), wk = 0.0027548 k( 277) = ( 0.3606557 0.3606557 0.2253674), wk = 0.0027548 k( 278) = ( 0.3524590 0.3524590 0.2253674), wk = 0.0027548 k( 279) = ( 0.3442623 0.3442623 0.2253674), wk = 0.0027548 k( 280) = ( 0.3360656 0.3360656 0.2253674), wk = 0.0027548 k( 281) = ( 0.3278688 0.3278688 0.2253674), wk = 0.0027548 k( 282) = ( 0.3196721 0.3196721 0.2253674), wk = 0.0027548 k( 283) = ( 0.3114754 0.3114754 0.2253674), wk = 0.0027548 k( 284) = ( 0.3032787 0.3032787 0.2253674), wk = 0.0027548 k( 285) = ( 0.2950820 0.2950820 0.2253674), wk = 0.0027548 k( 286) = ( 0.2868852 0.2868852 0.2253674), wk = 0.0027548 k( 287) = ( 0.2786885 0.2786885 0.2253674), wk = 0.0027548 k( 288) = ( 0.2704918 0.2704918 0.2253674), wk = 0.0027548 k( 289) = ( 0.2622951 0.2622951 0.2253674), wk = 0.0027548 k( 290) = ( 0.2540984 0.2540984 0.2253674), wk = 0.0027548 k( 291) = ( 0.2459016 0.2459016 0.2253674), wk = 0.0027548 k( 292) = ( 0.2377049 0.2377049 0.2253674), wk = 0.0027548 k( 293) = ( 0.2295082 0.2295082 0.2253674), wk = 0.0027548 k( 294) = ( 0.2213115 0.2213115 0.2253674), wk = 0.0027548 k( 295) = ( 0.2131147 0.2131147 0.2253674), wk = 0.0027548 k( 296) = ( 0.2049180 0.2049180 0.2253674), wk = 0.0027548 k( 297) = ( 0.1967213 0.1967213 0.2253674), wk = 0.0027548 k( 298) = ( 0.1885246 0.1885246 0.2253674), wk = 0.0027548 k( 299) = ( 0.1803279 0.1803279 0.2253674), wk = 0.0027548 k( 300) = ( 0.1721312 0.1721311 0.2253674), wk = 0.0027548 k( 301) = ( 0.1639344 0.1639344 0.2253674), wk = 0.0027548 k( 302) = ( 0.1557377 0.1557377 0.2253674), wk = 0.0027548 k( 303) = ( 0.1475410 0.1475410 0.2253674), wk = 0.0027548 k( 304) = ( 0.1393443 0.1393443 0.2253674), wk = 0.0027548 k( 305) = ( 0.1311475 0.1311475 0.2253674), wk = 0.0027548 k( 306) = ( 0.1229508 0.1229508 0.2253674), wk = 0.0027548 k( 307) = ( 0.1147541 0.1147541 0.2253674), wk = 0.0027548 k( 308) = ( 0.1065574 0.1065574 0.2253674), wk = 0.0027548 k( 309) = ( 0.0983607 0.0983607 0.2253674), wk = 0.0027548 k( 310) = ( 0.0901639 0.0901639 0.2253674), wk = 0.0027548 k( 311) = ( 0.0819672 0.0819672 0.2253674), wk = 0.0027548 k( 312) = ( 0.0737705 0.0737705 0.2253674), wk = 0.0027548 k( 313) = ( 0.0655738 0.0655738 0.2253674), wk = 0.0027548 k( 314) = ( 0.0573770 0.0573770 0.2253674), wk = 0.0027548 k( 315) = ( 0.0491803 0.0491803 0.2253674), wk = 0.0027548 k( 316) = ( 0.0409836 0.0409836 0.2253674), wk = 0.0027548 k( 317) = ( 0.0327869 0.0327869 0.2253674), wk = 0.0027548 k( 318) = ( 0.0245902 0.0245902 0.2253674), wk = 0.0027548 k( 319) = ( 0.0163934 0.0163934 0.2253674), wk = 0.0027548 k( 320) = ( 0.0081967 0.0081967 0.2253674), wk = 0.0027548 k( 321) = ( 0.0000000 0.0000000 0.2253674), wk = 0.0027548 k( 322) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 323) = ( 0.0000000 0.5000000 0.0112684), wk = 0.0027548 k( 324) = ( 0.0000000 0.5000000 0.0225367), wk = 0.0027548 k( 325) = ( 0.0000000 0.5000000 0.0338051), wk = 0.0027548 k( 326) = ( 0.0000000 0.5000000 0.0450735), wk = 0.0027548 k( 327) = ( 0.0000000 0.5000000 0.0563418), wk = 0.0027548 k( 328) = ( 0.0000000 0.5000000 0.0676102), wk = 0.0027548 k( 329) = ( 0.0000000 0.5000000 0.0788786), wk = 0.0027548 k( 330) = ( 0.0000000 0.5000000 0.0901469), wk = 0.0027548 k( 331) = ( 0.0000000 0.5000000 0.1014153), wk = 0.0027548 k( 332) = ( 0.0000000 0.5000000 0.1126837), wk = 0.0027548 k( 333) = ( 0.0000000 0.5000000 0.1239521), wk = 0.0027548 k( 334) = ( 0.0000000 0.5000000 0.1352204), wk = 0.0027548 k( 335) = ( 0.0000000 0.5000000 0.1464888), wk = 0.0027548 k( 336) = ( 0.0000000 0.5000000 0.1577572), wk = 0.0027548 k( 337) = ( 0.0000000 0.5000000 0.1690255), wk = 0.0027548 k( 338) = ( 0.0000000 0.5000000 0.1802939), wk = 0.0027548 k( 339) = ( 0.0000000 0.5000000 0.1915623), wk = 0.0027548 k( 340) = ( 0.0000000 0.5000000 0.2028306), wk = 0.0027548 k( 341) = ( 0.0000000 0.5000000 0.2140990), wk = 0.0027548 k( 342) = ( 0.0000000 0.5000000 0.2253674), wk = 0.0027548 k( 343) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 344) = ( 0.5000000 0.5000000 0.0112684), wk = 0.0027548 k( 345) = ( 0.5000000 0.5000000 0.0225367), wk = 0.0027548 k( 346) = ( 0.5000000 0.5000000 0.0338051), wk = 0.0027548 k( 347) = ( 0.5000000 0.5000000 0.0450735), wk = 0.0027548 k( 348) = ( 0.5000000 0.5000000 0.0563418), wk = 0.0027548 k( 349) = ( 0.5000000 0.5000000 0.0676102), wk = 0.0027548 k( 350) = ( 0.5000000 0.5000000 0.0788786), wk = 0.0027548 k( 351) = ( 0.5000000 0.5000000 0.0901469), wk = 0.0027548 k( 352) = ( 0.5000000 0.5000000 0.1014153), wk = 0.0027548 k( 353) = ( 0.5000000 0.5000000 0.1126837), wk = 0.0027548 k( 354) = ( 0.5000000 0.5000000 0.1239521), wk = 0.0027548 k( 355) = ( 0.5000000 0.5000000 0.1352204), wk = 0.0027548 k( 356) = ( 0.5000000 0.5000000 0.1464888), wk = 0.0027548 k( 357) = ( 0.5000000 0.5000000 0.1577572), wk = 0.0027548 k( 358) = ( 0.5000000 0.5000000 0.1690255), wk = 0.0027548 k( 359) = ( 0.5000000 0.5000000 0.1802939), wk = 0.0027548 k( 360) = ( 0.5000000 0.5000000 0.1915623), wk = 0.0027548 k( 361) = ( 0.5000000 0.5000000 0.2028306), wk = 0.0027548 k( 362) = ( 0.5000000 0.5000000 0.2140990), wk = 0.0027548 k( 363) = ( 0.5000000 0.5000000 0.2253674), wk = 0.0027548 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 2) = ( 0.0000000 0.0116279 -0.0000000), wk = 0.0027548 k( 3) = ( 0.0000000 0.0232558 -0.0000000), wk = 0.0027548 k( 4) = ( 0.0000000 0.0348837 -0.0000000), wk = 0.0027548 k( 5) = ( 0.0000000 0.0465116 -0.0000000), wk = 0.0027548 k( 6) = ( 0.0000000 0.0581395 0.0000000), wk = 0.0027548 k( 7) = ( 0.0000000 0.0697674 -0.0000000), wk = 0.0027548 k( 8) = ( 0.0000000 0.0813954 -0.0000000), wk = 0.0027548 k( 9) = ( 0.0000000 0.0930233 -0.0000000), wk = 0.0027548 k( 10) = ( 0.0000000 0.1046512 -0.0000000), wk = 0.0027548 k( 11) = ( 0.0000000 0.1162791 0.0000000), wk = 0.0027548 k( 12) = ( 0.0000000 0.1279070 0.0000000), wk = 0.0027548 k( 13) = ( 0.0000000 0.1395349 -0.0000000), wk = 0.0027548 k( 14) = ( 0.0000000 0.1511628 -0.0000000), wk = 0.0027548 k( 15) = ( 0.0000000 0.1627907 -0.0000000), wk = 0.0027548 k( 16) = ( 0.0000000 0.1744186 -0.0000000), wk = 0.0027548 k( 17) = ( 0.0000000 0.1860465 -0.0000000), wk = 0.0027548 k( 18) = ( 0.0000000 0.1976744 -0.0000000), wk = 0.0027548 k( 19) = ( 0.0000000 0.2093023 -0.0000000), wk = 0.0027548 k( 20) = ( 0.0000000 0.2209302 -0.0000000), wk = 0.0027548 k( 21) = ( 0.0000000 0.2325581 0.0000000), wk = 0.0027548 k( 22) = ( 0.0000000 0.2441860 -0.0000000), wk = 0.0027548 k( 23) = ( 0.0000000 0.2558140 0.0000000), wk = 0.0027548 k( 24) = ( 0.0000000 0.2674419 -0.0000000), wk = 0.0027548 k( 25) = ( 0.0000000 0.2790698 0.0000000), wk = 0.0027548 k( 26) = ( 0.0000000 0.2906977 0.0000000), wk = 0.0027548 k( 27) = ( 0.0000000 0.3023256 -0.0000000), wk = 0.0027548 k( 28) = ( 0.0000000 0.3139535 -0.0000000), wk = 0.0027548 k( 29) = ( 0.0000000 0.3255814 -0.0000000), wk = 0.0027548 k( 30) = ( 0.0000000 0.3372093 0.0000000), wk = 0.0027548 k( 31) = ( 0.0000000 0.3488372 -0.0000000), wk = 0.0027548 k( 32) = ( 0.0000000 0.3604651 -0.0000000), wk = 0.0027548 k( 33) = ( 0.0000000 0.3720930 -0.0000000), wk = 0.0027548 k( 34) = ( 0.0000000 0.3837209 0.0000000), wk = 0.0027548 k( 35) = ( 0.0000000 0.3953488 -0.0000000), wk = 0.0027548 k( 36) = ( 0.0000000 0.4069767 -0.0000000), wk = 0.0027548 k( 37) = ( 0.0000000 0.4186047 0.0000000), wk = 0.0027548 k( 38) = ( 0.0000000 0.4302326 0.0000000), wk = 0.0027548 k( 39) = ( 0.0000000 0.4418605 -0.0000000), wk = 0.0027548 k( 40) = ( 0.0000000 0.4534884 0.0000000), wk = 0.0027548 k( 41) = ( 0.0000000 0.4651163 0.0000000), wk = 0.0027548 k( 42) = ( 0.0000000 0.4767442 0.0000000), wk = 0.0027548 k( 43) = ( 0.0000000 0.4883721 0.0000000), wk = 0.0027548 k( 44) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 45) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 46) = ( 0.0116279 0.5000000 0.0000000), wk = 0.0027548 k( 47) = ( 0.0232558 0.5000000 0.0000000), wk = 0.0027548 k( 48) = ( 0.0348837 0.5000000 -0.0000000), wk = 0.0027548 k( 49) = ( 0.0465116 0.5000000 0.0000000), wk = 0.0027548 k( 50) = ( 0.0581395 0.5000000 -0.0000000), wk = 0.0027548 k( 51) = ( 0.0697674 0.5000000 -0.0000000), wk = 0.0027548 k( 52) = ( 0.0813954 0.5000000 -0.0000000), wk = 0.0027548 k( 53) = ( 0.0930233 0.5000000 0.0000000), wk = 0.0027548 k( 54) = ( 0.1046512 0.5000000 0.0000000), wk = 0.0027548 k( 55) = ( 0.1162791 0.5000000 0.0000000), wk = 0.0027548 k( 56) = ( 0.1279070 0.5000000 -0.0000000), wk = 0.0027548 k( 57) = ( 0.1395349 0.5000000 0.0000000), wk = 0.0027548 k( 58) = ( 0.1511628 0.5000000 0.0000000), wk = 0.0027548 k( 59) = ( 0.1627907 0.5000000 -0.0000000), wk = 0.0027548 k( 60) = ( 0.1744186 0.5000000 0.0000000), wk = 0.0027548 k( 61) = ( 0.1860465 0.5000000 0.0000000), wk = 0.0027548 k( 62) = ( 0.1976744 0.5000000 0.0000000), wk = 0.0027548 k( 63) = ( 0.2093023 0.5000000 0.0000000), wk = 0.0027548 k( 64) = ( 0.2209302 0.5000000 -0.0000000), wk = 0.0027548 k( 65) = ( 0.2325581 0.5000000 -0.0000000), wk = 0.0027548 k( 66) = ( 0.2441860 0.5000000 0.0000000), wk = 0.0027548 k( 67) = ( 0.2558140 0.5000000 -0.0000000), wk = 0.0027548 k( 68) = ( 0.2674419 0.5000000 -0.0000000), wk = 0.0027548 k( 69) = ( 0.2790698 0.5000000 -0.0000000), wk = 0.0027548 k( 70) = ( 0.2906977 0.5000000 -0.0000000), wk = 0.0027548 k( 71) = ( 0.3023256 0.5000000 -0.0000000), wk = 0.0027548 k( 72) = ( 0.3139535 0.5000000 -0.0000000), wk = 0.0027548 k( 73) = ( 0.3255814 0.5000000 0.0000000), wk = 0.0027548 k( 74) = ( 0.3372093 0.5000000 0.0000000), wk = 0.0027548 k( 75) = ( 0.3488372 0.5000000 0.0000000), wk = 0.0027548 k( 76) = ( 0.3604651 0.5000000 -0.0000000), wk = 0.0027548 k( 77) = ( 0.3720930 0.5000000 -0.0000000), wk = 0.0027548 k( 78) = ( 0.3837209 0.5000000 -0.0000000), wk = 0.0027548 k( 79) = ( 0.3953488 0.5000000 0.0000000), wk = 0.0027548 k( 80) = ( 0.4069767 0.5000000 0.0000000), wk = 0.0027548 k( 81) = ( 0.4186047 0.5000000 0.0000000), wk = 0.0027548 k( 82) = ( 0.4302326 0.5000000 0.0000000), wk = 0.0027548 k( 83) = ( 0.4418605 0.5000000 -0.0000000), wk = 0.0027548 k( 84) = ( 0.4534884 0.5000000 0.0000000), wk = 0.0027548 k( 85) = ( 0.4651163 0.5000000 0.0000000), wk = 0.0027548 k( 86) = ( 0.4767442 0.5000000 -0.0000000), wk = 0.0027548 k( 87) = ( 0.4883721 0.5000000 0.0000000), wk = 0.0027548 k( 88) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 89) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 90) = ( 0.4918033 0.4918033 -0.0000000), wk = 0.0027548 k( 91) = ( 0.4836066 0.4836066 0.0000000), wk = 0.0027548 k( 92) = ( 0.4754098 0.4754098 0.0000000), wk = 0.0027548 k( 93) = ( 0.4672131 0.4672131 -0.0000000), wk = 0.0027548 k( 94) = ( 0.4590164 0.4590164 0.0000000), wk = 0.0027548 k( 95) = ( 0.4508197 0.4508197 0.0000000), wk = 0.0027548 k( 96) = ( 0.4426230 0.4426230 0.0000000), wk = 0.0027548 k( 97) = ( 0.4344262 0.4344262 0.0000000), wk = 0.0027548 k( 98) = ( 0.4262295 0.4262295 -0.0000000), wk = 0.0027548 k( 99) = ( 0.4180328 0.4180328 -0.0000000), wk = 0.0027548 k( 100) = ( 0.4098361 0.4098361 -0.0000000), wk = 0.0027548 k( 101) = ( 0.4016393 0.4016393 -0.0000000), wk = 0.0027548 k( 102) = ( 0.3934426 0.3934426 -0.0000000), wk = 0.0027548 k( 103) = ( 0.3852459 0.3852459 -0.0000000), wk = 0.0027548 k( 104) = ( 0.3770492 0.3770492 -0.0000000), wk = 0.0027548 k( 105) = ( 0.3688525 0.3688525 -0.0000000), wk = 0.0027548 k( 106) = ( 0.3606557 0.3606557 -0.0000000), wk = 0.0027548 k( 107) = ( 0.3524590 0.3524590 -0.0000000), wk = 0.0027548 k( 108) = ( 0.3442623 0.3442623 -0.0000000), wk = 0.0027548 k( 109) = ( 0.3360656 0.3360656 -0.0000000), wk = 0.0027548 k( 110) = ( 0.3278688 0.3278688 -0.0000000), wk = 0.0027548 k( 111) = ( 0.3196721 0.3196721 0.0000000), wk = 0.0027548 k( 112) = ( 0.3114754 0.3114754 0.0000000), wk = 0.0027548 k( 113) = ( 0.3032787 0.3032787 0.0000000), wk = 0.0027548 k( 114) = ( 0.2950820 0.2950820 -0.0000000), wk = 0.0027548 k( 115) = ( 0.2868852 0.2868852 -0.0000000), wk = 0.0027548 k( 116) = ( 0.2786885 0.2786885 0.0000000), wk = 0.0027548 k( 117) = ( 0.2704918 0.2704918 0.0000000), wk = 0.0027548 k( 118) = ( 0.2622951 0.2622951 -0.0000000), wk = 0.0027548 k( 119) = ( 0.2540984 0.2540984 -0.0000000), wk = 0.0027548 k( 120) = ( 0.2459016 0.2459016 -0.0000000), wk = 0.0027548 k( 121) = ( 0.2377049 0.2377049 0.0000000), wk = 0.0027548 k( 122) = ( 0.2295082 0.2295082 -0.0000000), wk = 0.0027548 k( 123) = ( 0.2213115 0.2213115 -0.0000000), wk = 0.0027548 k( 124) = ( 0.2131147 0.2131147 0.0000000), wk = 0.0027548 k( 125) = ( 0.2049180 0.2049180 0.0000000), wk = 0.0027548 k( 126) = ( 0.1967213 0.1967213 -0.0000000), wk = 0.0027548 k( 127) = ( 0.1885246 0.1885246 -0.0000000), wk = 0.0027548 k( 128) = ( 0.1803279 0.1803279 -0.0000000), wk = 0.0027548 k( 129) = ( 0.1721312 0.1721312 -0.0000000), wk = 0.0027548 k( 130) = ( 0.1639344 0.1639344 0.0000000), wk = 0.0027548 k( 131) = ( 0.1557377 0.1557377 -0.0000000), wk = 0.0027548 k( 132) = ( 0.1475410 0.1475410 -0.0000000), wk = 0.0027548 k( 133) = ( 0.1393443 0.1393443 0.0000000), wk = 0.0027548 k( 134) = ( 0.1311475 0.1311475 -0.0000000), wk = 0.0027548 k( 135) = ( 0.1229508 0.1229508 -0.0000000), wk = 0.0027548 k( 136) = ( 0.1147541 0.1147541 -0.0000000), wk = 0.0027548 k( 137) = ( 0.1065574 0.1065574 0.0000000), wk = 0.0027548 k( 138) = ( 0.0983607 0.0983607 -0.0000000), wk = 0.0027548 k( 139) = ( 0.0901639 0.0901639 -0.0000000), wk = 0.0027548 k( 140) = ( 0.0819672 0.0819672 -0.0000000), wk = 0.0027548 k( 141) = ( 0.0737705 0.0737705 -0.0000000), wk = 0.0027548 k( 142) = ( 0.0655738 0.0655738 -0.0000000), wk = 0.0027548 k( 143) = ( 0.0573770 0.0573770 -0.0000000), wk = 0.0027548 k( 144) = ( 0.0491803 0.0491803 -0.0000000), wk = 0.0027548 k( 145) = ( 0.0409836 0.0409836 -0.0000000), wk = 0.0027548 k( 146) = ( 0.0327869 0.0327869 -0.0000000), wk = 0.0027548 k( 147) = ( 0.0245902 0.0245902 0.0000000), wk = 0.0027548 k( 148) = ( 0.0163934 0.0163934 0.0000000), wk = 0.0027548 k( 149) = ( 0.0081967 0.0081967 0.0000000), wk = 0.0027548 k( 150) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 151) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 152) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0027548 k( 153) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0027548 k( 154) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0027548 k( 155) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0027548 k( 156) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0027548 k( 157) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0027548 k( 158) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0027548 k( 159) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0027548 k( 160) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0027548 k( 161) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0027548 k( 162) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0027548 k( 163) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0027548 k( 164) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0027548 k( 165) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0027548 k( 166) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0027548 k( 167) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0027548 k( 168) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0027548 k( 169) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0027548 k( 170) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0027548 k( 171) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027548 k( 172) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027548 k( 173) = ( 0.0000000 0.0116279 0.5000000), wk = 0.0027548 k( 174) = ( 0.0000000 0.0232558 0.5000000), wk = 0.0027548 k( 175) = ( 0.0000000 0.0348837 0.5000000), wk = 0.0027548 k( 176) = ( 0.0000000 0.0465116 0.5000000), wk = 0.0027548 k( 177) = ( 0.0000000 0.0581395 0.5000000), wk = 0.0027548 k( 178) = ( 0.0000000 0.0697674 0.5000000), wk = 0.0027548 k( 179) = ( 0.0000000 0.0813954 0.5000000), wk = 0.0027548 k( 180) = ( 0.0000000 0.0930233 0.5000000), wk = 0.0027548 k( 181) = ( 0.0000000 0.1046512 0.5000000), wk = 0.0027548 k( 182) = ( 0.0000000 0.1162791 0.5000000), wk = 0.0027548 k( 183) = ( 0.0000000 0.1279070 0.5000000), wk = 0.0027548 k( 184) = ( 0.0000000 0.1395349 0.5000000), wk = 0.0027548 k( 185) = ( 0.0000000 0.1511628 0.5000000), wk = 0.0027548 k( 186) = ( 0.0000000 0.1627907 0.5000000), wk = 0.0027548 k( 187) = ( 0.0000000 0.1744186 0.5000000), wk = 0.0027548 k( 188) = ( 0.0000000 0.1860465 0.5000000), wk = 0.0027548 k( 189) = ( 0.0000000 0.1976744 0.5000000), wk = 0.0027548 k( 190) = ( 0.0000000 0.2093023 0.5000000), wk = 0.0027548 k( 191) = ( 0.0000000 0.2209302 0.5000000), wk = 0.0027548 k( 192) = ( 0.0000000 0.2325581 0.5000000), wk = 0.0027548 k( 193) = ( 0.0000000 0.2441860 0.5000000), wk = 0.0027548 k( 194) = ( 0.0000000 0.2558140 0.5000000), wk = 0.0027548 k( 195) = ( 0.0000000 0.2674419 0.5000000), wk = 0.0027548 k( 196) = ( 0.0000000 0.2790698 0.5000000), wk = 0.0027548 k( 197) = ( 0.0000000 0.2906977 0.5000000), wk = 0.0027548 k( 198) = ( 0.0000000 0.3023256 0.5000000), wk = 0.0027548 k( 199) = ( 0.0000000 0.3139535 0.5000000), wk = 0.0027548 k( 200) = ( 0.0000000 0.3255814 0.5000000), wk = 0.0027548 k( 201) = ( 0.0000000 0.3372093 0.5000000), wk = 0.0027548 k( 202) = ( 0.0000000 0.3488372 0.5000000), wk = 0.0027548 k( 203) = ( 0.0000000 0.3604651 0.5000000), wk = 0.0027548 k( 204) = ( 0.0000000 0.3720930 0.5000000), wk = 0.0027548 k( 205) = ( 0.0000000 0.3837209 0.5000000), wk = 0.0027548 k( 206) = ( 0.0000000 0.3953488 0.5000000), wk = 0.0027548 k( 207) = ( 0.0000000 0.4069767 0.5000000), wk = 0.0027548 k( 208) = ( 0.0000000 0.4186047 0.5000000), wk = 0.0027548 k( 209) = ( 0.0000000 0.4302326 0.5000000), wk = 0.0027548 k( 210) = ( 0.0000000 0.4418605 0.5000000), wk = 0.0027548 k( 211) = ( 0.0000000 0.4534884 0.5000000), wk = 0.0027548 k( 212) = ( 0.0000000 0.4651163 0.5000000), wk = 0.0027548 k( 213) = ( 0.0000000 0.4767442 0.5000000), wk = 0.0027548 k( 214) = ( 0.0000000 0.4883721 0.5000000), wk = 0.0027548 k( 215) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027548 k( 216) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027548 k( 217) = ( 0.0116279 0.5000000 0.5000000), wk = 0.0027548 k( 218) = ( 0.0232558 0.5000000 0.5000000), wk = 0.0027548 k( 219) = ( 0.0348837 0.5000000 0.5000000), wk = 0.0027548 k( 220) = ( 0.0465116 0.5000000 0.5000000), wk = 0.0027548 k( 221) = ( 0.0581395 0.5000000 0.5000000), wk = 0.0027548 k( 222) = ( 0.0697674 0.5000000 0.5000000), wk = 0.0027548 k( 223) = ( 0.0813954 0.5000000 0.5000000), wk = 0.0027548 k( 224) = ( 0.0930233 0.5000000 0.5000000), wk = 0.0027548 k( 225) = ( 0.1046512 0.5000000 0.5000000), wk = 0.0027548 k( 226) = ( 0.1162791 0.5000000 0.5000000), wk = 0.0027548 k( 227) = ( 0.1279070 0.5000000 0.5000000), wk = 0.0027548 k( 228) = ( 0.1395349 0.5000000 0.5000000), wk = 0.0027548 k( 229) = ( 0.1511628 0.5000000 0.5000000), wk = 0.0027548 k( 230) = ( 0.1627907 0.5000000 0.5000000), wk = 0.0027548 k( 231) = ( 0.1744186 0.5000000 0.5000000), wk = 0.0027548 k( 232) = ( 0.1860465 0.5000000 0.5000000), wk = 0.0027548 k( 233) = ( 0.1976744 0.5000000 0.5000000), wk = 0.0027548 k( 234) = ( 0.2093023 0.5000000 0.5000000), wk = 0.0027548 k( 235) = ( 0.2209302 0.5000000 0.5000000), wk = 0.0027548 k( 236) = ( 0.2325581 0.5000000 0.5000000), wk = 0.0027548 k( 237) = ( 0.2441860 0.5000000 0.5000000), wk = 0.0027548 k( 238) = ( 0.2558140 0.5000000 0.5000000), wk = 0.0027548 k( 239) = ( 0.2674419 0.5000000 0.5000000), wk = 0.0027548 k( 240) = ( 0.2790698 0.5000000 0.5000000), wk = 0.0027548 k( 241) = ( 0.2906977 0.5000000 0.5000000), wk = 0.0027548 k( 242) = ( 0.3023256 0.5000000 0.5000000), wk = 0.0027548 k( 243) = ( 0.3139535 0.5000000 0.5000000), wk = 0.0027548 k( 244) = ( 0.3255814 0.5000000 0.5000000), wk = 0.0027548 k( 245) = ( 0.3372093 0.5000000 0.5000000), wk = 0.0027548 k( 246) = ( 0.3488372 0.5000000 0.5000000), wk = 0.0027548 k( 247) = ( 0.3604651 0.5000000 0.5000000), wk = 0.0027548 k( 248) = ( 0.3720930 0.5000000 0.5000000), wk = 0.0027548 k( 249) = ( 0.3837209 0.5000000 0.5000000), wk = 0.0027548 k( 250) = ( 0.3953488 0.5000000 0.5000000), wk = 0.0027548 k( 251) = ( 0.4069767 0.5000000 0.5000000), wk = 0.0027548 k( 252) = ( 0.4186047 0.5000000 0.5000000), wk = 0.0027548 k( 253) = ( 0.4302326 0.5000000 0.5000000), wk = 0.0027548 k( 254) = ( 0.4418605 0.5000000 0.5000000), wk = 0.0027548 k( 255) = ( 0.4534884 0.5000000 0.5000000), wk = 0.0027548 k( 256) = ( 0.4651163 0.5000000 0.5000000), wk = 0.0027548 k( 257) = ( 0.4767442 0.5000000 0.5000000), wk = 0.0027548 k( 258) = ( 0.4883721 0.5000000 0.5000000), wk = 0.0027548 k( 259) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027548 k( 260) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027548 k( 261) = ( 0.4918033 0.4918033 0.5000000), wk = 0.0027548 k( 262) = ( 0.4836066 0.4836066 0.5000000), wk = 0.0027548 k( 263) = ( 0.4754098 0.4754098 0.5000000), wk = 0.0027548 k( 264) = ( 0.4672131 0.4672131 0.5000000), wk = 0.0027548 k( 265) = ( 0.4590164 0.4590164 0.5000000), wk = 0.0027548 k( 266) = ( 0.4508197 0.4508197 0.5000000), wk = 0.0027548 k( 267) = ( 0.4426230 0.4426230 0.5000000), wk = 0.0027548 k( 268) = ( 0.4344262 0.4344262 0.5000000), wk = 0.0027548 k( 269) = ( 0.4262295 0.4262295 0.5000000), wk = 0.0027548 k( 270) = ( 0.4180328 0.4180328 0.5000000), wk = 0.0027548 k( 271) = ( 0.4098361 0.4098361 0.5000000), wk = 0.0027548 k( 272) = ( 0.4016393 0.4016393 0.5000000), wk = 0.0027548 k( 273) = ( 0.3934426 0.3934426 0.5000000), wk = 0.0027548 k( 274) = ( 0.3852459 0.3852459 0.5000000), wk = 0.0027548 k( 275) = ( 0.3770492 0.3770492 0.5000000), wk = 0.0027548 k( 276) = ( 0.3688525 0.3688525 0.5000000), wk = 0.0027548 k( 277) = ( 0.3606557 0.3606557 0.5000000), wk = 0.0027548 k( 278) = ( 0.3524590 0.3524590 0.5000000), wk = 0.0027548 k( 279) = ( 0.3442623 0.3442623 0.5000000), wk = 0.0027548 k( 280) = ( 0.3360656 0.3360656 0.5000000), wk = 0.0027548 k( 281) = ( 0.3278688 0.3278688 0.5000000), wk = 0.0027548 k( 282) = ( 0.3196721 0.3196721 0.5000000), wk = 0.0027548 k( 283) = ( 0.3114754 0.3114754 0.5000000), wk = 0.0027548 k( 284) = ( 0.3032787 0.3032787 0.5000000), wk = 0.0027548 k( 285) = ( 0.2950820 0.2950820 0.5000000), wk = 0.0027548 k( 286) = ( 0.2868852 0.2868852 0.5000000), wk = 0.0027548 k( 287) = ( 0.2786885 0.2786885 0.5000000), wk = 0.0027548 k( 288) = ( 0.2704918 0.2704918 0.5000000), wk = 0.0027548 k( 289) = ( 0.2622951 0.2622951 0.5000000), wk = 0.0027548 k( 290) = ( 0.2540984 0.2540984 0.5000000), wk = 0.0027548 k( 291) = ( 0.2459016 0.2459016 0.5000000), wk = 0.0027548 k( 292) = ( 0.2377049 0.2377049 0.5000000), wk = 0.0027548 k( 293) = ( 0.2295082 0.2295082 0.5000000), wk = 0.0027548 k( 294) = ( 0.2213115 0.2213115 0.5000000), wk = 0.0027548 k( 295) = ( 0.2131147 0.2131147 0.5000000), wk = 0.0027548 k( 296) = ( 0.2049180 0.2049180 0.5000000), wk = 0.0027548 k( 297) = ( 0.1967213 0.1967213 0.5000000), wk = 0.0027548 k( 298) = ( 0.1885246 0.1885246 0.5000000), wk = 0.0027548 k( 299) = ( 0.1803279 0.1803279 0.5000000), wk = 0.0027548 k( 300) = ( 0.1721312 0.1721312 0.5000000), wk = 0.0027548 k( 301) = ( 0.1639344 0.1639344 0.5000000), wk = 0.0027548 k( 302) = ( 0.1557377 0.1557377 0.5000000), wk = 0.0027548 k( 303) = ( 0.1475410 0.1475410 0.5000000), wk = 0.0027548 k( 304) = ( 0.1393443 0.1393443 0.5000000), wk = 0.0027548 k( 305) = ( 0.1311475 0.1311475 0.5000000), wk = 0.0027548 k( 306) = ( 0.1229508 0.1229508 0.5000000), wk = 0.0027548 k( 307) = ( 0.1147541 0.1147541 0.5000000), wk = 0.0027548 k( 308) = ( 0.1065574 0.1065574 0.5000000), wk = 0.0027548 k( 309) = ( 0.0983607 0.0983607 0.5000000), wk = 0.0027548 k( 310) = ( 0.0901639 0.0901639 0.5000000), wk = 0.0027548 k( 311) = ( 0.0819672 0.0819672 0.5000000), wk = 0.0027548 k( 312) = ( 0.0737705 0.0737705 0.5000000), wk = 0.0027548 k( 313) = ( 0.0655738 0.0655738 0.5000000), wk = 0.0027548 k( 314) = ( 0.0573770 0.0573770 0.5000000), wk = 0.0027548 k( 315) = ( 0.0491803 0.0491803 0.5000000), wk = 0.0027548 k( 316) = ( 0.0409836 0.0409836 0.5000000), wk = 0.0027548 k( 317) = ( 0.0327869 0.0327869 0.5000000), wk = 0.0027548 k( 318) = ( 0.0245902 0.0245902 0.5000000), wk = 0.0027548 k( 319) = ( 0.0163934 0.0163934 0.5000000), wk = 0.0027548 k( 320) = ( 0.0081967 0.0081967 0.5000000), wk = 0.0027548 k( 321) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027548 k( 322) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 323) = ( 0.0000000 0.5000000 0.0250000), wk = 0.0027548 k( 324) = ( 0.0000000 0.5000000 0.0500000), wk = 0.0027548 k( 325) = ( 0.0000000 0.5000000 0.0750000), wk = 0.0027548 k( 326) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0027548 k( 327) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0027548 k( 328) = ( 0.0000000 0.5000000 0.1500000), wk = 0.0027548 k( 329) = ( 0.0000000 0.5000000 0.1750000), wk = 0.0027548 k( 330) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0027548 k( 331) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0027548 k( 332) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0027548 k( 333) = ( 0.0000000 0.5000000 0.2750000), wk = 0.0027548 k( 334) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0027548 k( 335) = ( 0.0000000 0.5000000 0.3250000), wk = 0.0027548 k( 336) = ( 0.0000000 0.5000000 0.3500000), wk = 0.0027548 k( 337) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0027548 k( 338) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0027548 k( 339) = ( 0.0000000 0.5000000 0.4250000), wk = 0.0027548 k( 340) = ( 0.0000000 0.5000000 0.4500000), wk = 0.0027548 k( 341) = ( 0.0000000 0.5000000 0.4750000), wk = 0.0027548 k( 342) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027548 k( 343) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 344) = ( 0.5000000 0.5000000 0.0250000), wk = 0.0027548 k( 345) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0027548 k( 346) = ( 0.5000000 0.5000000 0.0750000), wk = 0.0027548 k( 347) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0027548 k( 348) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0027548 k( 349) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0027548 k( 350) = ( 0.5000000 0.5000000 0.1750000), wk = 0.0027548 k( 351) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0027548 k( 352) = ( 0.5000000 0.5000000 0.2250000), wk = 0.0027548 k( 353) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0027548 k( 354) = ( 0.5000000 0.5000000 0.2750000), wk = 0.0027548 k( 355) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0027548 k( 356) = ( 0.5000000 0.5000000 0.3250000), wk = 0.0027548 k( 357) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0027548 k( 358) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0027548 k( 359) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0027548 k( 360) = ( 0.5000000 0.5000000 0.4250000), wk = 0.0027548 k( 361) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0027548 k( 362) = ( 0.5000000 0.5000000 0.4750000), wk = 0.0027548 k( 363) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027548 Dense grid: 73373 G-vectors FFT dimensions: ( 40, 40, 90) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.39 Mb ( 512, 50) NL pseudopotentials 0.64 Mb ( 256, 164) Each V/rho on FFT grid 0.07 Mb ( 4800) Each G-vector array 0.02 Mb ( 2043) G-vector shells 0.01 Mb ( 985) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.56 Mb ( 512, 200) Each subspace H/S matrix 0.04 Mb ( 50, 50) Each matrix 0.25 Mb ( 164, 2, 50) The potential is recalculated from file : ./TiGeSb.save/charge-density.dat Starting wfc are 32 randomized atomic wfcs + 18 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.7 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 5.1 secs Computing kpt #: 4 total cpu time spent up to now is 6.3 secs Computing kpt #: 5 total cpu time spent up to now is 7.4 secs Computing kpt #: 6 total cpu time spent up to now is 8.5 secs Computing kpt #: 7 total cpu time spent up to now is 9.7 secs Computing kpt #: 8 total cpu time spent up to now is 10.8 secs Computing kpt #: 9 total cpu time spent up to now is 11.9 secs Computing kpt #: 10 total cpu time spent up to now is 13.1 secs Computing kpt #: 11 total cpu time spent up to now is 14.2 secs Computing kpt #: 12 total cpu time spent up to now is 15.3 secs Computing kpt #: 13 total cpu time spent up to now is 17.3 secs Computing kpt #: 14 total cpu time spent up to now is 18.5 secs Computing kpt #: 15 total cpu time spent up to now is 19.6 secs Computing kpt #: 16 total cpu time spent up to now is 20.7 secs Computing kpt #: 17 total cpu time spent up to now is 21.8 secs Computing kpt #: 18 total cpu time spent up to now is 22.9 secs Computing kpt #: 19 total cpu time spent up to now is 24.0 secs Computing kpt #: 20 total cpu time spent up to now is 25.1 secs Computing kpt #: 21 total cpu time spent up to now is 26.2 secs Computing kpt #: 22 total cpu time spent up to now is 27.3 secs Computing kpt #: 23 total cpu time spent up to now is 28.4 secs Computing kpt #: 24 total cpu time spent up to now is 29.4 secs Computing kpt #: 25 total cpu time spent up to now is 30.5 secs Computing kpt #: 26 total cpu time spent up to now is 31.5 secs Computing kpt #: 27 total cpu time spent up to now is 32.6 secs Computing kpt #: 28 total cpu time spent up to now is 33.9 secs Computing kpt #: 29 total cpu time spent up to now is 35.1 secs Computing kpt #: 30 total cpu time spent up to now is 36.1 secs Computing kpt #: 31 total cpu time spent up to now is 37.1 secs Computing kpt #: 32 total cpu time spent up to now is 38.2 secs Computing kpt #: 33 total cpu time spent up to now is 39.2 secs Computing kpt #: 34 total cpu time spent up to now is 40.3 secs Computing kpt #: 35 total cpu time spent up to now is 41.4 secs Computing kpt #: 36 total cpu time spent up to now is 42.4 secs Computing kpt #: 37 total cpu time spent up to now is 43.5 secs Computing kpt #: 38 total cpu time spent up to now is 44.5 secs Computing kpt #: 39 total cpu time spent up to now is 45.6 secs Computing kpt #: 40 total cpu time spent up to now is 46.7 secs Computing kpt #: 41 total cpu time spent up to now is 47.8 secs Computing kpt #: 42 total cpu time spent up to now is 49.0 secs Computing kpt #: 43 total cpu time spent up to now is 50.2 secs Computing kpt #: 44 total cpu time spent up to now is 51.3 secs Computing kpt #: 45 total cpu time spent up to now is 52.5 secs Computing kpt #: 46 total cpu time spent up to now is 53.7 secs Computing kpt #: 47 total cpu time spent up to now is 55.0 secs Computing kpt #: 48 total cpu time spent up to now is 56.3 secs Computing kpt #: 49 total cpu time spent up to now is 57.6 secs Computing kpt #: 50 total cpu time spent up to now is 58.8 secs Computing kpt #: 51 total cpu time spent up to now is 60.1 secs Computing kpt #: 52 total cpu time spent up to now is 61.5 secs Computing kpt #: 53 total cpu time spent up to now is 62.8 secs Computing kpt #: 54 total cpu time spent up to now is 64.1 secs Computing kpt #: 55 total cpu time spent up to now is 65.3 secs Computing kpt #: 56 total cpu time spent up to now is 66.6 secs Computing kpt #: 57 total cpu time spent up to now is 67.8 secs Computing kpt #: 58 total cpu time spent up to now is 68.9 secs Computing kpt #: 59 total cpu time spent up to now is 70.1 secs Computing kpt #: 60 total cpu time spent up to now is 71.3 secs Computing kpt #: 61 total cpu time spent up to now is 72.5 secs Computing kpt #: 62 total cpu time spent up to now is 73.6 secs Computing kpt #: 63 total cpu time spent up to now is 74.8 secs Computing kpt #: 64 total cpu time spent up to now is 75.9 secs Computing kpt #: 65 total cpu time spent up to now is 77.1 secs Computing kpt #: 66 total cpu time spent up to now is 78.2 secs Computing kpt #: 67 total cpu time spent up to now is 79.4 secs Computing kpt #: 68 total cpu time spent up to now is 80.5 secs Computing kpt #: 69 total cpu time spent up to now is 81.7 secs Computing kpt #: 70 total cpu time spent up to now is 82.8 secs Computing kpt #: 71 total cpu time spent up to now is 84.0 secs Computing kpt #: 72 total cpu time spent up to now is 85.2 secs Computing kpt #: 73 total cpu time spent up to now is 86.3 secs Computing kpt #: 74 total cpu time spent up to now is 87.5 secs Computing kpt #: 75 total cpu time spent up to now is 88.6 secs Computing kpt #: 76 total cpu time spent up to now is 89.8 secs Computing kpt #: 77 total cpu time spent up to now is 90.9 secs Computing kpt #: 78 total cpu time spent up to now is 92.0 secs Computing kpt #: 79 total cpu time spent up to now is 93.2 secs Computing kpt #: 80 total cpu time spent up to now is 94.3 secs Computing kpt #: 81 total cpu time spent up to now is 95.4 secs Computing kpt #: 82 total cpu time spent up to now is 96.6 secs Computing kpt #: 83 total cpu time spent up to now is 97.7 secs Computing kpt #: 84 total cpu time spent up to now is 98.8 secs Computing kpt #: 85 total cpu time spent up to now is 99.9 secs Computing kpt #: 86 total cpu time spent up to now is 101.1 secs Computing kpt #: 87 total cpu time spent up to now is 102.4 secs Computing kpt #: 88 total cpu time spent up to now is 103.4 secs Computing kpt #: 89 total cpu time spent up to now is 104.5 secs Computing kpt #: 90 total cpu time spent up to now is 105.8 secs Computing kpt #: 91 total cpu time spent up to now is 107.0 secs Computing kpt #: 92 total cpu time spent up to now is 108.2 secs Computing kpt #: 93 total cpu time spent up to now is 109.4 secs Computing kpt #: 94 total cpu time spent up to now is 110.5 secs Computing kpt #: 95 total cpu time spent up to now is 111.7 secs Computing kpt #: 96 total cpu time spent up to now is 112.9 secs Computing kpt #: 97 total cpu time spent up to now is 114.0 secs Computing kpt #: 98 total cpu time spent up to now is 115.1 secs Computing kpt #: 99 total cpu time spent up to now is 116.2 secs Computing kpt #: 100 total cpu time spent up to now is 117.3 secs Computing kpt #: 101 total cpu time spent up to now is 118.5 secs Computing kpt #: 102 total cpu time spent up to now is 119.6 secs Computing kpt #: 103 total cpu time spent up to now is 120.7 secs Computing kpt #: 104 total cpu time spent up to now is 121.8 secs Computing kpt #: 105 total cpu time spent up to now is 123.0 secs Computing kpt #: 106 total cpu time spent up to now is 124.1 secs Computing kpt #: 107 total cpu time spent up to now is 125.2 secs Computing kpt #: 108 total cpu time spent up to now is 126.3 secs Computing kpt #: 109 total cpu time spent up to now is 127.4 secs Computing kpt #: 110 total cpu time spent up to now is 128.6 secs Computing kpt #: 111 total cpu time spent up to now is 129.6 secs Computing kpt #: 112 total cpu time spent up to now is 130.7 secs Computing kpt #: 113 total cpu time spent up to now is 131.7 secs Computing kpt #: 114 total cpu time spent up to now is 132.8 secs Computing kpt #: 115 total cpu time spent up to now is 133.9 secs Computing kpt #: 116 total cpu time spent up to now is 134.9 secs Computing kpt #: 117 total cpu time spent up to now is 136.0 secs Computing kpt #: 118 total cpu time spent up to now is 137.1 secs Computing kpt #: 119 total cpu time spent up to now is 138.3 secs Computing kpt #: 120 total cpu time spent up to now is 139.5 secs Computing kpt #: 121 total cpu time spent up to now is 140.7 secs Computing kpt #: 122 total cpu time spent up to now is 142.0 secs Computing kpt #: 123 total cpu time spent up to now is 143.4 secs Computing kpt #: 124 total cpu time spent up to now is 144.9 secs Computing kpt #: 125 total cpu time spent up to now is 146.1 secs Computing kpt #: 126 total cpu time spent up to now is 147.2 secs Computing kpt #: 127 total cpu time spent up to now is 148.3 secs Computing kpt #: 128 total cpu time spent up to now is 149.5 secs Computing kpt #: 129 total cpu time spent up to now is 150.6 secs Computing kpt #: 130 total cpu time spent up to now is 151.7 secs Computing kpt #: 131 total cpu time spent up to now is 153.0 secs Computing kpt #: 132 total cpu time spent up to now is 154.3 secs Computing kpt #: 133 total cpu time spent up to now is 155.5 secs Computing kpt #: 134 total cpu time spent up to now is 156.7 secs Computing kpt #: 135 total cpu time spent up to now is 157.7 secs Computing kpt #: 136 total cpu time spent up to now is 158.8 secs Computing kpt #: 137 total cpu time spent up to now is 159.9 secs Computing kpt #: 138 total cpu time spent up to now is 160.9 secs Computing kpt #: 139 total cpu time spent up to now is 161.9 secs Computing kpt #: 140 total cpu time spent up to now is 163.0 secs Computing kpt #: 141 total cpu time spent up to now is 164.0 secs Computing kpt #: 142 total cpu time spent up to now is 165.1 secs Computing kpt #: 143 total cpu time spent up to now is 166.1 secs Computing kpt #: 144 total cpu time spent up to now is 167.2 secs Computing kpt #: 145 total cpu time spent up to now is 168.3 secs Computing kpt #: 146 total cpu time spent up to now is 169.5 secs Computing kpt #: 147 total cpu time spent up to now is 170.6 secs Computing kpt #: 148 total cpu time spent up to now is 171.7 secs Computing kpt #: 149 total cpu time spent up to now is 172.9 secs Computing kpt #: 150 total cpu time spent up to now is 174.0 secs Computing kpt #: 151 total cpu time spent up to now is 175.0 secs Computing kpt #: 152 total cpu time spent up to now is 176.1 secs Computing kpt #: 153 total cpu time spent up to now is 177.3 secs Computing kpt #: 154 total cpu time spent up to now is 178.5 secs Computing kpt #: 155 total cpu time spent up to now is 179.6 secs Computing kpt #: 156 total cpu time spent up to now is 180.7 secs Computing kpt #: 157 total cpu time spent up to now is 181.9 secs Computing kpt #: 158 total cpu time spent up to now is 183.2 secs Computing kpt #: 159 total cpu time spent up to now is 184.6 secs Computing kpt #: 160 total cpu time spent up to now is 186.0 secs Computing kpt #: 161 total cpu time spent up to now is 187.3 secs Computing kpt #: 162 total cpu time spent up to now is 188.7 secs Computing kpt #: 163 total cpu time spent up to now is 190.1 secs Computing kpt #: 164 total cpu time spent up to now is 191.8 secs Computing kpt #: 165 total cpu time spent up to now is 193.3 secs Computing kpt #: 166 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 195.4 secs Computing kpt #: 167 total cpu time spent up to now is 196.9 secs Computing kpt #: 168 total cpu time spent up to now is 199.0 secs Computing kpt #: 169 total cpu time spent up to now is 200.9 secs Computing kpt #: 170 total cpu time spent up to now is 202.4 secs Computing kpt #: 171 total cpu time spent up to now is 204.0 secs Computing kpt #: 172 total cpu time spent up to now is 205.6 secs Computing kpt #: 173 total cpu time spent up to now is 207.0 secs Computing kpt #: 174 total cpu time spent up to now is 208.3 secs Computing kpt #: 175 total cpu time spent up to now is 209.4 secs Computing kpt #: 176 total cpu time spent up to now is 210.5 secs Computing kpt #: 177 total cpu time spent up to now is 211.6 secs Computing kpt #: 178 total cpu time spent up to now is 212.8 secs Computing kpt #: 179 total cpu time spent up to now is 214.1 secs Computing kpt #: 180 total cpu time spent up to now is 215.2 secs Computing kpt #: 181 total cpu time spent up to now is 216.4 secs Computing kpt #: 182 total cpu time spent up to now is 217.6 secs Computing kpt #: 183 total cpu time spent up to now is 218.6 secs Computing kpt #: 184 total cpu time spent up to now is 219.8 secs Computing kpt #: 185 total cpu time spent up to now is 220.9 secs Computing kpt #: 186 total cpu time spent up to now is 222.0 secs Computing kpt #: 187 total cpu time spent up to now is 223.2 secs Computing kpt #: 188 total cpu time spent up to now is 224.2 secs Computing kpt #: 189 total cpu time spent up to now is 225.3 secs Computing kpt #: 190 total cpu time spent up to now is 226.4 secs Computing kpt #: 191 total cpu time spent up to now is 227.5 secs Computing kpt #: 192 total cpu time spent up to now is 228.6 secs Computing kpt #: 193 total cpu time spent up to now is 229.7 secs Computing kpt #: 194 total cpu time spent up to now is 230.8 secs Computing kpt #: 195 total cpu time spent up to now is 231.9 secs Computing kpt #: 196 total cpu time spent up to now is 233.1 secs Computing kpt #: 197 total cpu time spent up to now is 234.3 secs Computing kpt #: 198 total cpu time spent up to now is 235.5 secs Computing kpt #: 199 total cpu time spent up to now is 236.7 secs Computing kpt #: 200 total cpu time spent up to now is 237.9 secs Computing kpt #: 201 total cpu time spent up to now is 239.2 secs Computing kpt #: 202 total cpu time spent up to now is 240.6 secs Computing kpt #: 203 total cpu time spent up to now is 242.5 secs Computing kpt #: 204 total cpu time spent up to now is 243.7 secs Computing kpt #: 205 total cpu time spent up to now is 245.0 secs Computing kpt #: 206 total cpu time spent up to now is 246.2 secs Computing kpt #: 207 total cpu time spent up to now is 247.5 secs Computing kpt #: 208 total cpu time spent up to now is 248.6 secs Computing kpt #: 209 total cpu time spent up to now is 249.7 secs Computing kpt #: 210 total cpu time spent up to now is 250.9 secs Computing kpt #: 211 total cpu time spent up to now is 252.0 secs Computing kpt #: 212 total cpu time spent up to now is 253.2 secs Computing kpt #: 213 total cpu time spent up to now is 254.5 secs Computing kpt #: 214 total cpu time spent up to now is 255.8 secs Computing kpt #: 215 total cpu time spent up to now is 256.9 secs Computing kpt #: 216 total cpu time spent up to now is 258.0 secs Computing kpt #: 217 total cpu time spent up to now is 259.3 secs Computing kpt #: 218 total cpu time spent up to now is 260.5 secs Computing kpt #: 219 total cpu time spent up to now is 261.7 secs Computing kpt #: 220 total cpu time spent up to now is 263.0 secs Computing kpt #: 221 total cpu time spent up to now is 264.2 secs Computing kpt #: 222 total cpu time spent up to now is 265.5 secs Computing kpt #: 223 total cpu time spent up to now is 266.6 secs Computing kpt #: 224 total cpu time spent up to now is 267.9 secs Computing kpt #: 225 total cpu time spent up to now is 269.1 secs Computing kpt #: 226 total cpu time spent up to now is 270.3 secs Computing kpt #: 227 total cpu time spent up to now is 271.6 secs Computing kpt #: 228 total cpu time spent up to now is 272.9 secs Computing kpt #: 229 total cpu time spent up to now is 274.1 secs Computing kpt #: 230 total cpu time spent up to now is 275.4 secs Computing kpt #: 231 total cpu time spent up to now is 276.6 secs Computing kpt #: 232 total cpu time spent up to now is 277.9 secs Computing kpt #: 233 total cpu time spent up to now is 279.1 secs Computing kpt #: 234 total cpu time spent up to now is 280.4 secs Computing kpt #: 235 total cpu time spent up to now is 281.5 secs Computing kpt #: 236 total cpu time spent up to now is 282.6 secs Computing kpt #: 237 total cpu time spent up to now is 283.8 secs Computing kpt #: 238 total cpu time spent up to now is 284.9 secs Computing kpt #: 239 total cpu time spent up to now is 286.0 secs Computing kpt #: 240 total cpu time spent up to now is 287.2 secs Computing kpt #: 241 total cpu time spent up to now is 288.3 secs Computing kpt #: 242 total cpu time spent up to now is 289.4 secs Computing kpt #: 243 total cpu time spent up to now is 290.5 secs Computing kpt #: 244 total cpu time spent up to now is 291.7 secs Computing kpt #: 245 total cpu time spent up to now is 292.8 secs Computing kpt #: 246 total cpu time spent up to now is 293.9 secs Computing kpt #: 247 total cpu time spent up to now is 295.0 secs Computing kpt #: 248 total cpu time spent up to now is 296.2 secs Computing kpt #: 249 total cpu time spent up to now is 297.3 secs Computing kpt #: 250 total cpu time spent up to now is 298.4 secs Computing kpt #: 251 total cpu time spent up to now is 299.5 secs Computing kpt #: 252 total cpu time spent up to now is 300.6 secs Computing kpt #: 253 total cpu time spent up to now is 301.7 secs Computing kpt #: 254 total cpu time spent up to now is 302.8 secs Computing kpt #: 255 total cpu time spent up to now is 303.9 secs Computing kpt #: 256 total cpu time spent up to now is 305.0 secs Computing kpt #: 257 total cpu time spent up to now is 306.1 secs Computing kpt #: 258 total cpu time spent up to now is 307.3 secs Computing kpt #: 259 total cpu time spent up to now is 308.4 secs Computing kpt #: 260 total cpu time spent up to now is 309.4 secs Computing kpt #: 261 total cpu time spent up to now is 310.5 secs Computing kpt #: 262 total cpu time spent up to now is 311.7 secs Computing kpt #: 263 total cpu time spent up to now is 312.9 secs Computing kpt #: 264 total cpu time spent up to now is 314.0 secs Computing kpt #: 265 total cpu time spent up to now is 315.1 secs Computing kpt #: 266 total cpu time spent up to now is 316.2 secs Computing kpt #: 267 total cpu time spent up to now is 317.3 secs Computing kpt #: 268 total cpu time spent up to now is 318.5 secs Computing kpt #: 269 total cpu time spent up to now is 319.6 secs Computing kpt #: 270 total cpu time spent up to now is 320.7 secs Computing kpt #: 271 total cpu time spent up to now is 321.7 secs Computing kpt #: 272 total cpu time spent up to now is 322.8 secs Computing kpt #: 273 total cpu time spent up to now is 323.9 secs Computing kpt #: 274 total cpu time spent up to now is 325.0 secs Computing kpt #: 275 total cpu time spent up to now is 326.1 secs Computing kpt #: 276 total cpu time spent up to now is 327.2 secs Computing kpt #: 277 total cpu time spent up to now is 328.2 secs Computing kpt #: 278 total cpu time spent up to now is 329.3 secs Computing kpt #: 279 total cpu time spent up to now is 330.4 secs Computing kpt #: 280 total cpu time spent up to now is 331.5 secs Computing kpt #: 281 total cpu time spent up to now is 332.5 secs Computing kpt #: 282 total cpu time spent up to now is 334.0 secs Computing kpt #: 283 total cpu time spent up to now is 335.2 secs Computing kpt #: 284 total cpu time spent up to now is 336.3 secs Computing kpt #: 285 total cpu time spent up to now is 337.5 secs Computing kpt #: 286 total cpu time spent up to now is 338.6 secs Computing kpt #: 287 total cpu time spent up to now is 339.8 secs Computing kpt #: 288 total cpu time spent up to now is 341.0 secs Computing kpt #: 289 total cpu time spent up to now is 342.2 secs Computing kpt #: 290 total cpu time spent up to now is 343.4 secs Computing kpt #: 291 total cpu time spent up to now is 344.6 secs Computing kpt #: 292 total cpu time spent up to now is 345.7 secs Computing kpt #: 293 total cpu time spent up to now is 346.8 secs Computing kpt #: 294 total cpu time spent up to now is 347.9 secs Computing kpt #: 295 total cpu time spent up to now is 349.0 secs Computing kpt #: 296 total cpu time spent up to now is 350.3 secs Computing kpt #: 297 total cpu time spent up to now is 351.5 secs Computing kpt #: 298 total cpu time spent up to now is 352.7 secs Computing kpt #: 299 total cpu time spent up to now is 354.0 secs Computing kpt #: 300 total cpu time spent up to now is 355.2 secs Computing kpt #: 301 total cpu time spent up to now is 356.5 secs Computing kpt #: 302 total cpu time spent up to now is 357.7 secs Computing kpt #: 303 total cpu time spent up to now is 359.0 secs Computing kpt #: 304 total cpu time spent up to now is 360.2 secs Computing kpt #: 305 total cpu time spent up to now is 361.3 secs Computing kpt #: 306 total cpu time spent up to now is 362.5 secs Computing kpt #: 307 total cpu time spent up to now is 363.6 secs Computing kpt #: 308 total cpu time spent up to now is 364.8 secs Computing kpt #: 309 total cpu time spent up to now is 365.9 secs Computing kpt #: 310 total cpu time spent up to now is 367.0 secs Computing kpt #: 311 total cpu time spent up to now is 368.2 secs Computing kpt #: 312 total cpu time spent up to now is 369.3 secs Computing kpt #: 313 total cpu time spent up to now is 370.5 secs Computing kpt #: 314 total cpu time spent up to now is 371.6 secs Computing kpt #: 315 total cpu time spent up to now is 372.7 secs Computing kpt #: 316 total cpu time spent up to now is 373.9 secs Computing kpt #: 317 total cpu time spent up to now is 375.0 secs Computing kpt #: 318 total cpu time spent up to now is 376.3 secs Computing kpt #: 319 total cpu time spent up to now is 377.5 secs Computing kpt #: 320 total cpu time spent up to now is 378.7 secs Computing kpt #: 321 total cpu time spent up to now is 380.0 secs Computing kpt #: 322 total cpu time spent up to now is 381.1 secs Computing kpt #: 323 total cpu time spent up to now is 382.2 secs Computing kpt #: 324 total cpu time spent up to now is 383.3 secs Computing kpt #: 325 total cpu time spent up to now is 384.4 secs Computing kpt #: 326 total cpu time spent up to now is 385.5 secs Computing kpt #: 327 total cpu time spent up to now is 386.7 secs Computing kpt #: 328 total cpu time spent up to now is 387.8 secs Computing kpt #: 329 total cpu time spent up to now is 388.8 secs Computing kpt #: 330 total cpu time spent up to now is 389.9 secs Computing kpt #: 331 total cpu time spent up to now is 391.0 secs Computing kpt #: 332 total cpu time spent up to now is 392.1 secs Computing kpt #: 333 total cpu time spent up to now is 393.3 secs Computing kpt #: 334 total cpu time spent up to now is 394.5 secs Computing kpt #: 335 total cpu time spent up to now is 395.6 secs Computing kpt #: 336 total cpu time spent up to now is 396.8 secs Computing kpt #: 337 total cpu time spent up to now is 398.0 secs Computing kpt #: 338 total cpu time spent up to now is 399.1 secs Computing kpt #: 339 total cpu time spent up to now is 400.2 secs Computing kpt #: 340 total cpu time spent up to now is 401.3 secs Computing kpt #: 341 total cpu time spent up to now is 402.4 secs Computing kpt #: 342 total cpu time spent up to now is 403.6 secs Computing kpt #: 343 total cpu time spent up to now is 404.6 secs Computing kpt #: 344 total cpu time spent up to now is 405.6 secs Computing kpt #: 345 total cpu time spent up to now is 406.7 secs Computing kpt #: 346 total cpu time spent up to now is 407.7 secs Computing kpt #: 347 total cpu time spent up to now is 408.7 secs Computing kpt #: 348 total cpu time spent up to now is 409.9 secs Computing kpt #: 349 total cpu time spent up to now is 411.0 secs Computing kpt #: 350 total cpu time spent up to now is 412.2 secs Computing kpt #: 351 total cpu time spent up to now is 413.3 secs Computing kpt #: 352 total cpu time spent up to now is 414.6 secs Computing kpt #: 353 total cpu time spent up to now is 415.8 secs Computing kpt #: 354 total cpu time spent up to now is 417.1 secs Computing kpt #: 355 total cpu time spent up to now is 418.3 secs Computing kpt #: 356 total cpu time spent up to now is 419.5 secs Computing kpt #: 357 total cpu time spent up to now is 420.6 secs Computing kpt #: 358 total cpu time spent up to now is 421.8 secs Computing kpt #: 359 total cpu time spent up to now is 422.9 secs Computing kpt #: 360 total cpu time spent up to now is 424.0 secs Computing kpt #: 361 total cpu time spent up to now is 425.1 secs Computing kpt #: 362 total cpu time spent up to now is 426.2 secs Computing kpt #: 363 total cpu time spent up to now is 427.3 secs ethr = 2.38E-08, avg # of iterations = 41.0 total cpu time spent up to now is 427.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 9141 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9050 -22.9050 -22.9018 -22.9018 -22.2564 -22.2564 -22.2503 -22.2503 -22.2472 -22.2472 -22.2460 -22.2460 -1.9018 -1.9018 -0.6555 -0.6555 1.5921 1.5921 7.1559 7.1559 7.3164 7.3164 7.3785 7.3785 8.2381 8.2381 8.3601 8.3601 9.1030 9.1030 9.4546 9.4546 9.5582 9.5582 10.8526 10.8526 11.0645 11.0645 11.1861 11.1861 11.3884 11.3884 11.8246 11.8246 11.8818 11.8818 k = 0.0000 0.0116-0.0000 ( 9149 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9051 -22.9051 -22.9018 -22.9018 -22.2564 -22.2564 -22.2503 -22.2503 -22.2472 -22.2472 -22.2460 -22.2460 -1.9003 -1.9003 -0.6542 -0.6542 1.5932 1.5932 7.1568 7.1568 7.2956 7.2956 7.3754 7.3754 8.2459 8.2459 8.3665 8.3665 9.1025 9.1025 9.4524 9.4524 9.5570 9.5570 10.8565 10.8565 11.0632 11.0632 11.1847 11.1847 11.3933 11.3933 11.8207 11.8207 11.8826 11.8826 k = 0.0000 0.0233-0.0000 ( 9149 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9051 -22.9051 -22.9018 -22.9018 -22.2564 -22.2564 -22.2503 -22.2503 -22.2473 -22.2473 -22.2461 -22.2461 -1.8957 -1.8957 -0.6503 -0.6503 1.5964 1.5964 7.1594 7.1594 7.2369 7.2369 7.3663 7.3663 8.2645 8.2645 8.3867 8.3867 9.1011 9.1011 9.4464 9.4464 9.5534 9.5534 10.8678 10.8678 11.0594 11.0594 11.1805 11.1805 11.4077 11.4077 11.8096 11.8096 11.8851 11.8851 k = 0.0000 0.0349-0.0000 ( 9141 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9051 -22.9051 -22.9019 -22.9019 -22.2564 -22.2564 -22.2503 -22.2503 -22.2474 -22.2474 -22.2462 -22.2462 -1.8882 -1.8882 -0.6437 -0.6437 1.6016 1.6016 7.1442 7.1442 7.1675 7.1675 7.3510 7.3510 8.2853 8.2853 8.4209 8.4209 9.0997 9.0997 9.4374 9.4374 9.5473 9.5473 10.8857 10.8857 11.0534 11.0534 11.1737 11.1737 11.4310 11.4310 11.7919 11.7919 11.8893 11.8893 k = 0.0000 0.0465-0.0000 ( 9134 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9052 -22.9052 -22.9020 -22.9020 -22.2564 -22.2564 -22.2504 -22.2504 -22.2475 -22.2475 -22.2464 -22.2464 -1.8777 -1.8777 -0.6345 -0.6345 1.6090 1.6090 7.0352 7.0352 7.1711 7.1711 7.3299 7.3299 8.3042 8.3042 8.4642 8.4642 9.0997 9.0997 9.4268 9.4268 9.5386 9.5386 10.9084 10.9084 11.0462 11.0462 11.1641 11.1641 11.4622 11.4622 11.7691 11.7691 11.8951 11.8951 k = 0.0000 0.0581-0.0000 ( 9140 PWs) bands (ev): -46.2046 -46.2046 -46.2043 -46.2043 -22.9053 -22.9053 -22.9021 -22.9021 -22.2565 -22.2565 -22.2504 -22.2504 -22.2477 -22.2477 -22.2465 -22.2465 -1.8642 -1.8642 -0.6227 -0.6227 1.6183 1.6183 6.9084 6.9084 7.1765 7.1765 7.3038 7.3038 8.3220 8.3220 8.5085 8.5085 9.1030 9.1030 9.4161 9.4161 9.5270 9.5270 10.9318 10.9318 11.0411 11.0411 11.1518 11.1518 11.4999 11.4999 11.7423 11.7423 11.9027 11.9027 k = 0.0000 0.0698-0.0000 ( 9154 PWs) bands (ev): -46.2045 -46.2045 -46.2043 -46.2043 -22.9054 -22.9054 -22.9023 -22.9023 -22.2565 -22.2565 -22.2506 -22.2506 -22.2480 -22.2480 -22.2467 -22.2467 -1.8476 -1.8476 -0.6083 -0.6083 1.6297 1.6297 6.7701 6.7701 7.1774 7.1774 7.2767 7.2767 8.3404 8.3404 8.5473 8.5473 9.1119 9.1119 9.4064 9.4064 9.5124 9.5124 10.9465 10.9465 11.0465 11.0465 11.1367 11.1367 11.5428 11.5428 11.7132 11.7132 11.9119 11.9119 k = 0.0000 0.0814-0.0000 ( 9160 PWs) bands (ev): -46.2045 -46.2045 -46.2043 -46.2043 -22.9056 -22.9056 -22.9024 -22.9024 -22.2566 -22.2566 -22.2507 -22.2507 -22.2482 -22.2482 -22.2469 -22.2469 -1.8281 -1.8281 -0.5913 -0.5913 1.6429 1.6429 6.6235 6.6235 7.1625 7.1625 7.2594 7.2594 8.3601 8.3601 8.5768 8.5768 9.1280 9.1280 9.3986 9.3986 9.4945 9.4945 10.9430 10.9430 11.0708 11.0708 11.1189 11.1189 11.5891 11.5891 11.6829 11.6829 11.9230 11.9230 k = 0.0000 0.0930-0.0000 ( 9160 PWs) bands (ev): -46.2045 -46.2045 -46.2042 -46.2042 -22.9057 -22.9057 -22.9026 -22.9026 -22.2566 -22.2566 -22.2509 -22.2509 -22.2485 -22.2485 -22.2471 -22.2471 -1.8056 -1.8056 -0.5717 -0.5717 1.6580 1.6580 6.4706 6.4706 7.1232 7.1232 7.2601 7.2601 8.3818 8.3818 8.5960 8.5960 9.1515 9.1515 9.3929 9.3929 9.4735 9.4735 10.9253 10.9253 11.0956 11.0956 11.1115 11.1115 11.6365 11.6365 11.6534 11.6534 11.9358 11.9358 k = 0.0000 0.1047-0.0000 ( 9144 PWs) bands (ev): -46.2044 -46.2044 -46.2042 -46.2042 -22.9059 -22.9059 -22.9028 -22.9028 -22.2568 -22.2568 -22.2512 -22.2512 -22.2487 -22.2487 -22.2473 -22.2473 -1.7801 -1.7801 -0.5494 -0.5494 1.6747 1.6747 6.3130 6.3130 7.0660 7.0660 7.2723 7.2723 8.4057 8.4057 8.6065 8.6065 9.1808 9.1808 9.3886 9.3886 9.4505 9.4505 10.8997 10.8997 11.0723 11.0723 11.1562 11.1562 11.6231 11.6231 11.6854 11.6854 11.9505 11.9505 k = 0.0000 0.1163-0.0000 ( 9132 PWs) bands (ev): -46.2044 -46.2044 -46.2042 -46.2042 -22.9061 -22.9061 -22.9031 -22.9031 -22.2569 -22.2569 -22.2516 -22.2516 -22.2490 -22.2490 -22.2475 -22.2475 -1.7516 -1.7516 -0.5246 -0.5246 1.6930 1.6930 6.1519 6.1519 6.9968 6.9968 7.2899 7.2899 8.4318 8.4318 8.6110 8.6110 9.2132 9.2132 9.3806 9.3806 9.4308 9.4308 10.8691 10.8691 11.0443 11.0443 11.2057 11.2057 11.5959 11.5959 11.7304 11.7304 11.9671 11.9671 k = 0.0000 0.1279-0.0000 ( 9128 PWs) bands (ev): -46.2043 -46.2043 -46.2041 -46.2041 -22.9063 -22.9063 -22.9033 -22.9033 -22.2571 -22.2571 -22.2520 -22.2520 -22.2493 -22.2493 -22.2476 -22.2476 -1.7201 -1.7201 -0.4972 -0.4972 1.7128 1.7128 5.9882 5.9882 6.9183 6.9183 7.3107 7.3107 8.4604 8.4604 8.6122 8.6122 9.2452 9.2452 9.3578 9.3578 9.4266 9.4266 10.8352 10.8352 11.0125 11.0125 11.2571 11.2571 11.5710 11.5710 11.7701 11.7701 11.9856 11.9856 k = 0.0000 0.1395-0.0000 ( 9148 PWs) bands (ev): -46.2043 -46.2043 -46.2041 -46.2041 -22.9065 -22.9065 -22.9036 -22.9036 -22.2574 -22.2574 -22.2526 -22.2526 -22.2495 -22.2495 -22.2476 -22.2476 -1.6857 -1.6857 -0.4672 -0.4672 1.7339 1.7339 5.8227 5.8227 6.8319 6.8319 7.3336 7.3336 8.4913 8.4913 8.6127 8.6127 9.2732 9.2732 9.3210 9.3210 9.4385 9.4385 10.7987 10.7987 10.9773 10.9773 11.3091 11.3091 11.5486 11.5486 11.8025 11.8025 12.0060 12.0060 k = 0.0000 0.1512-0.0000 ( 9156 PWs) bands (ev): -46.2042 -46.2042 -46.2040 -46.2040 -22.9067 -22.9067 -22.9039 -22.9039 -22.2577 -22.2577 -22.2532 -22.2532 -22.2497 -22.2497 -22.2477 -22.2477 -1.6483 -1.6483 -0.4346 -0.4346 1.7560 1.7560 5.6559 5.6559 6.7389 6.7389 7.3581 7.3581 8.5244 8.5244 8.6141 8.6141 9.2728 9.2728 9.2983 9.2983 9.4613 9.4613 10.7604 10.7604 10.9389 10.9389 11.3610 11.3610 11.5288 11.5288 11.8268 11.8268 12.0284 12.0284 k = 0.0000 0.1628-0.0000 ( 9160 PWs) bands (ev): -46.2041 -46.2041 -46.2039 -46.2039 -22.9070 -22.9070 -22.9042 -22.9042 -22.2580 -22.2580 -22.2538 -22.2538 -22.2499 -22.2499 -22.2477 -22.2477 -1.6080 -1.6080 -0.3995 -0.3995 1.7790 1.7790 5.4884 5.4884 6.6404 6.6404 7.3836 7.3836 8.5596 8.5596 8.6178 8.6178 9.2214 9.2214 9.3146 9.3146 9.4920 9.4920 10.7209 10.7209 10.8976 10.8976 11.4122 11.4122 11.5114 11.5114 11.8437 11.8437 12.0529 12.0529 k = 0.0000 0.1744-0.0000 ( 9160 PWs) bands (ev): -46.2041 -46.2041 -46.2039 -46.2039 -22.9072 -22.9072 -22.9045 -22.9045 -22.2585 -22.2585 -22.2545 -22.2545 -22.2500 -22.2500 -22.2476 -22.2476 -1.5648 -1.5648 -0.3618 -0.3618 1.8025 1.8025 5.3206 5.3206 6.5377 6.5377 7.4095 7.4095 8.5959 8.5959 8.6252 8.6252 9.1634 9.1634 9.3279 9.3279 9.5278 9.5278 10.6806 10.6806 10.8541 10.8541 11.4621 11.4621 11.4962 11.4962 11.8551 11.8551 12.0795 12.0795 k = 0.0000 0.1860-0.0000 ( 9164 PWs) bands (ev): -46.2040 -46.2040 -46.2038 -46.2038 -22.9075 -22.9075 -22.9048 -22.9048 -22.2590 -22.2590 -22.2553 -22.2553 -22.2500 -22.2500 -22.2476 -22.2476 -1.5186 -1.5186 -0.3215 -0.3215 1.8264 1.8264 5.1530 5.1530 6.4318 6.4318 7.4351 7.4351 8.6244 8.6244 8.6453 8.6453 9.1007 9.1007 9.3389 9.3389 9.5663 9.5663 10.6397 10.6397 10.8088 10.8088 11.4817 11.4817 11.5116 11.5116 11.8629 11.8629 12.1081 12.1081 k = 0.0000 0.1977-0.0000 ( 9172 PWs) bands (ev): -46.2039 -46.2039 -46.2037 -46.2037 -22.9078 -22.9078 -22.9052 -22.9052 -22.2595 -22.2595 -22.2561 -22.2561 -22.2501 -22.2501 -22.2475 -22.2475 -1.4696 -1.4696 -0.2788 -0.2788 1.8502 1.8502 4.9858 4.9858 6.3240 6.3240 7.4597 7.4597 8.6394 8.6394 8.6839 8.6839 9.0344 9.0344 9.3489 9.3489 9.6061 9.6061 10.5986 10.5986 10.7622 10.7622 11.4693 11.4693 11.5586 11.5586 11.8689 11.8689 12.1388 12.1388 k = 0.0000 0.2093-0.0000 ( 9182 PWs) bands (ev): -46.2039 -46.2039 -46.2037 -46.2037 -22.9081 -22.9081 -22.9055 -22.9055 -22.2601 -22.2601 -22.2569 -22.2569 -22.2501 -22.2501 -22.2475 -22.2475 -1.4176 -1.4176 -0.2335 -0.2335 1.8735 1.8735 4.8195 4.8195 6.2153 6.2153 7.4822 7.4822 8.6542 8.6542 8.7271 8.7271 8.9664 8.9664 9.3587 9.3587 9.6460 9.6460 10.5572 10.5572 10.7148 10.7148 11.4575 11.4575 11.6040 11.6040 11.8744 11.8744 12.1717 12.1717 k = 0.0000 0.2209-0.0000 ( 9178 PWs) bands (ev): -46.2038 -46.2038 -46.2036 -46.2036 -22.9084 -22.9084 -22.9059 -22.9059 -22.2608 -22.2608 -22.2578 -22.2578 -22.2500 -22.2500 -22.2474 -22.2474 -1.3628 -1.3628 -0.1857 -0.1857 1.8960 1.8960 4.6543 4.6543 6.1070 6.1070 7.5011 7.5011 8.6710 8.6710 8.7709 8.7709 8.9000 8.9000 9.3686 9.3686 9.6855 9.6855 10.5156 10.5156 10.6671 10.6671 11.4461 11.4461 11.6472 11.6472 11.8809 11.8809 12.2065 12.2065 k = 0.0000 0.2326-0.0000 ( 9176 PWs) bands (ev): -46.2037 -46.2037 -46.2035 -46.2035 -22.9087 -22.9087 -22.9063 -22.9063 -22.2615 -22.2615 -22.2587 -22.2587 -22.2500 -22.2500 -22.2473 -22.2473 -1.3051 -1.3051 -0.1354 -0.1354 1.9169 1.9169 4.4905 4.4905 6.0000 6.0000 7.5147 7.5147 8.6894 8.6894 8.7999 8.7999 8.8530 8.8530 9.3791 9.3791 9.7239 9.7239 10.4737 10.4737 10.6193 10.6193 11.4345 11.4345 11.6878 11.6878 11.8894 11.8894 12.2382 12.2382 k = 0.0000 0.2442-0.0000 ( 9168 PWs) bands (ev): -46.2036 -46.2036 -46.2035 -46.2035 -22.9090 -22.9090 -22.9067 -22.9067 -22.2622 -22.2622 -22.2595 -22.2595 -22.2499 -22.2499 -22.2472 -22.2472 -1.2446 -1.2446 -0.0827 -0.0827 1.9359 1.9359 4.3284 4.3284 5.8954 5.8954 7.5209 7.5209 8.7056 8.7056 8.7641 8.7641 8.8817 8.8817 9.3904 9.3904 9.7609 9.7609 10.4316 10.4316 10.5719 10.5719 11.4224 11.4224 11.7250 11.7250 11.9012 11.9012 12.2252 12.2252 k = 0.0000 0.2558-0.0000 ( 9172 PWs) bands (ev): -46.2035 -46.2035 -46.2034 -46.2034 -22.9093 -22.9093 -22.9071 -22.9071 -22.2629 -22.2629 -22.2604 -22.2604 -22.2497 -22.2497 -22.2471 -22.2471 -1.1812 -1.1812 -0.0275 -0.0275 1.9521 1.9521 4.1683 4.1683 5.7942 5.7942 7.5172 7.5172 8.6908 8.6908 8.7501 8.7501 8.9306 8.9306 9.4030 9.4030 9.7962 9.7962 10.3891 10.3891 10.5249 10.5249 11.4095 11.4095 11.7580 11.7580 11.9178 11.9178 12.2131 12.2131 k = 0.0000 0.2674-0.0000 ( 9174 PWs) bands (ev): -46.2035 -46.2035 -46.2033 -46.2033 -22.9096 -22.9096 -22.9075 -22.9075 -22.2637 -22.2637 -22.2613 -22.2613 -22.2496 -22.2496 -22.2470 -22.2470 -1.1151 -1.1151 0.0300 0.0300 1.9649 1.9649 4.0105 4.0105 5.6976 5.6976 7.5013 7.5013 8.6521 8.6521 8.7710 8.7710 8.9824 8.9824 9.4171 9.4171 9.8291 9.8291 10.3463 10.3463 10.4785 10.4785 11.3955 11.3955 11.7863 11.7863 11.9399 11.9399 12.2059 12.2059 k = 0.0000 0.2791-0.0000 ( 9174 PWs) bands (ev): -46.2034 -46.2034 -46.2033 -46.2033 -22.9099 -22.9099 -22.9078 -22.9078 -22.2644 -22.2644 -22.2622 -22.2622 -22.2495 -22.2495 -22.2469 -22.2469 -1.0462 -1.0462 0.0900 0.0900 1.9734 1.9734 3.8554 3.8554 5.6064 5.6064 7.4711 7.4711 8.6216 8.6216 8.7980 8.7980 9.0353 9.0353 9.4332 9.4332 9.8594 9.8594 10.3034 10.3034 10.4327 10.4327 11.3799 11.3799 11.8103 11.8103 11.9677 11.9677 12.2034 12.2034 k = 0.0000 0.2907-0.0000 ( 9180 PWs) bands (ev): -46.2033 -46.2033 -46.2032 -46.2032 -22.9102 -22.9102 -22.9082 -22.9082 -22.2651 -22.2651 -22.2631 -22.2631 -22.2493 -22.2493 -22.2469 -22.2469 -0.9745 -0.9745 0.1523 0.1523 1.9768 1.9768 3.7031 3.7031 5.5217 5.5217 7.4257 7.4257 8.6048 8.6048 8.8276 8.8276 9.0885 9.0885 9.4520 9.4520 9.8864 9.8864 10.2605 10.2605 10.3875 10.3875 11.3624 11.3624 11.8312 11.8312 12.0001 12.0001 12.2051 12.2051 k = 0.0000 0.3023-0.0000 ( 9184 PWs) bands (ev): -46.2032 -46.2032 -46.2031 -46.2031 -22.9105 -22.9105 -22.9086 -22.9086 -22.2659 -22.2659 -22.2639 -22.2639 -22.2491 -22.2491 -22.2468 -22.2468 -0.9001 -0.9001 0.2170 0.2170 1.9741 1.9741 3.5542 3.5542 5.4445 5.4445 7.3654 7.3654 8.6022 8.6022 8.8592 8.8592 9.1408 9.1408 9.4742 9.4742 9.9096 9.9096 10.2180 10.2180 10.3428 10.3428 11.3428 11.3428 11.8505 11.8505 12.0358 12.0358 12.2108 12.2108 k = 0.0000 0.3140-0.0000 ( 9174 PWs) bands (ev): -46.2032 -46.2032 -46.2031 -46.2031 -22.9107 -22.9107 -22.9090 -22.9090 -22.2666 -22.2666 -22.2648 -22.2648 -22.2489 -22.2489 -22.2467 -22.2467 -0.8230 -0.8230 0.2839 0.2839 1.9643 1.9643 3.4089 3.4089 5.3757 5.3757 7.2919 7.2919 8.6130 8.6130 8.8924 8.8924 9.1914 9.1914 9.5008 9.5008 9.9282 9.9282 10.1763 10.1763 10.2986 10.2986 11.3208 11.3208 11.8697 11.8697 12.0736 12.0736 12.2200 12.2200 k = 0.0000 0.3256-0.0000 ( 9166 PWs) bands (ev): -46.2031 -46.2031 -46.2030 -46.2030 -22.9110 -22.9110 -22.9094 -22.9094 -22.2673 -22.2673 -22.2656 -22.2656 -22.2488 -22.2488 -22.2466 -22.2466 -0.7433 -0.7433 0.3530 0.3530 1.9466 1.9466 3.2675 3.2675 5.3162 5.3162 7.2073 7.2073 8.6356 8.6356 8.9270 8.9270 9.2388 9.2388 9.5330 9.5330 9.9411 9.9411 10.1360 10.1360 10.2548 10.2548 11.2961 11.2961 11.8898 11.8898 12.1127 12.1127 12.2323 12.2323 k = 0.0000 0.3372-0.0000 ( 9166 PWs) bands (ev): -46.2030 -46.2030 -46.2029 -46.2029 -22.9113 -22.9113 -22.9097 -22.9097 -22.2679 -22.2679 -22.2664 -22.2664 -22.2486 -22.2486 -22.2466 -22.2466 -0.6610 -0.6610 0.4244 0.4244 1.9200 1.9200 3.1306 3.1306 5.2667 5.2667 7.1138 7.1138 8.6681 8.6681 8.9630 8.9630 9.2822 9.2822 9.5716 9.5716 9.9468 9.9468 10.0985 10.0985 10.2114 10.2114 11.2683 11.2683 11.9114 11.9114 12.1521 12.1521 12.2475 12.2475 k = 0.0000 0.3488-0.0000 ( 9162 PWs) bands (ev): -46.2030 -46.2030 -46.2029 -46.2029 -22.9115 -22.9115 -22.9101 -22.9101 -22.2686 -22.2686 -22.2671 -22.2671 -22.2484 -22.2484 -22.2465 -22.2465 -0.5761 -0.5761 0.4979 0.4979 1.8839 1.8839 2.9982 2.9982 5.2279 5.2279 7.0137 7.0137 8.7084 8.7084 9.0002 9.0002 9.3209 9.3209 9.6171 9.6171 9.9434 9.9434 10.0653 10.0653 10.1686 10.1686 11.2375 11.2375 11.9351 11.9351 12.1909 12.1909 12.2656 12.2656 k = 0.0000 0.3605-0.0000 ( 9170 PWs) bands (ev): -46.2029 -46.2029 -46.2028 -46.2028 -22.9117 -22.9117 -22.9104 -22.9104 -22.2692 -22.2692 -22.2678 -22.2678 -22.2482 -22.2482 -22.2464 -22.2464 -0.4887 -0.4887 0.5735 0.5735 1.8378 1.8378 2.8708 2.8708 5.2003 5.2003 6.9089 6.9089 8.7550 8.7550 9.0385 9.0385 9.3552 9.3552 9.6691 9.6691 9.9288 9.9288 10.0382 10.0382 10.1264 10.1264 11.2032 11.2032 11.9611 11.9611 12.2276 12.2276 12.2874 12.2874 k = 0.0000 0.3721-0.0000 ( 9160 PWs) bands (ev): -46.2029 -46.2029 -46.2028 -46.2028 -22.9120 -22.9120 -22.9107 -22.9107 -22.2697 -22.2697 -22.2685 -22.2685 -22.2480 -22.2480 -22.2464 -22.2464 -0.3988 -0.3988 0.6511 0.6511 1.7816 1.7816 2.7483 2.7483 5.1839 5.1839 6.8009 6.8009 8.8066 8.8066 9.0778 9.0778 9.3858 9.3858 9.7264 9.7264 9.9037 9.9037 10.0162 10.0162 10.0851 10.0851 11.1654 11.1654 11.9896 11.9896 12.2599 12.2599 12.3146 12.3146 k = 0.0000 0.3837-0.0000 ( 9160 PWs) bands (ev): -46.2028 -46.2028 -46.2027 -46.2027 -22.9122 -22.9122 -22.9110 -22.9110 -22.2703 -22.2703 -22.2692 -22.2692 -22.2479 -22.2479 -22.2464 -22.2464 -0.3065 -0.3065 0.7306 0.7306 1.7155 1.7155 2.6306 2.6306 5.1790 5.1790 6.6909 6.6909 8.8620 8.8620 9.1182 9.1182 9.4138 9.4138 9.7869 9.7869 9.8720 9.8720 9.9958 9.9958 10.0454 10.0454 11.1240 11.1240 12.0205 12.0205 12.2862 12.2862 12.3478 12.3478 k = 0.0000 0.3953-0.0000 ( 9158 PWs) bands (ev): -46.2027 -46.2027 -46.2027 -46.2027 -22.9123 -22.9123 -22.9113 -22.9113 -22.2708 -22.2708 -22.2697 -22.2697 -22.2477 -22.2477 -22.2463 -22.2463 -0.2118 -0.2118 0.8120 0.8120 1.6401 1.6401 2.5174 2.5174 5.1853 5.1853 6.5801 6.5801 8.9201 8.9201 9.1595 9.1595 9.4400 9.4400 9.8281 9.8281 9.8558 9.8558 9.9752 9.9752 10.0085 10.0085 11.0790 11.0790 12.0538 12.0538 12.3076 12.3076 12.3854 12.3854 k = 0.0000 0.4070-0.0000 ( 9158 PWs) bands (ev): -46.2027 -46.2027 -46.2026 -46.2026 -22.9125 -22.9125 -22.9116 -22.9116 -22.2712 -22.2712 -22.2703 -22.2703 -22.2475 -22.2475 -22.2463 -22.2463 -0.1149 -0.1149 0.8953 0.8953 1.5563 1.5563 2.4082 2.4082 5.2025 5.2025 6.4694 6.4694 8.9801 8.9801 9.2017 9.2017 9.4652 9.4652 9.7943 9.7943 9.8940 9.8940 9.9660 9.9660 9.9785 9.9785 11.0303 11.0303 12.0890 12.0890 12.3256 12.3256 12.4253 12.4253 k = 0.0000 0.4186-0.0000 ( 9172 PWs) bands (ev): -46.2027 -46.2027 -46.2026 -46.2026 -22.9126 -22.9126 -22.9118 -22.9118 -22.2716 -22.2716 -22.2708 -22.2708 -22.2474 -22.2474 -22.2463 -22.2463 -0.0159 -0.0159 0.9802 0.9802 1.4653 1.4653 2.3024 2.3024 5.2301 5.2301 6.3594 6.3594 9.0413 9.0413 9.2450 9.2450 9.4902 9.4902 9.7551 9.7551 9.8818 9.8818 9.9399 9.9399 10.0186 10.0186 10.9780 10.9780 12.1256 12.1256 12.3407 12.3407 12.4662 12.4662 k = 0.0000 0.4302-0.0000 ( 9180 PWs) bands (ev): -46.2026 -46.2026 -46.2026 -46.2026 -22.9127 -22.9127 -22.9120 -22.9120 -22.2719 -22.2719 -22.2712 -22.2712 -22.2472 -22.2472 -22.2463 -22.2463 0.0852 0.0852 1.0667 1.0667 1.3683 1.3683 2.1994 2.1994 5.2676 5.2676 6.2509 6.2509 9.1028 9.1028 9.2892 9.2892 9.5153 9.5153 9.7148 9.7148 9.8477 9.8477 9.9064 9.9064 10.0863 10.0863 10.9223 10.9223 12.1630 12.1630 12.3529 12.3529 12.5078 12.5078 k = 0.0000 0.4419-0.0000 ( 9176 PWs) bands (ev): -46.2026 -46.2026 -46.2025 -46.2025 -22.9128 -22.9128 -22.9122 -22.9122 -22.2722 -22.2722 -22.2716 -22.2716 -22.2471 -22.2471 -22.2463 -22.2463 0.1882 0.1882 1.1548 1.1548 1.2667 1.2667 2.0985 2.0985 5.3143 5.3143 6.1444 6.1444 9.1638 9.1638 9.3344 9.3344 9.5408 9.5408 9.6737 9.6737 9.8087 9.8087 9.8709 9.8709 10.1586 10.1586 10.8632 10.8632 12.2000 12.2000 12.3620 12.3620 12.5500 12.5500 k = 0.0000 0.4535-0.0000 ( 9186 PWs) bands (ev): -46.2026 -46.2026 -46.2025 -46.2025 -22.9129 -22.9129 -22.9124 -22.9124 -22.2724 -22.2724 -22.2719 -22.2719 -22.2470 -22.2470 -22.2463 -22.2463 0.2930 0.2930 1.1616 1.1616 1.2443 1.2443 1.9993 1.9993 5.3695 5.3695 6.0406 6.0406 9.2237 9.2237 9.3806 9.3806 9.5669 9.5669 9.6323 9.6323 9.7674 9.7674 9.8338 9.8338 10.2326 10.2326 10.8011 10.8011 12.2358 12.2358 12.3674 12.3674 12.5932 12.5932 k = 0.0000 0.4651-0.0000 ( 9182 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9126 -22.9126 -22.2725 -22.2725 -22.2722 -22.2722 -22.2469 -22.2469 -22.2464 -22.2464 0.3994 0.3994 1.0542 1.0542 1.3350 1.3350 1.9014 1.9014 5.4325 5.4325 5.9399 5.9399 9.2818 9.2818 9.4270 9.4270 9.5842 9.5842 9.6005 9.6005 9.7244 9.7244 9.7961 9.7961 10.3071 10.3071 10.7363 10.7363 12.2690 12.2690 12.3686 12.3686 12.6377 12.6377 k = 0.0000 0.4767-0.0000 ( 9174 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9127 -22.9127 -22.2726 -22.2726 -22.2724 -22.2724 -22.2468 -22.2468 -22.2464 -22.2464 0.5071 0.5071 0.9452 0.9452 1.4269 1.4269 1.8046 1.8046 5.5028 5.5028 5.8430 5.8430 9.3375 9.3375 9.4705 9.4705 9.5492 9.5492 9.6246 9.6246 9.6799 9.6799 9.7588 9.7588 10.3815 10.3815 10.6689 10.6689 12.2984 12.2984 12.3652 12.3652 12.6841 12.6841 k = 0.0000 0.4884-0.0000 ( 9166 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9128 -22.9128 -22.2727 -22.2727 -22.2725 -22.2725 -22.2467 -22.2467 -22.2465 -22.2465 0.6159 0.6159 0.8354 0.8354 1.5199 1.5199 1.7088 1.7088 5.5795 5.5795 5.7502 5.7502 9.3902 9.3902 9.4792 9.4792 9.5438 9.5438 9.6302 9.6302 9.6580 9.6580 9.7228 9.7228 10.4552 10.4552 10.5994 10.5994 12.3232 12.3232 12.3567 12.3567 12.7328 12.7328 k = 0.0000 0.5000-0.0000 ( 9164 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2726 -22.2726 -22.2726 -22.2726 -22.2466 -22.2466 -22.2466 -22.2466 0.7255 0.7255 0.7255 0.7255 1.6139 1.6139 1.6139 1.6139 5.6622 5.6622 5.6622 5.6622 9.4392 9.4392 9.4392 9.4392 9.5848 9.5848 9.5848 9.5848 9.6888 9.6888 9.6888 9.6888 10.5280 10.5280 10.5280 10.5280 12.3427 12.3427 12.3427 12.3427 12.7841 12.7841 k = 0.0000 0.5000-0.0000 ( 9164 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2726 -22.2726 -22.2726 -22.2726 -22.2466 -22.2466 -22.2466 -22.2466 0.7255 0.7255 0.7255 0.7255 1.6139 1.6139 1.6139 1.6139 5.6622 5.6622 5.6622 5.6622 9.4392 9.4392 9.4392 9.4392 9.5848 9.5848 9.5848 9.5848 9.6888 9.6888 9.6888 9.6888 10.5280 10.5280 10.5280 10.5280 12.3427 12.3427 12.3427 12.3427 12.7841 12.7841 k = 0.0116 0.5000-0.0000 ( 9166 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9128 -22.9128 -22.2726 -22.2726 -22.2726 -22.2726 -22.2466 -22.2466 -22.2466 -22.2466 0.7267 0.7267 0.7267 0.7267 1.6149 1.6149 1.6152 1.6152 5.6624 5.6624 5.6641 5.6641 9.4307 9.4307 9.4408 9.4408 9.5804 9.5804 9.5849 9.5849 9.6829 9.6829 9.6922 9.6922 10.5127 10.5127 10.5246 10.5246 12.3433 12.3433 12.3446 12.3446 12.7800 12.7800 k = 0.0233 0.5000-0.0000 ( 9170 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2726 -22.2726 -22.2467 -22.2467 -22.2466 -22.2466 0.7304 0.7304 0.7304 0.7304 1.6182 1.6182 1.6187 1.6187 5.6646 5.6646 5.6681 5.6681 9.4145 9.4145 9.4353 9.4353 9.5716 9.5716 9.5815 9.5815 9.6747 9.6747 9.6934 9.6934 10.4789 10.4789 10.5031 10.5031 12.3461 12.3461 12.3486 12.3486 12.7741 12.7741 k = 0.0349 0.5000-0.0000 ( 9182 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9130 -22.9130 -22.9129 -22.9129 -22.2727 -22.2727 -22.2726 -22.2726 -22.2469 -22.2469 -22.2467 -22.2467 0.7365 0.7365 0.7366 0.7366 1.6237 1.6237 1.6246 1.6246 5.6689 5.6689 5.6742 5.6742 9.3897 9.3897 9.4213 9.4213 9.5593 9.5593 9.5757 9.5757 9.6643 9.6643 9.6924 9.6924 10.4278 10.4278 10.4651 10.4651 12.3511 12.3511 12.3544 12.3544 12.7670 12.7670 k = 0.0465 0.5000-0.0000 ( 9186 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9131 -22.9131 -22.9129 -22.9129 -22.2727 -22.2727 -22.2725 -22.2725 -22.2471 -22.2471 -22.2468 -22.2468 0.7451 0.7451 0.7452 0.7452 1.6316 1.6316 1.6327 1.6327 5.6751 5.6751 5.6824 5.6824 9.3549 9.3549 9.3968 9.3968 9.5450 9.5450 9.5686 9.5686 9.6517 9.6517 9.6893 9.6893 10.3613 10.3613 10.4131 10.4131 12.3578 12.3578 12.3616 12.3616 12.7595 12.7595 k = 0.0581 0.5000-0.0000 ( 9172 PWs) bands (ev): -46.2024 -46.2024 -46.2024 -46.2024 -22.9132 -22.9132 -22.9130 -22.9130 -22.2727 -22.2727 -22.2725 -22.2725 -22.2474 -22.2474 -22.2470 -22.2470 0.7561 0.7561 0.7562 0.7562 1.6417 1.6417 1.6431 1.6431 5.6833 5.6833 5.6926 5.6926 9.3094 9.3094 9.3600 9.3600 9.5298 9.5298 9.5608 9.5608 9.6370 9.6370 9.6843 9.6843 10.2820 10.2820 10.3501 10.3501 12.3657 12.3657 12.3696 12.3696 12.7520 12.7520 k = 0.0698 0.5000-0.0000 ( 9180 PWs) bands (ev): -46.2024 -46.2024 -46.2024 -46.2024 -22.9133 -22.9133 -22.9131 -22.9131 -22.2727 -22.2727 -22.2725 -22.2725 -22.2477 -22.2477 -22.2473 -22.2473 0.7695 0.7695 0.7697 0.7697 1.6540 1.6540 1.6557 1.6557 5.6934 5.6934 5.7047 5.7047 9.2530 9.2530 9.3101 9.3101 9.5134 9.5134 9.5521 9.5521 9.6207 9.6207 9.6771 9.6771 10.1927 10.1927 10.2792 10.2792 12.3743 12.3743 12.3780 12.3780 12.7452 12.7452 k = 0.0814 0.5000-0.0000 ( 9184 PWs) bands (ev): -46.2024 -46.2024 -46.2024 -46.2024 -22.9134 -22.9134 -22.9132 -22.9132 -22.2727 -22.2727 -22.2725 -22.2725 -22.2480 -22.2480 -22.2475 -22.2475 0.7854 0.7854 0.7856 0.7856 1.6686 1.6686 1.6706 1.6706 5.7053 5.7053 5.7188 5.7188 9.1860 9.1860 9.2473 9.2473 9.4937 9.4937 9.5419 9.5419 9.6032 9.6032 9.6675 9.6675 10.0971 10.0971 10.2041 10.2041 12.3832 12.3832 12.3865 12.3865 12.7391 12.7391 k = 0.0930 0.5000-0.0000 ( 9188 PWs) bands (ev): -46.2023 -46.2023 -46.2023 -46.2023 -22.9136 -22.9136 -22.9133 -22.9133 -22.2727 -22.2727 -22.2724 -22.2724 -22.2484 -22.2484 -22.2478 -22.2478 0.8036 0.8036 0.8038 0.8038 1.6855 1.6855 1.6876 1.6876 5.7188 5.7188 5.7347 5.7347 9.1088 9.1088 9.1726 9.1726 9.4678 9.4678 9.5283 9.5283 9.5860 9.5860 9.6549 9.6549 9.9995 9.9995 10.1283 10.1283 12.3921 12.3921 12.3947 12.3947 12.7340 12.7340 k = 0.1047 0.5000-0.0000 ( 9196 PWs) bands (ev): -46.2023 -46.2023 -46.2023 -46.2023 -22.9138 -22.9138 -22.9134 -22.9134 -22.2727 -22.2727 -22.2724 -22.2724 -22.2488 -22.2488 -22.2482 -22.2482 0.8242 0.8242 0.8245 0.8245 1.7045 1.7045 1.7069 1.7069 5.7339 5.7339 5.7523 5.7523 9.0220 9.0220 9.0868 9.0868 9.4324 9.4324 9.5076 9.5076 9.5701 9.5701 9.6385 9.6385 9.9060 9.9060 10.0551 10.0551 12.4005 12.4005 12.4024 12.4024 12.7298 12.7298 k = 0.1163 0.5000-0.0000 ( 9186 PWs) bands (ev): -46.2022 -46.2022 -46.2022 -46.2022 -22.9140 -22.9140 -22.9136 -22.9136 -22.2727 -22.2727 -22.2724 -22.2724 -22.2492 -22.2492 -22.2486 -22.2486 0.8472 0.8472 0.8474 0.8474 1.7256 1.7256 1.7283 1.7283 5.7504 5.7504 5.7716 5.7716 8.9264 8.9264 8.9909 8.9909 9.3853 9.3853 9.4727 9.4727 9.5562 9.5562 9.6185 9.6185 9.8251 9.8251 9.9875 9.9875 12.4083 12.4083 12.4095 12.4095 12.7263 12.7263 k = 0.1279 0.5000-0.0000 ( 9186 PWs) bands (ev): -46.2022 -46.2022 -46.2022 -46.2022 -22.9141 -22.9141 -22.9137 -22.9137 -22.2727 -22.2727 -22.2724 -22.2724 -22.2497 -22.2497 -22.2490 -22.2490 0.8725 0.8725 0.8727 0.8727 1.7489 1.7489 1.7518 1.7518 5.7682 5.7682 5.7923 5.7923 8.8228 8.8228 8.8860 8.8860 9.3260 9.3260 9.4146 9.4146 9.5439 9.5439 9.5976 9.5976 9.7645 9.7645 9.9272 9.9272 12.4154 12.4154 12.4157 12.4157 12.7232 12.7232 k = 0.1395 0.5000-0.0000 ( 9198 PWs) bands (ev): -46.2021 -46.2021 -46.2021 -46.2021 -22.9144 -22.9144 -22.9139 -22.9139 -22.2728 -22.2728 -22.2724 -22.2724 -22.2502 -22.2502 -22.2494 -22.2494 0.9000 0.9000 0.9002 0.9002 1.7743 1.7743 1.7774 1.7774 5.7870 5.7870 5.8143 5.8143 8.7121 8.7121 8.7732 8.7732 9.2554 9.2554 9.3311 9.3311 9.5324 9.5324 9.5792 9.5792 9.7238 9.7238 9.8750 9.8750 12.4212 12.4212 12.4215 12.4215 12.7202 12.7202 k = 0.1512 0.5000-0.0000 ( 9218 PWs) bands (ev): -46.2021 -46.2021 -46.2021 -46.2021 -22.9146 -22.9146 -22.9141 -22.9141 -22.2728 -22.2728 -22.2724 -22.2724 -22.2507 -22.2507 -22.2499 -22.2499 0.9298 0.9298 0.9300 0.9300 1.8018 1.8018 1.8050 1.8050 5.8065 5.8065 5.8375 5.8375 8.5952 8.5952 8.6537 8.6537 9.1753 9.1753 9.2294 9.2294 9.5211 9.5211 9.5639 9.5639 9.6960 9.6960 9.8302 9.8302 12.4257 12.4257 12.4267 12.4267 12.7171 12.7171 k = 0.1628 0.5000-0.0000 ( 9208 PWs) bands (ev): -46.2020 -46.2020 -46.2020 -46.2020 -22.9148 -22.9148 -22.9143 -22.9143 -22.2728 -22.2728 -22.2725 -22.2725 -22.2512 -22.2512 -22.2503 -22.2503 0.9618 0.9618 0.9620 0.9620 1.8312 1.8312 1.8347 1.8347 5.8266 5.8266 5.8614 5.8614 8.4731 8.4731 8.5287 8.5287 9.0879 9.0879 9.1177 9.1177 9.5093 9.5093 9.5505 9.5505 9.6749 9.6749 9.7917 9.7917 12.4294 12.4294 12.4310 12.4310 12.7135 12.7135 k = 0.1744 0.5000-0.0000 ( 9212 PWs) bands (ev): -46.2019 -46.2019 -46.2019 -46.2019 -22.9151 -22.9151 -22.9145 -22.9145 -22.2729 -22.2729 -22.2725 -22.2725 -22.2517 -22.2517 -22.2508 -22.2508 0.9960 0.9960 0.9961 0.9961 1.8626 1.8626 1.8662 1.8662 5.8469 5.8469 5.8860 5.8860 8.3468 8.3468 8.3994 8.3994 8.9955 8.9955 9.0011 9.0011 9.4968 9.4968 9.5378 9.5378 9.6572 9.6572 9.7580 9.7580 12.4324 12.4324 12.4344 12.4344 12.7096 12.7096 k = 0.1860 0.5000-0.0000 ( 9212 PWs) bands (ev): -46.2019 -46.2019 -46.2019 -46.2019 -22.9153 -22.9153 -22.9148 -22.9148 -22.2730 -22.2730 -22.2726 -22.2726 -22.2522 -22.2522 -22.2513 -22.2513 1.0322 1.0322 1.0324 1.0324 1.8959 1.8959 1.8996 1.8996 5.8670 5.8670 5.9107 5.9107 8.2172 8.2172 8.2669 8.2669 8.8826 8.8826 8.8999 8.8999 9.4832 9.4832 9.5250 9.5250 9.6409 9.6409 9.7281 9.7281 12.4348 12.4348 12.4372 12.4372 12.7055 12.7055 k = 0.1977 0.5000-0.0000 ( 9202 PWs) bands (ev): -46.2018 -46.2018 -46.2018 -46.2018 -22.9156 -22.9156 -22.9150 -22.9150 -22.2731 -22.2731 -22.2727 -22.2727 -22.2527 -22.2527 -22.2518 -22.2518 1.0705 1.0705 1.0706 1.0706 1.9310 1.9310 1.9349 1.9349 5.8865 5.8865 5.9353 5.9353 8.0854 8.0854 8.1322 8.1322 8.7642 8.7642 8.8028 8.8028 9.4682 9.4682 9.5117 9.5117 9.6253 9.6253 9.7008 9.7008 12.4368 12.4368 12.4395 12.4395 12.7013 12.7013 k = 0.2093 0.5000-0.0000 ( 9190 PWs) bands (ev): -46.2017 -46.2017 -46.2017 -46.2017 -22.9158 -22.9158 -22.9153 -22.9153 -22.2732 -22.2732 -22.2728 -22.2728 -22.2532 -22.2532 -22.2522 -22.2522 1.1107 1.1107 1.1108 1.1108 1.9678 1.9678 1.9718 1.9718 5.9049 5.9049 5.9591 5.9591 7.9522 7.9522 7.9963 7.9963 8.6471 8.6471 8.7057 8.7057 9.4517 9.4517 9.4977 9.4977 9.6096 9.6096 9.6756 9.6756 12.4385 12.4385 12.4415 12.4415 12.6974 12.6974 k = 0.2209 0.5000-0.0000 ( 9194 PWs) bands (ev): -46.2016 -46.2016 -46.2016 -46.2016 -22.9161 -22.9161 -22.9155 -22.9155 -22.2734 -22.2734 -22.2730 -22.2730 -22.2536 -22.2536 -22.2527 -22.2527 1.1529 1.1529 1.1529 1.1529 2.0063 2.0063 2.0104 2.0104 5.9216 5.9216 5.9816 5.9816 7.8185 7.8185 7.8599 7.8599 8.5325 8.5325 8.6100 8.6100 9.4334 9.4334 9.4828 9.4828 9.5938 9.5938 9.6518 9.6518 12.4402 12.4402 12.4434 12.4434 12.6940 12.6940 k = 0.2326 0.5000-0.0000 ( 9194 PWs) bands (ev): -46.2016 -46.2016 -46.2016 -46.2016 -22.9164 -22.9164 -22.9158 -22.9158 -22.2735 -22.2735 -22.2731 -22.2731 -22.2541 -22.2541 -22.2531 -22.2531 1.1967 1.1967 1.1968 1.1968 2.0463 2.0463 2.0504 2.0504 5.9360 5.9360 6.0021 6.0021 7.6851 7.6851 7.7240 7.7240 8.4216 8.4216 8.5170 8.5170 9.4132 9.4132 9.4668 9.4668 9.5775 9.5775 9.6292 9.6292 12.4421 12.4421 12.4454 12.4454 12.6913 12.6913 k = 0.2442 0.5000-0.0000 ( 9206 PWs) bands (ev): -46.2015 -46.2015 -46.2015 -46.2015 -22.9166 -22.9166 -22.9161 -22.9161 -22.2737 -22.2737 -22.2733 -22.2733 -22.2545 -22.2545 -22.2536 -22.2536 1.2423 1.2423 1.2424 1.2424 2.0877 2.0877 2.0919 2.0919 5.9474 5.9474 6.0198 6.0198 7.5527 7.5527 7.5890 7.5890 8.3154 8.3154 8.4278 8.4278 9.3910 9.3910 9.4494 9.4494 9.5608 9.5608 9.6075 9.6075 12.4444 12.4444 12.4477 12.4477 12.6893 12.6893 k = 0.2558 0.5000-0.0000 ( 9206 PWs) bands (ev): -46.2014 -46.2014 -46.2014 -46.2014 -22.9169 -22.9169 -22.9163 -22.9163 -22.2740 -22.2740 -22.2736 -22.2736 -22.2549 -22.2549 -22.2540 -22.2540 1.2894 1.2894 1.2896 1.2896 2.1304 2.1304 2.1346 2.1346 5.9550 5.9550 6.0338 6.0338 7.4220 7.4220 7.4557 7.4557 8.2151 8.2151 8.3437 8.3437 9.3665 9.3665 9.4305 9.4305 9.5437 9.5437 9.5865 9.5865 12.4472 12.4472 12.4504 12.4504 12.6882 12.6882 k = 0.2674 0.5000-0.0000 ( 9210 PWs) bands (ev): -46.2013 -46.2013 -46.2013 -46.2013 -22.9172 -22.9172 -22.9166 -22.9166 -22.2742 -22.2742 -22.2739 -22.2739 -22.2552 -22.2552 -22.2543 -22.2543 1.3380 1.3380 1.3382 1.3382 2.1742 2.1742 2.1784 2.1784 5.9581 5.9581 6.0429 6.0429 7.2935 7.2935 7.3246 7.3246 8.1219 8.1219 8.2660 8.2660 9.3396 9.3396 9.4097 9.4097 9.5264 9.5264 9.5663 9.5663 12.4505 12.4505 12.4537 12.4537 12.6879 12.6879 k = 0.2791 0.5000-0.0000 ( 9198 PWs) bands (ev): -46.2013 -46.2013 -46.2013 -46.2013 -22.9175 -22.9175 -22.9169 -22.9169 -22.2745 -22.2745 -22.2741 -22.2741 -22.2555 -22.2555 -22.2547 -22.2547 1.3878 1.3878 1.3882 1.3882 2.2189 2.2189 2.2231 2.2231 5.9558 5.9558 6.0462 6.0462 7.1679 7.1679 7.1961 7.1961 8.0373 8.0373 8.1957 8.1957 9.3102 9.3102 9.3867 9.3867 9.5091 9.5091 9.5469 9.5469 12.4545 12.4545 12.4575 12.4575 12.6884 12.6884 k = 0.2907 0.5000-0.0000 ( 9186 PWs) bands (ev): -46.2012 -46.2012 -46.2012 -46.2012 -22.9177 -22.9177 -22.9172 -22.9172 -22.2748 -22.2748 -22.2745 -22.2745 -22.2558 -22.2558 -22.2550 -22.2550 1.4388 1.4388 1.4393 1.4393 2.2645 2.2645 2.2686 2.2686 5.9477 5.9477 6.0425 6.0425 7.0455 7.0455 7.0707 7.0707 7.9624 7.9624 8.1339 8.1339 9.2782 9.2782 9.3613 9.3613 9.4922 9.4922 9.5281 9.5281 12.4591 12.4591 12.4619 12.4619 12.6895 12.6895 k = 0.3023 0.5000-0.0000 ( 9186 PWs) bands (ev): -46.2011 -46.2011 -46.2011 -46.2011 -22.9180 -22.9180 -22.9174 -22.9174 -22.2751 -22.2751 -22.2748 -22.2748 -22.2560 -22.2560 -22.2553 -22.2553 1.4908 1.4908 1.4913 1.4913 2.3105 2.3105 2.3146 2.3146 5.9332 5.9332 6.0310 6.0310 6.9269 6.9269 6.9487 6.9487 7.8986 7.8986 8.0816 8.0816 9.2435 9.2435 9.3330 9.3330 9.4759 9.4759 9.5102 9.5102 12.4643 12.4643 12.4669 12.4669 12.6914 12.6914 k = 0.3140 0.5000-0.0000 ( 9188 PWs) bands (ev): -46.2010 -46.2010 -46.2010 -46.2010 -22.9183 -22.9183 -22.9177 -22.9177 -22.2754 -22.2754 -22.2752 -22.2752 -22.2563 -22.2563 -22.2555 -22.2555 1.5434 1.5434 1.5441 1.5441 2.3568 2.3568 2.3608 2.3608 5.9120 5.9120 6.0111 6.0111 6.8123 6.8123 6.8305 6.8305 7.8470 7.8470 8.0394 8.0394 9.2060 9.2060 9.3018 9.3018 9.4604 9.4604 9.4931 9.4931 12.4700 12.4700 12.4723 12.4723 12.6938 12.6938 k = 0.3256 0.5000-0.0000 ( 9202 PWs) bands (ev): -46.2010 -46.2010 -46.2010 -46.2010 -22.9185 -22.9185 -22.9180 -22.9180 -22.2758 -22.2758 -22.2755 -22.2755 -22.2564 -22.2564 -22.2557 -22.2557 1.5966 1.5966 1.5973 1.5973 2.4032 2.4032 2.4071 2.4071 5.8844 5.8844 5.9827 5.9827 6.7018 6.7018 6.7162 6.7162 7.8080 7.8080 8.0078 8.0078 9.1658 9.1658 9.2675 9.2675 9.4458 9.4458 9.4768 9.4768 12.4760 12.4760 12.4780 12.4780 12.6968 12.6968 k = 0.3372 0.5000-0.0000 ( 9198 PWs) bands (ev): -46.2009 -46.2009 -46.2009 -46.2009 -22.9187 -22.9187 -22.9182 -22.9182 -22.2761 -22.2761 -22.2759 -22.2759 -22.2566 -22.2566 -22.2559 -22.2559 1.6499 1.6499 1.6508 1.6508 2.4492 2.4492 2.4530 2.4530 5.8509 5.8509 5.9463 5.9463 6.5956 6.5956 6.6062 6.6062 7.7821 7.7821 7.9867 7.9867 9.1230 9.1230 9.2303 9.2303 9.4322 9.4322 9.4614 9.4614 12.4823 12.4823 12.4840 12.4840 12.7003 12.7003 k = 0.3488 0.5000-0.0000 ( 9202 PWs) bands (ev): -46.2008 -46.2008 -46.2008 -46.2008 -22.9190 -22.9190 -22.9185 -22.9185 -22.2765 -22.2765 -22.2763 -22.2763 -22.2567 -22.2567 -22.2561 -22.2561 1.7032 1.7032 1.7042 1.7042 2.4946 2.4946 2.4982 2.4982 5.8122 5.8122 5.9029 5.9029 6.4936 6.4936 6.5006 6.5006 7.7687 7.7687 7.9761 7.9761 9.0775 9.0775 9.1901 9.1901 9.4197 9.4197 9.4469 9.4469 12.4887 12.4887 12.4901 12.4901 12.7042 12.7042 k = 0.3605 0.5000-0.0000 ( 9200 PWs) bands (ev): -46.2008 -46.2008 -46.2008 -46.2008 -22.9192 -22.9192 -22.9187 -22.9187 -22.2768 -22.2768 -22.2767 -22.2767 -22.2568 -22.2568 -22.2562 -22.2562 1.7560 1.7560 1.7570 1.7570 2.5390 2.5390 2.5424 2.5424 5.7696 5.7696 5.8542 5.8542 6.3958 6.3958 6.3995 6.3995 7.7673 7.7673 7.9753 7.9753 9.0296 9.0296 9.1471 9.1471 9.4081 9.4081 9.4333 9.4333 12.4950 12.4950 12.4961 12.4961 12.7085 12.7085 k = 0.3721 0.5000-0.0000 ( 9200 PWs) bands (ev): -46.2007 -46.2007 -46.2007 -46.2007 -22.9194 -22.9194 -22.9190 -22.9190 -22.2772 -22.2772 -22.2770 -22.2770 -22.2569 -22.2569 -22.2564 -22.2564 1.8079 1.8079 1.8091 1.8091 2.5819 2.5819 2.5852 2.5852 5.7245 5.7245 5.8020 5.8020 6.3022 6.3022 6.3031 6.3031 7.7767 7.7767 7.9837 7.9837 8.9794 8.9794 9.1015 9.1015 9.3975 9.3975 9.4207 9.4207 12.5012 12.5012 12.5020 12.5020 12.7131 12.7131 k = 0.3837 0.5000-0.0000 ( 9196 PWs) bands (ev): -46.2007 -46.2007 -46.2007 -46.2007 -22.9196 -22.9196 -22.9192 -22.9192 -22.2775 -22.2775 -22.2774 -22.2774 -22.2569 -22.2569 -22.2565 -22.2565 1.8585 1.8585 1.8597 1.8597 2.6230 2.6230 2.6261 2.6261 5.6785 5.6785 5.7484 5.7484 6.2117 6.2117 6.2130 6.2130 7.7957 7.7957 8.0003 8.0003 8.9272 8.9272 9.0535 9.0535 9.3880 9.3880 9.4090 9.4090 12.5070 12.5070 12.5076 12.5076 12.7178 12.7178 k = 0.3953 0.5000-0.0000 ( 9188 PWs) bands (ev): -46.2006 -46.2006 -46.2006 -46.2006 -22.9197 -22.9197 -22.9194 -22.9194 -22.2778 -22.2778 -22.2777 -22.2777 -22.2569 -22.2569 -22.2565 -22.2565 1.9073 1.9073 1.9085 1.9085 2.6618 2.6618 2.6647 2.6647 5.6330 5.6330 5.6951 5.6951 6.1256 6.1256 6.1284 6.1284 7.8231 7.8231 8.0242 8.0242 8.8731 8.8731 9.0033 9.0033 9.3794 9.3794 9.3983 9.3983 12.5125 12.5125 12.5128 12.5128 12.7226 12.7226 k = 0.4070 0.5000-0.0000 ( 9200 PWs) bands (ev): -46.2006 -46.2006 -46.2006 -46.2006 -22.9199 -22.9199 -22.9196 -22.9196 -22.2781 -22.2781 -22.2780 -22.2780 -22.2570 -22.2570 -22.2566 -22.2566 1.9536 1.9536 1.9549 1.9549 2.6979 2.6979 2.7005 2.7005 5.5896 5.5896 5.6441 5.6441 6.0452 6.0452 6.0488 6.0488 7.8576 7.8576 8.0543 8.0543 8.8176 8.8176 8.9513 8.9513 9.3718 9.3718 9.3886 9.3886 12.5174 12.5174 12.5176 12.5176 12.7273 12.7273 k = 0.4186 0.5000-0.0000 ( 9196 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9200 -22.9200 -22.9197 -22.9197 -22.2784 -22.2784 -22.2783 -22.2783 -22.2570 -22.2570 -22.2567 -22.2567 1.9969 1.9969 1.9982 1.9982 2.7308 2.7308 2.7331 2.7331 5.5496 5.5496 5.5967 5.5967 5.9710 5.9710 5.9749 5.9749 7.8979 7.8979 8.0895 8.0895 8.7611 8.7611 8.8976 8.8976 9.3652 9.3652 9.3799 9.3799 12.5218 12.5218 12.5219 12.5219 12.7318 12.7318 k = 0.4302 0.5000-0.0000 ( 9192 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9201 -22.9201 -22.9199 -22.9199 -22.2786 -22.2786 -22.2786 -22.2786 -22.2570 -22.2570 -22.2567 -22.2567 2.0365 2.0365 2.0378 2.0378 2.7600 2.7600 2.7621 2.7621 5.5143 5.5143 5.5542 5.5542 5.9036 5.9036 5.9073 5.9073 7.9431 7.9431 8.1286 8.1286 8.7041 8.7041 8.8427 8.8427 9.3596 9.3596 9.3722 9.3722 12.5256 12.5256 12.5256 12.5256 12.7361 12.7361 k = 0.4419 0.5000-0.0000 ( 9188 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9202 -22.9202 -22.9200 -22.9200 -22.2788 -22.2788 -22.2788 -22.2788 -22.2570 -22.2570 -22.2568 -22.2568 2.0717 2.0717 2.0729 2.0729 2.7854 2.7854 2.7872 2.7872 5.4843 5.4843 5.5175 5.5175 5.8439 5.8439 5.8472 5.8472 7.9921 7.9921 8.1702 8.1702 8.6478 8.6478 8.7870 8.7870 9.3550 9.3550 9.3654 9.3654 12.5287 12.5287 12.5288 12.5288 12.7400 12.7400 k = 0.4535 0.5000-0.0000 ( 9194 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9203 -22.9203 -22.9201 -22.9201 -22.2790 -22.2790 -22.2790 -22.2790 -22.2570 -22.2570 -22.2568 -22.2568 2.1018 2.1018 2.1028 2.1028 2.8065 2.8065 2.8080 2.8080 5.4605 5.4605 5.4870 5.4870 5.7928 5.7928 5.7953 5.7953 8.0438 8.0438 8.2119 8.2119 8.5938 8.5938 8.7310 8.7310 9.3514 9.3514 9.3598 9.3598 12.5313 12.5313 12.5314 12.5314 12.7433 12.7433 k = 0.4651 0.5000-0.0000 ( 9200 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9202 -22.9202 -22.2791 -22.2791 -22.2791 -22.2791 -22.2570 -22.2570 -22.2568 -22.2568 2.1261 2.1261 2.1269 2.1269 2.8232 2.8232 2.8243 2.8243 5.4430 5.4430 5.4630 5.4630 5.7513 5.7513 5.7531 5.7531 8.0971 8.0971 8.2497 8.2497 8.5460 8.5460 8.6755 8.6755 9.3488 9.3488 9.3551 9.3551 12.5333 12.5333 12.5334 12.5334 12.7460 12.7460 k = 0.4767 0.5000-0.0000 ( 9196 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9203 -22.9203 -22.2792 -22.2792 -22.2792 -22.2792 -22.2570 -22.2570 -22.2569 -22.2569 2.1440 2.1440 2.1445 2.1445 2.8352 2.8352 2.8360 2.8360 5.4319 5.4319 5.4452 5.4452 5.7206 5.7206 5.7217 5.7217 8.1507 8.1507 8.2751 8.2751 8.5126 8.5126 8.6216 8.6216 9.3473 9.3473 9.3514 9.3514 12.5347 12.5347 12.5348 12.5348 12.7480 12.7480 k = 0.4884 0.5000-0.0000 ( 9196 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1550 2.1550 2.1553 2.1553 2.8425 2.8425 2.8429 2.8429 5.4268 5.4268 5.4335 5.4335 5.7017 5.7017 5.7022 5.7022 8.2021 8.2021 8.2749 8.2749 8.5065 8.5065 8.5716 8.5716 9.3468 9.3468 9.3488 9.3488 12.5356 12.5356 12.5356 12.5356 12.7493 12.7493 k = 0.5000 0.5000-0.0000 ( 9188 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1588 2.1588 2.1588 2.1588 2.8451 2.8451 2.8451 2.8451 5.4273 5.4273 5.4273 5.4273 5.6954 5.6954 5.6954 5.6954 8.2467 8.2467 8.2467 8.2467 8.5300 8.5300 8.5300 8.5300 9.3473 9.3473 9.3473 9.3473 12.5359 12.5359 12.5359 12.5359 12.7498 12.7498 k = 0.5000 0.5000-0.0000 ( 9188 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1588 2.1588 2.1588 2.1588 2.8451 2.8451 2.8451 2.8451 5.4273 5.4273 5.4273 5.4273 5.6954 5.6954 5.6954 5.6954 8.2467 8.2467 8.2467 8.2467 8.5300 8.5300 8.5300 8.5300 9.3473 9.3473 9.3473 9.3473 12.5359 12.5359 12.5359 12.5359 12.7498 12.7498 k = 0.4918 0.4918-0.0000 ( 9186 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1510 2.1510 2.1593 2.1593 2.8390 2.8390 2.8465 2.8465 5.4264 5.4264 5.4337 5.4337 5.6968 5.6968 5.7070 5.7070 8.2000 8.2000 8.2782 8.2782 8.5037 8.5037 8.5731 8.5731 9.3466 9.3466 9.3490 9.3490 12.5345 12.5345 12.5367 12.5367 12.7489 12.7489 k = 0.4836 0.4836-0.0000 ( 9190 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9203 -22.9203 -22.2792 -22.2792 -22.2792 -22.2792 -22.2570 -22.2570 -22.2569 -22.2569 2.1280 2.1280 2.1608 2.1608 2.8209 2.8209 2.8506 2.8506 5.4294 5.4294 5.4475 5.4475 5.7009 5.7009 5.7410 5.7410 8.1379 8.1379 8.3009 8.3009 8.4907 8.4907 8.6303 8.6303 9.3464 9.3464 9.3523 9.3523 12.5305 12.5305 12.5390 12.5390 12.7463 12.7463 k = 0.4754 0.4754-0.0000 ( 9188 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9202 -22.9202 -22.2791 -22.2791 -22.2791 -22.2791 -22.2570 -22.2570 -22.2568 -22.2568 2.0905 2.0905 2.1634 2.1634 2.7912 2.7912 2.8574 2.8574 5.4351 5.4351 5.4702 5.4702 5.7077 5.7077 5.7956 5.7956 8.0648 8.0648 8.3214 8.3214 8.4857 8.4857 8.6959 8.6959 9.3464 9.3464 9.3575 9.3575 12.5238 12.5238 12.5430 12.5430 12.7419 12.7419 k = 0.4672 0.4672-0.0000 ( 9188 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9203 -22.9203 -22.9201 -22.9201 -22.2790 -22.2790 -22.2790 -22.2790 -22.2570 -22.2570 -22.2568 -22.2568 2.0397 2.0397 2.1669 2.1669 2.7508 2.7508 2.8670 2.8670 5.4430 5.4430 5.5023 5.5023 5.7174 5.7174 5.8688 5.8688 7.9847 7.9847 8.3436 8.3436 8.4850 8.4850 8.7657 8.7657 9.3464 9.3464 9.3647 9.3647 12.5146 12.5146 12.5485 12.5485 12.7360 12.7360 k = 0.4590 0.4590-0.0000 ( 9196 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9202 -22.9202 -22.9200 -22.9200 -22.2788 -22.2788 -22.2788 -22.2788 -22.2570 -22.2570 -22.2568 -22.2568 1.9772 1.9772 2.1713 2.1713 2.7005 2.7005 2.8793 2.8793 5.4529 5.4529 5.5438 5.5438 5.7301 5.7301 5.9582 5.9582 7.9004 7.9004 8.3689 8.3689 8.4871 8.4871 8.8372 8.8372 9.3465 9.3465 9.3740 9.3740 12.5029 12.5029 12.5555 12.5555 12.7285 12.7285 k = 0.4508 0.4508-0.0000 ( 9200 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9201 -22.9201 -22.9199 -22.9199 -22.2786 -22.2786 -22.2785 -22.2785 -22.2570 -22.2570 -22.2567 -22.2567 1.9046 1.9046 2.1765 2.1765 2.6416 2.6416 2.8943 2.8943 5.4647 5.4647 5.5934 5.5934 5.7462 5.7462 6.0620 6.0620 7.8136 7.8136 8.3979 8.3979 8.4910 8.4910 8.9090 8.9090 9.3466 9.3466 9.3853 9.3853 12.4889 12.4889 12.5641 12.5641 12.7195 12.7195 k = 0.4426 0.4426-0.0000 ( 9202 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9200 -22.9200 -22.9197 -22.9197 -22.2783 -22.2783 -22.2783 -22.2783 -22.2570 -22.2570 -22.2567 -22.2567 1.8233 1.8233 2.1826 2.1826 2.5750 2.5750 2.9120 2.9120 5.4786 5.4786 5.6494 5.6494 5.7665 5.7665 6.1783 6.1783 7.7253 7.7253 8.4302 8.4302 8.4969 8.4969 8.9804 8.9804 9.3468 9.3468 9.3987 9.3987 12.4726 12.4726 12.5741 12.5741 12.7093 12.7093 k = 0.4344 0.4344-0.0000 ( 9188 PWs) bands (ev): -46.2006 -46.2006 -46.2006 -46.2006 -22.9199 -22.9199 -22.9195 -22.9195 -22.2780 -22.2780 -22.2780 -22.2780 -22.2571 -22.2571 -22.2566 -22.2566 1.7350 1.7350 2.1894 2.1894 2.5021 2.5021 2.9325 2.9325 5.4943 5.4943 5.7080 5.7080 5.7937 5.7937 6.3056 6.3056 7.6364 7.6364 8.4646 8.4646 8.5055 8.5055 9.0509 9.0509 9.3472 9.3472 9.4142 9.4142 12.4543 12.4543 12.5856 12.5856 12.6981 12.6981 k = 0.4262 0.4262-0.0000 ( 9182 PWs) bands (ev): -46.2006 -46.2006 -46.2006 -46.2006 -22.9197 -22.9197 -22.9193 -22.9193 -22.2777 -22.2777 -22.2776 -22.2776 -22.2571 -22.2571 -22.2566 -22.2566 1.6408 1.6408 2.1968 2.1968 2.4238 2.4238 2.9557 2.9557 5.5121 5.5121 5.7607 5.7607 5.8350 5.8350 6.4426 6.4426 7.5476 7.5476 8.4945 8.4945 8.5230 8.5230 9.1203 9.1203 9.3477 9.3477 9.4318 9.4318 12.4341 12.4341 12.5984 12.5984 12.6862 12.6862 k = 0.4180 0.4180-0.0000 ( 9190 PWs) bands (ev): -46.2007 -46.2007 -46.2007 -46.2007 -22.9196 -22.9196 -22.9191 -22.9191 -22.2773 -22.2773 -22.2772 -22.2772 -22.2571 -22.2571 -22.2565 -22.2565 1.5421 1.5421 2.2046 2.2046 2.3411 2.3411 2.9816 2.9816 5.5318 5.5318 5.8009 5.8009 5.8962 5.8962 6.5881 6.5881 7.4593 7.4593 8.5105 8.5105 8.5583 8.5583 9.1883 9.1883 9.3487 9.3487 9.4516 9.4516 12.4120 12.4120 12.6126 12.6126 12.6739 12.6739 k = 0.4098 0.4098-0.0000 ( 9190 PWs) bands (ev): -46.2007 -46.2007 -46.2007 -46.2007 -22.9194 -22.9194 -22.9189 -22.9189 -22.2769 -22.2769 -22.2768 -22.2768 -22.2571 -22.2571 -22.2564 -22.2564 1.4399 1.4399 2.2129 2.2129 2.2549 2.2549 3.0103 3.0103 5.5535 5.5535 5.8343 5.8343 5.9704 5.9704 6.7410 6.7410 7.3722 7.3722 8.5217 8.5217 8.6016 8.6016 9.2542 9.2542 9.3506 9.3506 9.4738 9.4738 12.3884 12.3884 12.6275 12.6275 12.6620 12.6620 k = 0.4016 0.4016-0.0000 ( 9188 PWs) bands (ev): -46.2008 -46.2008 -46.2008 -46.2008 -22.9192 -22.9192 -22.9186 -22.9186 -22.2765 -22.2765 -22.2764 -22.2764 -22.2571 -22.2571 -22.2564 -22.2564 1.3349 1.3349 2.1660 2.1660 2.2214 2.2214 3.0416 3.0416 5.5770 5.5770 5.8667 5.8667 6.0511 6.0511 6.9003 6.9003 7.2868 7.2868 8.5325 8.5325 8.6479 8.6479 9.3139 9.3139 9.3573 9.3573 9.4986 9.4986 12.3632 12.3632 12.6399 12.6399 12.6543 12.6543 k = 0.3934 0.3934-0.0000 ( 9172 PWs) bands (ev): -46.2009 -46.2009 -46.2008 -46.2008 -22.9189 -22.9189 -22.9183 -22.9183 -22.2760 -22.2760 -22.2759 -22.2759 -22.2571 -22.2571 -22.2563 -22.2563 1.2281 1.2281 2.0750 2.0750 2.2299 2.2299 3.0757 3.0757 5.6025 5.6025 5.9001 5.9001 6.1356 6.1356 7.0646 7.0646 7.2041 7.2041 8.5440 8.5440 8.6956 8.6956 9.3414 9.3414 9.3943 9.3943 9.5267 9.5267 12.3366 12.3366 12.6350 12.6350 12.6656 12.6656 k = 0.3852 0.3852-0.0000 ( 9178 PWs) bands (ev): -46.2009 -46.2009 -46.2009 -46.2009 -22.9187 -22.9187 -22.9181 -22.9181 -22.2755 -22.2755 -22.2754 -22.2754 -22.2571 -22.2571 -22.2562 -22.2562 1.1200 1.1200 1.9826 1.9826 2.2384 2.2384 3.1126 3.1126 5.6298 5.6298 5.9353 5.9353 6.2224 6.2224 7.1209 7.1209 7.2368 7.2368 8.5561 8.5561 8.7440 8.7440 9.3463 9.3463 9.4511 9.4511 9.5589 9.5589 12.3087 12.3087 12.6255 12.6255 12.6828 12.6828 k = 0.3770 0.3770-0.0000 ( 9172 PWs) bands (ev): -46.2010 -46.2010 -46.2010 -46.2010 -22.9184 -22.9184 -22.9177 -22.9177 -22.2750 -22.2750 -22.2748 -22.2748 -22.2571 -22.2571 -22.2561 -22.2561 1.0111 1.0111 1.8892 1.8892 2.2467 2.2467 3.1521 3.1521 5.6589 5.6589 5.9725 5.9725 6.3109 6.3109 7.0441 7.0441 7.4095 7.4095 8.5691 8.5691 8.7924 8.7924 9.3487 9.3487 9.5058 9.5058 9.5973 9.5973 12.2796 12.2796 12.6168 12.6168 12.6909 12.6909 k = 0.3689 0.3689-0.0000 ( 9174 PWs) bands (ev): -46.2011 -46.2011 -46.2011 -46.2011 -22.9181 -22.9181 -22.9174 -22.9174 -22.2744 -22.2744 -22.2742 -22.2742 -22.2572 -22.2572 -22.2560 -22.2560 0.9020 0.9020 1.7952 1.7952 2.2545 2.2545 3.1944 3.1944 5.6897 5.6897 6.0117 6.0117 6.4002 6.4002 6.9704 6.9704 7.5858 7.5858 8.5829 8.5829 8.8404 8.8404 9.3507 9.3507 9.5544 9.5544 9.6436 9.6436 12.2495 12.2495 12.6095 12.6095 12.6818 12.6818 k = 0.3607 0.3607-0.0000 ( 9170 PWs) bands (ev): -46.2012 -46.2012 -46.2011 -46.2011 -22.9179 -22.9179 -22.9171 -22.9171 -22.2738 -22.2738 -22.2736 -22.2736 -22.2572 -22.2572 -22.2559 -22.2559 0.7930 0.7930 1.7011 1.7011 2.2617 2.2617 3.2394 3.2394 5.7222 5.7222 6.0531 6.0531 6.4897 6.4897 6.9011 6.9011 7.7641 7.7641 8.5975 8.5975 8.8876 8.8876 9.3530 9.3530 9.5972 9.5972 9.6973 9.6973 12.2182 12.2182 12.6037 12.6037 12.6691 12.6691 k = 0.3525 0.3525-0.0000 ( 9178 PWs) bands (ev): -46.2013 -46.2013 -46.2012 -46.2012 -22.9175 -22.9175 -22.9167 -22.9167 -22.2732 -22.2732 -22.2729 -22.2729 -22.2572 -22.2572 -22.2558 -22.2558 0.6846 0.6846 1.6072 1.6072 2.2681 2.2681 3.2871 3.2871 5.7562 5.7562 6.0966 6.0966 6.5780 6.5780 6.8378 6.8378 7.9429 7.9429 8.6130 8.6130 8.9343 8.9343 9.3556 9.3556 9.6365 9.6365 9.7559 9.7559 12.1859 12.1859 12.5994 12.5994 12.6548 12.6548 k = 0.3443 0.3443-0.0000 ( 9184 PWs) bands (ev): -46.2014 -46.2014 -46.2013 -46.2013 -22.9172 -22.9172 -22.9163 -22.9163 -22.2725 -22.2725 -22.2723 -22.2723 -22.2572 -22.2572 -22.2557 -22.2557 0.5768 0.5768 1.5137 1.5137 2.2735 2.2735 3.3375 3.3375 5.7917 5.7917 6.1421 6.1421 6.6596 6.6596 6.7862 6.7862 8.1202 8.1202 8.6293 8.6293 8.9811 8.9811 9.3588 9.3588 9.6746 9.6746 9.8170 9.8170 12.1526 12.1526 12.5962 12.5962 12.6392 12.6392 k = 0.3361 0.3361-0.0000 ( 9188 PWs) bands (ev): -46.2014 -46.2014 -46.2014 -46.2014 -22.9169 -22.9169 -22.9159 -22.9159 -22.2718 -22.2718 -22.2716 -22.2716 -22.2572 -22.2572 -22.2556 -22.2556 0.4701 0.4701 1.4209 1.4209 2.2776 2.2776 3.3907 3.3907 5.8284 5.8284 6.1893 6.1893 6.6901 6.6901 6.7910 6.7910 8.2931 8.2931 8.6464 8.6464 9.0297 9.0297 9.3631 9.3631 9.7126 9.7126 9.8795 9.8795 12.1184 12.1184 12.5938 12.5938 12.6224 12.6224 k = 0.3279 0.3279-0.0000 ( 9196 PWs) bands (ev): -46.2015 -46.2015 -46.2015 -46.2015 -22.9166 -22.9166 -22.9155 -22.9155 -22.2711 -22.2711 -22.2709 -22.2709 -22.2572 -22.2572 -22.2554 -22.2554 0.3646 0.3646 1.3291 1.3291 2.2804 2.2804 3.4465 3.4465 5.8662 5.8662 6.2382 6.2382 6.6559 6.6559 6.8662 6.8662 8.4572 8.4572 8.6643 8.6643 9.0831 9.0831 9.3694 9.3694 9.7512 9.7512 9.9426 9.9426 12.0831 12.0831 12.5920 12.5920 12.6045 12.6045 k = 0.3197 0.3197-0.0000 ( 9202 PWs) bands (ev): -46.2016 -46.2016 -46.2016 -46.2016 -22.9162 -22.9162 -22.9151 -22.9151 -22.2704 -22.2704 -22.2701 -22.2701 -22.2572 -22.2572 -22.2553 -22.2553 0.2605 0.2605 1.2383 1.2383 2.2816 2.2816 3.5051 3.5051 5.9047 5.9047 6.2879 6.2879 6.6182 6.6182 6.9515 6.9515 8.6051 8.6051 8.6833 8.6833 9.1453 9.1453 9.3800 9.3800 9.7906 9.7906 10.0060 10.0060 12.0468 12.0468 12.5855 12.5855 12.5907 12.5907 k = 0.3115 0.3115-0.0000 ( 9208 PWs) bands (ev): -46.2017 -46.2017 -46.2017 -46.2017 -22.9158 -22.9158 -22.9147 -22.9147 -22.2697 -22.2697 -22.2693 -22.2693 -22.2572 -22.2572 -22.2552 -22.2552 0.1580 0.1580 1.1487 1.1487 2.2811 2.2811 3.5664 3.5664 5.9435 5.9435 6.3375 6.3375 6.5877 6.5877 7.0372 7.0372 8.7000 8.7000 8.7318 8.7318 9.2170 9.2170 9.4024 9.4024 9.8309 9.8309 10.0695 10.0695 12.0094 12.0094 12.5654 12.5654 12.5901 12.5901 k = 0.3033 0.3033-0.0000 ( 9198 PWs) bands (ev): -46.2018 -46.2018 -46.2018 -46.2018 -22.9155 -22.9155 -22.9143 -22.9143 -22.2689 -22.2689 -22.2686 -22.2686 -22.2572 -22.2572 -22.2550 -22.2550 0.0572 0.0572 1.0606 1.0606 2.2786 2.2786 3.6303 3.6303 5.9823 5.9823 6.3842 6.3842 6.5691 6.5691 7.1213 7.1213 8.7212 8.7212 8.8251 8.8251 9.2811 9.2811 9.4589 9.4589 9.8723 9.8723 10.1330 10.1330 11.9709 11.9709 12.5442 12.5442 12.5906 12.5906 k = 0.2951 0.2951-0.0000 ( 9194 PWs) bands (ev): -46.2019 -46.2019 -46.2019 -46.2019 -22.9151 -22.9151 -22.9138 -22.9138 -22.2682 -22.2682 -22.2678 -22.2678 -22.2572 -22.2572 -22.2549 -22.2549 -0.0417 -0.0417 0.9740 0.9740 2.2742 2.2742 3.6970 3.6970 6.0203 6.0203 6.4228 6.4228 6.5688 6.5688 7.2028 7.2028 8.7419 8.7419 8.8931 8.8931 9.3155 9.3155 9.5683 9.5683 9.9147 9.9147 10.1962 10.1962 11.9311 11.9311 12.5220 12.5220 12.5929 12.5929 k = 0.2869 0.2869-0.0000 ( 9194 PWs) bands (ev): -46.2021 -46.2021 -46.2020 -46.2020 -22.9147 -22.9147 -22.9134 -22.9134 -22.2674 -22.2674 -22.2669 -22.2669 -22.2572 -22.2572 -22.2547 -22.2547 -0.1387 -0.1387 0.8891 0.8891 2.2676 2.2676 3.7663 3.7663 6.0568 6.0568 6.4480 6.4480 6.5931 6.5931 7.2807 7.2807 8.7632 8.7632 8.9431 8.9431 9.3304 9.3304 9.7119 9.7119 9.9584 9.9584 10.2591 10.2591 11.8899 11.8899 12.4987 12.4987 12.5976 12.5976 k = 0.2787 0.2787-0.0000 ( 9192 PWs) bands (ev): -46.2022 -46.2022 -46.2021 -46.2021 -22.9143 -22.9143 -22.9129 -22.9129 -22.2666 -22.2666 -22.2661 -22.2661 -22.2572 -22.2572 -22.2546 -22.2546 -0.2336 -0.2336 0.8059 0.8059 2.2589 2.2589 3.8384 3.8384 6.0911 6.0911 6.4647 6.4647 6.6378 6.6378 7.3542 7.3542 8.7850 8.7850 8.9830 8.9830 9.3380 9.3380 9.8684 9.8684 10.0044 10.0044 10.3215 10.3215 11.8472 11.8472 12.4743 12.4743 12.6057 12.6057 k = 0.2705 0.2705-0.0000 ( 9188 PWs) bands (ev): -46.2023 -46.2023 -46.2022 -46.2022 -22.9139 -22.9139 -22.9125 -22.9125 -22.2658 -22.2658 -22.2653 -22.2653 -22.2572 -22.2572 -22.2544 -22.2544 -0.3264 -0.3264 0.7245 0.7245 2.2479 2.2479 3.9131 3.9131 6.1228 6.1228 6.4825 6.4825 6.6938 6.6938 7.4222 7.4222 8.8076 8.8076 9.0186 9.0186 9.3424 9.3424 10.0142 10.0142 10.0665 10.0665 10.3833 10.3833 11.8028 11.8028 12.4489 12.4489 12.6179 12.6179 k = 0.2623 0.2623-0.0000 ( 9184 PWs) bands (ev): -46.2024 -46.2024 -46.2023 -46.2023 -22.9135 -22.9135 -22.9120 -22.9120 -22.2649 -22.2649 -22.2644 -22.2644 -22.2572 -22.2572 -22.2542 -22.2542 -0.4169 -0.4169 0.6451 0.6451 2.2348 2.2348 3.9904 3.9904 6.1517 6.1517 6.5065 6.5065 6.7559 6.7559 7.4837 7.4837 8.8311 8.8311 9.0536 9.0536 9.3453 9.3453 10.0830 10.0830 10.2049 10.2049 10.4446 10.4446 11.7565 11.7565 12.4224 12.4224 12.6351 12.6351 k = 0.2541 0.2541-0.0000 ( 9188 PWs) bands (ev): -46.2025 -46.2025 -46.2024 -46.2024 -22.9131 -22.9131 -22.9115 -22.9115 -22.2641 -22.2641 -22.2636 -22.2636 -22.2572 -22.2572 -22.2541 -22.2541 -0.5052 -0.5052 0.5676 0.5676 2.2195 2.2195 4.0705 4.0705 6.1785 6.1785 6.5384 6.5384 6.8216 6.8216 7.5377 7.5377 8.8556 8.8556 9.0909 9.0909 9.3473 9.3473 10.1314 10.1314 10.3589 10.3589 10.5052 10.5052 11.7080 11.7080 12.3949 12.3949 12.6578 12.6578 k = 0.2459 0.2459-0.0000 ( 9190 PWs) bands (ev): -46.2026 -46.2026 -46.2025 -46.2025 -22.9127 -22.9127 -22.9110 -22.9110 -22.2633 -22.2633 -22.2627 -22.2627 -22.2571 -22.2571 -22.2539 -22.2539 -0.5911 -0.5911 0.4922 0.4922 2.2021 2.2021 4.1531 4.1531 6.2042 6.2042 6.5779 6.5779 6.8899 6.8899 7.5834 7.5834 8.8812 8.8812 9.1322 9.1322 9.3489 9.3489 10.1783 10.1783 10.5048 10.5048 10.5667 10.5667 11.6571 11.6571 12.3664 12.3664 12.6863 12.6863 k = 0.2377 0.2377-0.0000 ( 9182 PWs) bands (ev): -46.2027 -46.2027 -46.2026 -46.2026 -22.9123 -22.9123 -22.9106 -22.9106 -22.2625 -22.2625 -22.2619 -22.2619 -22.2571 -22.2571 -22.2537 -22.2537 -0.6746 -0.6746 0.4189 0.4189 2.1827 2.1827 4.2384 4.2384 6.2301 6.2301 6.6240 6.6240 6.9601 6.9601 7.6205 7.6205 8.9080 8.9080 9.1787 9.1787 9.3507 9.3507 10.2252 10.2252 10.6129 10.6129 10.6548 10.6548 11.6035 11.6035 12.3368 12.3368 12.7203 12.7203 k = 0.2295 0.2295-0.0000 ( 9168 PWs) bands (ev): -46.2028 -46.2028 -46.2027 -46.2027 -22.9119 -22.9119 -22.9101 -22.9101 -22.2616 -22.2616 -22.2610 -22.2610 -22.2571 -22.2571 -22.2535 -22.2535 -0.7556 -0.7556 0.3478 0.3478 2.1615 2.1615 4.3264 4.3264 6.2572 6.2572 6.6756 6.6756 7.0318 7.0318 7.6489 7.6489 8.9358 8.9358 9.2299 9.2299 9.3541 9.3541 10.2721 10.2721 10.6737 10.6737 10.7767 10.7767 11.5469 11.5469 12.3064 12.3064 12.7588 12.7588 k = 0.2213 0.2213-0.0000 ( 9162 PWs) bands (ev): -46.2029 -46.2029 -46.2028 -46.2028 -22.9115 -22.9115 -22.9096 -22.9096 -22.2608 -22.2608 -22.2602 -22.2602 -22.2571 -22.2571 -22.2534 -22.2534 -0.8341 -0.8341 0.2789 0.2789 2.1386 2.1386 4.4169 4.4169 6.2865 6.2865 6.7318 6.7318 7.1042 7.1042 7.6690 7.6690 8.9646 8.9646 9.2811 9.2811 9.3645 9.3645 10.3190 10.3190 10.7291 10.7291 10.8889 10.8889 11.4869 11.4869 12.2751 12.2751 12.7891 12.7893 k = 0.2131 0.2131-0.0000 ( 9162 PWs) bands (ev): -46.2030 -46.2030 -46.2029 -46.2029 -22.9111 -22.9111 -22.9092 -22.9092 -22.2600 -22.2600 -22.2593 -22.2593 -22.2570 -22.2570 -22.2532 -22.2532 -0.9101 -0.9101 0.2123 0.2123 2.1142 2.1142 4.5100 4.5100 6.3183 6.3183 6.7919 6.7919 7.1769 7.1769 7.6821 7.6821 8.9940 8.9940 9.3143 9.3143 9.4000 9.4000 10.3658 10.3658 10.7820 10.7820 10.9874 10.9874 11.4230 11.4230 12.2433 12.2433 12.7373 12.7373 k = 0.2049 0.2049-0.0000 ( 9160 PWs) bands (ev): -46.2031 -46.2031 -46.2030 -46.2030 -22.9108 -22.9108 -22.9087 -22.9087 -22.2592 -22.2592 -22.2585 -22.2585 -22.2570 -22.2570 -22.2530 -22.2530 -0.9835 -0.9835 0.1479 0.1479 2.0886 2.0886 4.6056 4.6056 6.3530 6.3530 6.8551 6.8551 7.2487 7.2487 7.6896 7.6896 9.0239 9.0239 9.3239 9.3239 9.4656 9.4656 10.4125 10.4125 10.8327 10.8327 11.0721 11.0721 11.3551 11.3551 12.2109 12.2109 12.6879 12.6879 k = 0.1967 0.1967-0.0000 ( 9154 PWs) bands (ev): -46.2032 -46.2032 -46.2031 -46.2031 -22.9104 -22.9104 -22.9082 -22.9082 -22.2584 -22.2584 -22.2577 -22.2577 -22.2569 -22.2569 -22.2528 -22.2528 -1.0542 -1.0542 0.0859 0.0859 2.0618 2.0618 4.7038 4.7038 6.3907 6.3907 6.9212 6.9212 7.3177 7.3177 7.6944 7.6944 9.0540 9.0540 9.3250 9.3250 9.5457 9.5457 10.4589 10.4589 10.8809 10.8809 11.1433 11.1433 11.2830 11.2830 12.1784 12.1784 12.6408 12.6408 k = 0.1885 0.1885-0.0000 ( 9168 PWs) bands (ev): -46.2033 -46.2033 -46.2032 -46.2032 -22.9100 -22.9100 -22.9078 -22.9078 -22.2576 -22.2576 -22.2571 -22.2571 -22.2567 -22.2567 -22.2527 -22.2527 -1.1222 -1.1222 0.0262 0.0262 2.0342 2.0342 4.8045 4.8045 6.4313 6.4313 6.9896 6.9896 7.3809 7.3809 7.7005 7.7005 9.0841 9.0841 9.3231 9.3231 9.6338 9.6338 10.5049 10.5049 10.9262 10.9262 11.1909 11.1909 11.2178 11.2178 12.1461 12.1461 12.5958 12.5958 k = 0.1803 0.1803-0.0000 ( 9164 PWs) bands (ev): -46.2034 -46.2034 -46.2033 -46.2033 -22.9096 -22.9096 -22.9073 -22.9073 -22.2571 -22.2571 -22.2568 -22.2568 -22.2560 -22.2560 -22.2525 -22.2525 -1.1876 -1.1876 -0.0311 -0.0311 2.0060 2.0060 4.9077 4.9077 6.4746 6.4746 7.0600 7.0600 7.4326 7.4326 7.7143 7.7143 9.1143 9.1143 9.3198 9.3198 9.7275 9.7275 10.5504 10.5504 10.9679 10.9679 11.1204 11.1204 11.2558 11.2558 12.1142 12.1142 12.5527 12.5527 k = 0.1721 0.1721-0.0000 ( 9160 PWs) bands (ev): -46.2035 -46.2035 -46.2034 -46.2034 -22.9093 -22.9093 -22.9069 -22.9069 -22.2570 -22.2570 -22.2560 -22.2560 -22.2552 -22.2552 -22.2523 -22.2523 -1.2502 -1.2502 -0.0860 -0.0860 1.9774 1.9774 5.0133 5.0133 6.5205 6.5205 7.1323 7.1323 7.4662 7.4662 7.7432 7.7432 9.1442 9.1442 9.3155 9.3155 9.8255 9.8255 10.5951 10.5951 10.9983 10.9983 11.0411 11.0411 11.2964 11.2964 12.0832 12.0832 12.5114 12.5114 k = 0.1639 0.1639-0.0000 ( 9158 PWs) bands (ev): -46.2036 -46.2036 -46.2034 -46.2034 -22.9089 -22.9089 -22.9065 -22.9065 -22.2569 -22.2569 -22.2553 -22.2553 -22.2545 -22.2545 -22.2521 -22.2521 -1.3101 -1.3101 -0.1385 -0.1385 1.9486 1.9486 5.1213 5.1213 6.5686 6.5686 7.2061 7.2061 7.4793 7.4793 7.7903 7.7903 9.1739 9.1739 9.3104 9.3104 9.9264 9.9264 10.6390 10.6390 10.9315 10.9315 11.0490 11.0490 11.3306 11.3306 12.0536 12.0536 12.4715 12.4715 k = 0.1557 0.1557-0.0000 ( 9154 PWs) bands (ev): -46.2037 -46.2037 -46.2035 -46.2035 -22.9086 -22.9086 -22.9061 -22.9061 -22.2569 -22.2569 -22.2546 -22.2546 -22.2537 -22.2537 -22.2520 -22.2520 -1.3672 -1.3672 -0.1885 -0.1885 1.9198 1.9198 5.2317 5.2317 6.6185 6.6185 7.2810 7.2810 7.4764 7.4764 7.8517 7.8517 9.2028 9.2028 9.3049 9.3049 10.0291 10.0291 10.6815 10.6815 10.8329 10.8329 11.0791 11.0791 11.3594 11.3594 12.0259 12.0259 12.4330 12.4330 k = 0.1475 0.1475-0.0000 ( 9158 PWs) bands (ev): -46.2038 -46.2038 -46.2036 -46.2036 -22.9082 -22.9082 -22.9057 -22.9057 -22.2568 -22.2568 -22.2539 -22.2539 -22.2530 -22.2530 -22.2518 -22.2518 -1.4214 -1.4214 -0.2360 -0.2360 1.8913 1.8913 5.3443 5.3443 6.6700 6.6700 7.3565 7.3565 7.4640 7.4640 7.9216 7.9216 9.2306 9.2306 9.2996 9.2996 10.1324 10.1324 10.7095 10.7095 10.7408 10.7408 11.1059 11.1059 11.3843 11.3843 12.0004 12.0004 12.3954 12.3954 k = 0.1393 0.1393-0.0000 ( 9150 PWs) bands (ev): -46.2039 -46.2039 -46.2037 -46.2037 -22.9079 -22.9079 -22.9053 -22.9053 -22.2568 -22.2568 -22.2532 -22.2532 -22.2524 -22.2524 -22.2516 -22.2516 -1.4729 -1.4729 -0.2810 -0.2810 1.8632 1.8632 5.4592 5.4592 6.7226 6.7226 7.4256 7.4256 7.4530 7.4530 7.9959 7.9959 9.2552 9.2552 9.2965 9.2965 10.2351 10.2351 10.6109 10.6109 10.7683 10.7683 11.1279 11.1279 11.4063 11.4063 11.9777 11.9777 12.3460 12.3460 k = 0.1311 0.1311-0.0000 ( 9146 PWs) bands (ev): -46.2040 -46.2040 -46.2038 -46.2038 -22.9076 -22.9076 -22.9049 -22.9049 -22.2568 -22.2568 -22.2526 -22.2526 -22.2518 -22.2518 -22.2513 -22.2513 -1.5215 -1.5215 -0.3235 -0.3235 1.8358 1.8358 5.5761 5.5761 6.7759 6.7759 7.4198 7.4198 7.5141 7.5141 8.0721 8.0721 9.2684 9.2684 9.3039 9.3039 10.3359 10.3359 10.4943 10.4943 10.8077 10.8077 11.1444 11.1444 11.4266 11.4266 11.9581 11.9581 12.2613 12.2613 k = 0.1230 0.1230-0.0000 ( 9146 PWs) bands (ev): -46.2040 -46.2040 -46.2038 -46.2038 -22.9073 -22.9073 -22.9045 -22.9045 -22.2567 -22.2567 -22.2520 -22.2520 -22.2515 -22.2515 -22.2509 -22.2509 -1.5673 -1.5673 -0.3636 -0.3636 1.8092 1.8092 5.6951 5.6951 6.8295 6.8295 7.3973 7.3973 7.5903 7.5903 8.1485 8.1485 9.2673 9.2673 9.3247 9.3247 10.3721 10.3721 10.4345 10.4345 10.8465 10.8465 11.1551 11.1551 11.4463 11.4463 11.9420 11.9420 12.1769 12.1769 k = 0.1148 0.1148-0.0000 ( 9142 PWs) bands (ev): -46.2041 -46.2041 -46.2039 -46.2039 -22.9070 -22.9070 -22.9042 -22.9042 -22.2567 -22.2567 -22.2515 -22.2515 -22.2512 -22.2512 -22.2503 -22.2503 -1.6101 -1.6101 -0.4010 -0.4010 1.7835 1.7835 5.8160 5.8160 6.8828 6.8828 7.3737 7.3737 7.6667 7.6667 8.2239 8.2239 9.2617 9.2617 9.3492 9.3492 10.2476 10.2476 10.5273 10.5273 10.8843 10.8843 11.1594 11.1594 11.4663 11.4663 11.9295 11.9295 12.0945 12.0945 k = 0.1066 0.1066-0.0000 ( 9132 PWs) bands (ev): -46.2042 -46.2042 -46.2040 -46.2040 -22.9068 -22.9068 -22.9039 -22.9039 -22.2567 -22.2567 -22.2512 -22.2512 -22.2508 -22.2508 -22.2498 -22.2498 -1.6501 -1.6501 -0.4360 -0.4360 1.7590 1.7590 5.9386 5.9386 6.9354 6.9354 7.3502 7.3502 7.7420 7.7420 8.2969 8.2969 9.2553 9.2553 9.3737 9.3737 10.1208 10.1208 10.6143 10.6143 10.9210 10.9210 11.1573 11.1573 11.4876 11.4876 11.9204 11.9204 12.0145 12.0145 k = 0.0984 0.0984-0.0000 ( 9126 PWs) bands (ev): -46.2042 -46.2042 -46.2040 -46.2040 -22.9065 -22.9065 -22.9036 -22.9036 -22.2566 -22.2566 -22.2510 -22.2510 -22.2503 -22.2503 -22.2492 -22.2492 -1.6872 -1.6872 -0.4683 -0.4683 1.7358 1.7358 6.0627 6.0627 6.9868 6.9868 7.3275 7.3275 7.8155 7.8155 8.3664 8.3664 9.2488 9.2488 9.3974 9.3974 9.9938 9.9938 10.6934 10.6934 10.9567 10.9567 11.1490 11.1490 11.5110 11.5110 11.9139 11.9139 11.9379 11.9379 k = 0.0902 0.0902-0.0000 ( 9134 PWs) bands (ev): -46.2043 -46.2043 -46.2041 -46.2041 -22.9063 -22.9063 -22.9033 -22.9033 -22.2566 -22.2566 -22.2509 -22.2509 -22.2498 -22.2498 -22.2487 -22.2487 -1.7214 -1.7214 -0.4982 -0.4982 1.7140 1.7140 6.1882 6.1882 7.0361 7.0361 7.3062 7.3062 7.8866 7.8866 8.4307 8.4307 9.2423 9.2423 9.4199 9.4199 9.8689 9.8689 10.7633 10.7633 10.9913 10.9913 11.1349 11.1349 11.5371 11.5371 11.8622 11.8622 11.9118 11.9118 k = 0.0820 0.0820-0.0000 ( 9134 PWs) bands (ev): -46.2044 -46.2044 -46.2041 -46.2041 -22.9061 -22.9061 -22.9031 -22.9031 -22.2566 -22.2566 -22.2508 -22.2508 -22.2494 -22.2494 -22.2483 -22.2483 -1.7526 -1.7526 -0.5254 -0.5254 1.6937 1.6937 6.3145 6.3145 7.0826 7.0826 7.2873 7.2873 7.9542 7.9542 8.4879 8.4879 9.2352 9.2352 9.4407 9.4407 9.7498 9.7498 10.8227 10.8227 11.0244 11.0244 11.1160 11.1160 11.5664 11.5664 11.7916 11.7916 11.9099 11.9099 k = 0.0738 0.0738-0.0000 ( 9132 PWs) bands (ev): -46.2044 -46.2044 -46.2042 -46.2042 -22.9059 -22.9059 -22.9028 -22.9028 -22.2565 -22.2565 -22.2507 -22.2507 -22.2490 -22.2490 -22.2479 -22.2479 -1.7809 -1.7809 -0.5501 -0.5501 1.6750 1.6750 6.4415 6.4415 7.1245 7.1245 7.2719 7.2719 8.0174 8.0174 8.5355 8.5355 9.2255 9.2255 9.4591 9.4591 9.6422 9.6422 10.8710 10.8710 11.0552 11.0552 11.0941 11.0941 11.5986 11.5986 11.7246 11.7246 11.9087 11.9087 k = 0.0656 0.0656-0.0000 ( 9144 PWs) bands (ev): -46.2045 -46.2045 -46.2042 -46.2042 -22.9057 -22.9057 -22.9026 -22.9026 -22.2565 -22.2565 -22.2506 -22.2506 -22.2486 -22.2486 -22.2475 -22.2475 -1.8062 -1.8062 -0.5722 -0.5722 1.6580 1.6580 6.5683 6.5683 7.1585 7.1585 7.2633 7.2633 8.0754 8.0754 8.5699 8.5699 9.2101 9.2101 9.4724 9.4724 9.5561 9.5561 10.9075 10.9075 11.0672 11.0672 11.0869 11.0869 11.6326 11.6326 11.6623 11.6623 11.9074 11.9074 k = 0.0574 0.0574-0.0000 ( 9144 PWs) bands (ev): -46.2045 -46.2045 -46.2043 -46.2043 -22.9056 -22.9056 -22.9024 -22.9024 -22.2565 -22.2565 -22.2505 -22.2505 -22.2483 -22.2483 -22.2471 -22.2471 -1.8286 -1.8286 -0.5917 -0.5917 1.6429 1.6429 6.6942 6.6942 7.1782 7.1782 7.2673 7.2673 8.1271 8.1271 8.5865 8.5865 9.1856 9.1856 9.4643 9.4643 9.5162 9.5162 10.9307 10.9307 11.0479 11.0479 11.1107 11.1107 11.6028 11.6028 11.6695 11.6695 11.9052 11.9052 k = 0.0492 0.0492-0.0000 ( 9148 PWs) bands (ev): -46.2045 -46.2045 -46.2043 -46.2043 -22.9054 -22.9054 -22.9023 -22.9023 -22.2565 -22.2565 -22.2505 -22.2505 -22.2480 -22.2480 -22.2468 -22.2468 -1.8480 -1.8480 -0.6086 -0.6086 1.6296 1.6296 6.8181 6.8181 7.1819 7.1819 7.2854 7.2854 8.1717 8.1717 8.5806 8.5806 9.1549 9.1549 9.4399 9.4399 9.5202 9.5202 10.9364 10.9364 11.0370 11.0370 11.1319 11.1319 11.5501 11.5501 11.7046 11.7046 11.9019 11.9019 k = 0.0410 0.0410-0.0000 ( 9153 PWs) bands (ev): -46.2046 -46.2046 -46.2043 -46.2043 -22.9053 -22.9053 -22.9021 -22.9021 -22.2564 -22.2564 -22.2504 -22.2504 -22.2478 -22.2478 -22.2466 -22.2466 -1.8644 -1.8644 -0.6229 -0.6229 1.6182 1.6182 6.9379 6.9379 7.1775 7.1775 7.3094 7.3094 8.2083 8.2083 8.5500 8.5500 9.1275 9.1275 9.4301 9.4301 9.5304 9.5304 10.9249 10.9249 11.0383 11.0383 11.1493 11.1493 11.5033 11.5033 11.7376 11.7376 11.8977 11.8977 k = 0.0328 0.0328-0.0000 ( 9157 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9052 -22.9052 -22.9020 -22.9020 -22.2564 -22.2564 -22.2504 -22.2504 -22.2476 -22.2476 -22.2464 -22.2464 -1.8778 -1.8778 -0.6347 -0.6347 1.6089 1.6089 7.0510 7.0510 7.1712 7.1712 7.3325 7.3325 8.2359 8.2359 8.4998 8.4998 9.1104 9.1104 9.4318 9.4318 9.5399 9.5399 10.9049 10.9049 11.0455 11.0455 11.1631 11.1631 11.4635 11.4635 11.7669 11.7669 11.8930 11.8930 k = 0.0246 0.0246-0.0000 ( 9155 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9051 -22.9051 -22.9019 -22.9019 -22.2564 -22.2564 -22.2503 -22.2503 -22.2474 -22.2474 -22.2462 -22.2462 -1.8883 -1.8883 -0.6438 -0.6438 1.6016 1.6016 7.1503 7.1503 7.1680 7.1680 7.3519 7.3519 8.2526 8.2526 8.4419 8.4419 9.1032 9.1032 9.4388 9.4388 9.5478 9.5478 10.8844 10.8844 11.0532 11.0532 11.1734 11.1734 11.4313 11.4313 11.7913 11.7913 11.8886 11.8886 k = 0.0164 0.0164-0.0000 ( 9149 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9051 -22.9051 -22.9018 -22.9018 -22.2564 -22.2564 -22.2503 -22.2503 -22.2473 -22.2473 -22.2461 -22.2461 -1.8958 -1.8958 -0.6503 -0.6503 1.5963 1.5963 7.1595 7.1595 7.2387 7.2387 7.3665 7.3665 8.2553 8.2553 8.3932 8.3932 9.1018 9.1018 9.4467 9.4467 9.5535 9.5535 10.8675 10.8675 11.0594 11.0594 11.1805 11.1805 11.4077 11.4077 11.8095 11.8095 11.8850 11.8850 k = 0.0082 0.0082-0.0000 ( 9147 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9051 -22.9051 -22.9018 -22.9018 -22.2564 -22.2564 -22.2503 -22.2503 -22.2472 -22.2472 -22.2460 -22.2460 -1.9003 -1.9003 -0.6542 -0.6542 1.5932 1.5932 7.1568 7.1568 7.2958 7.2958 7.3755 7.3755 8.2452 8.2452 8.3670 8.3670 9.1025 9.1025 9.4525 9.4525 9.5570 9.5570 10.8565 10.8565 11.0633 11.0633 11.1847 11.1847 11.3933 11.3933 11.8207 11.8207 11.8826 11.8826 k = 0.0000 0.0000 0.0000 ( 9141 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9050 -22.9050 -22.9018 -22.9018 -22.2564 -22.2564 -22.2503 -22.2503 -22.2472 -22.2472 -22.2460 -22.2460 -1.9018 -1.9018 -0.6555 -0.6555 1.5921 1.5921 7.1559 7.1559 7.3164 7.3164 7.3785 7.3785 8.2381 8.2381 8.3601 8.3601 9.1030 9.1030 9.4546 9.4546 9.5582 9.5582 10.8526 10.8526 11.0645 11.0645 11.1861 11.1861 11.3884 11.3884 11.8246 11.8246 11.8818 11.8818 k = 0.0000 0.0000 0.0000 ( 9141 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9050 -22.9050 -22.9018 -22.9018 -22.2564 -22.2564 -22.2503 -22.2503 -22.2472 -22.2472 -22.2460 -22.2460 -1.9018 -1.9018 -0.6555 -0.6555 1.5921 1.5921 7.1559 7.1559 7.3164 7.3164 7.3785 7.3785 8.2381 8.2381 8.3601 8.3601 9.1030 9.1030 9.4546 9.4546 9.5582 9.5582 10.8526 10.8526 11.0645 11.0645 11.1861 11.1861 11.3884 11.3884 11.8246 11.8246 11.8818 11.8818 k = 0.0000 0.0000 0.0113 ( 9157 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9050 -22.9050 -22.9018 -22.9018 -22.2564 -22.2564 -22.2503 -22.2503 -22.2472 -22.2472 -22.2460 -22.2460 -1.9006 -1.9006 -0.6588 -0.6588 1.5963 1.5963 7.0895 7.0895 7.3165 7.3165 7.4454 7.4454 8.2382 8.2382 8.3603 8.3603 9.1024 9.1024 9.4538 9.4538 9.5573 9.5573 10.8545 10.8545 11.0666 11.0666 11.1886 11.1886 11.3901 11.3901 11.8246 11.8246 11.8817 11.8817 k = 0.0000 0.0000 0.0225 ( 9181 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9050 -22.9050 -22.9018 -22.9018 -22.2564 -22.2564 -22.2503 -22.2503 -22.2472 -22.2472 -22.2460 -22.2460 -1.8970 -1.8970 -0.6687 -0.6687 1.6087 1.6087 6.9697 6.9697 7.3169 7.3169 7.5670 7.5670 8.2385 8.2385 8.3609 8.3609 9.1007 9.1007 9.4515 9.4515 9.5546 9.5546 10.8601 10.8601 11.0726 11.0726 11.1962 11.1962 11.3950 11.3950 11.8249 11.8249 11.8815 11.8815 k = 0.0000 0.0000 0.0338 ( 9169 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9050 -22.9050 -22.9018 -22.9018 -22.2563 -22.2563 -22.2503 -22.2503 -22.2472 -22.2472 -22.2460 -22.2460 -1.8911 -1.8911 -0.6848 -0.6848 1.6291 1.6291 6.8406 6.8406 7.3174 7.3174 7.6990 7.6990 8.2390 8.2390 8.3620 8.3620 9.0980 9.0980 9.4477 9.4477 9.5502 9.5502 10.8694 10.8694 11.0825 11.0825 11.2087 11.2087 11.4030 11.4030 11.8252 11.8252 11.8811 11.8811 k = 0.0000 0.0000 0.0451 ( 9168 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9050 -22.9050 -22.9019 -22.9019 -22.2563 -22.2563 -22.2504 -22.2504 -22.2472 -22.2472 -22.2460 -22.2460 -1.8828 -1.8828 -0.7067 -0.7067 1.6567 1.6567 6.7101 6.7101 7.3181 7.3181 7.8335 7.8335 8.2397 8.2397 8.3634 8.3634 9.0943 9.0943 9.4425 9.4425 9.5443 9.5443 10.8819 10.8819 11.0962 11.0962 11.2260 11.2260 11.4140 11.4140 11.8257 11.8257 11.8806 11.8806 k = 0.0000 0.0000 0.0563 ( 9148 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9049 -22.9049 -22.9019 -22.9019 -22.2562 -22.2562 -22.2505 -22.2505 -22.2471 -22.2471 -22.2461 -22.2461 -1.8722 -1.8722 -0.7339 -0.7339 1.6910 1.6910 6.5806 6.5806 7.3190 7.3190 7.9678 7.9678 8.2406 8.2406 8.3654 8.3654 9.0900 9.0900 9.4362 9.4362 9.5369 9.5369 10.8975 10.8975 11.1135 11.1135 11.2478 11.2478 11.4276 11.4276 11.8264 11.8264 11.8799 11.8799 k = 0.0000 0.0000 0.0676 ( 9144 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9049 -22.9049 -22.9020 -22.9020 -22.2561 -22.2561 -22.2506 -22.2506 -22.2471 -22.2471 -22.2461 -22.2461 -1.8592 -1.8592 -0.7657 -0.7657 1.7310 1.7310 6.4534 6.4534 7.3201 7.3201 8.1007 8.1007 8.2416 8.2416 8.3679 8.3679 9.0853 9.0853 9.4288 9.4288 9.5284 9.5284 10.9156 10.9156 11.1341 11.1341 11.2740 11.2740 11.4435 11.4435 11.8272 11.8272 11.8792 11.8792 k = 0.0000 0.0000 0.0789 ( 9140 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9048 -22.9048 -22.9020 -22.9020 -22.2560 -22.2560 -22.2507 -22.2507 -22.2471 -22.2471 -22.2461 -22.2461 -1.8441 -1.8441 -0.8013 -0.8013 1.7757 1.7757 6.3292 6.3292 7.3213 7.3213 8.2301 8.2301 8.2428 8.2428 8.3718 8.3718 9.0806 9.0806 9.4207 9.4207 9.5190 9.5190 10.9355 10.9355 11.1575 11.1575 11.3042 11.3042 11.4614 11.4614 11.8213 11.8213 11.8281 11.8281 k = 0.0000 0.0000 0.0901 ( 9124 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9047 -22.9047 -22.9021 -22.9021 -22.2558 -22.2558 -22.2508 -22.2508 -22.2471 -22.2471 -22.2461 -22.2461 -1.8267 -1.8267 -0.8402 -0.8402 1.8242 1.8242 6.2089 6.2089 7.3226 7.3226 8.2440 8.2440 8.3431 8.3431 8.3889 8.3889 9.0766 9.0766 9.4120 9.4120 9.5089 9.5089 10.9560 10.9560 11.1835 11.1835 11.3380 11.3380 11.4807 11.4807 11.7612 11.7612 11.8291 11.8291 k = 0.0000 0.0000 0.1014 ( 9124 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9047 -22.9047 -22.9022 -22.9022 -22.2557 -22.2557 -22.2510 -22.2510 -22.2471 -22.2471 -22.2461 -22.2461 -1.8072 -1.8072 -0.8816 -0.8816 1.8754 1.8754 6.0930 6.0930 7.3240 7.3240 8.2454 8.2454 8.3688 8.3688 8.4888 8.4888 9.0741 9.0741 9.4030 9.4030 9.4984 9.4984 10.9757 10.9757 11.2113 11.2113 11.3751 11.3751 11.5010 11.5010 11.7014 11.7014 11.8302 11.8302 k = 0.0000 0.0000 0.1127 ( 9104 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9046 -22.9046 -22.9023 -22.9023 -22.2555 -22.2555 -22.2512 -22.2512 -22.2470 -22.2470 -22.2462 -22.2462 -1.7857 -1.7857 -0.9248 -0.9248 1.9281 1.9281 5.9824 5.9824 7.3254 7.3254 8.2467 8.2467 8.3736 8.3736 8.6029 8.6029 9.0747 9.0747 9.3940 9.3940 9.4878 9.4878 10.9926 10.9926 11.2404 11.2404 11.4150 11.4150 11.5218 11.5218 11.6451 11.6451 11.8314 11.8314 k = 0.0000 0.0000 0.1240 ( 9112 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9045 -22.9045 -22.9024 -22.9024 -22.2553 -22.2553 -22.2513 -22.2513 -22.2470 -22.2470 -22.2462 -22.2462 -1.7623 -1.7623 -0.9693 -0.9693 1.9813 1.9813 5.8780 5.8780 7.3269 7.3269 8.2481 8.2481 8.3771 8.3771 8.7081 8.7081 9.0812 9.0812 9.3850 9.3850 9.4774 9.4774 11.0037 11.0037 11.2696 11.2696 11.4572 11.4572 11.5426 11.5426 11.5963 11.5963 11.8327 11.8327 k = 0.0000 0.0000 0.1352 ( 9132 PWs) bands (ev): -46.2046 -46.2046 -46.2044 -46.2044 -22.9044 -22.9044 -22.9025 -22.9025 -22.2551 -22.2551 -22.2515 -22.2515 -22.2469 -22.2469 -22.2463 -22.2463 -1.7372 -1.7372 -1.0144 -1.0144 2.0336 2.0336 5.7805 5.7805 7.3283 7.3283 8.2495 8.2495 8.3801 8.3801 8.7976 8.7976 9.0989 9.0989 9.3764 9.3764 9.4673 9.4673 11.0057 11.0057 11.2981 11.2981 11.5010 11.5010 11.5590 11.5590 11.5629 11.5629 11.8341 11.8341 k = 0.0000 0.0000 0.1465 ( 9132 PWs) bands (ev): -46.2046 -46.2046 -46.2045 -46.2045 -22.9043 -22.9043 -22.9026 -22.9026 -22.2549 -22.2549 -22.2517 -22.2517 -22.2469 -22.2469 -22.2463 -22.2463 -1.7106 -1.7106 -1.0595 -1.0595 2.0839 2.0839 5.6909 5.6909 7.3296 7.3296 8.2508 8.2508 8.3830 8.3830 8.8633 8.8633 9.1347 9.1347 9.3683 9.3683 9.4579 9.4579 10.9960 10.9960 11.3248 11.3248 11.5369 11.5369 11.5458 11.5458 11.5824 11.5824 11.8355 11.8355 k = 0.0000 0.0000 0.1578 ( 9124 PWs) bands (ev): -46.2046 -46.2046 -46.2045 -46.2045 -22.9042 -22.9042 -22.9027 -22.9027 -22.2547 -22.2547 -22.2519 -22.2519 -22.2469 -22.2469 -22.2463 -22.2463 -1.6827 -1.6827 -1.1040 -1.1040 2.1310 2.1310 5.6102 5.6102 7.3308 7.3308 8.2520 8.2520 8.3856 8.3856 8.9025 8.9025 9.1900 9.1900 9.3610 9.3610 9.4493 9.4493 10.9741 10.9741 11.3492 11.3492 11.5307 11.5307 11.5900 11.5900 11.6009 11.6009 11.8369 11.8369 k = 0.0000 0.0000 0.1690 ( 9108 PWs) bands (ev): -46.2046 -46.2046 -46.2045 -46.2045 -22.9040 -22.9040 -22.9028 -22.9028 -22.2545 -22.2545 -22.2522 -22.2522 -22.2468 -22.2468 -22.2464 -22.2464 -1.6543 -1.6543 -1.1470 -1.1470 2.1736 2.1736 5.5395 5.5395 7.3319 7.3319 8.2531 8.2531 8.3879 8.3879 8.9221 8.9221 9.2564 9.2564 9.3545 9.3545 9.4416 9.4416 10.9427 10.9427 11.3712 11.3712 11.5372 11.5372 11.6154 11.6154 11.6351 11.6351 11.8383 11.8384 k = 0.0000 0.0000 0.1803 ( 9100 PWs) bands (ev): -46.2046 -46.2046 -46.2045 -46.2045 -22.9039 -22.9039 -22.9029 -22.9029 -22.2543 -22.2543 -22.2524 -22.2524 -22.2468 -22.2468 -22.2464 -22.2464 -1.6259 -1.6259 -1.1875 -1.1875 2.2105 2.2105 5.4798 5.4798 7.3329 7.3329 8.2540 8.2540 8.3899 8.3899 8.9312 8.9312 9.3232 9.3232 9.3489 9.3489 9.4352 9.4352 10.9065 10.9065 11.3909 11.3909 11.5514 11.5514 11.6293 11.6293 11.6758 11.6758 11.8397 11.8398 k = 0.0000 0.0000 0.1916 ( 9112 PWs) bands (ev): -46.2046 -46.2046 -46.2045 -46.2045 -22.9038 -22.9038 -22.9030 -22.9030 -22.2541 -22.2541 -22.2526 -22.2526 -22.2467 -22.2467 -22.2465 -22.2465 -1.5990 -1.5990 -1.2241 -1.2241 2.2406 2.2406 5.4322 5.4322 7.3336 7.3336 8.2548 8.2548 8.3915 8.3915 8.9351 8.9351 9.3446 9.3446 9.3824 9.3824 9.4300 9.4300 10.8709 10.8709 11.4077 11.4077 11.5682 11.5682 11.6404 11.6404 11.7118 11.7118 11.8411 11.8411 k = 0.0000 0.0000 0.2028 ( 9128 PWs) bands (ev): -46.2046 -46.2046 -46.2045 -46.2045 -22.9037 -22.9037 -22.9032 -22.9032 -22.2538 -22.2538 -22.2529 -22.2529 -22.2467 -22.2467 -22.2465 -22.2465 -1.5755 -1.5755 -1.2545 -1.2545 2.2629 2.2629 5.3974 5.3974 7.3342 7.3342 8.2554 8.2554 8.3927 8.3927 8.9366 8.9366 9.3414 9.3414 9.4263 9.4263 9.4287 9.4287 10.8412 10.8412 11.4207 11.4207 11.5833 11.5833 11.6485 11.6485 11.7405 11.7405 11.8423 11.8423 k = 0.0000 0.0000 0.2141 ( 9132 PWs) bands (ev): -46.2045 -46.2045 -46.2045 -46.2045 -22.9035 -22.9035 -22.9033 -22.9033 -22.2536 -22.2536 -22.2531 -22.2531 -22.2466 -22.2466 -22.2466 -22.2466 -1.5589 -1.5589 -1.2753 -1.2753 2.2766 2.2766 5.3762 5.3762 7.3345 7.3345 8.2557 8.2557 8.3935 8.3935 8.9372 8.9372 9.3394 9.3394 9.4240 9.4240 9.4583 9.4583 10.8214 10.8214 11.4289 11.4289 11.5937 11.5937 11.6534 11.6534 11.7591 11.7591 11.8433 11.8433 k = 0.0000 0.0000 0.2254 ( 9124 PWs) bands (ev): -46.2045 -46.2045 -46.2045 -46.2045 -22.9034 -22.9034 -22.9034 -22.9034 -22.2534 -22.2534 -22.2533 -22.2533 -22.2466 -22.2466 -22.2466 -22.2466 -1.5528 -1.5528 -1.2829 -1.2829 2.2812 2.2812 5.3691 5.3691 7.3346 7.3346 8.2558 8.2558 8.3937 8.3937 8.9373 8.9373 9.3388 9.3388 9.4232 9.4232 9.4684 9.4684 10.8145 10.8145 11.4317 11.4317 11.5974 11.5974 11.6550 11.6550 11.7656 11.7656 11.8436 11.8437 k = 0.0000 0.0000 0.2254 ( 9124 PWs) bands (ev): -46.2045 -46.2045 -46.2045 -46.2045 -22.9034 -22.9034 -22.9034 -22.9034 -22.2534 -22.2534 -22.2533 -22.2533 -22.2466 -22.2466 -22.2466 -22.2466 -1.5528 -1.5528 -1.2829 -1.2829 2.2812 2.2812 5.3691 5.3691 7.3346 7.3346 8.2558 8.2558 8.3937 8.3937 8.9373 8.9373 9.3388 9.3388 9.4232 9.4232 9.4684 9.4684 10.8145 10.8145 11.4317 11.4317 11.5974 11.5974 11.6550 11.6550 11.7656 11.7656 11.8436 11.8437 k = 0.0000 0.0116 0.2254 ( 9134 PWs) bands (ev): -46.2045 -46.2045 -46.2045 -46.2045 -22.9034 -22.9034 -22.9034 -22.9034 -22.2534 -22.2534 -22.2533 -22.2533 -22.2466 -22.2466 -22.2466 -22.2466 -1.5513 -1.5513 -1.2815 -1.2815 2.2818 2.2818 5.3705 5.3705 7.3130 7.3130 8.2648 8.2648 8.4020 8.4020 8.9282 8.9282 9.3161 9.3161 9.4404 9.4404 9.4710 9.4710 10.8199 10.8199 11.4311 11.4311 11.5881 11.5881 11.6566 11.6566 11.7587 11.7587 11.8402 11.8402 k = 0.0000 0.0233 0.2254 ( 9142 PWs) bands (ev): -46.2045 -46.2045 -46.2045 -46.2045 -22.9035 -22.9035 -22.9034 -22.9034 -22.2534 -22.2534 -22.2533 -22.2533 -22.2467 -22.2467 -22.2467 -22.2467 -1.5469 -1.5469 -1.2772 -1.2772 2.2837 2.2837 5.3746 5.3746 7.2522 7.2522 8.2856 8.2856 8.4291 8.4291 8.8994 8.8994 9.2757 9.2757 9.4592 9.4592 9.4864 9.4864 10.8352 10.8352 11.4280 11.4280 11.5699 11.5699 11.6469 11.6469 11.7582 11.7582 11.8318 11.8318 k = 0.0000 0.0349 0.2254 ( 9134 PWs) bands (ev): -46.2045 -46.2045 -46.2045 -46.2045 -22.9035 -22.9035 -22.9035 -22.9035 -22.2534 -22.2534 -22.2534 -22.2534 -22.2468 -22.2468 -22.2468 -22.2468 -1.5396 -1.5396 -1.2700 -1.2700 2.2868 2.2868 5.3815 5.3815 7.1610 7.1610 8.3075 8.3075 8.4769 8.4769 8.8479 8.8479 9.2386 9.2386 9.4647 9.4647 9.5134 9.5134 10.8576 10.8576 11.4190 11.4190 11.5548 11.5548 11.6200 11.6200 11.7759 11.7759 11.8194 11.8194 k = 0.0000 0.0465 0.2254 ( 9152 PWs) bands (ev): -46.2045 -46.2045 -46.2044 -46.2044 -22.9036 -22.9036 -22.9036 -22.9036 -22.2534 -22.2534 -22.2534 -22.2534 -22.2470 -22.2470 -22.2469 -22.2469 -1.5294 -1.5294 -1.2600 -1.2600 2.2912 2.2912 5.3910 5.3910 7.0484 7.0484 8.3264 8.3264 8.5408 8.5408 8.7728 8.7728 9.2113 9.2113 9.4676 9.4676 9.5384 9.5384 10.8834 10.8834 11.4002 11.4002 11.5500 11.5500 11.5865 11.5865 11.7963 11.7963 11.8105 11.8105 k = 0.0000 0.0581 0.2254 ( 9144 PWs) bands (ev): -46.2045 -46.2045 -46.2044 -46.2044 -22.9037 -22.9037 -22.9037 -22.9037 -22.2535 -22.2535 -22.2534 -22.2534 -22.2471 -22.2471 -22.2471 -22.2471 -1.5163 -1.5163 -1.2471 -1.2471 2.2966 2.2966 5.4032 5.4032 6.9208 6.9208 8.3437 8.3437 8.6129 8.6129 8.6773 8.6773 9.1940 9.1940 9.4697 9.4697 9.5593 9.5593 10.9086 10.9086 11.3707 11.3707 11.5437 11.5437 11.5666 11.5666 11.7809 11.7809 11.8393 11.8393 k = 0.0000 0.0698 0.2254 ( 9142 PWs) bands (ev): -46.2045 -46.2045 -46.2044 -46.2044 -22.9039 -22.9039 -22.9038 -22.9038 -22.2536 -22.2536 -22.2535 -22.2535 -22.2474 -22.2474 -22.2473 -22.2473 -1.5003 -1.5003 -1.2314 -1.2314 2.3031 2.3031 5.4178 5.4178 6.7828 6.7828 8.3612 8.3612 8.5645 8.5645 8.6891 8.6891 9.1844 9.1844 9.4709 9.4709 9.5764 9.5764 10.9300 10.9300 11.3338 11.3338 11.5113 11.5113 11.5851 11.5851 11.7593 11.7593 11.8750 11.8750 k = 0.0000 0.0814 0.2254 ( 9148 PWs) bands (ev): -46.2044 -46.2044 -46.2044 -46.2044 -22.9040 -22.9040 -22.9039 -22.9039 -22.2537 -22.2537 -22.2536 -22.2536 -22.2476 -22.2476 -22.2476 -22.2476 -1.4813 -1.4813 -1.2128 -1.2128 2.3106 2.3106 5.4348 5.4348 6.6374 6.6374 8.3797 8.3797 8.4417 8.4417 8.7633 8.7633 9.1801 9.1801 9.4704 9.4704 9.5903 9.5903 10.9454 10.9454 11.2926 11.2926 11.4776 11.4776 11.6154 11.6154 11.7360 11.7360 11.9132 11.9132 k = 0.0000 0.0930 0.2254 ( 9148 PWs) bands (ev): -46.2044 -46.2044 -46.2043 -46.2043 -22.9042 -22.9042 -22.9041 -22.9041 -22.2538 -22.2538 -22.2537 -22.2537 -22.2478 -22.2478 -22.2478 -22.2478 -1.4595 -1.4595 -1.1914 -1.1914 2.3190 2.3190 5.4537 5.4537 6.4871 6.4871 8.3094 8.3094 8.4010 8.4010 8.8348 8.8348 9.1793 9.1793 9.4675 9.4675 9.6016 9.6016 10.9536 10.9536 11.2491 11.2491 11.4452 11.4452 11.6525 11.6525 11.7119 11.7119 11.9533 11.9533 k = 0.0000 0.1047 0.2254 ( 9142 PWs) bands (ev): -46.2043 -46.2043 -46.2043 -46.2043 -22.9044 -22.9044 -22.9043 -22.9043 -22.2540 -22.2540 -22.2539 -22.2539 -22.2481 -22.2481 -22.2480 -22.2480 -1.4347 -1.4347 -1.1672 -1.1672 2.3280 2.3280 5.4740 5.4740 6.3337 6.3337 8.1727 8.1727 8.4234 8.4234 8.9025 8.9025 9.1809 9.1809 9.4613 9.4613 9.6106 9.6106 10.9546 10.9546 11.2049 11.2049 11.4148 11.4148 11.6849 11.6849 11.6966 11.6966 11.9950 11.9950 k = 0.0000 0.1163 0.2254 ( 9154 PWs) bands (ev): -46.2043 -46.2043 -46.2042 -46.2042 -22.9046 -22.9046 -22.9045 -22.9045 -22.2543 -22.2543 -22.2541 -22.2541 -22.2483 -22.2483 -22.2482 -22.2482 -1.4071 -1.4071 -1.1401 -1.1401 2.3377 2.3377 5.4945 5.4945 6.1797 6.1797 8.0321 8.0321 8.4480 8.4480 8.9657 8.9657 9.1841 9.1841 9.4510 9.4510 9.6174 9.6174 10.9490 10.9490 11.1608 11.1608 11.3870 11.3870 11.6620 11.6620 11.7389 11.7389 12.0382 12.0382 k = 0.0000 0.1279 0.2254 ( 9166 PWs) bands (ev): -46.2042 -46.2042 -46.2042 -46.2042 -22.9049 -22.9049 -22.9047 -22.9047 -22.2546 -22.2546 -22.2544 -22.2544 -22.2485 -22.2485 -22.2484 -22.2484 -1.3765 -1.3765 -1.1103 -1.1103 2.3477 2.3477 5.5122 5.5122 6.0287 6.0287 7.8896 7.8896 8.4749 8.4749 9.0240 9.0240 9.1884 9.1884 9.4360 9.4360 9.6221 9.6221 10.9374 10.9374 11.1176 11.1176 11.3622 11.3622 11.6379 11.6379 11.7836 11.7836 12.0826 12.0826 k = 0.0000 0.1395 0.2254 ( 9162 PWs) bands (ev): -46.2042 -46.2042 -46.2041 -46.2041 -22.9051 -22.9051 -22.9050 -22.9050 -22.2550 -22.2550 -22.2548 -22.2548 -22.2487 -22.2487 -22.2486 -22.2486 -1.3431 -1.3431 -1.0776 -1.0776 2.3580 2.3580 5.5188 5.5188 5.8897 5.8897 7.7463 7.7463 8.5040 8.5040 9.0769 9.0769 9.1937 9.1937 9.4160 9.4160 9.6246 9.6246 10.9204 10.9204 11.0759 11.0759 11.3412 11.3412 11.6144 11.6144 11.8276 11.8276 12.1281 12.1281 k = 0.0000 0.1512 0.2254 ( 9162 PWs) bands (ev): -46.2041 -46.2041 -46.2041 -46.2041 -22.9054 -22.9054 -22.9052 -22.9052 -22.2554 -22.2554 -22.2552 -22.2552 -22.2488 -22.2488 -22.2487 -22.2487 -1.3067 -1.3067 -1.0422 -1.0422 2.3681 2.3681 5.4909 5.4909 5.7866 5.7866 7.6033 7.6033 8.5352 8.5352 9.1216 9.1216 9.2014 9.2014 9.3914 9.3914 9.6246 9.6246 10.8988 10.8988 11.0362 11.0362 11.3245 11.3245 11.5917 11.5917 11.8701 11.8701 12.1744 12.1744 k = 0.0000 0.1628 0.2254 ( 9154 PWs) bands (ev): -46.2041 -46.2041 -46.2040 -46.2040 -22.9057 -22.9057 -22.9055 -22.9055 -22.2560 -22.2560 -22.2557 -22.2557 -22.2489 -22.2489 -22.2488 -22.2488 -1.2675 -1.2675 -1.0041 -1.0041 2.3780 2.3780 5.4000 5.4000 5.7483 5.7483 7.4618 7.4618 8.5685 8.5685 9.1494 9.1494 9.2181 9.2181 9.3642 9.3642 9.6218 9.6218 10.8728 10.8728 10.9988 10.9988 11.3127 11.3127 11.5700 11.5700 11.9105 11.9105 12.2214 12.2214 k = 0.0000 0.1744 0.2254 ( 9148 PWs) bands (ev): -46.2040 -46.2040 -46.2039 -46.2039 -22.9059 -22.9059 -22.9058 -22.9058 -22.2565 -22.2565 -22.2563 -22.2563 -22.2489 -22.2489 -22.2488 -22.2488 -1.2255 -1.2255 -0.9632 -0.9632 2.3872 2.3872 5.2641 5.2641 5.7572 5.7572 7.3224 7.3224 8.6039 8.6039 9.1504 9.1504 9.2490 9.2490 9.3389 9.3389 9.6161 9.6161 10.8432 10.8432 10.9640 10.9640 11.3063 11.3063 11.5495 11.5495 11.9487 11.9487 12.2689 12.2689 k = 0.0000 0.1860 0.2254 ( 9156 PWs) bands (ev): -46.2039 -46.2039 -46.2039 -46.2039 -22.9063 -22.9063 -22.9061 -22.9061 -22.2572 -22.2572 -22.2570 -22.2570 -22.2490 -22.2490 -22.2488 -22.2488 -1.1805 -1.1805 -0.9196 -0.9196 2.3955 2.3955 5.1105 5.1105 5.7863 5.7863 7.1861 7.1861 8.6413 8.6413 9.1275 9.1275 9.2838 9.2838 9.3233 9.3233 9.6070 9.6070 10.8107 10.8107 10.9316 10.9316 11.3055 11.3055 11.5302 11.5302 11.9844 11.9844 12.3165 12.3165 k = 0.0000 0.1977 0.2254 ( 9150 PWs) bands (ev): -46.2039 -46.2039 -46.2038 -46.2038 -22.9066 -22.9066 -22.9064 -22.9064 -22.2579 -22.2579 -22.2576 -22.2576 -22.2489 -22.2489 -22.2488 -22.2488 -1.1327 -1.1327 -0.8733 -0.8733 2.4025 2.4025 4.9503 4.9503 5.8246 5.8246 7.0538 7.0538 8.6804 8.6804 9.0840 9.0840 9.3001 9.3001 9.3366 9.3366 9.5944 9.5944 10.7760 10.7760 10.9012 10.9012 11.3104 11.3104 11.5123 11.5123 12.0179 12.0179 12.3641 12.3641 k = 0.0000 0.2093 0.2254 ( 9166 PWs) bands (ev): -46.2038 -46.2038 -46.2037 -46.2037 -22.9069 -22.9069 -22.9067 -22.9067 -22.2586 -22.2586 -22.2584 -22.2584 -22.2489 -22.2489 -22.2487 -22.2487 -1.0821 -1.0821 -0.8243 -0.8243 2.4077 2.4077 4.7873 4.7873 5.8685 5.8685 6.9262 6.9262 8.7211 8.7211 9.0241 9.0241 9.3021 9.3021 9.3716 9.3716 9.5779 9.5779 10.7403 10.7403 10.8723 10.8723 11.3210 11.3210 11.4957 11.4957 12.0493 12.0493 12.4115 12.4115 k = 0.0000 0.2209 0.2254 ( 9168 PWs) bands (ev): -46.2037 -46.2037 -46.2037 -46.2037 -22.9072 -22.9072 -22.9071 -22.9071 -22.2594 -22.2594 -22.2591 -22.2591 -22.2488 -22.2488 -22.2487 -22.2487 -1.0286 -1.0286 -0.7728 -0.7728 2.4108 2.4108 4.6232 4.6232 5.9163 5.9163 6.8042 6.8042 8.7626 8.7626 8.9523 8.9523 9.3061 9.3061 9.4080 9.4080 9.5576 9.5576 10.7042 10.7042 10.8447 10.8447 11.3369 11.3369 11.4804 11.4804 12.0789 12.0789 12.4583 12.4583 k = 0.0000 0.2326 0.2254 ( 9168 PWs) bands (ev): -46.2036 -46.2036 -46.2036 -46.2036 -22.9076 -22.9076 -22.9074 -22.9074 -22.2602 -22.2602 -22.2599 -22.2599 -22.2487 -22.2487 -22.2486 -22.2486 -0.9723 -0.9723 -0.7186 -0.7186 2.4113 2.4113 4.4590 4.4590 5.9671 5.9671 6.6888 6.6888 8.8009 8.8009 8.8756 8.8756 9.3122 9.3122 9.4423 9.4423 9.5345 9.5345 10.6684 10.6684 10.8180 10.8180 11.3579 11.3579 11.4664 11.4664 12.1068 12.1068 12.5045 12.5045 k = 0.0000 0.2442 0.2254 ( 9162 PWs) bands (ev): -46.2036 -46.2036 -46.2035 -46.2035 -22.9079 -22.9079 -22.9077 -22.9077 -22.2610 -22.2610 -22.2607 -22.2607 -22.2486 -22.2486 -22.2485 -22.2485 -0.9131 -0.9131 -0.6618 -0.6618 2.4086 2.4086 4.2951 4.2951 6.0199 6.0199 6.5811 6.5811 8.7691 8.7691 8.8627 8.8627 9.3196 9.3196 9.4663 9.4663 9.5165 9.5165 10.6335 10.6335 10.7921 10.7921 11.3835 11.3835 11.4537 11.4537 12.1334 12.1334 12.5497 12.5497 k = 0.0000 0.2558 0.2254 ( 9168 PWs) bands (ev): -46.2035 -46.2035 -46.2035 -46.2035 -22.9083 -22.9083 -22.9081 -22.9081 -22.2618 -22.2618 -22.2616 -22.2616 -22.2485 -22.2485 -22.2484 -22.2484 -0.8512 -0.8512 -0.6026 -0.6026 2.4023 2.4023 4.1320 4.1320 6.0734 6.0734 6.4831 6.4831 8.6771 8.6771 8.9048 8.9048 9.3276 9.3276 9.4528 9.4528 9.5308 9.5308 10.5999 10.5999 10.7668 10.7668 11.4131 11.4131 11.4425 11.4425 12.1589 12.1589 12.5937 12.5937 k = 0.0000 0.2674 0.2254 ( 9172 PWs) bands (ev): -46.2034 -46.2034 -46.2034 -46.2034 -22.9086 -22.9086 -22.9084 -22.9084 -22.2626 -22.2626 -22.2624 -22.2624 -22.2484 -22.2484 -22.2482 -22.2482 -0.7864 -0.7864 -0.5408 -0.5408 2.3919 2.3919 3.9699 3.9699 6.1238 6.1238 6.3989 6.3989 8.5767 8.5767 8.9508 8.9508 9.3352 9.3352 9.4179 9.4179 9.5619 9.5619 10.5681 10.5681 10.7420 10.7420 11.4286 11.4286 11.4502 11.4502 12.1836 12.1836 12.6364 12.6364 k = 0.0000 0.2791 0.2254 ( 9160 PWs) bands (ev): -46.2033 -46.2033 -46.2033 -46.2033 -22.9089 -22.9089 -22.9088 -22.9088 -22.2634 -22.2634 -22.2632 -22.2632 -22.2483 -22.2483 -22.2481 -22.2481 -0.7189 -0.7189 -0.4766 -0.4766 2.3769 2.3769 3.8090 3.8090 6.1586 6.1586 6.3416 6.3416 8.4717 8.4717 8.9974 8.9974 9.3383 9.3383 9.3803 9.3803 9.5953 9.5953 10.5384 10.5384 10.7175 10.7175 11.4193 11.4193 11.4869 11.4869 12.2077 12.2077 12.6774 12.6774 k = 0.0000 0.2907 0.2254 ( 9162 PWs) bands (ev): -46.2033 -46.2033 -46.2032 -46.2032 -22.9093 -22.9093 -22.9091 -22.9091 -22.2642 -22.2642 -22.2640 -22.2640 -22.2481 -22.2481 -22.2480 -22.2480 -0.6486 -0.6486 -0.4101 -0.4101 2.3568 2.3568 3.6495 3.6495 6.1504 6.1504 6.3390 6.3390 8.3633 8.3633 9.0431 9.0431 9.3140 9.3140 9.3657 9.3657 9.6289 9.6289 10.5113 10.5113 10.6934 10.6934 11.4094 11.4094 11.5280 11.5280 12.2314 12.2314 12.7167 12.7167 k = 0.0000 0.3023 0.2254 ( 9160 PWs) bands (ev): -46.2032 -46.2032 -46.2032 -46.2032 -22.9096 -22.9096 -22.9095 -22.9095 -22.2650 -22.2650 -22.2648 -22.2648 -22.2480 -22.2480 -22.2479 -22.2479 -0.5755 -0.5755 -0.3412 -0.3412 2.3314 2.3314 3.4916 3.4916 6.1076 6.1076 6.3831 6.3831 8.2524 8.2524 9.0854 9.0854 9.2681 9.2681 9.3710 9.3710 9.6624 9.6624 10.4871 10.4871 10.6694 10.6694 11.3994 11.3994 11.5722 11.5722 12.2548 12.2548 12.7539 12.7539 k = 0.0000 0.3140 0.2254 ( 9172 PWs) bands (ev): -46.2031 -46.2031 -46.2031 -46.2031 -22.9100 -22.9100 -22.9098 -22.9098 -22.2658 -22.2658 -22.2656 -22.2656 -22.2479 -22.2479 -22.2477 -22.2477 -0.4997 -0.4997 -0.2700 -0.2700 2.3002 2.3002 3.3353 3.3353 6.0598 6.0598 6.4447 6.4447 8.1395 8.1395 9.1135 9.1135 9.2279 9.2279 9.3793 9.3793 9.6956 9.6956 10.4662 10.4662 10.6455 10.6455 11.3889 11.3889 11.6191 11.6191 12.2780 12.2780 12.7890 12.7890 k = 0.0000 0.3256 0.2254 ( 9170 PWs) bands (ev): -46.2031 -46.2031 -46.2030 -46.2030 -22.9103 -22.9103 -22.9101 -22.9101 -22.2666 -22.2666 -22.2664 -22.2664 -22.2477 -22.2477 -22.2476 -22.2476 -0.4212 -0.4212 -0.1966 -0.1966 2.2631 2.2631 3.1808 3.1808 6.0176 6.0176 6.5134 6.5134 8.0254 8.0254 9.0967 9.0967 9.2264 9.2264 9.3881 9.3881 9.7285 9.7285 10.4489 10.4489 10.6217 10.6217 11.3777 11.3777 11.6685 11.6685 12.3010 12.3010 12.8218 12.8218 k = 0.0000 0.3372 0.2254 ( 9170 PWs) bands (ev): -46.2030 -46.2030 -46.2030 -46.2030 -22.9106 -22.9106 -22.9104 -22.9104 -22.2673 -22.2673 -22.2671 -22.2671 -22.2476 -22.2476 -22.2475 -22.2475 -0.3400 -0.3400 -0.1212 -0.1212 2.2201 2.2201 3.0282 3.0282 5.9839 5.9839 6.5861 6.5861 7.9107 7.9107 9.0410 9.0410 9.2576 9.2576 9.3971 9.3971 9.7611 9.7611 10.4356 10.4356 10.5982 10.5982 11.3651 11.3651 11.7200 11.7200 12.3238 12.3238 12.8520 12.8520 k = 0.0000 0.3488 0.2254 ( 9166 PWs) bands (ev): -46.2029 -46.2029 -46.2029 -46.2029 -22.9109 -22.9109 -22.9107 -22.9107 -22.2680 -22.2680 -22.2678 -22.2678 -22.2475 -22.2475 -22.2474 -22.2474 -0.2561 -0.2561 -0.0437 -0.0437 2.1711 2.1711 2.8777 2.8777 5.9599 5.9599 6.6619 6.6619 7.7958 7.7958 8.9722 8.9722 9.2957 9.2957 9.4060 9.4060 9.7933 9.7933 10.4266 10.4266 10.5751 10.5751 11.3508 11.3508 11.7733 11.7733 12.3463 12.3463 12.8792 12.8792 k = 0.0000 0.3605 0.2254 ( 9172 PWs) bands (ev): -46.2029 -46.2029 -46.2029 -46.2029 -22.9111 -22.9111 -22.9110 -22.9110 -22.2686 -22.2686 -22.2685 -22.2685 -22.2473 -22.2473 -22.2472 -22.2472 -0.1696 -0.1696 0.0356 0.0356 2.1163 2.1163 2.7292 2.7292 5.9458 5.9458 6.7400 6.7400 7.6814 7.6814 8.8971 8.8971 9.3335 9.3335 9.4149 9.4149 9.8252 9.8252 10.4216 10.4216 10.5531 10.5531 11.3343 11.3343 11.8281 11.8281 12.3682 12.3682 12.9016 12.9016 k = 0.0000 0.3721 0.2254 ( 9170 PWs) bands (ev): -46.2028 -46.2028 -46.2028 -46.2028 -22.9114 -22.9114 -22.9113 -22.9113 -22.2693 -22.2693 -22.2691 -22.2691 -22.2472 -22.2472 -22.2471 -22.2471 -0.0805 -0.0805 0.1168 0.1168 2.0561 2.0561 2.5830 2.5830 5.9417 5.9417 6.8200 6.8200 7.5678 7.5678 8.8178 8.8178 9.3688 9.3688 9.4237 9.4237 9.8567 9.8567 10.4196 10.4196 10.5337 10.5337 11.3150 11.3150 11.8839 11.8839 12.3893 12.3893 12.9060 12.9060 k = 0.0000 0.3837 0.2254 ( 9180 PWs) bands (ev): -46.2028 -46.2028 -46.2027 -46.2027 -22.9117 -22.9117 -22.9115 -22.9115 -22.2698 -22.2698 -22.2697 -22.2697 -22.2471 -22.2471 -22.2470 -22.2470 0.0111 0.0111 0.1996 0.1996 1.9907 1.9907 2.4390 2.4390 5.9474 5.9474 6.9014 6.9014 7.4560 7.4560 8.7351 8.7351 9.4006 9.4006 9.4324 9.4324 9.8880 9.8880 10.4179 10.4179 10.5199 10.5199 11.2926 11.2926 11.9405 11.9405 12.4091 12.4091 12.8997 12.8997 k = 0.0000 0.3953 0.2254 ( 9180 PWs) bands (ev): -46.2027 -46.2027 -46.2027 -46.2027 -22.9119 -22.9119 -22.9118 -22.9118 -22.2704 -22.2704 -22.2702 -22.2702 -22.2470 -22.2470 -22.2469 -22.2469 0.1051 0.1051 0.2838 0.2838 1.9207 1.9207 2.2975 2.2975 5.9626 5.9626 6.9832 6.9832 7.3471 7.3471 8.6496 8.6496 9.4281 9.4281 9.4410 9.4410 9.9189 9.9189 10.4117 10.4117 10.5169 10.5169 11.2666 11.2666 11.9972 11.9972 12.4272 12.4272 12.8921 12.8921 k = 0.0000 0.4070 0.2254 ( 9192 PWs) bands (ev): -46.2027 -46.2027 -46.2027 -46.2027 -22.9121 -22.9121 -22.9120 -22.9120 -22.2708 -22.2708 -22.2707 -22.2707 -22.2469 -22.2469 -22.2468 -22.2468 0.2015 0.2015 0.3693 0.3693 1.8466 1.8466 2.1587 2.1587 5.9868 5.9868 7.0599 7.0599 7.2466 7.2466 8.5618 8.5618 9.4484 9.4484 9.4521 9.4521 9.9496 9.9496 10.3978 10.3978 10.5278 10.5278 11.2368 11.2368 12.0537 12.0537 12.4431 12.4431 12.8845 12.8845 k = 0.0000 0.4186 0.2254 ( 9196 PWs) bands (ev): -46.2026 -46.2026 -46.2026 -46.2026 -22.9123 -22.9123 -22.9122 -22.9122 -22.2713 -22.2713 -22.2712 -22.2712 -22.2468 -22.2468 -22.2468 -22.2468 0.3001 0.3001 0.4557 0.4557 1.7692 1.7692 2.0226 2.0226 6.0195 6.0195 7.0829 7.0829 7.2035 7.2035 8.4721 8.4721 9.4571 9.4571 9.4702 9.4702 9.9800 9.9800 10.3776 10.3776 10.5510 10.5510 11.2030 11.2030 12.1093 12.1093 12.4561 12.4561 12.8779 12.8779 k = 0.0000 0.4302 0.2254 ( 9212 PWs) bands (ev): -46.2026 -46.2026 -46.2026 -46.2026 -22.9124 -22.9124 -22.9124 -22.9124 -22.2716 -22.2716 -22.2716 -22.2716 -22.2467 -22.2467 -22.2467 -22.2467 0.4006 0.4006 0.5427 0.5427 1.6890 1.6890 1.8896 1.8896 6.0604 6.0604 7.0022 7.0022 7.2681 7.2681 8.3808 8.3808 9.4650 9.4650 9.4845 9.4845 10.0102 10.0102 10.3538 10.3538 10.5833 10.5833 11.1653 11.1653 12.1634 12.1634 12.4656 12.4656 12.8727 12.8727 k = 0.0000 0.4419 0.2254 ( 9200 PWs) bands (ev): -46.2026 -46.2026 -46.2026 -46.2026 -22.9126 -22.9126 -22.9125 -22.9125 -22.2720 -22.2720 -22.2719 -22.2719 -22.2467 -22.2467 -22.2466 -22.2466 0.5027 0.5027 0.6295 0.6295 1.6071 1.6071 1.7602 1.7602 6.1089 6.1089 6.9045 6.9045 7.3536 7.3536 8.2882 8.2882 9.4727 9.4727 9.4947 9.4947 10.0401 10.0401 10.3280 10.3280 10.6226 10.6226 11.1237 11.1237 12.2153 12.2153 12.4709 12.4709 12.8693 12.8693 k = 0.0000 0.4535 0.2254 ( 9194 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9127 -22.9127 -22.9126 -22.9126 -22.2722 -22.2722 -22.2722 -22.2722 -22.2466 -22.2466 -22.2466 -22.2466 0.6055 0.6055 0.7152 0.7152 1.5247 1.5247 1.6353 1.6353 6.1644 6.1644 6.8067 6.8067 7.4434 7.4434 8.1946 8.1946 9.4799 9.4799 9.5014 9.5014 10.0699 10.0699 10.3010 10.3010 10.6671 10.6671 11.0786 11.0786 12.2642 12.2642 12.4714 12.4714 12.8680 12.8680 k = 0.0000 0.4651 0.2254 ( 9202 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9128 -22.9128 -22.9127 -22.9127 -22.2724 -22.2724 -22.2724 -22.2724 -22.2466 -22.2466 -22.2466 -22.2466 0.7076 0.7076 0.7978 0.7978 1.4436 1.4436 1.5168 1.5168 6.2265 6.2265 6.7114 6.7114 7.5351 7.5351 8.1004 8.1004 9.4866 9.4866 9.5050 9.5050 10.0996 10.0996 10.2732 10.2732 10.7155 10.7155 11.0304 11.0304 12.3094 12.3094 12.4664 12.4664 12.8687 12.8687 k = 0.0000 0.4767 0.2254 ( 9186 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9128 -22.9128 -22.9128 -22.9128 -22.2726 -22.2726 -22.2725 -22.2725 -22.2465 -22.2465 -22.2465 -22.2465 0.8055 0.8055 0.8726 0.8726 1.3679 1.3679 1.4089 1.4089 6.2947 6.2947 6.6194 6.6194 7.6280 7.6280 8.0057 8.0057 9.4927 9.4927 9.5060 9.5060 10.1290 10.1290 10.2450 10.2450 10.7668 10.7668 10.9797 10.9797 12.3500 12.3500 12.4555 12.4555 12.8714 12.8714 k = 0.0000 0.4884 0.2254 ( 9194 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9128 -22.9128 -22.2727 -22.2727 -22.2726 -22.2726 -22.2465 -22.2465 -22.2465 -22.2465 0.8900 0.8900 0.9281 0.9281 1.3071 1.3071 1.3231 1.3231 6.3685 6.3685 6.5313 6.5313 7.7218 7.7218 7.9109 7.9109 9.4979 9.4979 9.5049 9.5049 10.1583 10.1583 10.2163 10.2163 10.8198 10.8198 10.9271 10.9271 12.3854 12.3854 12.4384 12.4384 12.8757 12.8757 k = 0.0000 0.5000 0.2254 ( 9196 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.9388 0.9388 0.9388 0.9388 1.2842 1.2842 1.2842 1.2842 6.4475 6.4475 6.4475 6.4475 7.8162 7.8162 7.8162 7.8162 9.5021 9.5021 9.5021 9.5021 10.1874 10.1874 10.1874 10.1874 10.8736 10.8736 10.8736 10.8736 12.4150 12.4150 12.4150 12.4150 12.8814 12.8814 k = 0.0000 0.5000 0.2254 ( 9196 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.9388 0.9388 0.9388 0.9388 1.2842 1.2842 1.2842 1.2842 6.4475 6.4475 6.4475 6.4475 7.8162 7.8162 7.8162 7.8162 9.5021 9.5021 9.5021 9.5021 10.1874 10.1874 10.1874 10.1874 10.8736 10.8736 10.8736 10.8736 12.4150 12.4150 12.4150 12.4150 12.8814 12.8814 k = 0.0116 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9128 -22.9128 -22.2727 -22.2727 -22.2727 -22.2727 -22.2466 -22.2466 -22.2465 -22.2465 0.9400 0.9400 0.9400 0.9400 1.2854 1.2854 1.2857 1.2857 6.4467 6.4467 6.4492 6.4492 7.8150 7.8150 7.8188 7.8188 9.4932 9.4932 9.5010 9.5010 10.1719 10.1719 10.1925 10.1925 10.8609 10.8609 10.8804 10.8804 12.4147 12.4147 12.4161 12.4161 12.8662 12.8662 k = 0.0233 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2726 -22.2726 -22.2467 -22.2467 -22.2465 -22.2465 0.9433 0.9433 0.9433 0.9433 1.2892 1.2892 1.2897 1.2897 6.4466 6.4466 6.4516 6.4516 7.8151 7.8151 7.8228 7.8228 9.4744 9.4744 9.4901 9.4901 10.1462 10.1462 10.1866 10.1866 10.8431 10.8431 10.8812 10.8812 12.4150 12.4150 12.4179 12.4179 12.8323 12.8323 k = 0.0349 0.5000 0.2254 ( 9188 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9130 -22.9130 -22.9129 -22.9129 -22.2727 -22.2727 -22.2726 -22.2726 -22.2468 -22.2468 -22.2466 -22.2466 0.9489 0.9489 0.9489 0.9489 1.2956 1.2956 1.2964 1.2964 6.4471 6.4471 6.4549 6.4549 7.8165 7.8165 7.8281 7.8281 9.4458 9.4458 9.4694 9.4694 10.1105 10.1105 10.1695 10.1695 10.8209 10.8209 10.8762 10.8762 12.4158 12.4158 12.4204 12.4204 12.7839 12.7839 k = 0.0465 0.5000 0.2254 ( 9200 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9131 -22.9131 -22.9129 -22.9129 -22.2727 -22.2727 -22.2726 -22.2726 -22.2471 -22.2471 -22.2468 -22.2468 0.9567 0.9567 0.9568 0.9568 1.3046 1.3046 1.3057 1.3057 6.4483 6.4483 6.4588 6.4588 7.8192 7.8192 7.8348 7.8348 9.4075 9.4075 9.4392 9.4392 10.0651 10.0651 10.1408 10.1408 10.7954 10.7954 10.8657 10.8657 12.4166 12.4166 12.4231 12.4231 12.7260 12.7260 k = 0.0581 0.5000 0.2254 ( 9204 PWs) bands (ev): -46.2024 -46.2024 -46.2024 -46.2024 -22.9132 -22.9132 -22.9130 -22.9130 -22.2727 -22.2727 -22.2726 -22.2726 -22.2473 -22.2473 -22.2470 -22.2470 0.9668 0.9668 0.9668 0.9668 1.3162 1.3162 1.3176 1.3176 6.4500 6.4500 6.4633 6.4633 7.8231 7.8231 7.8428 7.8428 9.3599 9.3599 9.3996 9.3996 10.0104 10.0104 10.1004 10.1004 10.7676 10.7676 10.8502 10.8502 12.4166 12.4166 12.4257 12.4257 12.6639 12.6639 k = 0.0698 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2024 -46.2024 -46.2024 -46.2024 -22.9133 -22.9133 -22.9131 -22.9131 -22.2727 -22.2727 -22.2725 -22.2725 -22.2476 -22.2476 -22.2472 -22.2472 0.9790 0.9790 0.9790 0.9790 1.3304 1.3304 1.3321 1.3321 6.4519 6.4519 6.4683 6.4683 7.8282 7.8282 7.8520 7.8520 9.3032 9.3032 9.3511 9.3511 9.9466 9.9466 10.0486 10.0486 10.7384 10.7384 10.8304 10.8304 12.4139 12.4139 12.4272 12.4272 12.6030 12.6030 k = 0.0814 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2024 -46.2024 -46.2024 -46.2024 -22.9135 -22.9135 -22.9132 -22.9132 -22.2727 -22.2727 -22.2725 -22.2725 -22.2479 -22.2479 -22.2475 -22.2475 0.9934 0.9934 0.9935 0.9935 1.3472 1.3472 1.3491 1.3491 6.4539 6.4539 6.4736 6.4736 7.8342 7.8342 7.8624 7.8624 9.2381 9.2381 9.2941 9.2941 9.8745 9.8745 9.9863 9.9863 10.7082 10.7082 10.8067 10.8067 12.4049 12.4049 12.4254 12.4254 12.5499 12.5499 k = 0.0930 0.5000 0.2254 ( 9188 PWs) bands (ev): -46.2023 -46.2023 -46.2023 -46.2023 -22.9136 -22.9136 -22.9133 -22.9133 -22.2727 -22.2727 -22.2725 -22.2725 -22.2483 -22.2483 -22.2478 -22.2478 1.0100 1.0100 1.0101 1.0101 1.3666 1.3666 1.3687 1.3687 6.4558 6.4558 6.4791 6.4791 7.8411 7.8411 7.8738 7.8738 9.1651 9.1651 9.2291 9.2291 9.7948 9.7948 9.9146 9.9146 10.6771 10.6771 10.7795 10.7795 12.3830 12.3830 12.4145 12.4145 12.5128 12.5128 k = 0.1047 0.5000 0.2254 ( 9180 PWs) bands (ev): -46.2023 -46.2023 -46.2023 -46.2023 -22.9138 -22.9138 -22.9134 -22.9134 -22.2727 -22.2727 -22.2725 -22.2725 -22.2487 -22.2487 -22.2481 -22.2481 1.0287 1.0287 1.0288 1.0288 1.3885 1.3885 1.3909 1.3909 6.4573 6.4573 6.4843 6.4843 7.8486 7.8486 7.8861 7.8861 9.0851 9.0851 9.1569 9.1569 9.7085 9.7085 9.8350 9.8350 10.6449 10.6449 10.7491 10.7491 12.3469 12.3469 12.3862 12.3862 12.4947 12.4947 k = 0.1163 0.5000 0.2254 ( 9176 PWs) bands (ev): -46.2022 -46.2022 -46.2022 -46.2022 -22.9140 -22.9140 -22.9136 -22.9136 -22.2728 -22.2728 -22.2725 -22.2725 -22.2492 -22.2492 -22.2485 -22.2485 1.0496 1.0496 1.0497 1.0497 1.4129 1.4129 1.4155 1.4155 6.4579 6.4579 6.4891 6.4891 7.8565 7.8565 7.8990 7.8990 8.9988 8.9988 9.0783 9.0783 9.6167 9.6167 9.7492 9.7492 10.6113 10.6113 10.7157 10.7157 12.3040 12.3040 12.3444 12.3444 12.4871 12.4871 k = 0.1279 0.5000 0.2254 ( 9180 PWs) bands (ev): -46.2022 -46.2022 -46.2022 -46.2022 -22.9142 -22.9142 -22.9137 -22.9137 -22.2728 -22.2728 -22.2725 -22.2725 -22.2496 -22.2496 -22.2489 -22.2489 1.0725 1.0725 1.0726 1.0726 1.4398 1.4398 1.4427 1.4427 6.4574 6.4574 6.4931 6.4931 7.8641 7.8641 7.9120 7.9120 8.9076 8.9076 8.9943 8.9943 9.5205 9.5205 9.6589 9.6589 10.5759 10.5759 10.6795 10.6795 12.2614 12.2614 12.3000 12.3000 12.4867 12.4867 k = 0.1395 0.5000 0.2254 ( 9188 PWs) bands (ev): -46.2021 -46.2021 -46.2021 -46.2021 -22.9144 -22.9144 -22.9139 -22.9139 -22.2728 -22.2728 -22.2725 -22.2725 -22.2501 -22.2501 -22.2494 -22.2494 1.0975 1.0975 1.0976 1.0976 1.4692 1.4692 1.4723 1.4723 6.4554 6.4554 6.4958 6.4958 7.8710 7.8710 7.9245 7.9245 8.8127 8.8127 8.9062 8.9062 9.4212 9.4212 9.5657 9.5657 10.5384 10.5384 10.6406 10.6406 12.2225 12.2225 12.2585 12.2585 12.4893 12.4893 k = 0.1512 0.5000 0.2254 ( 9196 PWs) bands (ev): -46.2021 -46.2021 -46.2021 -46.2021 -22.9146 -22.9146 -22.9141 -22.9141 -22.2728 -22.2728 -22.2725 -22.2725 -22.2506 -22.2506 -22.2498 -22.2498 1.1244 1.1244 1.1246 1.1246 1.5011 1.5011 1.5043 1.5043 6.4513 6.4513 6.4968 6.4968 7.8759 7.8759 7.9353 7.9353 8.7161 8.7161 8.8159 8.8159 9.3201 9.3201 9.4713 9.4713 10.4987 10.4987 10.5991 10.5991 12.1886 12.1886 12.2216 12.2216 12.4931 12.4931 k = 0.1628 0.5000 0.2254 ( 9204 PWs) bands (ev): -46.2020 -46.2020 -46.2020 -46.2020 -22.9148 -22.9148 -22.9143 -22.9143 -22.2729 -22.2729 -22.2725 -22.2725 -22.2511 -22.2511 -22.2503 -22.2503 1.1534 1.1534 1.1535 1.1535 1.5353 1.5353 1.5387 1.5387 6.4447 6.4447 6.4956 6.4956 7.8775 7.8775 7.9427 7.9427 8.6202 8.6202 8.7254 8.7254 9.2185 9.2185 9.3770 9.3770 10.4564 10.4564 10.5550 10.5550 12.1601 12.1601 12.1901 12.1901 12.4973 12.4973 k = 0.1744 0.5000 0.2254 ( 9200 PWs) bands (ev): -46.2019 -46.2019 -46.2019 -46.2019 -22.9151 -22.9151 -22.9145 -22.9145 -22.2730 -22.2730 -22.2726 -22.2726 -22.2516 -22.2516 -22.2508 -22.2508 1.1842 1.1842 1.1844 1.1844 1.5719 1.5719 1.5755 1.5755 6.4350 6.4350 6.4915 6.4915 7.8734 7.8734 7.9433 7.9433 8.5290 8.5290 8.6379 8.6379 9.1178 9.1178 9.2843 9.2843 10.4117 10.4117 10.5087 10.5087 12.1372 12.1372 12.1641 12.1641 12.5017 12.5017 k = 0.1860 0.5000 0.2254 ( 9200 PWs) bands (ev): -46.2019 -46.2019 -46.2019 -46.2019 -22.9153 -22.9153 -22.9148 -22.9148 -22.2730 -22.2730 -22.2726 -22.2726 -22.2521 -22.2521 -22.2513 -22.2513 1.2169 1.2169 1.2171 1.2171 1.6108 1.6108 1.6145 1.6145 6.4217 6.4217 6.4840 6.4840 7.8603 7.8603 7.9323 7.9323 8.4480 8.4480 8.5572 8.5572 9.0194 9.0194 9.1944 9.1944 10.3645 10.3645 10.4603 10.4603 12.1196 12.1196 12.1437 12.1437 12.5060 12.5060 k = 0.1977 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2018 -46.2018 -46.2018 -46.2018 -22.9156 -22.9156 -22.9150 -22.9150 -22.2731 -22.2731 -22.2727 -22.2727 -22.2526 -22.2526 -22.2517 -22.2517 1.2514 1.2514 1.2516 1.2516 1.6519 1.6519 1.6557 1.6557 6.4043 6.4043 6.4723 6.4723 7.8342 7.8342 7.9027 7.9027 8.3845 8.3845 8.4882 8.4882 8.9247 8.9247 9.1086 9.1086 10.3151 10.3151 10.4099 10.4099 12.1071 12.1071 12.1285 12.1285 12.5101 12.5101 k = 0.2093 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2017 -46.2017 -46.2017 -46.2017 -22.9158 -22.9158 -22.9153 -22.9153 -22.2733 -22.2733 -22.2728 -22.2728 -22.2531 -22.2531 -22.2522 -22.2522 1.2875 1.2875 1.2879 1.2879 1.6952 1.6952 1.6991 1.6991 6.3822 6.3822 6.4558 6.4558 7.7911 7.7911 7.8493 7.8493 8.3443 8.3443 8.4353 8.4353 8.8352 8.8352 9.0278 9.0278 10.2636 10.2636 10.3579 10.3579 12.0992 12.0992 12.1183 12.1183 12.5138 12.5138 k = 0.2209 0.5000 0.2254 ( 9188 PWs) bands (ev): -46.2016 -46.2016 -46.2016 -46.2016 -22.9161 -22.9161 -22.9155 -22.9155 -22.2734 -22.2734 -22.2730 -22.2730 -22.2536 -22.2536 -22.2527 -22.2527 1.3253 1.3253 1.3257 1.3257 1.7406 1.7406 1.7446 1.7446 6.3551 6.3551 6.4338 6.4338 7.7292 7.7292 7.7727 7.7727 8.3269 8.3269 8.4009 8.4009 8.7522 8.7522 8.9530 8.9530 10.2103 10.2103 10.3044 10.3044 12.0958 12.0958 12.1126 12.1126 12.5171 12.5171 k = 0.2326 0.5000 0.2254 ( 9196 PWs) bands (ev): -46.2016 -46.2016 -46.2016 -46.2016 -22.9164 -22.9164 -22.9158 -22.9158 -22.2736 -22.2736 -22.2732 -22.2732 -22.2540 -22.2540 -22.2531 -22.2531 1.3647 1.3647 1.3651 1.3651 1.7880 1.7880 1.7921 1.7921 6.3226 6.3226 6.4058 6.4058 7.6498 7.6498 7.6785 7.6785 8.3269 8.3269 8.3843 8.3843 8.6773 8.6773 8.8851 8.8851 10.1554 10.1554 10.2497 10.2497 12.0962 12.0962 12.1111 12.1111 12.5200 12.5200 k = 0.2442 0.5000 0.2254 ( 9188 PWs) bands (ev): -46.2015 -46.2015 -46.2015 -46.2015 -22.9166 -22.9166 -22.9161 -22.9161 -22.2738 -22.2738 -22.2734 -22.2734 -22.2544 -22.2544 -22.2535 -22.2535 1.4055 1.4055 1.4059 1.4059 1.8373 1.8373 1.8414 1.8414 6.2845 6.2845 6.3715 6.3715 7.5565 7.5565 7.5729 7.5729 8.3379 8.3379 8.3822 8.3822 8.6119 8.6119 8.8246 8.8246 10.0991 10.0991 10.1940 10.1940 12.1001 12.1001 12.1133 12.1133 12.5224 12.5224 k = 0.2558 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2014 -46.2014 -46.2014 -46.2014 -22.9169 -22.9169 -22.9163 -22.9163 -22.2740 -22.2740 -22.2736 -22.2736 -22.2548 -22.2548 -22.2539 -22.2539 1.4476 1.4476 1.4481 1.4481 1.8884 1.8884 1.8925 1.8925 6.2408 6.2408 6.3306 6.3306 7.4531 7.4531 7.4602 7.4602 8.3543 8.3543 8.3912 8.3912 8.5580 8.5580 8.7721 8.7721 10.0417 10.0417 10.1375 10.1375 12.1070 12.1070 12.1188 12.1188 12.5244 12.5244 k = 0.2674 0.5000 0.2254 ( 9204 PWs) bands (ev): -46.2013 -46.2013 -46.2013 -46.2013 -22.9172 -22.9172 -22.9166 -22.9166 -22.2742 -22.2742 -22.2739 -22.2739 -22.2552 -22.2552 -22.2543 -22.2543 1.4908 1.4908 1.4914 1.4914 1.9412 1.9412 1.9453 1.9453 6.1916 6.1916 6.2831 6.2831 7.3430 7.3430 7.3434 7.3434 8.3707 8.3707 8.4082 8.4082 8.5191 8.5191 8.7277 8.7277 9.9835 9.9835 10.0804 10.0804 12.1166 12.1166 12.1271 12.1271 12.5258 12.5258 k = 0.2791 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2013 -46.2013 -46.2013 -46.2013 -22.9175 -22.9175 -22.9169 -22.9169 -22.2745 -22.2745 -22.2742 -22.2742 -22.2555 -22.2555 -22.2546 -22.2546 1.5352 1.5352 1.5358 1.5358 1.9955 1.9955 1.9995 1.9995 6.1373 6.1373 6.2294 6.2294 7.2243 7.2243 7.2287 7.2287 8.3791 8.3791 8.4309 8.4309 8.5015 8.5015 8.6917 8.6917 9.9246 9.9246 10.0230 10.0230 12.1286 12.1286 12.1380 12.1380 12.5267 12.5267 k = 0.2907 0.5000 0.2254 ( 9188 PWs) bands (ev): -46.2012 -46.2012 -46.2012 -46.2012 -22.9177 -22.9177 -22.9172 -22.9172 -22.2748 -22.2748 -22.2745 -22.2745 -22.2558 -22.2558 -22.2550 -22.2550 1.5804 1.5804 1.5811 1.5811 2.0511 2.0511 2.0550 2.0550 6.0785 6.0785 6.1701 6.1701 7.1042 7.1042 7.1120 7.1120 8.3752 8.3752 8.4576 8.4576 8.5085 8.5085 8.6640 8.6640 9.8653 9.8653 9.9653 9.9653 12.1424 12.1424 12.1508 12.1508 12.5271 12.5271 k = 0.3023 0.5000 0.2254 ( 9176 PWs) bands (ev): -46.2011 -46.2011 -46.2011 -46.2011 -22.9180 -22.9180 -22.9174 -22.9174 -22.2751 -22.2751 -22.2748 -22.2748 -22.2560 -22.2560 -22.2552 -22.2552 1.6262 1.6262 1.6270 1.6270 2.1079 2.1079 2.1117 2.1117 6.0156 6.0156 6.1057 6.1057 6.9841 6.9841 6.9944 6.9944 8.3658 8.3658 8.4867 8.4867 8.5320 8.5320 8.6448 8.6448 9.8058 9.8058 9.9076 9.9076 12.1577 12.1577 12.1654 12.1654 12.5270 12.5270 k = 0.3140 0.5000 0.2254 ( 9184 PWs) bands (ev): -46.2010 -46.2010 -46.2010 -46.2010 -22.9183 -22.9183 -22.9177 -22.9177 -22.2754 -22.2754 -22.2752 -22.2752 -22.2562 -22.2562 -22.2555 -22.2555 1.6726 1.6726 1.6734 1.6734 2.1656 2.1656 2.1692 2.1692 5.9496 5.9496 6.0374 6.0374 6.8647 6.8647 6.8770 6.8770 8.3581 8.3581 8.5165 8.5165 8.5636 8.5636 8.6344 8.6344 9.7462 9.7462 9.8499 9.8499 12.1742 12.1742 12.1811 12.1811 12.5266 12.5266 k = 0.3256 0.5000 0.2254 ( 9176 PWs) bands (ev): -46.2010 -46.2010 -46.2010 -46.2010 -22.9185 -22.9185 -22.9180 -22.9180 -22.2758 -22.2758 -22.2755 -22.2755 -22.2564 -22.2564 -22.2557 -22.2557 1.7192 1.7192 1.7200 1.7200 2.2239 2.2239 2.2274 2.2274 5.8813 5.8813 5.9660 5.9660 6.7468 6.7468 6.7606 6.7606 8.3554 8.3554 8.5446 8.5446 8.5990 8.5990 8.6341 8.6341 9.6867 9.6867 9.7925 9.7925 12.1915 12.1915 12.1978 12.1978 12.5258 12.5258 k = 0.3372 0.5000 0.2254 ( 9180 PWs) bands (ev): -46.2009 -46.2009 -46.2009 -46.2009 -22.9187 -22.9187 -22.9182 -22.9182 -22.2761 -22.2761 -22.2759 -22.2759 -22.2566 -22.2566 -22.2559 -22.2559 1.7658 1.7658 1.7667 1.7667 2.2826 2.2826 2.2859 2.2859 5.8115 5.8115 5.8927 5.8927 6.6312 6.6312 6.6460 6.6460 8.3582 8.3582 8.5679 8.5679 8.6363 8.6363 8.6457 8.6457 9.6276 9.6276 9.7354 9.7354 12.2092 12.2092 12.2149 12.2149 12.5248 12.5248 k = 0.3488 0.5000 0.2254 ( 9180 PWs) bands (ev): -46.2008 -46.2008 -46.2008 -46.2008 -22.9190 -22.9190 -22.9185 -22.9185 -22.2765 -22.2765 -22.2763 -22.2763 -22.2567 -22.2567 -22.2561 -22.2561 1.8120 1.8120 1.8129 1.8129 2.3413 2.3413 2.3444 2.3444 5.7412 5.7412 5.8184 5.8184 6.5183 6.5183 6.5340 6.5340 8.3665 8.3665 8.5857 8.5857 8.6688 8.6688 8.6746 8.6746 9.5689 9.5689 9.6787 9.6787 12.2270 12.2270 12.2320 12.2320 12.5237 12.5237 k = 0.3605 0.5000 0.2254 ( 9188 PWs) bands (ev): -46.2008 -46.2008 -46.2008 -46.2008 -22.9192 -22.9192 -22.9187 -22.9187 -22.2768 -22.2768 -22.2767 -22.2767 -22.2568 -22.2568 -22.2562 -22.2562 1.8576 1.8576 1.8586 1.8586 2.3996 2.3996 2.4024 2.4024 5.6713 5.6713 5.7442 5.7442 6.4090 6.4090 6.4253 6.4253 8.3799 8.3799 8.6013 8.6013 8.6991 8.6991 8.7130 8.7130 9.5108 9.5108 9.6227 9.6227 12.2443 12.2443 12.2488 12.2488 12.5226 12.5226 k = 0.3721 0.5000 0.2254 ( 9196 PWs) bands (ev): -46.2007 -46.2007 -46.2007 -46.2007 -22.9194 -22.9194 -22.9190 -22.9190 -22.2772 -22.2772 -22.2770 -22.2770 -22.2569 -22.2569 -22.2564 -22.2564 1.9021 1.9021 1.9031 1.9031 2.4571 2.4571 2.4596 2.4596 5.6029 5.6029 5.6712 5.6712 6.3040 6.3040 6.3207 6.3207 8.3978 8.3978 8.6177 8.6177 8.7324 8.7324 8.7509 8.7509 9.4535 9.4535 9.5672 9.5672 12.2609 12.2609 12.2649 12.2649 12.5218 12.5218 k = 0.3837 0.5000 0.2254 ( 9200 PWs) bands (ev): -46.2007 -46.2007 -46.2007 -46.2007 -22.9196 -22.9196 -22.9192 -22.9192 -22.2775 -22.2775 -22.2774 -22.2774 -22.2569 -22.2569 -22.2565 -22.2565 1.9453 1.9453 1.9463 1.9463 2.5132 2.5132 2.5155 2.5155 5.5367 5.5367 5.6003 5.6003 6.2038 6.2038 6.2207 6.2207 8.4198 8.4198 8.6361 8.6361 8.7664 8.7664 8.7879 8.7879 9.3973 9.3973 9.5126 9.5126 12.2763 12.2763 12.2797 12.2797 12.5212 12.5212 k = 0.3953 0.5000 0.2254 ( 9204 PWs) bands (ev): -46.2006 -46.2006 -46.2006 -46.2006 -22.9197 -22.9197 -22.9194 -22.9194 -22.2778 -22.2778 -22.2777 -22.2777 -22.2570 -22.2570 -22.2565 -22.2565 1.9865 1.9865 1.9875 1.9875 2.5674 2.5674 2.5693 2.5693 5.4737 5.4737 5.5324 5.5324 6.1094 6.1094 6.1262 6.1262 8.4453 8.4453 8.6567 8.6567 8.7998 8.7998 8.8234 8.8234 9.3424 9.3424 9.4588 9.4588 12.2903 12.2903 12.2931 12.2931 12.5212 12.5212 k = 0.4070 0.5000 0.2254 ( 9196 PWs) bands (ev): -46.2006 -46.2006 -46.2006 -46.2006 -22.9199 -22.9199 -22.9196 -22.9196 -22.2781 -22.2781 -22.2780 -22.2780 -22.2570 -22.2570 -22.2566 -22.2566 2.0254 2.0254 2.0264 2.0264 2.6190 2.6190 2.6206 2.6206 5.4149 5.4149 5.4683 5.4683 6.0216 6.0216 6.0380 6.0380 8.4739 8.4739 8.6793 8.6793 8.8318 8.8318 8.8569 8.8569 9.2891 9.2891 9.4060 9.4060 12.3024 12.3024 12.3046 12.3046 12.5219 12.5219 k = 0.4186 0.5000 0.2254 ( 9204 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9200 -22.9200 -22.9197 -22.9197 -22.2784 -22.2784 -22.2783 -22.2783 -22.2570 -22.2570 -22.2567 -22.2567 2.0615 2.0615 2.0624 2.0624 2.6672 2.6672 2.6685 2.6685 5.3610 5.3610 5.4090 5.4090 5.9412 5.9412 5.9568 5.9568 8.5052 8.5052 8.7032 8.7032 8.8617 8.8617 8.8881 8.8881 9.2379 9.2379 9.3543 9.3543 12.3125 12.3125 12.3142 12.3142 12.5233 12.5233 k = 0.4302 0.5000 0.2254 ( 9196 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9201 -22.9201 -22.9199 -22.9199 -22.2786 -22.2786 -22.2785 -22.2785 -22.2570 -22.2570 -22.2567 -22.2567 2.0942 2.0942 2.0950 2.0950 2.7114 2.7114 2.7124 2.7124 5.3129 5.3129 5.3552 5.3552 5.8691 5.8691 5.8837 5.8837 8.5386 8.5386 8.7277 8.7277 8.8889 8.8889 8.9165 8.9165 9.1896 9.1896 9.3039 9.3039 12.3205 12.3205 12.3218 12.3218 12.5252 12.5252 k = 0.4419 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9202 -22.9202 -22.9200 -22.9200 -22.2788 -22.2788 -22.2788 -22.2788 -22.2570 -22.2570 -22.2568 -22.2568 2.1229 2.1229 2.1237 2.1237 2.7506 2.7506 2.7514 2.7514 5.2714 5.2714 5.3075 5.3075 5.8063 5.8063 5.8194 5.8194 8.5737 8.5737 8.7511 8.7511 8.9133 8.9133 8.9418 8.9418 9.1452 9.1452 9.2549 9.2549 12.3266 12.3266 12.3275 12.3275 12.5275 12.5275 k = 0.4535 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9203 -22.9203 -22.9201 -22.9201 -22.2790 -22.2790 -22.2789 -22.2789 -22.2570 -22.2570 -22.2568 -22.2568 2.1473 2.1473 2.1480 2.1480 2.7842 2.7842 2.7847 2.7847 5.2372 5.2372 5.2668 5.2668 5.7537 5.7537 5.7649 5.7649 8.6101 8.6101 8.7710 8.7710 8.9352 8.9352 8.9637 8.9637 9.1063 9.1063 9.2075 9.2075 12.3309 12.3309 12.3315 12.3315 12.5300 12.5300 k = 0.4651 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9202 -22.9202 -22.2791 -22.2791 -22.2791 -22.2791 -22.2570 -22.2570 -22.2569 -22.2569 2.1669 2.1669 2.1674 2.1674 2.8112 2.8112 2.8116 2.8116 5.2108 5.2108 5.2335 5.2335 5.7121 5.7121 5.7210 5.7210 8.6469 8.6469 8.7836 8.7836 8.9560 8.9560 8.9820 8.9820 9.0748 9.0748 9.1621 9.1621 12.3339 12.3339 12.3342 12.3342 12.5324 12.5324 k = 0.4767 0.5000 0.2254 ( 9196 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9203 -22.9203 -22.2792 -22.2792 -22.2792 -22.2792 -22.2570 -22.2570 -22.2569 -22.2569 2.1812 2.1812 2.1815 2.1815 2.8311 2.8311 2.8313 2.8313 5.1928 5.1928 5.2082 5.2082 5.6823 5.6823 5.6885 5.6885 8.6835 8.6835 8.7847 8.7847 8.9781 8.9781 8.9968 8.9968 9.0523 9.0523 9.1192 9.1192 12.3357 12.3357 12.3359 12.3359 12.5344 12.5344 k = 0.4884 0.5000 0.2254 ( 9192 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2570 -22.2570 -22.2569 -22.2569 2.1899 2.1899 2.1901 2.1901 2.8433 2.8433 2.8434 2.8434 5.1835 5.1835 5.1912 5.1912 5.6649 5.6649 5.6680 5.6680 8.7182 8.7182 8.7724 8.7724 9.0023 9.0023 9.0083 9.0083 9.0392 9.0392 9.0797 9.0797 12.3367 12.3367 12.3368 12.3368 12.5358 12.5358 k = 0.5000 0.5000 0.2254 ( 9200 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1929 2.1929 2.1929 2.1929 2.8474 2.8474 2.8474 2.8474 5.1829 5.1829 5.1829 5.1829 5.6601 5.6601 5.6601 5.6601 8.7489 8.7489 8.7489 8.7489 9.0151 9.0151 9.0151 9.0151 9.0470 9.0470 9.0470 9.0470 12.3370 12.3370 12.3370 12.3370 12.5363 12.5363 k = 0.5000 0.5000 0.2254 ( 9200 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1929 2.1929 2.1929 2.1929 2.8474 2.8474 2.8474 2.8474 5.1829 5.1829 5.1829 5.1829 5.6601 5.6601 5.6601 5.6601 8.7489 8.7489 8.7489 8.7489 9.0151 9.0151 9.0151 9.0151 9.0470 9.0470 9.0470 9.0470 12.3370 12.3370 12.3370 12.3370 12.5363 12.5363 k = 0.4918 0.4918 0.2254 ( 9190 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2570 -22.2570 -22.2569 -22.2569 2.1881 2.1881 2.1920 2.1920 2.8380 2.8380 2.8488 2.8488 5.1778 5.1778 5.1970 5.1970 5.6611 5.6611 5.6716 5.6716 8.7178 8.7178 8.7730 8.7730 8.9942 8.9942 9.0202 9.0202 9.0360 9.0360 9.0789 9.0789 12.3367 12.3367 12.3368 12.3368 12.5355 12.5355 k = 0.4836 0.4836 0.2254 ( 9194 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9203 -22.9203 -22.2792 -22.2792 -22.2792 -22.2792 -22.2570 -22.2570 -22.2569 -22.2569 2.1736 2.1736 2.1889 2.1889 2.8107 2.8107 2.8529 2.8529 5.1660 5.1660 5.2360 5.2360 5.6649 5.6649 5.7039 5.7039 8.6800 8.6800 8.7902 8.7902 8.9575 8.9575 9.0321 9.0321 9.0402 9.0402 9.1146 9.1146 12.3357 12.3357 12.3360 12.3360 12.5333 12.5333 k = 0.4754 0.4754 0.2254 ( 9190 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9202 -22.9202 -22.2791 -22.2791 -22.2791 -22.2791 -22.2570 -22.2570 -22.2569 -22.2569 2.1498 2.1498 2.1830 2.1830 2.7681 2.7681 2.8597 2.8597 5.1502 5.1502 5.2987 5.2987 5.6712 5.6712 5.7536 5.7536 8.6367 8.6367 8.8004 8.8004 8.9191 8.9191 9.0380 9.0380 9.0605 9.0605 9.1507 9.1507 12.3342 12.3342 12.3345 12.3345 12.5296 12.5296 k = 0.4672 0.4672 0.2254 ( 9186 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9203 -22.9203 -22.9201 -22.9201 -22.2790 -22.2790 -22.2789 -22.2789 -22.2570 -22.2570 -22.2568 -22.2568 2.1169 2.1169 2.1731 2.1731 2.7142 2.7142 2.8693 2.8693 5.1336 5.1336 5.3824 5.3824 5.6799 5.6799 5.8171 5.8171 8.5888 8.5888 8.8007 8.8007 8.8850 8.8850 9.0432 9.0432 9.0884 9.0884 9.1871 9.1871 12.3318 12.3318 12.3325 12.3325 12.5244 12.5244 k = 0.4590 0.4590 0.2254 ( 9190 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9202 -22.9202 -22.9200 -22.9200 -22.2788 -22.2788 -22.2788 -22.2788 -22.2570 -22.2570 -22.2568 -22.2568 2.0757 2.0757 2.1567 2.1567 2.6541 2.6541 2.8816 2.8816 5.1186 5.1186 5.4841 5.4841 5.6912 5.6912 5.8914 5.8914 8.5371 8.5371 8.7809 8.7809 8.8666 8.8666 9.0496 9.0496 9.1202 9.1202 9.2240 9.2240 12.3284 12.3284 12.3299 12.3299 12.5180 12.5180 k = 0.4508 0.4508 0.2254 ( 9190 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9201 -22.9201 -22.9199 -22.9199 -22.2786 -22.2786 -22.2785 -22.2785 -22.2570 -22.2570 -22.2568 -22.2568 2.0266 2.0266 2.1309 2.1309 2.5939 2.5939 2.8966 2.8966 5.1069 5.1069 5.6009 5.6009 5.7050 5.7050 5.9743 5.9743 8.4824 8.4824 8.7403 8.7403 8.8655 8.8655 9.0573 9.0573 9.1545 9.1545 9.2616 9.2616 12.3237 12.3237 12.3270 12.3270 12.5104 12.5104 k = 0.4426 0.4426 0.2254 ( 9190 PWs) bands (ev): -46.2005 -46.2005 -46.2005 -46.2005 -22.9200 -22.9200 -22.9197 -22.9197 -22.2783 -22.2783 -22.2783 -22.2783 -22.2570 -22.2570 -22.2567 -22.2567 1.9704 1.9704 2.0917 2.0917 2.5399 2.5399 2.9144 2.9144 5.0993 5.0993 5.7208 5.7208 5.7305 5.7305 6.0640 6.0640 8.4253 8.4253 8.6892 8.6892 8.8720 8.8720 9.0664 9.0664 9.1906 9.1906 9.3002 9.3002 12.3174 12.3174 12.3240 12.3240 12.5017 12.5017 k = 0.4344 0.4344 0.2254 ( 9194 PWs) bands (ev): -46.2006 -46.2006 -46.2006 -46.2006 -22.9199 -22.9199 -22.9195 -22.9195 -22.2780 -22.2780 -22.2780 -22.2780 -22.2570 -22.2570 -22.2567 -22.2567 1.9078 1.9078 2.0360 2.0360 2.4971 2.4971 2.9349 2.9349 5.0963 5.0963 5.7400 5.7400 5.8694 5.8694 6.1595 6.1595 8.3662 8.3662 8.6326 8.6326 8.8818 8.8818 9.0768 9.0768 9.2282 9.2282 9.3397 9.3397 12.3096 12.3096 12.3209 12.3209 12.4920 12.4920 k = 0.4262 0.4262 0.2254 ( 9206 PWs) bands (ev): -46.2006 -46.2006 -46.2006 -46.2006 -22.9197 -22.9197 -22.9194 -22.9194 -22.2777 -22.2777 -22.2776 -22.2776 -22.2570 -22.2570 -22.2566 -22.2566 1.8394 1.8394 1.9638 1.9638 2.4672 2.4672 2.9581 2.9581 5.0981 5.0981 5.7612 5.7612 6.0168 6.0168 6.2598 6.2598 8.3057 8.3057 8.5719 8.5719 8.8935 8.8935 9.0885 9.0885 9.2671 9.2671 9.3805 9.3805 12.3002 12.3002 12.3180 12.3180 12.4814 12.4814 k = 0.4180 0.4180 0.2254 ( 9204 PWs) bands (ev): -46.2007 -46.2007 -46.2007 -46.2007 -22.9195 -22.9195 -22.9191 -22.9191 -22.2773 -22.2773 -22.2773 -22.2773 -22.2570 -22.2570 -22.2566 -22.2566 1.7662 1.7662 1.8776 1.8776 2.4490 2.4490 2.9841 2.9841 5.1047 5.1047 5.7848 5.7848 6.1705 6.1705 6.3645 6.3645 8.2442 8.2442 8.5079 8.5079 8.9068 8.9068 9.1015 9.1015 9.3071 9.3071 9.4226 9.4226 12.2894 12.2894 12.3155 12.3155 12.4701 12.4701 k = 0.4098 0.4098 0.2254 ( 9216 PWs) bands (ev): -46.2007 -46.2007 -46.2007 -46.2007 -22.9193 -22.9193 -22.9189 -22.9189 -22.2769 -22.2769 -22.2768 -22.2768 -22.2570 -22.2570 -22.2566 -22.2566 1.6887 1.6887 1.7814 1.7814 2.4396 2.4396 3.0128 3.0128 5.1160 5.1160 5.8109 5.8109 6.3283 6.3283 6.4739 6.4739 8.1823 8.1823 8.4413 8.4413 8.9214 8.9214 9.1157 9.1157 9.3482 9.3482 9.4662 9.4662 12.2774 12.2774 12.3139 12.3139 12.4582 12.4582 k = 0.4016 0.4016 0.2254 ( 9204 PWs) bands (ev): -46.2008 -46.2008 -46.2008 -46.2008 -22.9191 -22.9191 -22.9187 -22.9187 -22.2765 -22.2765 -22.2764 -22.2764 -22.2570 -22.2570 -22.2565 -22.2565 1.6076 1.6076 1.6783 1.6783 2.4364 2.4364 3.0442 3.0442 5.1319 5.1319 5.8394 5.8394 6.4861 6.4861 6.5898 6.5898 8.1205 8.1205 8.3726 8.3726 8.9375 8.9375 9.1312 9.1312 9.3901 9.3901 9.5112 9.5112 12.2646 12.2646 12.3134 12.3134 12.4458 12.4458 k = 0.3934 0.3934 0.2254 ( 9196 PWs) bands (ev): -46.2009 -46.2009 -46.2009 -46.2009 -22.9189 -22.9189 -22.9184 -22.9184 -22.2760 -22.2760 -22.2759 -22.2759 -22.2569 -22.2569 -22.2565 -22.2565 1.5235 1.5235 1.5709 1.5709 2.4376 2.4376 3.0783 3.0783 5.1521 5.1521 5.8704 5.8704 6.6352 6.6352 6.7197 6.7197 8.0592 8.0592 8.3024 8.3024 8.9548 8.9548 9.1478 9.1478 9.4327 9.4327 9.5579 9.5579 12.2514 12.2514 12.3144 12.3144 12.4329 12.4329 k = 0.3852 0.3852 0.2254 ( 9192 PWs) bands (ev): -46.2009 -46.2009 -46.2009 -46.2009 -22.9186 -22.9186 -22.9181 -22.9181 -22.2755 -22.2755 -22.2754 -22.2754 -22.2569 -22.2569 -22.2564 -22.2564 1.4369 1.4369 1.4609 1.4609 2.4418 2.4418 3.1152 3.1152 5.1765 5.1765 5.9037 5.9037 6.7662 6.7662 6.8709 6.8709 7.9992 7.9992 8.2313 8.2313 8.9734 8.9734 9.1656 9.1656 9.4757 9.4757 9.6063 9.6063 12.2382 12.2382 12.3173 12.3173 12.4197 12.4197 k = 0.3770 0.3770 0.2254 ( 9196 PWs) bands (ev): -46.2010 -46.2010 -46.2010 -46.2010 -22.9183 -22.9183 -22.9178 -22.9178 -22.2749 -22.2749 -22.2748 -22.2748 -22.2569 -22.2569 -22.2564 -22.2564 1.3465 1.3465 1.3516 1.3516 2.4481 2.4481 3.1548 3.1548 5.2048 5.2048 5.9393 5.9393 6.8854 6.8854 7.0351 7.0351 7.9414 7.9414 8.1604 8.1604 8.9933 8.9933 9.1845 9.1845 9.5189 9.5189 9.6564 9.6564 12.2255 12.2255 12.3224 12.3224 12.4062 12.4062 k = 0.3689 0.3689 0.2254 ( 9194 PWs) bands (ev): -46.2011 -46.2011 -46.2011 -46.2011 -22.9181 -22.9181 -22.9175 -22.9175 -22.2744 -22.2744 -22.2743 -22.2743 -22.2568 -22.2568 -22.2563 -22.2563 1.2371 1.2371 1.2592 1.2592 2.4559 2.4559 3.1971 3.1971 5.2369 5.2369 5.9773 5.9773 6.9999 6.9999 7.2018 7.2018 7.8872 7.8872 8.0913 8.0913 9.0144 9.0144 9.2045 9.2045 9.5619 9.5619 9.7082 9.7082 12.2137 12.2137 12.3301 12.3301 12.3925 12.3925 k = 0.3607 0.3607 0.2254 ( 9198 PWs) bands (ev): -46.2012 -46.2012 -46.2012 -46.2012 -22.9177 -22.9177 -22.9172 -22.9172 -22.2738 -22.2738 -22.2737 -22.2737 -22.2568 -22.2568 -22.2562 -22.2562 1.1256 1.1256 1.1682 1.1682 2.4647 2.4647 3.2422 3.2422 5.2724 5.2724 6.0176 6.0176 7.1117 7.1117 7.3623 7.3623 7.8398 7.8398 8.0275 8.0275 9.0367 9.0367 9.2254 9.2254 9.6043 9.6043 9.7617 9.7617 12.2034 12.2034 12.3407 12.3407 12.3787 12.3787 k = 0.3525 0.3525 0.2254 ( 9208 PWs) bands (ev): -46.2012 -46.2012 -46.2012 -46.2012 -22.9174 -22.9174 -22.9168 -22.9168 -22.2731 -22.2731 -22.2730 -22.2730 -22.2567 -22.2567 -22.2562 -22.2562 1.0146 1.0146 1.0767 1.0767 2.4740 2.4740 3.2899 3.2899 5.3111 5.3111 6.0602 6.0602 7.2204 7.2204 7.4991 7.4991 7.8073 7.8073 7.9787 7.9787 9.0601 9.0601 9.2473 9.2473 9.6460 9.6460 9.8169 9.8169 12.1949 12.1949 12.3544 12.3544 12.3649 12.3649 k = 0.3443 0.3443 0.2254 ( 9212 PWs) bands (ev): -46.2013 -46.2013 -46.2013 -46.2013 -22.9171 -22.9171 -22.9165 -22.9165 -22.2725 -22.2725 -22.2724 -22.2724 -22.2567 -22.2567 -22.2561 -22.2561 0.9046 0.9046 0.9849 0.9849 2.4837 2.4837 3.3404 3.3404 5.3529 5.3529 6.1050 6.1050 7.3240 7.3240 7.5722 7.5722 7.7968 7.7968 7.9797 7.9797 9.0847 9.0847 9.2701 9.2701 9.6865 9.6865 9.8737 9.8737 12.1886 12.1886 12.3505 12.3505 12.3720 12.3720 k = 0.3361 0.3361 0.2254 ( 9196 PWs) bands (ev): -46.2014 -46.2014 -46.2014 -46.2014 -22.9167 -22.9167 -22.9161 -22.9161 -22.2718 -22.2718 -22.2717 -22.2717 -22.2566 -22.2566 -22.2561 -22.2561 0.7959 0.7959 0.8931 0.8931 2.4933 2.4933 3.3936 3.3936 5.3974 5.3974 6.1519 6.1519 7.4167 7.4167 7.5698 7.5698 7.7825 7.7825 8.0739 8.0739 9.1103 9.1103 9.2937 9.2937 9.7256 9.7256 9.9320 9.9320 12.1848 12.1848 12.3364 12.3364 12.3928 12.3928 k = 0.3279 0.3279 0.2254 ( 9192 PWs) bands (ev): -46.2015 -46.2015 -46.2015 -46.2015 -22.9164 -22.9164 -22.9158 -22.9158 -22.2711 -22.2711 -22.2710 -22.2710 -22.2566 -22.2566 -22.2560 -22.2560 0.6888 0.6888 0.8016 0.8016 2.5028 2.5028 3.4495 3.4495 5.4444 5.4444 6.2011 6.2011 7.4802 7.4802 7.5384 7.5384 7.7746 7.7746 8.2227 8.2227 9.1370 9.1370 9.3181 9.3181 9.7631 9.7631 9.9916 9.9916 12.1838 12.1838 12.3222 12.3222 12.4171 12.4171 k = 0.3197 0.3197 0.2254 ( 9196 PWs) bands (ev): -46.2016 -46.2016 -46.2016 -46.2016 -22.9160 -22.9160 -22.9154 -22.9154 -22.2704 -22.2704 -22.2702 -22.2702 -22.2565 -22.2565 -22.2559 -22.2559 0.5834 0.5834 0.7106 0.7106 2.5119 2.5119 3.5082 3.5082 5.4937 5.4937 6.2523 6.2523 7.4651 7.4651 7.5310 7.5310 7.8065 7.8065 8.3890 8.3890 9.1648 9.1648 9.3432 9.3432 9.7988 9.7988 10.0522 10.0522 12.1857 12.1857 12.3080 12.3080 12.4450 12.4450 k = 0.3115 0.3115 0.2254 ( 9198 PWs) bands (ev): -46.2017 -46.2017 -46.2017 -46.2017 -22.9156 -22.9156 -22.9150 -22.9150 -22.2696 -22.2696 -22.2695 -22.2695 -22.2564 -22.2564 -22.2559 -22.2559 0.4798 0.4798 0.6204 0.6204 2.5203 2.5203 3.5695 3.5695 5.5448 5.5448 6.3055 6.3055 7.4096 7.4096 7.5211 7.5211 7.8786 7.8786 8.5607 8.5607 9.1935 9.1935 9.3688 9.3688 9.8325 9.8325 10.1138 10.1138 12.1908 12.1908 12.2938 12.2938 12.4762 12.4762 k = 0.3033 0.3033 0.2254 ( 9198 PWs) bands (ev): -46.2018 -46.2018 -46.2018 -46.2018 -22.9152 -22.9152 -22.9146 -22.9146 -22.2689 -22.2689 -22.2687 -22.2687 -22.2563 -22.2563 -22.2558 -22.2558 0.3783 0.3783 0.5311 0.5311 2.5280 2.5280 3.6335 3.6335 5.5974 5.5974 6.3606 6.3606 7.3475 7.3475 7.5001 7.5001 7.9700 7.9700 8.7329 8.7329 9.2234 9.2234 9.3950 9.3950 9.8644 9.8644 10.1759 10.1759 12.1990 12.1990 12.2795 12.2795 12.4856 12.4856 k = 0.2951 0.2951 0.2254 ( 9196 PWs) bands (ev): -46.2019 -46.2019 -46.2019 -46.2019 -22.9148 -22.9148 -22.9142 -22.9142 -22.2681 -22.2681 -22.2679 -22.2679 -22.2563 -22.2563 -22.2557 -22.2557 0.2789 0.2789 0.4429 0.4429 2.5347 2.5347 3.7003 3.7003 5.6510 5.6510 6.4176 6.4176 7.2836 7.2836 7.4778 7.4778 8.0686 8.0686 8.9030 8.9030 9.2545 9.2545 9.4216 9.4216 9.8944 9.8944 10.2384 10.2384 12.2099 12.2099 12.2654 12.2654 12.4833 12.4833 k = 0.2869 0.2869 0.2254 ( 9204 PWs) bands (ev): -46.2020 -46.2020 -46.2020 -46.2020 -22.9143 -22.9143 -22.9138 -22.9138 -22.2673 -22.2673 -22.2671 -22.2671 -22.2562 -22.2562 -22.2556 -22.2556 0.1816 0.1816 0.3560 0.3560 2.5404 2.5404 3.7697 3.7697 5.7052 5.7052 6.4762 6.4762 7.2202 7.2202 7.4582 7.4582 8.1695 8.1695 9.0685 9.0685 9.2879 9.2879 9.4485 9.4485 9.9227 9.9227 10.3008 10.3008 12.2222 12.2222 12.2524 12.2524 12.4810 12.4810 k = 0.2787 0.2787 0.2254 ( 9212 PWs) bands (ev): -46.2021 -46.2021 -46.2021 -46.2021 -22.9139 -22.9139 -22.9133 -22.9133 -22.2665 -22.2665 -22.2663 -22.2663 -22.2561 -22.2561 -22.2555 -22.2555 0.0867 0.0867 0.2704 0.2704 2.5449 2.5449 3.8418 3.8418 5.7591 5.7591 6.5364 6.5364 7.1590 7.1590 7.4428 7.4428 8.2708 8.2708 9.2221 9.2221 9.3294 9.3294 9.4757 9.4757 9.9494 9.9494 10.3628 10.3628 12.2271 12.2271 12.2487 12.2487 12.4787 12.4787 k = 0.2705 0.2705 0.2254 ( 9208 PWs) bands (ev): -46.2022 -46.2022 -46.2022 -46.2022 -22.9135 -22.9135 -22.9129 -22.9129 -22.2657 -22.2657 -22.2655 -22.2655 -22.2560 -22.2560 -22.2555 -22.2555 -0.0059 -0.0059 0.1864 0.1864 2.5482 2.5482 3.9166 3.9166 5.8119 5.8119 6.5977 6.5977 7.1018 7.1018 7.4324 7.4324 8.3712 8.3712 9.3214 9.3214 9.4203 9.4203 9.5031 9.5031 9.9751 9.9751 10.4240 10.4240 12.2158 12.2158 12.2621 12.2621 12.4765 12.4765 k = 0.2623 0.2623 0.2254 ( 9198 PWs) bands (ev): -46.2023 -46.2023 -46.2023 -46.2023 -22.9130 -22.9130 -22.9125 -22.9125 -22.2648 -22.2648 -22.2647 -22.2647 -22.2559 -22.2559 -22.2554 -22.2554 -0.0961 -0.0961 0.1041 0.1041 2.5500 2.5500 3.9940 3.9940 5.8624 5.8624 6.6597 6.6597 7.0505 7.0505 7.4276 7.4276 8.4699 8.4699 9.3650 9.3650 9.5288 9.5288 9.5627 9.5627 10.0000 10.0000 10.4841 10.4841 12.2009 12.2009 12.2790 12.2790 12.4743 12.4743 k = 0.2541 0.2541 0.2254 ( 9190 PWs) bands (ev): -46.2024 -46.2024 -46.2024 -46.2024 -22.9126 -22.9126 -22.9121 -22.9121 -22.2640 -22.2640 -22.2638 -22.2638 -22.2558 -22.2558 -22.2553 -22.2553 -0.1838 -0.1838 0.0236 0.0236 2.5505 2.5505 4.0741 4.0741 5.9092 5.9092 6.7211 6.7211 7.0079 7.0079 7.4285 7.4285 8.5665 8.5665 9.3998 9.3998 9.5565 9.5565 9.7048 9.7048 10.0249 10.0249 10.5426 10.5426 12.1848 12.1848 12.2955 12.2955 12.4721 12.4721 k = 0.2459 0.2459 0.2254 ( 9178 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9122 -22.9122 -22.9116 -22.9116 -22.2632 -22.2632 -22.2630 -22.2630 -22.2557 -22.2557 -22.2552 -22.2552 -0.2690 -0.2690 -0.0551 -0.0551 2.5496 2.5496 4.1569 4.1569 5.9504 5.9504 6.7793 6.7793 6.9786 6.9786 7.4353 7.4353 8.6604 8.6604 9.4325 9.4325 9.5833 9.5833 9.8416 9.8416 10.0507 10.0507 10.5994 10.5994 12.1678 12.1678 12.3099 12.3099 12.4699 12.4699 k = 0.2377 0.2377 0.2254 ( 9174 PWs) bands (ev): -46.2027 -46.2027 -46.2026 -46.2026 -22.9117 -22.9117 -22.9112 -22.9112 -22.2624 -22.2624 -22.2622 -22.2622 -22.2555 -22.2555 -22.2551 -22.2551 -0.3517 -0.3517 -0.1319 -0.1319 2.5472 2.5472 4.2423 4.2423 5.9839 5.9839 6.8274 6.8274 6.9715 6.9715 7.4483 7.4483 8.7509 8.7509 9.4642 9.4642 9.6095 9.6095 9.9690 9.9690 10.0798 10.0798 10.6542 10.6542 12.1500 12.1500 12.3211 12.3211 12.4677 12.4677 k = 0.2295 0.2295 0.2254 ( 9170 PWs) bands (ev): -46.2028 -46.2028 -46.2027 -46.2027 -22.9113 -22.9113 -22.9108 -22.9108 -22.2615 -22.2615 -22.2613 -22.2613 -22.2554 -22.2554 -22.2550 -22.2550 -0.4318 -0.4318 -0.2066 -0.2066 2.5433 2.5433 4.3303 4.3303 6.0077 6.0077 6.8567 6.8567 6.9973 6.9973 7.4674 7.4674 8.8375 8.8375 9.4950 9.4950 9.6351 9.6351 10.0714 10.0714 10.1278 10.1278 10.7069 10.7069 12.1312 12.1312 12.3284 12.3284 12.4655 12.4655 k = 0.2213 0.2213 0.2254 ( 9162 PWs) bands (ev): -46.2029 -46.2029 -46.2028 -46.2028 -22.9108 -22.9108 -22.9103 -22.9103 -22.2607 -22.2607 -22.2605 -22.2605 -22.2553 -22.2553 -22.2549 -22.2549 -0.5093 -0.5093 -0.2791 -0.2791 2.5381 2.5381 4.4209 4.4209 6.0202 6.0202 6.8752 6.8752 7.0494 7.0494 7.4928 7.4928 8.9196 8.9196 9.5246 9.5246 9.6599 9.6599 10.1194 10.1194 10.2245 10.2245 10.7577 10.7577 12.1112 12.1112 12.3312 12.3312 12.4632 12.4632 k = 0.2131 0.2131 0.2254 ( 9166 PWs) bands (ev): -46.2030 -46.2030 -46.2029 -46.2029 -22.9104 -22.9104 -22.9099 -22.9099 -22.2599 -22.2599 -22.2597 -22.2597 -22.2552 -22.2552 -22.2548 -22.2548 -0.5842 -0.5842 -0.3496 -0.3496 2.5316 2.5316 4.5141 4.5141 6.0209 6.0209 6.8978 6.8978 7.1133 7.1133 7.5244 7.5244 8.9966 8.9966 9.5528 9.5528 9.6837 9.6837 10.1546 10.1546 10.3288 10.3288 10.8067 10.8067 12.0896 12.0896 12.3293 12.3293 12.4609 12.4609 k = 0.2049 0.2049 0.2254 ( 9174 PWs) bands (ev): -46.2031 -46.2031 -46.2030 -46.2030 -22.9099 -22.9099 -22.9095 -22.9095 -22.2591 -22.2591 -22.2589 -22.2589 -22.2550 -22.2550 -22.2547 -22.2547 -0.6564 -0.6564 -0.4177 -0.4177 2.5238 2.5238 4.6099 4.6099 6.0104 6.0104 6.9303 6.9303 7.1823 7.1823 7.5623 7.5623 9.0678 9.0678 9.5793 9.5793 9.7064 9.7064 10.1910 10.1910 10.4270 10.4270 10.8544 10.8544 12.0664 12.0664 12.3229 12.3229 12.4585 12.4585 k = 0.1967 0.1967 0.2254 ( 9162 PWs) bands (ev): -46.2032 -46.2032 -46.2031 -46.2031 -22.9095 -22.9095 -22.9091 -22.9091 -22.2584 -22.2584 -22.2581 -22.2581 -22.2549 -22.2549 -22.2545 -22.2545 -0.7259 -0.7259 -0.4836 -0.4836 2.5148 2.5148 4.7082 4.7082 5.9904 5.9904 6.9733 6.9733 7.2539 7.2539 7.6062 7.6062 9.1327 9.1327 9.6036 9.6036 9.7278 9.7278 10.2307 10.2307 10.5175 10.5175 10.9014 10.9014 12.0410 12.0410 12.3121 12.3121 12.4560 12.4560 k = 0.1885 0.1885 0.2254 ( 9162 PWs) bands (ev): -46.2033 -46.2033 -46.2032 -46.2032 -22.9091 -22.9091 -22.9087 -22.9087 -22.2576 -22.2576 -22.2573 -22.2573 -22.2547 -22.2547 -22.2544 -22.2544 -0.7927 -0.7927 -0.5471 -0.5471 2.5047 2.5047 4.8090 4.8090 5.9631 5.9631 7.0257 7.0257 7.3272 7.3272 7.6562 7.6562 9.1909 9.1909 9.6253 9.6253 9.7477 9.7477 10.2744 10.2744 10.5996 10.5996 10.9485 10.9485 12.0131 12.0131 12.2973 12.2973 12.4535 12.4535 k = 0.1803 0.1803 0.2254 ( 9170 PWs) bands (ev): -46.2034 -46.2034 -46.2033 -46.2033 -22.9087 -22.9087 -22.9083 -22.9083 -22.2569 -22.2569 -22.2566 -22.2566 -22.2546 -22.2546 -22.2542 -22.2542 -0.8568 -0.8568 -0.6083 -0.6083 2.4938 2.4938 4.9123 4.9123 5.9304 5.9304 7.0855 7.0855 7.4017 7.4017 7.7118 7.7118 9.2421 9.2421 9.6436 9.6436 9.7658 9.7658 10.3223 10.3223 10.6729 10.6729 10.9963 10.9963 11.9822 11.9822 12.2785 12.2785 12.4509 12.4509 k = 0.1721 0.1721 0.2254 ( 9156 PWs) bands (ev): -46.2035 -46.2035 -46.2034 -46.2034 -22.9083 -22.9083 -22.9079 -22.9079 -22.2563 -22.2563 -22.2559 -22.2559 -22.2543 -22.2543 -22.2540 -22.2540 -0.9181 -0.9181 -0.6669 -0.6669 2.4820 2.4820 5.0180 5.0180 5.8941 5.8941 7.1511 7.1511 7.4772 7.4772 7.7729 7.7729 9.2865 9.2865 9.6579 9.6579 9.7820 9.7820 10.3743 10.3743 10.7374 10.7374 11.0455 11.0455 11.9478 11.9478 12.2561 12.2561 12.4482 12.4482 k = 0.1639 0.1639 0.2254 ( 9164 PWs) bands (ev): -46.2036 -46.2036 -46.2035 -46.2035 -22.9079 -22.9079 -22.9075 -22.9075 -22.2557 -22.2557 -22.2553 -22.2553 -22.2541 -22.2541 -22.2537 -22.2537 -0.9767 -0.9767 -0.7231 -0.7231 2.4696 2.4696 5.1261 5.1261 5.8557 5.8557 7.2210 7.2210 7.5538 7.5538 7.8388 7.8388 9.3242 9.3242 9.6673 9.6673 9.7959 9.7959 10.4301 10.4301 10.7933 10.7933 11.0963 11.0963 11.9095 11.9095 12.2303 12.2303 12.4455 12.4455 k = 0.1557 0.1557 0.2254 ( 9164 PWs) bands (ev): -46.2036 -46.2036 -46.2036 -46.2036 -22.9075 -22.9075 -22.9071 -22.9071 -22.2553 -22.2553 -22.2549 -22.2549 -22.2537 -22.2537 -22.2534 -22.2534 -1.0325 -1.0325 -0.7768 -0.7768 2.4566 2.4566 5.2366 5.2366 5.8163 5.8163 7.2941 7.2941 7.6315 7.6315 7.9093 7.9093 9.3557 9.3557 9.6708 9.6708 9.8074 9.8074 10.4891 10.4891 10.8412 10.8412 11.1483 11.1483 11.8670 11.8670 12.2011 12.2011 12.4426 12.4426 k = 0.1475 0.1475 0.2254 ( 9162 PWs) bands (ev): -46.2037 -46.2037 -46.2037 -46.2037 -22.9071 -22.9071 -22.9068 -22.9068 -22.2549 -22.2549 -22.2546 -22.2546 -22.2531 -22.2531 -22.2529 -22.2529 -1.0855 -1.0855 -0.8279 -0.8279 2.4433 2.4433 5.3493 5.3493 5.7766 5.7766 7.3692 7.3692 7.7102 7.7102 7.9837 7.9837 9.3815 9.3815 9.6671 9.6671 9.8162 9.8162 10.5506 10.5506 10.8823 10.8823 11.2010 11.2010 11.8207 11.8207 12.1688 12.1688 12.4396 12.4396 k = 0.1393 0.1393 0.2254 ( 9158 PWs) bands (ev): -46.2038 -46.2038 -46.2038 -46.2038 -22.9067 -22.9067 -22.9065 -22.9065 -22.2547 -22.2547 -22.2544 -22.2544 -22.2525 -22.2525 -22.2524 -22.2524 -1.1358 -1.1358 -0.8764 -0.8764 2.4297 2.4297 5.4643 5.4643 5.7373 5.7373 7.4455 7.4455 7.7900 7.7900 8.0615 8.0615 9.4023 9.4023 9.6549 9.6549 9.8220 9.8220 10.6136 10.6136 10.9176 10.9176 11.2534 11.2534 11.7715 11.7715 12.1332 12.1332 12.4170 12.4170 k = 0.1311 0.1311 0.2254 ( 9158 PWs) bands (ev): -46.2039 -46.2039 -46.2038 -46.2038 -22.9064 -22.9064 -22.9061 -22.9061 -22.2545 -22.2545 -22.2542 -22.2542 -22.2519 -22.2519 -22.2518 -22.2518 -1.1832 -1.1832 -0.9223 -0.9223 2.4161 2.4161 5.5814 5.5814 5.6989 5.6989 7.5224 7.5224 7.8710 7.8710 8.1423 8.1423 9.4187 9.4187 9.6331 9.6331 9.8246 9.8246 10.6773 10.6773 10.9483 10.9483 11.3047 11.3047 11.7211 11.7211 12.0945 12.0945 12.3399 12.3399 k = 0.1230 0.1230 0.2254 ( 9162 PWs) bands (ev): -46.2040 -46.2040 -46.2039 -46.2039 -22.9060 -22.9060 -22.9058 -22.9058 -22.2543 -22.2543 -22.2541 -22.2541 -22.2514 -22.2514 -22.2513 -22.2513 -1.2277 -1.2277 -0.9655 -0.9655 2.4025 2.4025 5.6615 5.6615 5.7008 5.7008 7.5990 7.5990 7.9531 7.9531 8.2255 8.2255 9.4313 9.4313 9.6003 9.6003 9.8239 9.8239 10.7405 10.7405 10.9755 10.9755 11.3540 11.3540 11.6723 11.6723 12.0527 12.0527 12.2712 12.2712 k = 0.1148 0.1148 0.2254 ( 9162 PWs) bands (ev): -46.2040 -46.2040 -46.2040 -46.2040 -22.9057 -22.9057 -22.9055 -22.9055 -22.2542 -22.2542 -22.2540 -22.2540 -22.2508 -22.2508 -22.2507 -22.2507 -1.2695 -1.2695 -1.0061 -1.0061 2.3891 2.3891 5.6261 5.6261 5.8217 5.8217 7.6748 7.6748 8.0360 8.0360 8.3106 8.3106 9.4408 9.4408 9.5556 9.5556 9.8197 9.8197 10.8017 10.8017 11.0005 11.0005 11.4002 11.4002 11.6281 11.6281 12.0078 12.0078 12.2105 12.2105 k = 0.1066 0.1066 0.2254 ( 9166 PWs) bands (ev): -46.2041 -46.2041 -46.2041 -46.2041 -22.9054 -22.9054 -22.9052 -22.9052 -22.2541 -22.2541 -22.2539 -22.2539 -22.2502 -22.2502 -22.2502 -22.2502 -1.3084 -1.3084 -1.0439 -1.0439 2.3761 2.3761 5.5923 5.5923 5.9445 5.9445 7.7492 7.7492 8.1196 8.1196 8.3973 8.3973 9.4475 9.4475 9.4988 9.4988 9.8117 9.8117 10.8586 10.8586 11.0253 11.0253 11.4418 11.4418 11.5922 11.5922 11.9601 11.9601 12.1566 12.1566 k = 0.0984 0.0984 0.2254 ( 9164 PWs) bands (ev): -46.2042 -46.2042 -46.2041 -46.2041 -22.9051 -22.9051 -22.9050 -22.9050 -22.2540 -22.2540 -22.2538 -22.2538 -22.2497 -22.2497 -22.2497 -22.2497 -1.3445 -1.3445 -1.0791 -1.0791 2.3635 2.3635 5.5605 5.5605 6.0688 6.0688 7.8215 7.8215 8.2034 8.2034 8.4850 8.4850 9.4282 9.4282 9.4535 9.4535 9.8000 9.8000 10.9075 10.9075 11.0530 11.0530 11.4741 11.4741 11.5704 11.5704 11.9106 11.9106 12.1079 12.1079 k = 0.0902 0.0902 0.2254 ( 9164 PWs) bands (ev): -46.2042 -46.2042 -46.2042 -46.2042 -22.9049 -22.9049 -22.9047 -22.9047 -22.2539 -22.2539 -22.2537 -22.2537 -22.2492 -22.2492 -22.2492 -22.2492 -1.3777 -1.3777 -1.1114 -1.1114 2.3515 2.3515 5.5308 5.5308 6.1946 6.1946 7.8912 7.8912 8.2871 8.2871 8.5732 8.5732 9.3477 9.3477 9.4558 9.4558 9.7845 9.7845 10.9434 10.9434 11.0879 11.0879 11.4889 11.4889 11.5715 11.5715 11.8607 11.8607 12.0633 12.0633 k = 0.0820 0.0820 0.2254 ( 9164 PWs) bands (ev): -46.2043 -46.2043 -46.2042 -46.2042 -22.9046 -22.9046 -22.9045 -22.9045 -22.2538 -22.2538 -22.2537 -22.2537 -22.2488 -22.2488 -22.2488 -22.2488 -1.4080 -1.4080 -1.1411 -1.1411 2.3401 2.3401 5.5034 5.5034 6.3213 6.3213 7.9577 7.9577 8.3702 8.3702 8.6615 8.6615 9.2563 9.2563 9.4574 9.4574 9.7650 9.7650 10.9641 10.9641 11.1314 11.1314 11.4897 11.4897 11.5908 11.5908 11.8130 11.8130 12.0218 12.0218 k = 0.0738 0.0738 0.2254 ( 9160 PWs) bands (ev): -46.2043 -46.2043 -46.2043 -46.2043 -22.9044 -22.9044 -22.9043 -22.9043 -22.2537 -22.2537 -22.2536 -22.2536 -22.2484 -22.2484 -22.2484 -22.2484 -1.4355 -1.4355 -1.1679 -1.1679 2.3295 2.3295 5.4783 5.4783 6.4486 6.4486 8.0203 8.0203 8.4520 8.4520 8.7492 8.7492 9.1560 9.1560 9.4579 9.4579 9.7416 9.7416 10.9715 10.9715 11.1806 11.1806 11.4901 11.4901 11.6109 11.6109 11.7726 11.7726 11.9823 11.9823 k = 0.0656 0.0656 0.2254 ( 9152 PWs) bands (ev): -46.2044 -46.2044 -46.2043 -46.2043 -22.9042 -22.9042 -22.9041 -22.9041 -22.2536 -22.2536 -22.2535 -22.2535 -22.2480 -22.2480 -22.2480 -22.2480 -1.4601 -1.4601 -1.1920 -1.1920 2.3198 2.3198 5.4557 5.4557 6.5760 6.5760 8.0784 8.0784 8.5318 8.5318 8.8356 8.8356 9.0488 9.0488 9.4578 9.4578 9.7144 9.7144 10.9684 10.9684 11.2316 11.2316 11.4959 11.4959 11.6183 11.6183 11.7489 11.7489 11.9446 11.9446 k = 0.0574 0.0574 0.2254 ( 9144 PWs) bands (ev): -46.2044 -46.2044 -46.2044 -46.2044 -22.9040 -22.9040 -22.9039 -22.9039 -22.2536 -22.2536 -22.2535 -22.2535 -22.2477 -22.2477 -22.2477 -22.2477 -1.4818 -1.4818 -1.2132 -1.2132 2.3111 2.3111 5.4356 5.4356 6.7027 6.7027 8.1312 8.1312 8.6087 8.6087 8.9193 8.9193 8.9374 8.9374 9.4572 9.4572 9.6836 9.6836 10.9566 10.9566 11.2815 11.2815 11.5078 11.5078 11.6067 11.6067 11.7487 11.7487 11.9080 11.9080 k = 0.0492 0.0492 0.2254 ( 9152 PWs) bands (ev): -46.2045 -46.2045 -46.2044 -46.2044 -22.9039 -22.9039 -22.9038 -22.9038 -22.2535 -22.2535 -22.2534 -22.2534 -22.2474 -22.2474 -22.2474 -22.2474 -1.5006 -1.5006 -1.2317 -1.2317 2.3033 2.3033 5.4181 5.4181 6.8274 6.8274 8.1780 8.1780 8.6816 8.6816 8.8232 8.8232 9.0007 9.0007 9.4567 9.4567 9.6495 9.6495 10.9374 10.9374 11.3280 11.3280 11.5253 11.5253 11.5871 11.5871 11.7633 11.7633 11.8727 11.8727 k = 0.0410 0.0410 0.2254 ( 9142 PWs) bands (ev): -46.2045 -46.2045 -46.2044 -46.2044 -22.9037 -22.9037 -22.9037 -22.9037 -22.2535 -22.2535 -22.2534 -22.2534 -22.2472 -22.2472 -22.2471 -22.2471 -1.5165 -1.5165 -1.2473 -1.2473 2.2967 2.2967 5.4032 5.4032 6.9486 6.9486 8.2178 8.2178 8.7082 8.7082 8.7517 8.7517 9.0771 9.0771 9.4564 9.4564 9.6124 9.6124 10.9127 10.9127 11.3683 11.3683 11.5431 11.5431 11.5759 11.5759 11.7821 11.7821 11.8390 11.8390 k = 0.0328 0.0328 0.2254 ( 9148 PWs) bands (ev): -46.2045 -46.2045 -46.2044 -46.2044 -22.9036 -22.9036 -22.9036 -22.9036 -22.2534 -22.2534 -22.2534 -22.2534 -22.2470 -22.2470 -22.2469 -22.2469 -1.5296 -1.5296 -1.2601 -1.2601 2.2912 2.2912 5.3910 5.3910 7.0633 7.0633 8.2491 8.2491 8.6025 8.6025 8.8112 8.8112 9.1480 9.1480 9.4565 9.4565 9.5730 9.5730 10.8851 10.8851 11.3994 11.3994 11.5486 11.5486 11.5916 11.5916 11.7970 11.7970 11.8110 11.8110 k = 0.0246 0.0246 0.2254 ( 9142 PWs) bands (ev): -46.2045 -46.2045 -46.2045 -46.2045 -22.9035 -22.9035 -22.9035 -22.9035 -22.2534 -22.2534 -22.2533 -22.2533 -22.2468 -22.2468 -22.2468 -22.2468 -1.5397 -1.5397 -1.2701 -1.2701 2.2868 2.2868 5.3814 5.3814 7.1674 7.1674 8.2696 8.2696 8.5084 8.5084 8.8629 8.8629 9.2122 9.2122 9.4567 9.4567 9.5325 9.5325 10.8581 10.8581 11.4189 11.4189 11.5551 11.5551 11.6208 11.6208 11.7770 11.7770 11.8195 11.8195 k = 0.0164 0.0164 0.2254 ( 9140 PWs) bands (ev): -46.2045 -46.2045 -46.2045 -46.2045 -22.9035 -22.9035 -22.9034 -22.9034 -22.2534 -22.2534 -22.2533 -22.2533 -22.2467 -22.2467 -22.2467 -22.2467 -1.5470 -1.5470 -1.2772 -1.2772 2.2837 2.2837 5.3746 5.3746 7.2540 7.2540 8.2745 8.2745 8.4384 8.4384 8.9029 8.9029 9.2688 9.2688 9.4551 9.4551 9.4939 9.4939 10.8352 10.8352 11.4279 11.4279 11.5702 11.5702 11.6467 11.6467 11.7589 11.7589 11.8319 11.8319 k = 0.0082 0.0082 0.2254 ( 9134 PWs) bands (ev): -46.2045 -46.2045 -46.2045 -46.2045 -22.9034 -22.9034 -22.9034 -22.9034 -22.2534 -22.2534 -22.2533 -22.2533 -22.2466 -22.2466 -22.2466 -22.2466 -1.5513 -1.5513 -1.2815 -1.2815 2.2818 2.2818 5.3705 5.3705 7.3132 7.3132 8.2639 8.2639 8.4027 8.4027 8.9285 8.9285 9.3156 9.3156 9.4402 9.4402 9.4715 9.4715 10.8199 10.8199 11.4311 11.4311 11.5882 11.5882 11.6565 11.6565 11.7588 11.7588 11.8402 11.8402 k = 0.0000 0.0000 0.2254 ( 9124 PWs) bands (ev): -46.2045 -46.2045 -46.2045 -46.2045 -22.9034 -22.9034 -22.9034 -22.9034 -22.2534 -22.2534 -22.2533 -22.2533 -22.2466 -22.2466 -22.2466 -22.2466 -1.5528 -1.5528 -1.2829 -1.2829 2.2812 2.2812 5.3691 5.3691 7.3346 7.3346 8.2558 8.2558 8.3937 8.3937 8.9373 8.9373 9.3388 9.3388 9.4232 9.4232 9.4684 9.4684 10.8145 10.8145 11.4317 11.4317 11.5974 11.5974 11.6550 11.6550 11.7656 11.7656 11.8436 11.8437 k = 0.0000 0.5000-0.0000 ( 9164 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2726 -22.2726 -22.2726 -22.2726 -22.2466 -22.2466 -22.2466 -22.2466 0.7255 0.7255 0.7255 0.7255 1.6139 1.6139 1.6139 1.6139 5.6622 5.6622 5.6622 5.6622 9.4392 9.4392 9.4392 9.4392 9.5848 9.5848 9.5848 9.5848 9.6888 9.6888 9.6888 9.6888 10.5280 10.5280 10.5280 10.5280 12.3427 12.3427 12.3427 12.3427 12.7841 12.7841 k = 0.0000 0.5000 0.0113 ( 9164 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2726 -22.2726 -22.2726 -22.2726 -22.2466 -22.2466 -22.2466 -22.2466 0.7264 0.7264 0.7264 0.7264 1.6122 1.6122 1.6122 1.6122 5.6657 5.6657 5.6657 5.6657 9.4057 9.4057 9.4057 9.4057 9.5999 9.5999 9.5999 9.5999 9.7006 9.7006 9.7006 9.7006 10.5302 10.5302 10.5302 10.5302 12.3434 12.3434 12.3434 12.3434 12.7864 12.7864 k = 0.0000 0.5000 0.0225 ( 9168 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2726 -22.2726 -22.2726 -22.2726 -22.2466 -22.2466 -22.2466 -22.2466 0.7289 0.7289 0.7289 0.7289 1.6074 1.6074 1.6074 1.6074 5.6762 5.6762 5.6762 5.6762 9.3343 9.3343 9.3343 9.3343 9.6154 9.6154 9.6154 9.6154 9.7370 9.7370 9.7370 9.7370 10.5366 10.5366 10.5366 10.5366 12.3453 12.3453 12.3453 12.3453 12.7932 12.7932 k = 0.0000 0.5000 0.0338 ( 9178 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2726 -22.2726 -22.2726 -22.2726 -22.2466 -22.2466 -22.2466 -22.2466 0.7332 0.7332 0.7332 0.7332 1.5994 1.5994 1.5994 1.5994 5.6935 5.6935 5.6935 5.6935 9.2485 9.2485 9.2485 9.2485 9.6187 9.6187 9.6187 9.6187 9.7874 9.7874 9.7874 9.7874 10.5470 10.5470 10.5470 10.5470 12.3484 12.3484 12.3484 12.3484 12.8043 12.8043 k = 0.0000 0.5000 0.0451 ( 9182 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2726 -22.2726 -22.2726 -22.2726 -22.2466 -22.2466 -22.2466 -22.2466 0.7392 0.7392 0.7392 0.7392 1.5884 1.5884 1.5884 1.5884 5.7174 5.7174 5.7174 5.7174 9.1552 9.1552 9.1552 9.1552 9.6156 9.6156 9.6156 9.6156 9.8401 9.8401 9.8401 9.8401 10.5612 10.5612 10.5612 10.5612 12.3524 12.3524 12.3524 12.3524 12.8189 12.8189 k = 0.0000 0.5000 0.0563 ( 9182 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2726 -22.2726 -22.2726 -22.2726 -22.2466 -22.2466 -22.2466 -22.2466 0.7468 0.7468 0.7468 0.7468 1.5745 1.5745 1.5745 1.5745 5.7478 5.7478 5.7478 5.7478 9.0567 9.0567 9.0567 9.0567 9.6093 9.6093 9.6093 9.6093 9.8902 9.8902 9.8902 9.8902 10.5787 10.5787 10.5787 10.5787 12.3572 12.3572 12.3572 12.3572 12.8365 12.8365 k = 0.0000 0.5000 0.0676 ( 9174 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2726 -22.2726 -22.2726 -22.2726 -22.2466 -22.2466 -22.2466 -22.2466 0.7560 0.7560 0.7560 0.7560 1.5581 1.5581 1.5581 1.5581 5.7842 5.7842 5.7842 5.7842 8.9547 8.9547 8.9547 8.9547 9.6011 9.6011 9.6011 9.6011 9.9363 9.9363 9.9363 9.9363 10.5991 10.5991 10.5991 10.5991 12.3625 12.3625 12.3625 12.3625 12.8562 12.8562 k = 0.0000 0.5000 0.0789 ( 9184 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2726 -22.2726 -22.2726 -22.2726 -22.2466 -22.2466 -22.2466 -22.2466 0.7667 0.7667 0.7667 0.7667 1.5393 1.5393 1.5393 1.5393 5.8261 5.8261 5.8261 5.8261 8.8501 8.8501 8.8501 8.8501 9.5917 9.5917 9.5917 9.5917 9.9777 9.9777 9.9777 9.9777 10.6218 10.6218 10.6218 10.6218 12.3682 12.3682 12.3682 12.3682 12.8774 12.8774 k = 0.0000 0.5000 0.0901 ( 9184 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2466 -22.2466 -22.2466 -22.2466 0.7788 0.7788 0.7788 0.7788 1.5185 1.5185 1.5185 1.5185 5.8733 5.8733 5.8733 5.8733 8.7441 8.7441 8.7441 8.7441 9.5817 9.5817 9.5817 9.5817 10.0145 10.0145 10.0145 10.0145 10.6464 10.6464 10.6464 10.6464 12.3740 12.3740 12.3740 12.3740 12.8994 12.8994 k = 0.0000 0.5000 0.1014 ( 9172 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.7923 0.7923 0.7923 0.7923 1.4961 1.4961 1.4961 1.4961 5.9249 5.9249 5.9249 5.9249 8.6374 8.6374 8.6374 8.6374 9.5714 9.5714 9.5714 9.5714 10.0468 10.0468 10.0468 10.0468 10.6723 10.6723 10.6723 10.6723 12.3797 12.3797 12.3797 12.3797 12.9214 12.9214 k = 0.0000 0.5000 0.1127 ( 9164 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.8069 0.8069 0.8069 0.8069 1.4723 1.4723 1.4723 1.4723 5.9804 5.9804 5.9804 5.9804 8.5311 8.5311 8.5311 8.5311 9.5612 9.5612 9.5612 9.5612 10.0748 10.0748 10.0748 10.0748 10.6988 10.6988 10.6988 10.6988 12.3853 12.3853 12.3853 12.3853 12.9426 12.9426 k = 0.0000 0.5000 0.1240 ( 9178 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.8226 0.8226 0.8226 0.8226 1.4476 1.4476 1.4476 1.4476 6.0389 6.0389 6.0389 6.0389 8.4262 8.4262 8.4262 8.4262 9.5512 9.5512 9.5512 9.5512 10.0989 10.0989 10.0989 10.0989 10.7254 10.7254 10.7254 10.7254 12.3906 12.3906 12.3906 12.3906 12.9619 12.9619 k = 0.0000 0.5000 0.1352 ( 9172 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.8390 0.8390 0.8390 0.8390 1.4225 1.4225 1.4225 1.4225 6.0994 6.0994 6.0994 6.0994 8.3238 8.3238 8.3238 8.3238 9.5418 9.5418 9.5418 9.5418 10.1194 10.1194 10.1194 10.1194 10.7516 10.7516 10.7516 10.7516 12.3955 12.3955 12.3955 12.3955 12.9768 12.9768 k = 0.0000 0.5000 0.1465 ( 9178 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.8559 0.8559 0.8559 0.8559 1.3974 1.3974 1.3974 1.3974 6.1608 6.1608 6.1608 6.1608 8.2253 8.2253 8.2253 8.2253 9.5330 9.5330 9.5330 9.5330 10.1367 10.1367 10.1367 10.1367 10.7766 10.7766 10.7766 10.7766 12.4000 12.4000 12.4000 12.4000 12.9819 12.9819 k = 0.0000 0.5000 0.1578 ( 9178 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.8729 0.8729 0.8729 0.8729 1.3729 1.3729 1.3729 1.3729 6.2216 6.2216 6.2216 6.2216 8.1322 8.1322 8.1322 8.1322 9.5252 9.5252 9.5252 9.5252 10.1510 10.1510 10.1510 10.1510 10.7999 10.7999 10.7999 10.7999 12.4039 12.4039 12.4039 12.4039 12.9717 12.9717 k = 0.0000 0.5000 0.1690 ( 9176 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.8894 0.8894 0.8894 0.8894 1.3497 1.3497 1.3497 1.3497 6.2800 6.2800 6.2800 6.2800 8.0464 8.0464 8.0464 8.0464 9.5183 9.5183 9.5183 9.5183 10.1627 10.1627 10.1627 10.1627 10.8209 10.8209 10.8209 10.8209 12.4073 12.4073 12.4073 12.4073 12.9510 12.9510 k = 0.0000 0.5000 0.1803 ( 9170 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.9050 0.9050 0.9050 0.9050 1.3286 1.3286 1.3286 1.3286 6.3337 6.3337 6.3337 6.3337 7.9702 7.9702 7.9702 7.9702 9.5126 9.5126 9.5126 9.5126 10.1718 10.1718 10.1718 10.1718 10.8391 10.8391 10.8391 10.8391 12.4101 12.4101 12.4101 12.4101 12.9285 12.9285 k = 0.0000 0.5000 0.1916 ( 9176 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.9186 0.9186 0.9186 0.9186 1.3104 1.3104 1.3104 1.3104 6.3801 6.3801 6.3801 6.3801 7.9062 7.9062 7.9062 7.9062 9.5080 9.5080 9.5080 9.5080 10.1788 10.1788 10.1788 10.1788 10.8538 10.8538 10.8538 10.8538 12.4122 12.4122 12.4122 12.4122 12.9088 12.9088 k = 0.0000 0.5000 0.2028 ( 9188 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.9294 0.9294 0.9294 0.9294 1.2963 1.2963 1.2963 1.2963 6.4163 6.4163 6.4163 6.4163 7.8575 7.8575 7.8575 7.8575 9.5048 9.5048 9.5048 9.5048 10.1836 10.1836 10.1836 10.1836 10.8647 10.8647 10.8647 10.8647 12.4138 12.4138 12.4138 12.4138 12.8938 12.8938 k = 0.0000 0.5000 0.2141 ( 9190 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.9364 0.9364 0.9364 0.9364 1.2873 1.2873 1.2873 1.2873 6.4395 6.4395 6.4395 6.4395 7.8267 7.8267 7.8267 7.8267 9.5028 9.5028 9.5028 9.5028 10.1865 10.1865 10.1865 10.1865 10.8713 10.8713 10.8713 10.8713 12.4147 12.4147 12.4147 12.4147 12.8845 12.8845 k = 0.0000 0.5000 0.2254 ( 9196 PWs) bands (ev): -46.2025 -46.2025 -46.2025 -46.2025 -22.9129 -22.9129 -22.9129 -22.9129 -22.2727 -22.2727 -22.2727 -22.2727 -22.2465 -22.2465 -22.2465 -22.2465 0.9388 0.9388 0.9388 0.9388 1.2842 1.2842 1.2842 1.2842 6.4475 6.4475 6.4475 6.4475 7.8162 7.8162 7.8162 7.8162 9.5021 9.5021 9.5021 9.5021 10.1874 10.1874 10.1874 10.1874 10.8736 10.8736 10.8736 10.8736 12.4150 12.4150 12.4150 12.4150 12.8814 12.8814 k = 0.5000 0.5000-0.0000 ( 9188 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1588 2.1588 2.1588 2.1588 2.8451 2.8451 2.8451 2.8451 5.4273 5.4273 5.4273 5.4273 5.6954 5.6954 5.6954 5.6954 8.2467 8.2467 8.2467 8.2467 8.5300 8.5300 8.5300 8.5300 9.3473 9.3473 9.3473 9.3473 12.5359 12.5359 12.5359 12.5359 12.7498 12.7498 k = 0.5000 0.5000 0.0113 ( 9184 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1590 2.1590 2.1590 2.1590 2.8451 2.8451 2.8451 2.8451 5.4256 5.4256 5.4256 5.4256 5.6952 5.6952 5.6952 5.6952 8.2499 8.2499 8.2499 8.2499 8.5319 8.5319 8.5319 8.5319 9.3462 9.3462 9.3462 9.3462 12.5359 12.5359 12.5359 12.5359 12.7482 12.7482 k = 0.5000 0.5000 0.0225 ( 9180 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1596 2.1596 2.1596 2.1596 2.8452 2.8452 2.8452 2.8452 5.4206 5.4206 5.4206 5.4206 5.6946 5.6946 5.6946 5.6946 8.2595 8.2595 8.2595 8.2595 8.5375 8.5375 8.5375 8.5375 9.3430 9.3430 9.3430 9.3430 12.5359 12.5359 12.5359 12.5359 12.7436 12.7436 k = 0.5000 0.5000 0.0338 ( 9188 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1606 2.1606 2.1606 2.1606 2.8453 2.8453 2.8453 2.8453 5.4124 5.4124 5.4124 5.4124 5.6936 5.6936 5.6936 5.6936 8.2751 8.2751 8.2751 8.2751 8.5467 8.5467 8.5467 8.5467 9.3377 9.3377 9.3377 9.3377 12.5359 12.5359 12.5359 12.5359 12.7358 12.7358 k = 0.5000 0.5000 0.0451 ( 9196 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1620 2.1620 2.1620 2.1620 2.8454 2.8454 2.8454 2.8454 5.4014 5.4014 5.4014 5.4014 5.6922 5.6922 5.6922 5.6922 8.2962 8.2962 8.2962 8.2962 8.5598 8.5598 8.5598 8.5598 9.3303 9.3303 9.3303 9.3303 12.5359 12.5359 12.5359 12.5359 12.7248 12.7248 k = 0.5000 0.5000 0.0563 ( 9180 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1637 2.1637 2.1637 2.1637 2.8455 2.8455 2.8455 2.8455 5.3878 5.3878 5.3878 5.3878 5.6904 5.6904 5.6904 5.6904 8.3222 8.3222 8.3222 8.3222 8.5766 8.5766 8.5766 8.5766 9.3209 9.3209 9.3209 9.3209 12.5358 12.5358 12.5358 12.5358 12.7105 12.7105 k = 0.5000 0.5000 0.0676 ( 9172 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1657 2.1657 2.1657 2.1657 2.8456 2.8456 2.8456 2.8456 5.3722 5.3722 5.3722 5.3722 5.6883 5.6883 5.6883 5.6883 8.3523 8.3523 8.3523 8.3523 8.5972 8.5972 8.5972 8.5972 9.3094 9.3094 9.3094 9.3094 12.5358 12.5358 12.5358 12.5358 12.6929 12.6929 k = 0.5000 0.5000 0.0789 ( 9176 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1679 2.1679 2.1679 2.1679 2.8458 2.8458 2.8458 2.8458 5.3549 5.3549 5.3549 5.3549 5.6860 5.6860 5.6860 5.6860 8.3854 8.3854 8.3854 8.3854 8.6215 8.6215 8.6215 8.6215 9.2961 9.2961 9.2961 9.2961 12.5358 12.5358 12.5358 12.5358 12.6718 12.6718 k = 0.5000 0.5000 0.0901 ( 9184 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1704 2.1704 2.1704 2.1704 2.8459 2.8459 2.8459 2.8459 5.3365 5.3365 5.3365 5.3365 5.6835 5.6835 5.6835 5.6835 8.4207 8.4207 8.4207 8.4207 8.6496 8.6496 8.6496 8.6496 9.2809 9.2809 9.2809 9.2809 12.5357 12.5357 12.5357 12.5357 12.6475 12.6475 k = 0.5000 0.5000 0.1014 ( 9196 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1730 2.1730 2.1730 2.1730 2.8461 2.8461 2.8461 2.8461 5.3175 5.3175 5.3175 5.3175 5.6807 5.6807 5.6807 5.6807 8.4572 8.4572 8.4572 8.4572 8.6812 8.6812 8.6812 8.6812 9.2639 9.2639 9.2639 9.2639 12.5356 12.5356 12.5356 12.5356 12.6201 12.6201 k = 0.5000 0.5000 0.1127 ( 9196 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1756 2.1756 2.1756 2.1756 2.8463 2.8463 2.8463 2.8463 5.2984 5.2984 5.2984 5.2984 5.6780 5.6780 5.6780 5.6780 8.4940 8.4940 8.4940 8.4940 8.7158 8.7158 8.7158 8.7158 9.2454 9.2454 9.2454 9.2454 12.5353 12.5353 12.5353 12.5353 12.5900 12.5900 k = 0.5000 0.5000 0.1240 ( 9212 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1783 2.1783 2.1783 2.1783 2.8465 2.8465 2.8465 2.8465 5.2796 5.2796 5.2796 5.2796 5.6752 5.6752 5.6752 5.6752 8.5304 8.5304 8.5304 8.5304 8.7528 8.7528 8.7528 8.7528 9.2254 9.2254 9.2254 9.2254 12.5342 12.5342 12.5342 12.5342 12.5584 12.5584 k = 0.5000 0.5000 0.1352 ( 9220 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1809 2.1809 2.1809 2.1809 2.8466 2.8466 2.8466 2.8466 5.2615 5.2615 5.2615 5.2615 5.6725 5.6725 5.6725 5.6725 8.5659 8.5659 8.5659 8.5659 8.7913 8.7913 8.7913 8.7913 9.2043 9.2043 9.2043 9.2043 12.5199 12.5199 12.5199 12.5199 12.5387 12.5387 k = 0.5000 0.5000 0.1465 ( 9228 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1834 2.1834 2.1834 2.1834 2.8468 2.8468 2.8468 2.8468 5.2446 5.2446 5.2446 5.2446 5.6699 5.6699 5.6699 5.6699 8.6002 8.6002 8.6002 8.6002 8.8301 8.8301 8.8301 8.8301 9.1821 9.1821 9.1821 9.1821 12.4870 12.4870 12.4870 12.4870 12.5369 12.5369 k = 0.5000 0.5000 0.1578 ( 9240 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1857 2.1857 2.1857 2.1857 2.8470 2.8470 2.8470 2.8470 5.2292 5.2292 5.2292 5.2292 5.6675 5.6675 5.6675 5.6675 8.6327 8.6327 8.6327 8.6327 8.8678 8.8678 8.8678 8.8678 9.1594 9.1594 9.1594 9.1594 12.4535 12.4535 12.4535 12.4535 12.5366 12.5366 k = 0.5000 0.5000 0.1690 ( 9240 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1878 2.1878 2.1878 2.1878 2.8471 2.8471 2.8471 2.8471 5.2156 5.2156 5.2156 5.2156 5.6653 5.6653 5.6653 5.6653 8.6630 8.6630 8.6630 8.6630 8.9034 8.9034 8.9034 8.9034 9.1364 9.1364 9.1364 9.1364 12.4218 12.4218 12.4218 12.4218 12.5365 12.5365 k = 0.5000 0.5000 0.1803 ( 9232 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1896 2.1896 2.1896 2.1896 2.8472 2.8472 2.8472 2.8472 5.2042 5.2042 5.2042 5.2042 5.6635 5.6635 5.6635 5.6635 8.6905 8.6905 8.6905 8.6905 8.9357 8.9357 8.9357 8.9357 9.1139 9.1139 9.1139 9.1139 12.3934 12.3934 12.3934 12.3934 12.5364 12.5364 k = 0.5000 0.5000 0.1916 ( 9220 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1910 2.1910 2.1910 2.1910 2.8473 2.8473 2.8473 2.8473 5.1950 5.1950 5.1950 5.1950 5.6620 5.6620 5.6620 5.6620 8.7142 8.7142 8.7142 8.7142 8.9639 8.9639 8.9639 8.9639 9.0923 9.0923 9.0923 9.0923 12.3697 12.3697 12.3697 12.3697 12.5363 12.5363 k = 0.5000 0.5000 0.2028 ( 9212 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1921 2.1921 2.1921 2.1921 2.8474 2.8474 2.8474 2.8474 5.1883 5.1883 5.1883 5.1883 5.6610 5.6610 5.6610 5.6610 8.7328 8.7328 8.7328 8.7328 8.9875 8.9875 8.9875 8.9875 9.0724 9.0724 9.0724 9.0724 12.3519 12.3519 12.3519 12.3519 12.5363 12.5363 k = 0.5000 0.5000 0.2141 ( 9204 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1927 2.1927 2.1927 2.1927 2.8474 2.8474 2.8474 2.8474 5.1843 5.1843 5.1843 5.1843 5.6603 5.6603 5.6603 5.6603 8.7448 8.7448 8.7448 8.7448 9.0060 9.0060 9.0060 9.0060 9.0556 9.0556 9.0556 9.0556 12.3408 12.3408 12.3408 12.3408 12.5363 12.5363 k = 0.5000 0.5000 0.2254 ( 9200 PWs) bands (ev): -46.2004 -46.2004 -46.2004 -46.2004 -22.9204 -22.9204 -22.9204 -22.9204 -22.2793 -22.2793 -22.2793 -22.2793 -22.2569 -22.2569 -22.2569 -22.2569 2.1929 2.1929 2.1929 2.1929 2.8474 2.8474 2.8474 2.8474 5.1829 5.1829 5.1829 5.1829 5.6601 5.6601 5.6601 5.6601 8.7489 8.7489 8.7489 8.7489 9.0151 9.0151 9.0151 9.0151 9.0470 9.0470 9.0470 9.0470 12.3370 12.3370 12.3370 12.3370 12.5363 12.5363 Writing output data file TiGeSb.save init_run : 0.21s CPU 0.35s WALL ( 1 calls) electrons : 420.75s CPU 425.70s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.02s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 420.74s CPU 425.69s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.06s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.13s CPU 0.16s WALL ( 363 calls) cegterg : 402.08s CPU 406.23s WALL ( 865 calls) Called by sum_band: Called by *egterg: h_psi : 222.22s CPU 225.16s WALL ( 16129 calls) s_psi : 12.37s CPU 12.34s WALL ( 16129 calls) g_psi : 1.05s CPU 1.00s WALL ( 14901 calls) cdiaghg : 111.78s CPU 113.22s WALL ( 15264 calls) cegterg:over : 23.05s CPU 23.26s WALL ( 14901 calls) cegterg:upda : 24.31s CPU 24.30s WALL ( 14901 calls) cegterg:last : 11.76s CPU 11.80s WALL ( 2339 calls) cdiaghg:chol : 6.44s CPU 6.49s WALL ( 15264 calls) cdiaghg:inve : 4.30s CPU 4.36s WALL ( 15264 calls) cdiaghg:para : 6.58s CPU 6.64s WALL ( 30528 calls) Called by h_psi: h_psi:vloc : 186.84s CPU 189.52s WALL ( 16129 calls) h_psi:vnl : 34.39s CPU 34.65s WALL ( 16129 calls) add_vuspsi : 17.43s CPU 17.58s WALL ( 16129 calls) General routines calbec : 16.89s CPU 17.02s WALL ( 16129 calls) fft : 0.01s CPU 0.01s WALL ( 15 calls) fftw : 177.00s CPU 179.59s WALL ( 1457640 calls) davcio : 0.39s CPU 0.45s WALL ( 726 calls) Parallel routines fft_scatter : 63.23s CPU 64.62s WALL ( 1457655 calls) PWSCF : 7m28.20s CPU 7m47.22s WALL This run was terminated on: 19: 1:12 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=