Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 14:19: 8 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: ./BaMnGe.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S 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 51 51 14 2904 2904 432 Max 52 52 15 2906 2906 439 Sum 1861 1861 517 104577 104577 15689 bravais-lattice index = 14 lattice parameter (alat) = 8.5038 a.u. unit-cell volume = 1082.2977 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 58.00 number of Kohn-Sham states= 70 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)= 8.503767 celldm(2)= 1.000000 celldm(3)= 1.760000 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.760000 ) 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 0.568182 ) 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 Mn read from file: /users/gautes/Pseudo/Mn.rel-pbe-oncvpsp.UPF MD5 check sum: d838f0974ec4eb0180564ac5264e0bcc Pseudo is Norm-conserving, Zval = 15.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1464 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 PseudoPot. # 3 for Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) Mn 15.00 54.93800 Mn( 1.00) Ba 10.00 137.32700 Ba( 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= 309 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032362 k( 2) = ( 0.0000000 0.0142857 -0.0000000), wk = 0.0032362 k( 3) = ( 0.0000000 0.0285714 -0.0000000), wk = 0.0032362 k( 4) = ( 0.0000000 0.0428571 -0.0000000), wk = 0.0032362 k( 5) = ( 0.0000000 0.0571429 -0.0000000), wk = 0.0032362 k( 6) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0032362 k( 7) = ( 0.0000000 0.0857143 -0.0000000), wk = 0.0032362 k( 8) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0032362 k( 9) = ( 0.0000000 0.1142857 -0.0000000), wk = 0.0032362 k( 10) = ( 0.0000000 0.1285714 -0.0000000), wk = 0.0032362 k( 11) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0032362 k( 12) = ( 0.0000000 0.1571429 -0.0000000), wk = 0.0032362 k( 13) = ( 0.0000000 0.1714286 -0.0000000), wk = 0.0032362 k( 14) = ( 0.0000000 0.1857143 -0.0000000), wk = 0.0032362 k( 15) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0032362 k( 16) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0032362 k( 17) = ( 0.0000000 0.2285714 -0.0000000), wk = 0.0032362 k( 18) = ( 0.0000000 0.2428571 -0.0000000), wk = 0.0032362 k( 19) = ( 0.0000000 0.2571429 -0.0000000), wk = 0.0032362 k( 20) = ( 0.0000000 0.2714286 -0.0000000), wk = 0.0032362 k( 21) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0032362 k( 22) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0032362 k( 23) = ( 0.0000000 0.3142857 -0.0000000), wk = 0.0032362 k( 24) = ( 0.0000000 0.3285714 -0.0000000), wk = 0.0032362 k( 25) = ( 0.0000000 0.3428571 -0.0000000), wk = 0.0032362 k( 26) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0032362 k( 27) = ( 0.0000000 0.3714286 -0.0000000), wk = 0.0032362 k( 28) = ( 0.0000000 0.3857143 -0.0000000), wk = 0.0032362 k( 29) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0032362 k( 30) = ( 0.0000000 0.4142857 -0.0000000), wk = 0.0032362 k( 31) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0032362 k( 32) = ( 0.0000000 0.4428571 -0.0000000), wk = 0.0032362 k( 33) = ( 0.0000000 0.4571429 -0.0000000), wk = 0.0032362 k( 34) = ( 0.0000000 0.4714286 -0.0000000), wk = 0.0032362 k( 35) = ( 0.0000000 0.4857143 -0.0000000), wk = 0.0032362 k( 36) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032362 k( 37) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032362 k( 38) = ( 0.0142857 0.5000000 -0.0000000), wk = 0.0032362 k( 39) = ( 0.0285714 0.5000000 -0.0000000), wk = 0.0032362 k( 40) = ( 0.0428571 0.5000000 -0.0000000), wk = 0.0032362 k( 41) = ( 0.0571429 0.5000000 -0.0000000), wk = 0.0032362 k( 42) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0032362 k( 43) = ( 0.0857143 0.5000000 -0.0000000), wk = 0.0032362 k( 44) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0032362 k( 45) = ( 0.1142857 0.5000000 -0.0000000), wk = 0.0032362 k( 46) = ( 0.1285714 0.5000000 -0.0000000), wk = 0.0032362 k( 47) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0032362 k( 48) = ( 0.1571429 0.5000000 -0.0000000), wk = 0.0032362 k( 49) = ( 0.1714286 0.5000000 -0.0000000), wk = 0.0032362 k( 50) = ( 0.1857143 0.5000000 -0.0000000), wk = 0.0032362 k( 51) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0032362 k( 52) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0032362 k( 53) = ( 0.2285714 0.5000000 -0.0000000), wk = 0.0032362 k( 54) = ( 0.2428571 0.5000000 -0.0000000), wk = 0.0032362 k( 55) = ( 0.2571429 0.5000000 -0.0000000), wk = 0.0032362 k( 56) = ( 0.2714286 0.5000000 -0.0000000), wk = 0.0032362 k( 57) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0032362 k( 58) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0032362 k( 59) = ( 0.3142857 0.5000000 -0.0000000), wk = 0.0032362 k( 60) = ( 0.3285714 0.5000000 -0.0000000), wk = 0.0032362 k( 61) = ( 0.3428571 0.5000000 -0.0000000), wk = 0.0032362 k( 62) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0032362 k( 63) = ( 0.3714286 0.5000000 -0.0000000), wk = 0.0032362 k( 64) = ( 0.3857143 0.5000000 -0.0000000), wk = 0.0032362 k( 65) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0032362 k( 66) = ( 0.4142857 0.5000000 -0.0000000), wk = 0.0032362 k( 67) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0032362 k( 68) = ( 0.4428571 0.5000000 -0.0000000), wk = 0.0032362 k( 69) = ( 0.4571429 0.5000000 -0.0000000), wk = 0.0032362 k( 70) = ( 0.4714286 0.5000000 -0.0000000), wk = 0.0032362 k( 71) = ( 0.4857143 0.5000000 -0.0000000), wk = 0.0032362 k( 72) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032362 k( 73) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032362 k( 74) = ( 0.4900000 0.4900000 -0.0000000), wk = 0.0032362 k( 75) = ( 0.4800000 0.4800000 -0.0000000), wk = 0.0032362 k( 76) = ( 0.4700000 0.4700000 -0.0000000), wk = 0.0032362 k( 77) = ( 0.4600000 0.4600000 -0.0000000), wk = 0.0032362 k( 78) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0032362 k( 79) = ( 0.4400000 0.4400000 -0.0000000), wk = 0.0032362 k( 80) = ( 0.4300000 0.4300000 -0.0000000), wk = 0.0032362 k( 81) = ( 0.4200000 0.4200000 -0.0000000), wk = 0.0032362 k( 82) = ( 0.4100000 0.4100000 -0.0000000), wk = 0.0032362 k( 83) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0032362 k( 84) = ( 0.3900000 0.3900000 -0.0000000), wk = 0.0032362 k( 85) = ( 0.3800000 0.3800000 -0.0000000), wk = 0.0032362 k( 86) = ( 0.3700000 0.3700000 -0.0000000), wk = 0.0032362 k( 87) = ( 0.3600000 0.3600000 -0.0000000), wk = 0.0032362 k( 88) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0032362 k( 89) = ( 0.3400000 0.3400000 -0.0000000), wk = 0.0032362 k( 90) = ( 0.3300000 0.3300000 -0.0000000), wk = 0.0032362 k( 91) = ( 0.3200000 0.3200000 -0.0000000), wk = 0.0032362 k( 92) = ( 0.3100000 0.3100000 -0.0000000), wk = 0.0032362 k( 93) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0032362 k( 94) = ( 0.2900000 0.2900000 -0.0000000), wk = 0.0032362 k( 95) = ( 0.2800000 0.2800000 -0.0000000), wk = 0.0032362 k( 96) = ( 0.2700000 0.2700000 -0.0000000), wk = 0.0032362 k( 97) = ( 0.2600000 0.2600000 -0.0000000), wk = 0.0032362 k( 98) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0032362 k( 99) = ( 0.2400000 0.2400000 -0.0000000), wk = 0.0032362 k( 100) = ( 0.2300000 0.2300000 -0.0000000), wk = 0.0032362 k( 101) = ( 0.2200000 0.2200000 -0.0000000), wk = 0.0032362 k( 102) = ( 0.2100000 0.2100000 -0.0000000), wk = 0.0032362 k( 103) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0032362 k( 104) = ( 0.1900000 0.1900000 -0.0000000), wk = 0.0032362 k( 105) = ( 0.1800000 0.1800000 -0.0000000), wk = 0.0032362 k( 106) = ( 0.1700000 0.1700000 -0.0000000), wk = 0.0032362 k( 107) = ( 0.1600000 0.1600000 -0.0000000), wk = 0.0032362 k( 108) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0032362 k( 109) = ( 0.1400000 0.1400000 -0.0000000), wk = 0.0032362 k( 110) = ( 0.1300000 0.1300000 -0.0000000), wk = 0.0032362 k( 111) = ( 0.1200000 0.1200000 -0.0000000), wk = 0.0032362 k( 112) = ( 0.1100000 0.1100000 -0.0000000), wk = 0.0032362 k( 113) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0032362 k( 114) = ( 0.0900000 0.0900000 -0.0000000), wk = 0.0032362 k( 115) = ( 0.0800000 0.0800000 -0.0000000), wk = 0.0032362 k( 116) = ( 0.0700000 0.0700000 -0.0000000), wk = 0.0032362 k( 117) = ( 0.0600000 0.0600000 -0.0000000), wk = 0.0032362 k( 118) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0032362 k( 119) = ( 0.0400000 0.0400000 -0.0000000), wk = 0.0032362 k( 120) = ( 0.0300000 0.0300000 -0.0000000), wk = 0.0032362 k( 121) = ( 0.0200000 0.0200000 -0.0000000), wk = 0.0032362 k( 122) = ( 0.0100000 0.0100000 -0.0000000), wk = 0.0032362 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032362 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032362 k( 125) = ( 0.0000000 0.0000000 0.0142045), wk = 0.0032362 k( 126) = ( 0.0000000 0.0000000 0.0284091), wk = 0.0032362 k( 127) = ( 0.0000000 0.0000000 0.0426136), wk = 0.0032362 k( 128) = ( 0.0000000 0.0000000 0.0568182), wk = 0.0032362 k( 129) = ( 0.0000000 0.0000000 0.0710227), wk = 0.0032362 k( 130) = ( 0.0000000 0.0000000 0.0852273), wk = 0.0032362 k( 131) = ( 0.0000000 0.0000000 0.0994318), wk = 0.0032362 k( 132) = ( 0.0000000 0.0000000 0.1136364), wk = 0.0032362 k( 133) = ( 0.0000000 0.0000000 0.1278409), wk = 0.0032362 k( 134) = ( 0.0000000 0.0000000 0.1420455), wk = 0.0032362 k( 135) = ( 0.0000000 0.0000000 0.1562500), wk = 0.0032362 k( 136) = ( 0.0000000 0.0000000 0.1704545), wk = 0.0032362 k( 137) = ( 0.0000000 0.0000000 0.1846591), wk = 0.0032362 k( 138) = ( 0.0000000 0.0000000 0.1988636), wk = 0.0032362 k( 139) = ( 0.0000000 0.0000000 0.2130682), wk = 0.0032362 k( 140) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0032362 k( 141) = ( 0.0000000 0.0000000 0.2414773), wk = 0.0032362 k( 142) = ( 0.0000000 0.0000000 0.2556818), wk = 0.0032362 k( 143) = ( 0.0000000 0.0000000 0.2698864), wk = 0.0032362 k( 144) = ( 0.0000000 0.0000000 0.2840909), wk = 0.0032362 k( 145) = ( 0.0000000 0.0000000 0.2840909), wk = 0.0032362 k( 146) = ( 0.0000000 0.0142857 0.2840909), wk = 0.0032362 k( 147) = ( 0.0000000 0.0285714 0.2840909), wk = 0.0032362 k( 148) = ( 0.0000000 0.0428571 0.2840909), wk = 0.0032362 k( 149) = ( 0.0000000 0.0571429 0.2840909), wk = 0.0032362 k( 150) = ( 0.0000000 0.0714286 0.2840909), wk = 0.0032362 k( 151) = ( 0.0000000 0.0857143 0.2840909), wk = 0.0032362 k( 152) = ( 0.0000000 0.1000000 0.2840909), wk = 0.0032362 k( 153) = ( 0.0000000 0.1142857 0.2840909), wk = 0.0032362 k( 154) = ( 0.0000000 0.1285714 0.2840909), wk = 0.0032362 k( 155) = ( 0.0000000 0.1428571 0.2840909), wk = 0.0032362 k( 156) = ( 0.0000000 0.1571429 0.2840909), wk = 0.0032362 k( 157) = ( 0.0000000 0.1714286 0.2840909), wk = 0.0032362 k( 158) = ( 0.0000000 0.1857143 0.2840909), wk = 0.0032362 k( 159) = ( 0.0000000 0.2000000 0.2840909), wk = 0.0032362 k( 160) = ( 0.0000000 0.2142857 0.2840909), wk = 0.0032362 k( 161) = ( 0.0000000 0.2285714 0.2840909), wk = 0.0032362 k( 162) = ( 0.0000000 0.2428571 0.2840909), wk = 0.0032362 k( 163) = ( 0.0000000 0.2571429 0.2840909), wk = 0.0032362 k( 164) = ( 0.0000000 0.2714286 0.2840909), wk = 0.0032362 k( 165) = ( 0.0000000 0.2857143 0.2840909), wk = 0.0032362 k( 166) = ( 0.0000000 0.3000000 0.2840909), wk = 0.0032362 k( 167) = ( 0.0000000 0.3142857 0.2840909), wk = 0.0032362 k( 168) = ( 0.0000000 0.3285714 0.2840909), wk = 0.0032362 k( 169) = ( 0.0000000 0.3428571 0.2840909), wk = 0.0032362 k( 170) = ( 0.0000000 0.3571429 0.2840909), wk = 0.0032362 k( 171) = ( 0.0000000 0.3714286 0.2840909), wk = 0.0032362 k( 172) = ( 0.0000000 0.3857143 0.2840909), wk = 0.0032362 k( 173) = ( 0.0000000 0.4000000 0.2840909), wk = 0.0032362 k( 174) = ( 0.0000000 0.4142857 0.2840909), wk = 0.0032362 k( 175) = ( 0.0000000 0.4285714 0.2840909), wk = 0.0032362 k( 176) = ( 0.0000000 0.4428571 0.2840909), wk = 0.0032362 k( 177) = ( 0.0000000 0.4571429 0.2840909), wk = 0.0032362 k( 178) = ( 0.0000000 0.4714286 0.2840909), wk = 0.0032362 k( 179) = ( 0.0000000 0.4857143 0.2840909), wk = 0.0032362 k( 180) = ( 0.0000000 0.5000000 0.2840909), wk = 0.0032362 k( 181) = ( 0.0000000 0.5000000 0.2840909), wk = 0.0032362 k( 182) = ( 0.0142857 0.5000000 0.2840909), wk = 0.0032362 k( 183) = ( 0.0285714 0.5000000 0.2840909), wk = 0.0032362 k( 184) = ( 0.0428571 0.5000000 0.2840909), wk = 0.0032362 k( 185) = ( 0.0571429 0.5000000 0.2840909), wk = 0.0032362 k( 186) = ( 0.0714286 0.5000000 0.2840909), wk = 0.0032362 k( 187) = ( 0.0857143 0.5000000 0.2840909), wk = 0.0032362 k( 188) = ( 0.1000000 0.5000000 0.2840909), wk = 0.0032362 k( 189) = ( 0.1142857 0.5000000 0.2840909), wk = 0.0032362 k( 190) = ( 0.1285714 0.5000000 0.2840909), wk = 0.0032362 k( 191) = ( 0.1428571 0.5000000 0.2840909), wk = 0.0032362 k( 192) = ( 0.1571429 0.5000000 0.2840909), wk = 0.0032362 k( 193) = ( 0.1714286 0.5000000 0.2840909), wk = 0.0032362 k( 194) = ( 0.1857143 0.5000000 0.2840909), wk = 0.0032362 k( 195) = ( 0.2000000 0.5000000 0.2840909), wk = 0.0032362 k( 196) = ( 0.2142857 0.5000000 0.2840909), wk = 0.0032362 k( 197) = ( 0.2285714 0.5000000 0.2840909), wk = 0.0032362 k( 198) = ( 0.2428571 0.5000000 0.2840909), wk = 0.0032362 k( 199) = ( 0.2571429 0.5000000 0.2840909), wk = 0.0032362 k( 200) = ( 0.2714286 0.5000000 0.2840909), wk = 0.0032362 k( 201) = ( 0.2857143 0.5000000 0.2840909), wk = 0.0032362 k( 202) = ( 0.3000000 0.5000000 0.2840909), wk = 0.0032362 k( 203) = ( 0.3142857 0.5000000 0.2840909), wk = 0.0032362 k( 204) = ( 0.3285714 0.5000000 0.2840909), wk = 0.0032362 k( 205) = ( 0.3428571 0.5000000 0.2840909), wk = 0.0032362 k( 206) = ( 0.3571429 0.5000000 0.2840909), wk = 0.0032362 k( 207) = ( 0.3714286 0.5000000 0.2840909), wk = 0.0032362 k( 208) = ( 0.3857143 0.5000000 0.2840909), wk = 0.0032362 k( 209) = ( 0.4000000 0.5000000 0.2840909), wk = 0.0032362 k( 210) = ( 0.4142857 0.5000000 0.2840909), wk = 0.0032362 k( 211) = ( 0.4285714 0.5000000 0.2840909), wk = 0.0032362 k( 212) = ( 0.4428571 0.5000000 0.2840909), wk = 0.0032362 k( 213) = ( 0.4571429 0.5000000 0.2840909), wk = 0.0032362 k( 214) = ( 0.4714286 0.5000000 0.2840909), wk = 0.0032362 k( 215) = ( 0.4857143 0.5000000 0.2840909), wk = 0.0032362 k( 216) = ( 0.5000000 0.5000000 0.2840909), wk = 0.0032362 k( 217) = ( 0.5000000 0.5000000 0.2840909), wk = 0.0032362 k( 218) = ( 0.4900000 0.4900000 0.2840909), wk = 0.0032362 k( 219) = ( 0.4800000 0.4800000 0.2840909), wk = 0.0032362 k( 220) = ( 0.4700000 0.4700000 0.2840909), wk = 0.0032362 k( 221) = ( 0.4600000 0.4600000 0.2840909), wk = 0.0032362 k( 222) = ( 0.4500000 0.4500000 0.2840909), wk = 0.0032362 k( 223) = ( 0.4400000 0.4400000 0.2840909), wk = 0.0032362 k( 224) = ( 0.4300000 0.4300000 0.2840909), wk = 0.0032362 k( 225) = ( 0.4200000 0.4200000 0.2840909), wk = 0.0032362 k( 226) = ( 0.4100000 0.4100000 0.2840909), wk = 0.0032362 k( 227) = ( 0.4000000 0.4000000 0.2840909), wk = 0.0032362 k( 228) = ( 0.3900000 0.3900000 0.2840909), wk = 0.0032362 k( 229) = ( 0.3800000 0.3800000 0.2840909), wk = 0.0032362 k( 230) = ( 0.3700000 0.3700000 0.2840909), wk = 0.0032362 k( 231) = ( 0.3600000 0.3600000 0.2840909), wk = 0.0032362 k( 232) = ( 0.3500000 0.3500000 0.2840909), wk = 0.0032362 k( 233) = ( 0.3400000 0.3400000 0.2840909), wk = 0.0032362 k( 234) = ( 0.3300000 0.3300000 0.2840909), wk = 0.0032362 k( 235) = ( 0.3200000 0.3200000 0.2840909), wk = 0.0032362 k( 236) = ( 0.3100000 0.3100000 0.2840909), wk = 0.0032362 k( 237) = ( 0.3000000 0.3000000 0.2840909), wk = 0.0032362 k( 238) = ( 0.2900000 0.2900000 0.2840909), wk = 0.0032362 k( 239) = ( 0.2800000 0.2800000 0.2840909), wk = 0.0032362 k( 240) = ( 0.2700000 0.2700000 0.2840909), wk = 0.0032362 k( 241) = ( 0.2600000 0.2600000 0.2840909), wk = 0.0032362 k( 242) = ( 0.2500000 0.2500000 0.2840909), wk = 0.0032362 k( 243) = ( 0.2400000 0.2400000 0.2840909), wk = 0.0032362 k( 244) = ( 0.2300000 0.2300000 0.2840909), wk = 0.0032362 k( 245) = ( 0.2200000 0.2200000 0.2840909), wk = 0.0032362 k( 246) = ( 0.2100000 0.2100000 0.2840909), wk = 0.0032362 k( 247) = ( 0.2000000 0.2000000 0.2840909), wk = 0.0032362 k( 248) = ( 0.1900000 0.1900000 0.2840909), wk = 0.0032362 k( 249) = ( 0.1800000 0.1800000 0.2840909), wk = 0.0032362 k( 250) = ( 0.1700000 0.1700000 0.2840909), wk = 0.0032362 k( 251) = ( 0.1600000 0.1600000 0.2840909), wk = 0.0032362 k( 252) = ( 0.1500000 0.1500000 0.2840909), wk = 0.0032362 k( 253) = ( 0.1400000 0.1400000 0.2840909), wk = 0.0032362 k( 254) = ( 0.1300000 0.1300000 0.2840909), wk = 0.0032362 k( 255) = ( 0.1200000 0.1200000 0.2840909), wk = 0.0032362 k( 256) = ( 0.1100000 0.1100000 0.2840909), wk = 0.0032362 k( 257) = ( 0.1000000 0.1000000 0.2840909), wk = 0.0032362 k( 258) = ( 0.0900000 0.0900000 0.2840909), wk = 0.0032362 k( 259) = ( 0.0800000 0.0800000 0.2840909), wk = 0.0032362 k( 260) = ( 0.0700000 0.0700000 0.2840909), wk = 0.0032362 k( 261) = ( 0.0600000 0.0600000 0.2840909), wk = 0.0032362 k( 262) = ( 0.0500000 0.0500000 0.2840909), wk = 0.0032362 k( 263) = ( 0.0400000 0.0400000 0.2840909), wk = 0.0032362 k( 264) = ( 0.0300000 0.0300000 0.2840909), wk = 0.0032362 k( 265) = ( 0.0200000 0.0200000 0.2840909), wk = 0.0032362 k( 266) = ( 0.0100000 0.0100000 0.2840909), wk = 0.0032362 k( 267) = ( 0.0000000 0.0000000 0.2840909), wk = 0.0032362 k( 268) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032362 k( 269) = ( 0.0000000 0.5000000 0.0142045), wk = 0.0032362 k( 270) = ( 0.0000000 0.5000000 0.0284091), wk = 0.0032362 k( 271) = ( 0.0000000 0.5000000 0.0426136), wk = 0.0032362 k( 272) = ( 0.0000000 0.5000000 0.0568182), wk = 0.0032362 k( 273) = ( 0.0000000 0.5000000 0.0710227), wk = 0.0032362 k( 274) = ( 0.0000000 0.5000000 0.0852273), wk = 0.0032362 k( 275) = ( 0.0000000 0.5000000 0.0994318), wk = 0.0032362 k( 276) = ( 0.0000000 0.5000000 0.1136364), wk = 0.0032362 k( 277) = ( 0.0000000 0.5000000 0.1278409), wk = 0.0032362 k( 278) = ( 0.0000000 0.5000000 0.1420455), wk = 0.0032362 k( 279) = ( 0.0000000 0.5000000 0.1562500), wk = 0.0032362 k( 280) = ( 0.0000000 0.5000000 0.1704545), wk = 0.0032362 k( 281) = ( 0.0000000 0.5000000 0.1846591), wk = 0.0032362 k( 282) = ( 0.0000000 0.5000000 0.1988636), wk = 0.0032362 k( 283) = ( 0.0000000 0.5000000 0.2130682), wk = 0.0032362 k( 284) = ( 0.0000000 0.5000000 0.2272727), wk = 0.0032362 k( 285) = ( 0.0000000 0.5000000 0.2414773), wk = 0.0032362 k( 286) = ( 0.0000000 0.5000000 0.2556818), wk = 0.0032362 k( 287) = ( 0.0000000 0.5000000 0.2698864), wk = 0.0032362 k( 288) = ( 0.0000000 0.5000000 0.2840909), wk = 0.0032362 k( 289) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032362 k( 290) = ( 0.5000000 0.5000000 0.0142045), wk = 0.0032362 k( 291) = ( 0.5000000 0.5000000 0.0284091), wk = 0.0032362 k( 292) = ( 0.5000000 0.5000000 0.0426136), wk = 0.0032362 k( 293) = ( 0.5000000 0.5000000 0.0568182), wk = 0.0032362 k( 294) = ( 0.5000000 0.5000000 0.0710227), wk = 0.0032362 k( 295) = ( 0.5000000 0.5000000 0.0852273), wk = 0.0032362 k( 296) = ( 0.5000000 0.5000000 0.0994318), wk = 0.0032362 k( 297) = ( 0.5000000 0.5000000 0.1136364), wk = 0.0032362 k( 298) = ( 0.5000000 0.5000000 0.1278409), wk = 0.0032362 k( 299) = ( 0.5000000 0.5000000 0.1420455), wk = 0.0032362 k( 300) = ( 0.5000000 0.5000000 0.1562500), wk = 0.0032362 k( 301) = ( 0.5000000 0.5000000 0.1704545), wk = 0.0032362 k( 302) = ( 0.5000000 0.5000000 0.1846591), wk = 0.0032362 k( 303) = ( 0.5000000 0.5000000 0.1988636), wk = 0.0032362 k( 304) = ( 0.5000000 0.5000000 0.2130682), wk = 0.0032362 k( 305) = ( 0.5000000 0.5000000 0.2272727), wk = 0.0032362 k( 306) = ( 0.5000000 0.5000000 0.2414773), wk = 0.0032362 k( 307) = ( 0.5000000 0.5000000 0.2556818), wk = 0.0032362 k( 308) = ( 0.5000000 0.5000000 0.2698864), wk = 0.0032362 k( 309) = ( 0.5000000 0.5000000 0.2840909), wk = 0.0032362 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032362 k( 2) = ( 0.0000000 0.0142857 -0.0000000), wk = 0.0032362 k( 3) = ( 0.0000000 0.0285714 0.0000000), wk = 0.0032362 k( 4) = ( 0.0000000 0.0428571 0.0000000), wk = 0.0032362 k( 5) = ( 0.0000000 0.0571429 0.0000000), wk = 0.0032362 k( 6) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0032362 k( 7) = ( 0.0000000 0.0857143 0.0000000), wk = 0.0032362 k( 8) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0032362 k( 9) = ( 0.0000000 0.1142857 0.0000000), wk = 0.0032362 k( 10) = ( 0.0000000 0.1285714 0.0000000), wk = 0.0032362 k( 11) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0032362 k( 12) = ( 0.0000000 0.1571429 -0.0000000), wk = 0.0032362 k( 13) = ( 0.0000000 0.1714286 0.0000000), wk = 0.0032362 k( 14) = ( 0.0000000 0.1857143 0.0000000), wk = 0.0032362 k( 15) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0032362 k( 16) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0032362 k( 17) = ( 0.0000000 0.2285714 0.0000000), wk = 0.0032362 k( 18) = ( 0.0000000 0.2428571 0.0000000), wk = 0.0032362 k( 19) = ( 0.0000000 0.2571429 0.0000000), wk = 0.0032362 k( 20) = ( 0.0000000 0.2714286 0.0000000), wk = 0.0032362 k( 21) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0032362 k( 22) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0032362 k( 23) = ( 0.0000000 0.3142857 -0.0000000), wk = 0.0032362 k( 24) = ( 0.0000000 0.3285714 0.0000000), wk = 0.0032362 k( 25) = ( 0.0000000 0.3428571 0.0000000), wk = 0.0032362 k( 26) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0032362 k( 27) = ( 0.0000000 0.3714286 0.0000000), wk = 0.0032362 k( 28) = ( 0.0000000 0.3857143 0.0000000), wk = 0.0032362 k( 29) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0032362 k( 30) = ( 0.0000000 0.4142857 0.0000000), wk = 0.0032362 k( 31) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0032362 k( 32) = ( 0.0000000 0.4428571 0.0000000), wk = 0.0032362 k( 33) = ( 0.0000000 0.4571429 0.0000000), wk = 0.0032362 k( 34) = ( 0.0000000 0.4714286 0.0000000), wk = 0.0032362 k( 35) = ( 0.0000000 0.4857143 -0.0000000), wk = 0.0032362 k( 36) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032362 k( 37) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032362 k( 38) = ( 0.0142857 0.5000000 0.0000000), wk = 0.0032362 k( 39) = ( 0.0285714 0.5000000 0.0000000), wk = 0.0032362 k( 40) = ( 0.0428571 0.5000000 0.0000000), wk = 0.0032362 k( 41) = ( 0.0571429 0.5000000 0.0000000), wk = 0.0032362 k( 42) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0032362 k( 43) = ( 0.0857143 0.5000000 -0.0000000), wk = 0.0032362 k( 44) = ( 0.1000000 0.5000000 0.0000000), wk = 0.0032362 k( 45) = ( 0.1142857 0.5000000 0.0000000), wk = 0.0032362 k( 46) = ( 0.1285714 0.5000000 0.0000000), wk = 0.0032362 k( 47) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0032362 k( 48) = ( 0.1571429 0.5000000 0.0000000), wk = 0.0032362 k( 49) = ( 0.1714286 0.5000000 0.0000000), wk = 0.0032362 k( 50) = ( 0.1857143 0.5000000 0.0000000), wk = 0.0032362 k( 51) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0032362 k( 52) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0032362 k( 53) = ( 0.2285714 0.5000000 0.0000000), wk = 0.0032362 k( 54) = ( 0.2428571 0.5000000 0.0000000), wk = 0.0032362 k( 55) = ( 0.2571429 0.5000000 0.0000000), wk = 0.0032362 k( 56) = ( 0.2714286 0.5000000 0.0000000), wk = 0.0032362 k( 57) = ( 0.2857143 0.5000000 0.0000000), wk = 0.0032362 k( 58) = ( 0.3000000 0.5000000 0.0000000), wk = 0.0032362 k( 59) = ( 0.3142857 0.5000000 0.0000000), wk = 0.0032362 k( 60) = ( 0.3285714 0.5000000 -0.0000000), wk = 0.0032362 k( 61) = ( 0.3428571 0.5000000 -0.0000000), wk = 0.0032362 k( 62) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0032362 k( 63) = ( 0.3714286 0.5000000 0.0000000), wk = 0.0032362 k( 64) = ( 0.3857143 0.5000000 0.0000000), wk = 0.0032362 k( 65) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0032362 k( 66) = ( 0.4142857 0.5000000 -0.0000000), wk = 0.0032362 k( 67) = ( 0.4285714 0.5000000 0.0000000), wk = 0.0032362 k( 68) = ( 0.4428571 0.5000000 0.0000000), wk = 0.0032362 k( 69) = ( 0.4571429 0.5000000 0.0000000), wk = 0.0032362 k( 70) = ( 0.4714286 0.5000000 0.0000000), wk = 0.0032362 k( 71) = ( 0.4857143 0.5000000 0.0000000), wk = 0.0032362 k( 72) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032362 k( 73) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032362 k( 74) = ( 0.4900000 0.4900000 0.0000000), wk = 0.0032362 k( 75) = ( 0.4800000 0.4800000 0.0000000), wk = 0.0032362 k( 76) = ( 0.4700000 0.4700000 0.0000000), wk = 0.0032362 k( 77) = ( 0.4600000 0.4600000 0.0000000), wk = 0.0032362 k( 78) = ( 0.4500000 0.4500000 0.0000000), wk = 0.0032362 k( 79) = ( 0.4400000 0.4400000 0.0000000), wk = 0.0032362 k( 80) = ( 0.4300000 0.4300000 0.0000000), wk = 0.0032362 k( 81) = ( 0.4200000 0.4200000 -0.0000000), wk = 0.0032362 k( 82) = ( 0.4100000 0.4100000 -0.0000000), wk = 0.0032362 k( 83) = ( 0.4000000 0.4000000 0.0000000), wk = 0.0032362 k( 84) = ( 0.3900000 0.3900000 -0.0000000), wk = 0.0032362 k( 85) = ( 0.3800000 0.3800000 0.0000000), wk = 0.0032362 k( 86) = ( 0.3700000 0.3700000 -0.0000000), wk = 0.0032362 k( 87) = ( 0.3600000 0.3600000 -0.0000000), wk = 0.0032362 k( 88) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0032362 k( 89) = ( 0.3400000 0.3400000 -0.0000000), wk = 0.0032362 k( 90) = ( 0.3300000 0.3300000 -0.0000000), wk = 0.0032362 k( 91) = ( 0.3200000 0.3200000 0.0000000), wk = 0.0032362 k( 92) = ( 0.3100000 0.3100000 0.0000000), wk = 0.0032362 k( 93) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0032362 k( 94) = ( 0.2900000 0.2900000 -0.0000000), wk = 0.0032362 k( 95) = ( 0.2800000 0.2800000 0.0000000), wk = 0.0032362 k( 96) = ( 0.2700000 0.2700000 0.0000000), wk = 0.0032362 k( 97) = ( 0.2600000 0.2600000 0.0000000), wk = 0.0032362 k( 98) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0032362 k( 99) = ( 0.2400000 0.2400000 0.0000000), wk = 0.0032362 k( 100) = ( 0.2300000 0.2300000 0.0000000), wk = 0.0032362 k( 101) = ( 0.2200000 0.2200000 0.0000000), wk = 0.0032362 k( 102) = ( 0.2100000 0.2100000 -0.0000000), wk = 0.0032362 k( 103) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0032362 k( 104) = ( 0.1900000 0.1900000 0.0000000), wk = 0.0032362 k( 105) = ( 0.1800000 0.1800000 -0.0000000), wk = 0.0032362 k( 106) = ( 0.1700000 0.1700000 -0.0000000), wk = 0.0032362 k( 107) = ( 0.1600000 0.1600000 0.0000000), wk = 0.0032362 k( 108) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0032362 k( 109) = ( 0.1400000 0.1400000 0.0000000), wk = 0.0032362 k( 110) = ( 0.1300000 0.1300000 0.0000000), wk = 0.0032362 k( 111) = ( 0.1200000 0.1200000 0.0000000), wk = 0.0032362 k( 112) = ( 0.1100000 0.1100000 0.0000000), wk = 0.0032362 k( 113) = ( 0.1000000 0.1000000 0.0000000), wk = 0.0032362 k( 114) = ( 0.0900000 0.0900000 -0.0000000), wk = 0.0032362 k( 115) = ( 0.0800000 0.0800000 0.0000000), wk = 0.0032362 k( 116) = ( 0.0700000 0.0700000 0.0000000), wk = 0.0032362 k( 117) = ( 0.0600000 0.0600000 0.0000000), wk = 0.0032362 k( 118) = ( 0.0500000 0.0500000 0.0000000), wk = 0.0032362 k( 119) = ( 0.0400000 0.0400000 0.0000000), wk = 0.0032362 k( 120) = ( 0.0300000 0.0300000 0.0000000), wk = 0.0032362 k( 121) = ( 0.0200000 0.0200000 0.0000000), wk = 0.0032362 k( 122) = ( 0.0100000 0.0100000 0.0000000), wk = 0.0032362 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032362 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032362 k( 125) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0032362 k( 126) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0032362 k( 127) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0032362 k( 128) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0032362 k( 129) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0032362 k( 130) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0032362 k( 131) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0032362 k( 132) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0032362 k( 133) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0032362 k( 134) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0032362 k( 135) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0032362 k( 136) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0032362 k( 137) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0032362 k( 138) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0032362 k( 139) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0032362 k( 140) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0032362 k( 141) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0032362 k( 142) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0032362 k( 143) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0032362 k( 144) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032362 k( 145) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032362 k( 146) = ( 0.0000000 0.0142857 0.5000000), wk = 0.0032362 k( 147) = ( 0.0000000 0.0285714 0.5000000), wk = 0.0032362 k( 148) = ( 0.0000000 0.0428571 0.5000000), wk = 0.0032362 k( 149) = ( 0.0000000 0.0571429 0.5000000), wk = 0.0032362 k( 150) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0032362 k( 151) = ( 0.0000000 0.0857143 0.5000000), wk = 0.0032362 k( 152) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0032362 k( 153) = ( 0.0000000 0.1142857 0.5000000), wk = 0.0032362 k( 154) = ( 0.0000000 0.1285714 0.5000000), wk = 0.0032362 k( 155) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0032362 k( 156) = ( 0.0000000 0.1571429 0.5000000), wk = 0.0032362 k( 157) = ( 0.0000000 0.1714286 0.5000000), wk = 0.0032362 k( 158) = ( 0.0000000 0.1857143 0.5000000), wk = 0.0032362 k( 159) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0032362 k( 160) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0032362 k( 161) = ( 0.0000000 0.2285714 0.5000000), wk = 0.0032362 k( 162) = ( 0.0000000 0.2428571 0.5000000), wk = 0.0032362 k( 163) = ( 0.0000000 0.2571429 0.5000000), wk = 0.0032362 k( 164) = ( 0.0000000 0.2714286 0.5000000), wk = 0.0032362 k( 165) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0032362 k( 166) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0032362 k( 167) = ( 0.0000000 0.3142857 0.5000000), wk = 0.0032362 k( 168) = ( 0.0000000 0.3285714 0.5000000), wk = 0.0032362 k( 169) = ( 0.0000000 0.3428571 0.5000000), wk = 0.0032362 k( 170) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0032362 k( 171) = ( 0.0000000 0.3714286 0.5000000), wk = 0.0032362 k( 172) = ( 0.0000000 0.3857143 0.5000000), wk = 0.0032362 k( 173) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0032362 k( 174) = ( 0.0000000 0.4142857 0.5000000), wk = 0.0032362 k( 175) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0032362 k( 176) = ( 0.0000000 0.4428571 0.5000000), wk = 0.0032362 k( 177) = ( 0.0000000 0.4571429 0.5000000), wk = 0.0032362 k( 178) = ( 0.0000000 0.4714286 0.5000000), wk = 0.0032362 k( 179) = ( 0.0000000 0.4857143 0.5000000), wk = 0.0032362 k( 180) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032362 k( 181) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032362 k( 182) = ( 0.0142857 0.5000000 0.5000000), wk = 0.0032362 k( 183) = ( 0.0285714 0.5000000 0.5000000), wk = 0.0032362 k( 184) = ( 0.0428571 0.5000000 0.5000000), wk = 0.0032362 k( 185) = ( 0.0571429 0.5000000 0.5000000), wk = 0.0032362 k( 186) = ( 0.0714286 0.5000000 0.5000000), wk = 0.0032362 k( 187) = ( 0.0857143 0.5000000 0.5000000), wk = 0.0032362 k( 188) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0032362 k( 189) = ( 0.1142857 0.5000000 0.5000000), wk = 0.0032362 k( 190) = ( 0.1285714 0.5000000 0.5000000), wk = 0.0032362 k( 191) = ( 0.1428571 0.5000000 0.5000000), wk = 0.0032362 k( 192) = ( 0.1571429 0.5000000 0.5000000), wk = 0.0032362 k( 193) = ( 0.1714286 0.5000000 0.5000000), wk = 0.0032362 k( 194) = ( 0.1857143 0.5000000 0.5000000), wk = 0.0032362 k( 195) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0032362 k( 196) = ( 0.2142857 0.5000000 0.5000000), wk = 0.0032362 k( 197) = ( 0.2285714 0.5000000 0.5000000), wk = 0.0032362 k( 198) = ( 0.2428571 0.5000000 0.5000000), wk = 0.0032362 k( 199) = ( 0.2571429 0.5000000 0.5000000), wk = 0.0032362 k( 200) = ( 0.2714286 0.5000000 0.5000000), wk = 0.0032362 k( 201) = ( 0.2857143 0.5000000 0.5000000), wk = 0.0032362 k( 202) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0032362 k( 203) = ( 0.3142857 0.5000000 0.5000000), wk = 0.0032362 k( 204) = ( 0.3285714 0.5000000 0.5000000), wk = 0.0032362 k( 205) = ( 0.3428571 0.5000000 0.5000000), wk = 0.0032362 k( 206) = ( 0.3571429 0.5000000 0.5000000), wk = 0.0032362 k( 207) = ( 0.3714286 0.5000000 0.5000000), wk = 0.0032362 k( 208) = ( 0.3857143 0.5000000 0.5000000), wk = 0.0032362 k( 209) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0032362 k( 210) = ( 0.4142857 0.5000000 0.5000000), wk = 0.0032362 k( 211) = ( 0.4285714 0.5000000 0.5000000), wk = 0.0032362 k( 212) = ( 0.4428571 0.5000000 0.5000000), wk = 0.0032362 k( 213) = ( 0.4571429 0.5000000 0.5000000), wk = 0.0032362 k( 214) = ( 0.4714286 0.5000000 0.5000000), wk = 0.0032362 k( 215) = ( 0.4857143 0.5000000 0.5000000), wk = 0.0032362 k( 216) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032362 k( 217) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032362 k( 218) = ( 0.4900000 0.4900000 0.5000000), wk = 0.0032362 k( 219) = ( 0.4800000 0.4800000 0.5000000), wk = 0.0032362 k( 220) = ( 0.4700000 0.4700000 0.5000000), wk = 0.0032362 k( 221) = ( 0.4600000 0.4600000 0.5000000), wk = 0.0032362 k( 222) = ( 0.4500000 0.4500000 0.5000000), wk = 0.0032362 k( 223) = ( 0.4400000 0.4400000 0.5000000), wk = 0.0032362 k( 224) = ( 0.4300000 0.4300000 0.5000000), wk = 0.0032362 k( 225) = ( 0.4200000 0.4200000 0.5000000), wk = 0.0032362 k( 226) = ( 0.4100000 0.4100000 0.5000000), wk = 0.0032362 k( 227) = ( 0.4000000 0.4000000 0.5000000), wk = 0.0032362 k( 228) = ( 0.3900000 0.3900000 0.5000000), wk = 0.0032362 k( 229) = ( 0.3800000 0.3800000 0.5000000), wk = 0.0032362 k( 230) = ( 0.3700000 0.3700000 0.5000000), wk = 0.0032362 k( 231) = ( 0.3600000 0.3600000 0.5000000), wk = 0.0032362 k( 232) = ( 0.3500000 0.3500000 0.5000000), wk = 0.0032362 k( 233) = ( 0.3400000 0.3400000 0.5000000), wk = 0.0032362 k( 234) = ( 0.3300000 0.3300000 0.5000000), wk = 0.0032362 k( 235) = ( 0.3200000 0.3200000 0.5000000), wk = 0.0032362 k( 236) = ( 0.3100000 0.3100000 0.5000000), wk = 0.0032362 k( 237) = ( 0.3000000 0.3000000 0.5000000), wk = 0.0032362 k( 238) = ( 0.2900000 0.2900000 0.5000000), wk = 0.0032362 k( 239) = ( 0.2800000 0.2800000 0.5000000), wk = 0.0032362 k( 240) = ( 0.2700000 0.2700000 0.5000000), wk = 0.0032362 k( 241) = ( 0.2600000 0.2600000 0.5000000), wk = 0.0032362 k( 242) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0032362 k( 243) = ( 0.2400000 0.2400000 0.5000000), wk = 0.0032362 k( 244) = ( 0.2300000 0.2300000 0.5000000), wk = 0.0032362 k( 245) = ( 0.2200000 0.2200000 0.5000000), wk = 0.0032362 k( 246) = ( 0.2100000 0.2100000 0.5000000), wk = 0.0032362 k( 247) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0032362 k( 248) = ( 0.1900000 0.1900000 0.5000000), wk = 0.0032362 k( 249) = ( 0.1800000 0.1800000 0.5000000), wk = 0.0032362 k( 250) = ( 0.1700000 0.1700000 0.5000000), wk = 0.0032362 k( 251) = ( 0.1600000 0.1600000 0.5000000), wk = 0.0032362 k( 252) = ( 0.1500000 0.1500000 0.5000000), wk = 0.0032362 k( 253) = ( 0.1400000 0.1400000 0.5000000), wk = 0.0032362 k( 254) = ( 0.1300000 0.1300000 0.5000000), wk = 0.0032362 k( 255) = ( 0.1200000 0.1200000 0.5000000), wk = 0.0032362 k( 256) = ( 0.1100000 0.1100000 0.5000000), wk = 0.0032362 k( 257) = ( 0.1000000 0.1000000 0.5000000), wk = 0.0032362 k( 258) = ( 0.0900000 0.0900000 0.5000000), wk = 0.0032362 k( 259) = ( 0.0800000 0.0800000 0.5000000), wk = 0.0032362 k( 260) = ( 0.0700000 0.0700000 0.5000000), wk = 0.0032362 k( 261) = ( 0.0600000 0.0600000 0.5000000), wk = 0.0032362 k( 262) = ( 0.0500000 0.0500000 0.5000000), wk = 0.0032362 k( 263) = ( 0.0400000 0.0400000 0.5000000), wk = 0.0032362 k( 264) = ( 0.0300000 0.0300000 0.5000000), wk = 0.0032362 k( 265) = ( 0.0200000 0.0200000 0.5000000), wk = 0.0032362 k( 266) = ( 0.0100000 0.0100000 0.5000000), wk = 0.0032362 k( 267) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032362 k( 268) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032362 k( 269) = ( 0.0000000 0.5000000 0.0250000), wk = 0.0032362 k( 270) = ( 0.0000000 0.5000000 0.0500000), wk = 0.0032362 k( 271) = ( 0.0000000 0.5000000 0.0750000), wk = 0.0032362 k( 272) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0032362 k( 273) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0032362 k( 274) = ( 0.0000000 0.5000000 0.1500000), wk = 0.0032362 k( 275) = ( 0.0000000 0.5000000 0.1750000), wk = 0.0032362 k( 276) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0032362 k( 277) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0032362 k( 278) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0032362 k( 279) = ( 0.0000000 0.5000000 0.2750000), wk = 0.0032362 k( 280) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0032362 k( 281) = ( 0.0000000 0.5000000 0.3250000), wk = 0.0032362 k( 282) = ( 0.0000000 0.5000000 0.3500000), wk = 0.0032362 k( 283) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0032362 k( 284) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0032362 k( 285) = ( 0.0000000 0.5000000 0.4250000), wk = 0.0032362 k( 286) = ( 0.0000000 0.5000000 0.4500000), wk = 0.0032362 k( 287) = ( 0.0000000 0.5000000 0.4750000), wk = 0.0032362 k( 288) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032362 k( 289) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032362 k( 290) = ( 0.5000000 0.5000000 0.0250000), wk = 0.0032362 k( 291) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0032362 k( 292) = ( 0.5000000 0.5000000 0.0750000), wk = 0.0032362 k( 293) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0032362 k( 294) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0032362 k( 295) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0032362 k( 296) = ( 0.5000000 0.5000000 0.1750000), wk = 0.0032362 k( 297) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0032362 k( 298) = ( 0.5000000 0.5000000 0.2250000), wk = 0.0032362 k( 299) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0032362 k( 300) = ( 0.5000000 0.5000000 0.2750000), wk = 0.0032362 k( 301) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0032362 k( 302) = ( 0.5000000 0.5000000 0.3250000), wk = 0.0032362 k( 303) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0032362 k( 304) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0032362 k( 305) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0032362 k( 306) = ( 0.5000000 0.5000000 0.4250000), wk = 0.0032362 k( 307) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0032362 k( 308) = ( 0.5000000 0.5000000 0.4750000), wk = 0.0032362 k( 309) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032362 Dense grid: 104577 G-vectors FFT dimensions: ( 50, 50, 90) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.79 Mb ( 738, 70) NL pseudopotentials 0.93 Mb ( 369, 166) Each V/rho on FFT grid 0.11 Mb ( 7500) Each G-vector array 0.02 Mb ( 2905) G-vector shells 0.01 Mb ( 1401) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 3.15 Mb ( 738, 280) Each subspace H/S matrix 0.07 Mb ( 70, 70) Each matrix 0.35 Mb ( 166, 2, 70) The potential is recalculated from file : ./BaMnGe.save/charge-density.dat Starting wfc are 76 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.3 secs Computing kpt #: 2 total cpu time spent up to now is 4.9 secs Computing kpt #: 3 total cpu time spent up to now is 6.6 secs Computing kpt #: 4 total cpu time spent up to now is 8.2 secs Computing kpt #: 5 total cpu time spent up to now is 9.8 secs Computing kpt #: 6 total cpu time spent up to now is 11.3 secs Computing kpt #: 7 total cpu time spent up to now is 12.9 secs Computing kpt #: 8 total cpu time spent up to now is 14.4 secs Computing kpt #: 9 total cpu time spent up to now is 16.0 secs Computing kpt #: 10 total cpu time spent up to now is 17.5 secs Computing kpt #: 11 total cpu time spent up to now is 19.1 secs Computing kpt #: 12 total cpu time spent up to now is 20.7 secs Computing kpt #: 13 total cpu time spent up to now is 22.2 secs Computing kpt #: 14 total cpu time spent up to now is 23.7 secs Computing kpt #: 15 total cpu time spent up to now is 24.9 secs Computing kpt #: 16 total cpu time spent up to now is 26.1 secs Computing kpt #: 17 total cpu time spent up to now is 27.3 secs Computing kpt #: 18 total cpu time spent up to now is 28.5 secs Computing kpt #: 19 total cpu time spent up to now is 29.8 secs Computing kpt #: 20 total cpu time spent up to now is 31.0 secs Computing kpt #: 21 total cpu time spent up to now is 32.2 secs Computing kpt #: 22 total cpu time spent up to now is 33.4 secs Computing kpt #: 23 total cpu time spent up to now is 34.6 secs Computing kpt #: 24 total cpu time spent up to now is 35.8 secs Computing kpt #: 25 total cpu time spent up to now is 37.0 secs Computing kpt #: 26 total cpu time spent up to now is 38.1 secs Computing kpt #: 27 total cpu time spent up to now is 39.3 secs Computing kpt #: 28 total cpu time spent up to now is 40.5 secs Computing kpt #: 29 total cpu time spent up to now is 41.7 secs Computing kpt #: 30 total cpu time spent up to now is 42.9 secs Computing kpt #: 31 total cpu time spent up to now is 44.1 secs Computing kpt #: 32 total cpu time spent up to now is 45.4 secs Computing kpt #: 33 total cpu time spent up to now is 46.6 secs Computing kpt #: 34 total cpu time spent up to now is 47.9 secs Computing kpt #: 35 total cpu time spent up to now is 49.2 secs Computing kpt #: 36 total cpu time spent up to now is 50.4 secs Computing kpt #: 37 total cpu time spent up to now is 51.6 secs Computing kpt #: 38 total cpu time spent up to now is 53.0 secs Computing kpt #: 39 total cpu time spent up to now is 54.3 secs Computing kpt #: 40 total cpu time spent up to now is 55.6 secs Computing kpt #: 41 total cpu time spent up to now is 57.0 secs Computing kpt #: 42 total cpu time spent up to now is 58.3 secs Computing kpt #: 43 total cpu time spent up to now is 60.2 secs Computing kpt #: 44 total cpu time spent up to now is 62.1 secs Computing kpt #: 45 total cpu time spent up to now is 63.4 secs Computing kpt #: 46 total cpu time spent up to now is 65.3 secs Computing kpt #: 47 total cpu time spent up to now is 67.1 secs Computing kpt #: 48 total cpu time spent up to now is 68.4 secs Computing kpt #: 49 total cpu time spent up to now is 71.7 secs Computing kpt #: 50 total cpu time spent up to now is 73.5 secs Computing kpt #: 51 total cpu time spent up to now is 75.4 secs Computing kpt #: 52 total cpu time spent up to now is 77.3 secs Computing kpt #: 53 total cpu time spent up to now is 79.1 secs Computing kpt #: 54 total cpu time spent up to now is 81.0 secs Computing kpt #: 55 total cpu time spent up to now is 82.9 secs Computing kpt #: 56 total cpu time spent up to now is 84.8 secs Computing kpt #: 57 total cpu time spent up to now is 86.5 secs Computing kpt #: 58 total cpu time spent up to now is 88.4 secs Computing kpt #: 59 total cpu time spent up to now is 90.3 secs Computing kpt #: 60 total cpu time spent up to now is 92.2 secs Computing kpt #: 61 total cpu time spent up to now is 94.2 secs Computing kpt #: 62 total cpu time spent up to now is 96.1 secs Computing kpt #: 63 total cpu time spent up to now is 98.0 secs Computing kpt #: 64 total cpu time spent up to now is 100.1 secs Computing kpt #: 65 total cpu time spent up to now is 102.0 secs Computing kpt #: 66 total cpu time spent up to now is 104.0 secs Computing kpt #: 67 total cpu time spent up to now is 106.0 secs Computing kpt #: 68 total cpu time spent up to now is 108.0 secs Computing kpt #: 69 total cpu time spent up to now is 109.9 secs Computing kpt #: 70 total cpu time spent up to now is 111.1 secs Computing kpt #: 71 total cpu time spent up to now is 112.3 secs Computing kpt #: 72 total cpu time spent up to now is 113.5 secs Computing kpt #: 73 total cpu time spent up to now is 114.7 secs Computing kpt #: 74 total cpu time spent up to now is 116.7 secs Computing kpt #: 75 total cpu time spent up to now is 117.9 secs Computing kpt #: 76 total cpu time spent up to now is 119.9 secs Computing kpt #: 77 total cpu time spent up to now is 121.8 secs Computing kpt #: 78 total cpu time spent up to now is 123.7 secs Computing kpt #: 79 total cpu time spent up to now is 125.5 secs Computing kpt #: 80 total cpu time spent up to now is 127.4 secs Computing kpt #: 81 total cpu time spent up to now is 129.4 secs Computing kpt #: 82 total cpu time spent up to now is 131.3 secs Computing kpt #: 83 total cpu time spent up to now is 133.3 secs Computing kpt #: 84 total cpu time spent up to now is 135.2 secs Computing kpt #: 85 total cpu time spent up to now is 136.9 secs Computing kpt #: 86 total cpu time spent up to now is 138.5 secs Computing kpt #: 87 total cpu time spent up to now is 141.0 secs Computing kpt #: 88 total cpu time spent up to now is 142.6 secs Computing kpt #: 89 total cpu time spent up to now is 144.1 secs Computing kpt #: 90 total cpu time spent up to now is 145.3 secs Computing kpt #: 91 total cpu time spent up to now is 146.5 secs Computing kpt #: 92 total cpu time spent up to now is 147.7 secs Computing kpt #: 93 total cpu time spent up to now is 149.0 secs Computing kpt #: 94 total cpu time spent up to now is 150.2 secs Computing kpt #: 95 total cpu time spent up to now is 151.5 secs Computing kpt #: 96 total cpu time spent up to now is 152.7 secs Computing kpt #: 97 total cpu time spent up to now is 153.9 secs Computing kpt #: 98 total cpu time spent up to now is 155.1 secs Computing kpt #: 99 total cpu time spent up to now is 156.4 secs Computing kpt #: 100 total cpu time spent up to now is 157.6 secs Computing kpt #: 101 total cpu time spent up to now is 158.8 secs Computing kpt #: 102 total cpu time spent up to now is 160.0 secs Computing kpt #: 103 total cpu time spent up to now is 161.2 secs Computing kpt #: 104 total cpu time spent up to now is 162.5 secs Computing kpt #: 105 total cpu time spent up to now is 163.7 secs Computing kpt #: 106 total cpu time spent up to now is 164.9 secs Computing kpt #: 107 total cpu time spent up to now is 166.1 secs Computing kpt #: 108 total cpu time spent up to now is 167.4 secs Computing kpt #: 109 total cpu time spent up to now is 168.6 secs Computing kpt #: 110 total cpu time spent up to now is 169.8 secs Computing kpt #: 111 total cpu time spent up to now is 171.3 secs Computing kpt #: 112 total cpu time spent up to now is 172.8 secs Computing kpt #: 113 total cpu time spent up to now is 174.3 secs Computing kpt #: 114 total cpu time spent up to now is 175.9 secs Computing kpt #: 115 total cpu time spent up to now is 177.5 secs Computing kpt #: 116 total cpu time spent up to now is 179.0 secs Computing kpt #: 117 total cpu time spent up to now is 180.6 secs Computing kpt #: 118 total cpu time spent up to now is 182.1 secs Computing kpt #: 119 total cpu time spent up to now is 183.7 secs Computing kpt #: 120 total cpu time spent up to now is 185.3 secs Computing kpt #: 121 total cpu time spent up to now is 187.0 secs Computing kpt #: 122 total cpu time spent up to now is 188.4 secs Computing kpt #: 123 total cpu time spent up to now is 189.8 secs Computing kpt #: 124 total cpu time spent up to now is 191.3 secs Computing kpt #: 125 total cpu time spent up to now is 192.7 secs Computing kpt #: 126 total cpu time spent up to now is 194.1 secs Computing kpt #: 127 total cpu time spent up to now is 195.5 secs Computing kpt #: 128 total cpu time spent up to now is 197.0 secs Computing kpt #: 129 total cpu time spent up to now is 198.4 secs Computing kpt #: 130 total cpu time spent up to now is 199.8 secs Computing kpt #: 131 total cpu time spent up to now is 201.2 secs Computing kpt #: 132 total cpu time spent up to now is 202.7 secs Computing kpt #: 133 total cpu time spent up to now is 203.9 secs Computing kpt #: 134 total cpu time spent up to now is 205.2 secs Computing kpt #: 135 total cpu time spent up to now is 206.4 secs Computing kpt #: 136 total cpu time spent up to now is 207.7 secs Computing kpt #: 137 total cpu time spent up to now is 209.0 secs Computing kpt #: 138 total cpu time spent up to now is 210.3 secs Computing kpt #: 139 total cpu time spent up to now is 211.6 secs Computing kpt #: 140 total cpu time spent up to now is 212.9 secs Computing kpt #: 141 total cpu time spent up to now is 214.2 secs Computing kpt #: 142 total cpu time spent up to now is 215.5 secs Computing kpt #: 143 total cpu time spent up to now is 216.8 secs Computing kpt #: 144 total cpu time spent up to now is 218.1 secs Computing kpt #: 145 total cpu time spent up to now is 219.4 secs Computing kpt #: 146 total cpu time spent up to now is 220.7 secs Computing kpt #: 147 total cpu time spent up to now is 222.1 secs Computing kpt #: 148 total cpu time spent up to now is 223.5 secs Computing kpt #: 149 total cpu time spent up to now is 225.0 secs Computing kpt #: 150 total cpu time spent up to now is 226.2 secs Computing kpt #: 151 total cpu time spent up to now is 227.4 secs Computing kpt #: 152 total cpu time spent up to now is 228.6 secs Computing kpt #: 153 total cpu time spent up to now is 229.8 secs Computing kpt #: 154 total cpu time spent up to now is 231.0 secs Computing kpt #: 155 total cpu time spent up to now is 232.2 secs Computing kpt #: 156 total cpu time spent up to now is 233.5 secs Computing kpt #: 157 total cpu time spent up to now is 234.6 secs Computing kpt #: 158 total cpu time spent up to now is 235.8 secs Computing kpt #: 159 total cpu time spent up to now is 237.0 secs Computing kpt #: 160 total cpu time spent up to now is 238.1 secs Computing kpt #: 161 total cpu time spent up to now is 239.3 secs Computing kpt #: 162 total cpu time spent up to now is 240.5 secs Computing kpt #: 163 total cpu time spent up to now is 241.7 secs Computing kpt #: 164 total cpu time spent up to now is 242.8 secs Computing kpt #: 165 total cpu time spent up to now is 244.0 secs Computing kpt #: 166 total cpu time spent up to now is 245.4 secs Computing kpt #: 167 total cpu time spent up to now is 246.6 secs Computing kpt #: 168 total cpu time spent up to now is 247.8 secs Computing kpt #: 169 total cpu time spent up to now is 249.1 secs Computing kpt #: 170 total cpu time spent up to now is 250.3 secs Computing kpt #: 171 total cpu time spent up to now is 251.6 secs Computing kpt #: 172 total cpu time spent up to now is 253.1 secs Computing kpt #: 173 total cpu time spent up to now is 254.5 secs Computing kpt #: 174 total cpu time spent up to now is 255.7 secs Computing kpt #: 175 total cpu time spent up to now is 257.0 secs Computing kpt #: 176 total cpu time spent up to now is 258.5 secs Computing kpt #: 177 total cpu time spent up to now is 259.7 secs Computing kpt #: 178 total cpu time spent up to now is 261.0 secs Computing kpt #: 179 total cpu time spent up to now is 262.6 secs Computing kpt #: 180 total cpu time spent up to now is 263.8 secs Computing kpt #: 181 total cpu time spent up to now is 265.0 secs Computing kpt #: 182 total cpu time spent up to now is 266.8 secs Computing kpt #: 183 total cpu time spent up to now is 268.4 secs Computing kpt #: 184 total cpu time spent up to now is 270.1 secs Computing kpt #: 185 total cpu time spent up to now is 272.0 secs Computing kpt #: 186 total cpu time spent up to now is 273.9 secs Computing kpt #: 187 total cpu time spent up to now is 275.5 secs Computing kpt #: 188 total cpu time spent up to now is 277.5 secs Computing kpt #: 189 total cpu time spent up to now is 279.4 secs Computing kpt #: 190 total cpu time spent up to now is 281.3 secs Computing kpt #: 191 total cpu time spent up to now is 283.3 secs Computing kpt #: 192 total cpu time spent up to now is 285.2 secs Computing kpt #: 193 total cpu time spent up to now is 287.2 secs Computing kpt #: 194 total cpu time spent up to now is 289.1 secs Computing kpt #: 195 total cpu time spent up to now is 291.0 secs Computing kpt #: 196 total cpu time spent up to now is 292.6 secs Computing kpt #: 197 total cpu time spent up to now is 294.3 secs Computing kpt #: 198 total cpu time spent up to now is 296.2 secs Computing kpt #: 199 total cpu time spent up to now is 297.4 secs Computing kpt #: 200 total cpu time spent up to now is 298.7 secs Computing kpt #: 201 total cpu time spent up to now is 300.6 secs Computing kpt #: 202 total cpu time spent up to now is 302.3 secs Computing kpt #: 203 total cpu time spent up to now is 303.5 secs Computing kpt #: 204 total cpu time spent up to now is 304.8 secs Computing kpt #: 205 total cpu time spent up to now is 306.0 secs Computing kpt #: 206 total cpu time spent up to now is 307.3 secs Computing kpt #: 207 total cpu time spent up to now is 309.2 secs Computing kpt #: 208 total cpu time spent up to now is 311.0 secs Computing kpt #: 209 total cpu time spent up to now is 312.3 secs Computing kpt #: 210 total cpu time spent up to now is 313.5 secs Computing kpt #: 211 total cpu time spent up to now is 315.2 secs Computing kpt #: 212 total cpu time spent up to now is 316.6 secs Computing kpt #: 213 total cpu time spent up to now is 317.9 secs Computing kpt #: 214 total cpu time spent up to now is 319.2 secs Computing kpt #: 215 total cpu time spent up to now is 320.4 secs Computing kpt #: 216 total cpu time spent up to now is 321.6 secs Computing kpt #: 217 total cpu time spent up to now is 322.8 secs Computing kpt #: 218 total cpu time spent up to now is 324.0 secs Computing kpt #: 219 total cpu time spent up to now is 325.2 secs Computing kpt #: 220 total cpu time spent up to now is 326.5 secs Computing kpt #: 221 total cpu time spent up to now is 327.9 secs Computing kpt #: 222 total cpu time spent up to now is 329.2 secs Computing kpt #: 223 total cpu time spent up to now is 330.7 secs Computing kpt #: 224 total cpu time spent up to now is 332.2 secs Computing kpt #: 225 total cpu time spent up to now is 333.8 secs Computing kpt #: 226 total cpu time spent up to now is 335.0 secs Computing kpt #: 227 total cpu time spent up to now is 336.5 secs Computing kpt #: 228 total cpu time spent up to now is 338.1 secs Computing kpt #: 229 total cpu time spent up to now is 339.8 secs Computing kpt #: 230 total cpu time spent up to now is 341.5 secs Computing kpt #: 231 total cpu time spent up to now is 343.1 secs Computing kpt #: 232 total cpu time spent up to now is 344.6 secs Computing kpt #: 233 total cpu time spent up to now is 346.2 secs Computing kpt #: 234 total cpu time spent up to now is 347.8 secs Computing kpt #: 235 total cpu time spent up to now is 349.3 secs Computing kpt #: 236 total cpu time spent up to now is 350.6 secs Computing kpt #: 237 total cpu time spent up to now is 351.8 secs Computing kpt #: 238 total cpu time spent up to now is 353.0 secs Computing kpt #: 239 total cpu time spent up to now is 354.3 secs Computing kpt #: 240 total cpu time spent up to now is 355.5 secs Computing kpt #: 241 total cpu time spent up to now is 356.8 secs Computing kpt #: 242 total cpu time spent up to now is 358.0 secs Computing kpt #: 243 total cpu time spent up to now is 359.2 secs Computing kpt #: 244 total cpu time spent up to now is 360.4 secs Computing kpt #: 245 total cpu time spent up to now is 361.5 secs Computing kpt #: 246 total cpu time spent up to now is 362.7 secs Computing kpt #: 247 total cpu time spent up to now is 363.9 secs Computing kpt #: 248 total cpu time spent up to now is 365.0 secs Computing kpt #: 249 total cpu time spent up to now is 366.2 secs Computing kpt #: 250 total cpu time spent up to now is 367.3 secs Computing kpt #: 251 total cpu time spent up to now is 368.5 secs Computing kpt #: 252 total cpu time spent up to now is 369.7 secs Computing kpt #: 253 total cpu time spent up to now is 370.8 secs Computing kpt #: 254 total cpu time spent up to now is 372.0 secs Computing kpt #: 255 total cpu time spent up to now is 373.1 secs Computing kpt #: 256 total cpu time spent up to now is 374.3 secs Computing kpt #: 257 total cpu time spent up to now is 375.4 secs Computing kpt #: 258 total cpu time spent up to now is 376.6 secs Computing kpt #: 259 total cpu time spent up to now is 377.8 secs Computing kpt #: 260 total cpu time spent up to now is 379.0 secs Computing kpt #: 261 total cpu time spent up to now is 380.3 secs Computing kpt #: 262 total cpu time spent up to now is 381.7 secs Computing kpt #: 263 total cpu time spent up to now is 382.9 secs Computing kpt #: 264 total cpu time spent up to now is 384.2 secs Computing kpt #: 265 total cpu time spent up to now is 385.5 secs Computing kpt #: 266 total cpu time spent up to now is 386.7 secs Computing kpt #: 267 total cpu time spent up to now is 388.0 secs Computing kpt #: 268 total cpu time spent up to now is 389.3 secs Computing kpt #: 269 total cpu time spent up to now is 390.5 secs Computing kpt #: 270 total cpu time spent up to now is 391.7 secs Computing kpt #: 271 total cpu time spent up to now is 392.9 secs Computing kpt #: 272 total cpu time spent up to now is 394.1 secs Computing kpt #: 273 total cpu time spent up to now is 395.3 secs Computing kpt #: 274 total cpu time spent up to now is 396.5 secs Computing kpt #: 275 total cpu time spent up to now is 397.6 secs Computing kpt #: 276 total cpu time spent up to now is 398.8 secs Computing kpt #: 277 total cpu time spent up to now is 399.9 secs Computing kpt #: 278 total cpu time spent up to now is 401.1 secs Computing kpt #: 279 total cpu time spent up to now is 402.3 secs Computing kpt #: 280 total cpu time spent up to now is 403.5 secs Computing kpt #: 281 total cpu time spent up to now is 404.7 secs Computing kpt #: 282 total cpu time spent up to now is 405.9 secs Computing kpt #: 283 total cpu time spent up to now is 407.1 secs Computing kpt #: 284 total cpu time spent up to now is 408.3 secs Computing kpt #: 285 total cpu time spent up to now is 409.6 secs Computing kpt #: 286 total cpu time spent up to now is 410.8 secs Computing kpt #: 287 total cpu time spent up to now is 412.0 secs Computing kpt #: 288 total cpu time spent up to now is 413.2 secs Computing kpt #: 289 total cpu time spent up to now is 414.4 secs Computing kpt #: 290 total cpu time spent up to now is 415.6 secs Computing kpt #: 291 total cpu time spent up to now is 416.8 secs Computing kpt #: 292 total cpu time spent up to now is 418.0 secs Computing kpt #: 293 total cpu time spent up to now is 419.2 secs Computing kpt #: 294 total cpu time spent up to now is 420.4 secs Computing kpt #: 295 total cpu time spent up to now is 421.6 secs Computing kpt #: 296 total cpu time spent up to now is 422.8 secs Computing kpt #: 297 total cpu time spent up to now is 424.0 secs Computing kpt #: 298 total cpu time spent up to now is 425.1 secs Computing kpt #: 299 total cpu time spent up to now is 426.3 secs Computing kpt #: 300 total cpu time spent up to now is 427.5 secs Computing kpt #: 301 total cpu time spent up to now is 428.7 secs Computing kpt #: 302 total cpu time spent up to now is 429.9 secs Computing kpt #: 303 total cpu time spent up to now is 431.1 secs Computing kpt #: 304 total cpu time spent up to now is 432.3 secs Computing kpt #: 305 total cpu time spent up to now is 433.5 secs Computing kpt #: 306 total cpu time spent up to now is 434.7 secs Computing kpt #: 307 total cpu time spent up to now is 435.9 secs Computing kpt #: 308 total cpu time spent up to now is 437.1 secs Computing kpt #: 309 total cpu time spent up to now is 438.2 secs ethr = 1.72E-08, avg # of iterations = 22.8 total cpu time spent up to now is 438.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 13115 PWs) bands (ev): -69.5358 -69.5358 -69.5290 -69.5290 -39.3900 -39.3900 -39.3705 -39.3705 -38.2431 -38.2431 -38.2085 -38.2085 -38.1422 -38.1422 -38.1390 -38.1390 -18.7332 -18.7332 -18.6324 -18.6324 -5.7002 -5.7002 -5.5082 -5.5082 -3.9215 -3.9215 -3.7589 -3.7589 -3.6032 -3.6032 -3.5693 -3.5693 0.2845 0.2845 0.9369 0.9369 6.1023 6.1023 6.3483 6.3483 7.0275 7.0275 7.0652 7.0652 7.5063 7.5063 7.8432 7.8432 7.8970 7.8970 7.9644 7.9644 8.1484 8.1484 8.2410 8.2410 9.1019 9.1019 9.2255 9.2255 9.3399 9.3399 9.4089 9.4089 9.4660 9.4660 9.5187 9.5187 9.9055 9.9055 k = 0.0000 0.0143-0.0000 ( 13103 PWs) bands (ev): -69.5356 -69.5356 -69.5285 -69.5285 -39.3900 -39.3900 -39.3705 -39.3705 -38.2431 -38.2431 -38.2085 -38.2085 -38.1422 -38.1422 -38.1390 -38.1390 -18.7331 -18.7331 -18.6324 -18.6324 -5.7002 -5.7002 -5.5085 -5.5085 -3.9215 -3.9215 -3.7596 -3.7596 -3.6030 -3.6030 -3.5698 -3.5698 0.2862 0.2862 0.9375 0.9375 6.1044 6.1044 6.3496 6.3496 7.0283 7.0283 7.0644 7.0644 7.5053 7.5053 7.8439 7.8439 7.8975 7.8975 7.9627 7.9627 8.1501 8.1501 8.2420 8.2420 9.0999 9.0999 9.2063 9.2063 9.3222 9.3222 9.4257 9.4257 9.4535 9.4535 9.5289 9.5289 9.9018 9.9018 k = 0.0000 0.0286-0.0000 ( 13093 PWs) bands (ev): -69.5353 -69.5353 -69.5280 -69.5280 -39.3899 -39.3899 -39.3705 -39.3705 -38.2430 -38.2430 -38.2085 -38.2085 -38.1422 -38.1422 -38.1390 -38.1390 -18.7328 -18.7328 -18.6324 -18.6324 -5.7004 -5.7004 -5.5093 -5.5093 -3.9214 -3.9214 -3.7617 -3.7617 -3.6022 -3.6022 -3.5712 -3.5712 0.2911 0.2911 0.9394 0.9394 6.1064 6.1064 6.3530 6.3530 7.0270 7.0270 7.0597 7.0597 7.5031 7.5031 7.8460 7.8460 7.8996 7.8996 7.9551 7.9551 8.1550 8.1550 8.2457 8.2457 9.0860 9.0860 9.1568 9.1568 9.2750 9.2750 9.4304 9.4304 9.4527 9.4527 9.5589 9.5589 9.8897 9.8897 k = 0.0000 0.0429-0.0000 ( 13083 PWs) bands (ev): -69.5348 -69.5348 -69.5277 -69.5277 -39.3899 -39.3899 -39.3705 -39.3705 -38.2429 -38.2429 -38.2086 -38.2086 -38.1422 -38.1422 -38.1390 -38.1390 -18.7323 -18.7323 -18.6324 -18.6324 -5.7005 -5.7005 -5.5107 -5.5107 -3.9211 -3.9211 -3.7651 -3.7651 -3.6013 -3.6013 -3.5733 -3.5733 0.2994 0.2994 0.9424 0.9424 6.1077 6.1077 6.3585 6.3585 7.0251 7.0251 7.0525 7.0525 7.4997 7.4997 7.8469 7.8469 7.9032 7.9032 7.9476 7.9476 8.1605 8.1605 8.2508 8.2508 9.0551 9.0551 9.1003 9.1003 9.1998 9.1998 9.4151 9.4151 9.4750 9.4750 9.6011 9.6011 9.8704 9.8704 k = 0.0000 0.0571-0.0000 ( 13071 PWs) bands (ev): -69.5345 -69.5345 -69.5271 -69.5271 -39.3898 -39.3898 -39.3706 -39.3706 -38.2428 -38.2428 -38.2087 -38.2087 -38.1422 -38.1422 -38.1390 -38.1390 -18.7316 -18.7316 -18.6324 -18.6324 -5.7008 -5.7008 -5.5125 -5.5125 -3.9209 -3.9209 -3.7696 -3.7696 -3.6006 -3.6006 -3.5758 -3.5758 0.3109 0.3109 0.9467 0.9467 6.1091 6.1091 6.3662 6.3662 7.0187 7.0187 7.0464 7.0464 7.4935 7.4935 7.8434 7.8434 7.8994 7.8994 7.9503 7.9503 8.1661 8.1661 8.2580 8.2580 9.0029 9.0029 9.0531 9.0531 9.1075 9.1075 9.4076 9.4076 9.4940 9.4940 9.6413 9.6413 9.8524 9.8524 k = 0.0000 0.0714-0.0000 ( 13059 PWs) bands (ev): -69.5344 -69.5344 -69.5264 -69.5264 -39.3897 -39.3897 -39.3707 -39.3707 -38.2426 -38.2426 -38.2089 -38.2089 -38.1421 -38.1421 -38.1390 -38.1390 -18.7307 -18.7307 -18.6323 -18.6323 -5.7011 -5.7011 -5.5149 -5.5149 -3.9207 -3.9207 -3.7751 -3.7751 -3.6009 -3.6009 -3.5777 -3.5777 0.3254 0.3254 0.9521 0.9521 6.1099 6.1099 6.3758 6.3758 7.0088 7.0088 7.0420 7.0420 7.4846 7.4846 7.8355 7.8355 7.8823 7.8823 7.9690 7.9690 8.1711 8.1711 8.2636 8.2636 8.9377 8.9377 9.0032 9.0032 9.0208 9.0208 9.4044 9.4044 9.5109 9.5109 9.6645 9.6645 9.8445 9.8445 k = 0.0000 0.0857-0.0000 ( 13069 PWs) bands (ev): -69.5349 -69.5349 -69.5266 -69.5266 -39.3896 -39.3896 -39.3708 -39.3708 -38.2425 -38.2425 -38.2091 -38.2091 -38.1421 -38.1421 -38.1390 -38.1390 -18.7296 -18.7296 -18.6323 -18.6323 -5.7015 -5.7015 -5.5179 -5.5179 -3.9206 -3.9206 -3.7814 -3.7814 -3.6031 -3.6031 -3.5783 -3.5783 0.3429 0.3429 0.9586 0.9586 6.1105 6.1105 6.3870 6.3870 6.9920 6.9920 7.0395 7.0395 7.4726 7.4726 7.8238 7.8238 7.8550 7.8550 7.9941 7.9941 8.1725 8.1725 8.2660 8.2660 8.8668 8.8668 8.9054 8.9054 8.9787 8.9787 9.4029 9.4029 9.5252 9.5252 9.6586 9.6586 9.8554 9.8554 k = 0.0000 0.1000-0.0000 ( 13069 PWs) bands (ev): -69.5354 -69.5354 -69.5263 -69.5263 -39.3895 -39.3895 -39.3710 -39.3710 -38.2422 -38.2422 -38.2094 -38.2094 -38.1421 -38.1421 -38.1391 -38.1391 -18.7283 -18.7283 -18.6324 -18.6324 -5.7020 -5.7020 -5.5213 -5.5213 -3.9207 -3.9207 -3.7883 -3.7883 -3.6075 -3.6075 -3.5772 -3.5772 0.3633 0.3633 0.9662 0.9662 6.1101 6.1101 6.4000 6.4000 6.9721 6.9721 7.0380 7.0380 7.4602 7.4602 7.8082 7.8082 7.8289 7.8289 8.0221 8.0221 8.1758 8.1758 8.2690 8.2690 8.7959 8.7959 8.8109 8.8109 8.9352 8.9352 9.4027 9.4027 9.5345 9.5345 9.6326 9.6326 9.8823 9.8823 k = 0.0000 0.1143-0.0000 ( 13070 PWs) bands (ev): -69.5354 -69.5354 -69.5263 -69.5263 -39.3893 -39.3893 -39.3711 -39.3711 -38.2420 -38.2420 -38.2097 -38.2097 -38.1421 -38.1421 -38.1391 -38.1391 -18.7268 -18.7268 -18.6324 -18.6324 -5.7026 -5.7026 -5.5252 -5.5252 -3.9211 -3.9211 -3.7956 -3.7956 -3.6135 -3.6135 -3.5751 -3.5751 0.3862 0.3862 0.9748 0.9748 6.1114 6.1114 6.4143 6.4143 6.9516 6.9516 7.0354 7.0354 7.4445 7.4445 7.7900 7.7900 7.7989 7.7989 8.0534 8.0534 8.1758 8.1758 8.2663 8.2663 8.7247 8.7247 8.7295 8.7295 8.8888 8.8888 9.4029 9.4029 9.5341 9.5341 9.6005 9.6005 9.9168 9.9168 k = 0.0000 0.1286-0.0000 ( 13062 PWs) bands (ev): -69.5351 -69.5351 -69.5261 -69.5261 -39.3892 -39.3892 -39.3713 -39.3713 -38.2417 -38.2417 -38.2100 -38.2100 -38.1420 -38.1420 -38.1391 -38.1391 -18.7252 -18.7252 -18.6324 -18.6324 -5.7032 -5.7032 -5.5296 -5.5296 -3.9219 -3.9219 -3.8032 -3.8032 -3.6204 -3.6204 -3.5722 -3.5722 0.4116 0.4116 0.9842 0.9842 6.1154 6.1154 6.4298 6.4298 6.9299 6.9299 7.0334 7.0334 7.4296 7.4296 7.7640 7.7640 7.7717 7.7717 8.0816 8.0816 8.1753 8.1753 8.2573 8.2573 8.6536 8.6536 8.6662 8.6662 8.8392 8.8392 9.4036 9.4036 9.5106 9.5106 9.5856 9.5856 9.9511 9.9511 k = 0.0000 0.1429-0.0000 ( 13074 PWs) bands (ev): -69.5354 -69.5354 -69.5268 -69.5268 -39.3890 -39.3890 -39.3715 -39.3715 -38.2415 -38.2415 -38.2103 -38.2103 -38.1420 -38.1420 -38.1392 -38.1392 -18.7234 -18.7234 -18.6325 -18.6325 -5.7039 -5.7039 -5.5344 -5.5344 -3.9231 -3.9231 -3.8109 -3.8109 -3.6278 -3.6278 -3.5691 -3.5691 0.4393 0.4393 0.9945 0.9945 6.1169 6.1169 6.4459 6.4459 6.9068 6.9068 7.0285 7.0285 7.4128 7.4128 7.7282 7.7282 7.7469 7.7469 8.1030 8.1030 8.1727 8.1727 8.2399 8.2399 8.5971 8.5971 8.6073 8.6073 8.7877 8.7877 9.4036 9.4036 9.4689 9.4689 9.5835 9.5835 9.9822 9.9822 k = 0.0000 0.1571-0.0000 ( 13066 PWs) bands (ev): -69.5342 -69.5342 -69.5274 -69.5274 -39.3889 -39.3889 -39.3717 -39.3717 -38.2412 -38.2412 -38.2107 -38.2107 -38.1420 -38.1420 -38.1392 -38.1392 -18.7214 -18.7214 -18.6325 -18.6325 -5.7047 -5.7047 -5.5397 -5.5397 -3.9250 -3.9250 -3.8186 -3.8186 -3.6354 -3.6354 -3.5659 -3.5659 0.4689 0.4689 1.0055 1.0055 6.1228 6.1228 6.4625 6.4625 6.8836 6.8836 7.0218 7.0218 7.3953 7.3953 7.6881 7.6881 7.7241 7.7241 8.1151 8.1151 8.1718 8.1718 8.2204 8.2204 8.5476 8.5476 8.5642 8.5642 8.7369 8.7369 9.4019 9.4019 9.4283 9.4283 9.5877 9.5877 10.0108 10.0108 k = 0.0000 0.1714-0.0000 ( 13054 PWs) bands (ev): -69.5336 -69.5336 -69.5272 -69.5272 -39.3886 -39.3886 -39.3719 -39.3719 -38.2408 -38.2408 -38.2111 -38.2111 -38.1420 -38.1420 -38.1392 -38.1392 -18.7193 -18.7193 -18.6326 -18.6326 -5.7055 -5.7055 -5.5454 -5.5454 -3.9275 -3.9275 -3.8263 -3.8263 -3.6426 -3.6426 -3.5627 -3.5627 0.5003 0.5003 1.0172 1.0172 6.1286 6.1286 6.4790 6.4790 6.8609 6.8609 7.0137 7.0137 7.3770 7.3770 7.6453 7.6453 7.6951 7.6951 8.1096 8.1096 8.1688 8.1688 8.2080 8.2080 8.5008 8.5008 8.5434 8.5434 8.6893 8.6893 9.3780 9.3780 9.4125 9.4125 9.5892 9.5892 10.0372 10.0372 k = 0.0000 0.1857-0.0000 ( 13042 PWs) bands (ev): -69.5331 -69.5331 -69.5268 -69.5268 -39.3884 -39.3884 -39.3721 -39.3721 -38.2404 -38.2404 -38.2115 -38.2115 -38.1419 -38.1419 -38.1392 -38.1392 -18.7170 -18.7170 -18.6328 -18.6328 -5.7064 -5.7064 -5.5515 -5.5515 -3.9308 -3.9308 -3.8339 -3.8339 -3.6494 -3.6494 -3.5597 -3.5597 0.5333 0.5333 1.0294 1.0294 6.1336 6.1336 6.4948 6.4948 6.8378 6.8378 7.0044 7.0044 7.3556 7.3556 7.6002 7.6002 7.6629 7.6629 8.0887 8.0887 8.1632 8.1632 8.2041 8.2041 8.4615 8.4615 8.5347 8.5347 8.6427 8.6427 9.3442 9.3442 9.4129 9.4129 9.5892 9.5892 10.0619 10.0619 k = 0.0000 0.2000-0.0000 ( 13042 PWs) bands (ev): -69.5337 -69.5337 -69.5263 -69.5263 -39.3882 -39.3882 -39.3724 -39.3724 -38.2400 -38.2400 -38.2120 -38.2120 -38.1419 -38.1419 -38.1393 -38.1393 -18.7146 -18.7146 -18.6330 -18.6330 -5.7073 -5.7073 -5.5579 -5.5579 -3.9349 -3.9349 -3.8415 -3.8415 -3.6554 -3.6554 -3.5568 -3.5568 0.5675 0.5675 1.0420 1.0420 6.1390 6.1390 6.5094 6.5094 6.8138 6.8138 6.9928 6.9928 7.3291 7.3291 7.5542 7.5542 7.6278 7.6278 8.0608 8.0608 8.1555 8.1555 8.1984 8.1984 8.4294 8.4294 8.5315 8.5315 8.5969 8.5969 9.3135 9.3135 9.4148 9.4148 9.5877 9.5877 10.0840 10.0840 k = 0.0000 0.2143-0.0000 ( 13046 PWs) bands (ev): -69.5333 -69.5333 -69.5270 -69.5270 -39.3879 -39.3879 -39.3727 -39.3727 -38.2396 -38.2396 -38.2125 -38.2125 -38.1418 -38.1418 -38.1393 -38.1393 -18.7121 -18.7121 -18.6332 -18.6332 -5.7083 -5.7083 -5.5646 -5.5646 -3.9396 -3.9396 -3.8492 -3.8492 -3.6604 -3.6604 -3.5542 -3.5542 0.6027 0.6027 1.0550 1.0550 6.1465 6.1465 6.5222 6.5222 6.7882 6.7882 6.9799 6.9799 7.2956 7.2956 7.5123 7.5123 7.5906 7.5906 8.0346 8.0346 8.1438 8.1438 8.1880 8.1880 8.4064 8.4064 8.5319 8.5319 8.5483 8.5483 9.2914 9.2914 9.4173 9.4173 9.5858 9.5858 10.1056 10.1056 k = 0.0000 0.2286-0.0000 ( 13036 PWs) bands (ev): -69.5324 -69.5324 -69.5272 -69.5272 -39.3877 -39.3877 -39.3730 -39.3730 -38.2391 -38.2391 -38.2130 -38.2130 -38.1418 -38.1418 -38.1393 -38.1393 -18.7095 -18.7095 -18.6335 -18.6335 -5.7092 -5.7092 -5.5716 -5.5716 -3.9448 -3.9448 -3.8570 -3.8570 -3.6642 -3.6642 -3.5519 -3.5519 0.6387 0.6387 1.0681 1.0681 6.1547 6.1547 6.5328 6.5328 6.7621 6.7621 6.9664 6.9664 7.2546 7.2546 7.4807 7.4807 7.5521 7.5521 8.0139 8.0139 8.1238 8.1238 8.1765 8.1765 8.3905 8.3905 8.5060 8.5060 8.5373 8.5373 9.2772 9.2772 9.4198 9.4198 9.5832 9.5832 10.1275 10.1275 k = 0.0000 0.2429-0.0000 ( 13050 PWs) bands (ev): -69.5331 -69.5331 -69.5276 -69.5276 -39.3874 -39.3874 -39.3733 -39.3733 -38.2386 -38.2386 -38.2136 -38.2136 -38.1418 -38.1418 -38.1394 -38.1394 -18.7068 -18.7068 -18.6339 -18.6339 -5.7102 -5.7102 -5.5788 -5.5788 -3.9505 -3.9505 -3.8651 -3.8651 -3.6668 -3.6668 -3.5498 -3.5498 0.6753 0.6753 1.0813 1.0813 6.1615 6.1615 6.5402 6.5402 6.7342 6.7342 6.9514 6.9514 7.2049 7.2049 7.4534 7.4534 7.5120 7.5120 7.9953 7.9953 8.0943 8.0943 8.1677 8.1677 8.3790 8.3790 8.4627 8.4627 8.5410 8.5410 9.2665 9.2665 9.4222 9.4222 9.5789 9.5789 10.1499 10.1499 k = 0.0000 0.2571-0.0000 ( 13046 PWs) bands (ev): -69.5330 -69.5330 -69.5273 -69.5273 -39.3871 -39.3871 -39.3736 -39.3736 -38.2381 -38.2381 -38.2142 -38.2142 -38.1417 -38.1417 -38.1395 -38.1395 -18.7041 -18.7041 -18.6343 -18.6343 -5.7111 -5.7111 -5.5862 -5.5862 -3.9564 -3.9564 -3.8735 -3.8735 -3.6681 -3.6681 -3.5481 -3.5481 0.7120 0.7120 1.0944 1.0944 6.1717 6.1717 6.5441 6.5441 6.7054 6.7054 6.9372 6.9372 7.1519 7.1519 7.4274 7.4274 7.4783 7.4783 7.9814 7.9814 8.0593 8.0593 8.1610 8.1610 8.3719 8.3719 8.4266 8.4266 8.5475 8.5475 9.2601 9.2601 9.4250 9.4250 9.5745 9.5745 10.1746 10.1746 k = 0.0000 0.2714-0.0000 ( 13058 PWs) bands (ev): -69.5333 -69.5333 -69.5280 -69.5280 -39.3868 -39.3868 -39.3739 -39.3739 -38.2376 -38.2376 -38.2148 -38.2148 -38.1417 -38.1417 -38.1395 -38.1395 -18.7012 -18.7012 -18.6348 -18.6348 -5.7120 -5.7120 -5.5938 -5.5938 -3.9625 -3.9625 -3.8821 -3.8821 -3.6681 -3.6681 -3.5468 -3.5468 0.7488 0.7488 1.1073 1.1073 6.1843 6.1843 6.5440 6.5440 6.6743 6.6743 6.9219 6.9219 7.0969 7.0969 7.3911 7.3911 7.4582 7.4582 7.9675 7.9675 8.0229 8.0229 8.1533 8.1533 8.3641 8.3641 8.3931 8.3931 8.5530 8.5530 9.2537 9.2537 9.4274 9.4274 9.5690 9.5690 10.2005 10.2005 k = 0.0000 0.2857-0.0000 ( 13068 PWs) bands (ev): -69.5335 -69.5335 -69.5286 -69.5286 -39.3865 -39.3865 -39.3743 -39.3743 -38.2370 -38.2370 -38.2155 -38.2155 -38.1416 -38.1416 -38.1396 -38.1396 -18.6983 -18.6983 -18.6354 -18.6354 -5.7128 -5.7128 -5.6014 -5.6014 -3.9685 -3.9685 -3.8910 -3.8910 -3.6669 -3.6669 -3.5459 -3.5459 0.7854 0.7854 1.1199 1.1199 6.1970 6.1970 6.5392 6.5392 6.6414 6.6414 6.9075 6.9075 7.0441 7.0441 7.3459 7.3459 7.4489 7.4489 7.9415 7.9415 7.9987 7.9987 8.1502 8.1502 8.3511 8.3511 8.3708 8.3708 8.5589 8.5589 9.2489 9.2489 9.4310 9.4310 9.5639 9.5639 10.2293 10.2293 k = 0.0000 0.3000-0.0000 ( 13066 PWs) bands (ev): -69.5334 -69.5334 -69.5285 -69.5285 -39.3861 -39.3861 -39.3747 -39.3747 -38.2365 -38.2365 -38.2161 -38.2161 -38.1416 -38.1416 -38.1397 -38.1397 -18.6954 -18.6954 -18.6360 -18.6360 -5.7136 -5.7136 -5.6091 -5.6091 -3.9743 -3.9743 -3.9001 -3.9001 -3.6646 -3.6646 -3.5454 -3.5454 0.8215 0.8215 1.1320 1.1320 6.2113 6.2113 6.5296 6.5296 6.6079 6.6079 6.8946 6.8946 6.9957 6.9957 7.2968 7.2968 7.4467 7.4467 7.9009 7.9009 7.9952 7.9952 8.1472 8.1472 8.3264 8.3264 8.3688 8.3688 8.5663 8.5663 9.2425 9.2425 9.4347 9.4347 9.5585 9.5585 10.2620 10.2620 k = 0.0000 0.3143-0.0000 ( 13064 PWs) bands (ev): -69.5330 -69.5330 -69.5288 -69.5288 -39.3858 -39.3858 -39.3750 -39.3750 -38.2359 -38.2359 -38.2168 -38.2168 -38.1415 -38.1415 -38.1397 -38.1397 -18.6925 -18.6925 -18.6368 -18.6368 -5.7142 -5.7142 -5.6168 -5.6168 -3.9798 -3.9798 -3.9093 -3.9093 -3.6613 -3.6613 -3.5453 -3.5453 0.8569 0.8569 1.1435 1.1435 6.2265 6.2265 6.5152 6.5152 6.5737 6.5737 6.8832 6.8832 6.9523 6.9523 7.2465 7.2465 7.4478 7.4478 7.8552 7.8552 8.0023 8.0023 8.1431 8.1431 8.3016 8.3016 8.3718 8.3718 8.5726 8.5726 9.2336 9.2336 9.4378 9.4378 9.5547 9.5547 10.2980 10.2980 k = 0.0000 0.3286-0.0000 ( 13064 PWs) bands (ev): -69.5329 -69.5329 -69.5289 -69.5289 -39.3854 -39.3854 -39.3754 -39.3754 -38.2352 -38.2352 -38.2175 -38.2175 -38.1415 -38.1415 -38.1398 -38.1398 -18.6895 -18.6895 -18.6377 -18.6377 -5.7146 -5.7146 -5.6245 -5.6245 -3.9850 -3.9850 -3.9184 -3.9184 -3.6572 -3.6572 -3.5456 -3.5456 0.8914 0.8914 1.1542 1.1542 6.2439 6.2439 6.4962 6.4962 6.5390 6.5390 6.8722 6.8722 6.9164 6.9164 7.1939 7.1939 7.4493 7.4493 7.8074 7.8074 8.0166 8.0166 8.1399 8.1399 8.2780 8.2780 8.3775 8.3775 8.5801 8.5801 9.2197 9.2197 9.4411 9.4411 9.5490 9.5490 10.3375 10.3375 k = 0.0000 0.3429-0.0000 ( 13068 PWs) bands (ev): -69.5331 -69.5331 -69.5290 -69.5290 -39.3851 -39.3851 -39.3758 -39.3758 -38.2346 -38.2346 -38.2182 -38.2182 -38.1414 -38.1414 -38.1399 -38.1399 -18.6865 -18.6865 -18.6386 -18.6386 -5.7149 -5.7149 -5.6320 -5.6320 -3.9897 -3.9897 -3.9275 -3.9275 -3.6524 -3.6524 -3.5464 -3.5464 0.9247 0.9247 1.1640 1.1640 6.2636 6.2636 6.4734 6.4734 6.5047 6.5047 6.8604 6.8604 6.8872 6.8872 7.1407 7.1407 7.4495 7.4495 7.7613 7.7613 8.0360 8.0360 8.1378 8.1378 8.2570 8.2570 8.3844 8.3844 8.5861 8.5861 9.1996 9.1996 9.4448 9.4448 9.5431 9.5431 10.3803 10.3803 k = 0.0000 0.3571-0.0000 ( 13080 PWs) bands (ev): -69.5336 -69.5336 -69.5294 -69.5294 -39.3847 -39.3847 -39.3762 -39.3762 -38.2339 -38.2339 -38.2189 -38.2189 -38.1414 -38.1414 -38.1400 -38.1400 -18.6835 -18.6835 -18.6397 -18.6397 -5.7149 -5.7149 -5.6394 -5.6394 -3.9938 -3.9938 -3.9363 -3.9363 -3.6470 -3.6470 -3.5477 -3.5477 0.9567 0.9567 1.1728 1.1728 6.2835 6.2835 6.4477 6.4477 6.4713 6.4713 6.8465 6.8465 6.8667 6.8667 7.0870 7.0870 7.4490 7.4490 7.7171 7.7171 8.0591 8.0591 8.1360 8.1360 8.2376 8.2376 8.3923 8.3923 8.5913 8.5913 9.1741 9.1741 9.4477 9.4477 9.5370 9.5370 10.4259 10.4259 k = 0.0000 0.3714-0.0000 ( 13078 PWs) bands (ev): -69.5333 -69.5333 -69.5295 -69.5295 -39.3843 -39.3843 -39.3766 -39.3766 -38.2333 -38.2333 -38.2197 -38.2197 -38.1413 -38.1413 -38.1400 -38.1400 -18.6806 -18.6806 -18.6409 -18.6409 -5.7147 -5.7147 -5.6467 -5.6467 -3.9974 -3.9974 -3.9448 -3.9448 -3.6412 -3.6412 -3.5494 -3.5494 0.9871 0.9871 1.1803 1.1803 6.3061 6.3061 6.4206 6.4206 6.4394 6.4394 6.8313 6.8313 6.8555 6.8555 7.0339 7.0339 7.4487 7.4487 7.6769 7.6769 8.0834 8.0834 8.1393 8.1393 8.2215 8.2215 8.4020 8.4020 8.5971 8.5971 9.1461 9.1461 9.4517 9.4517 9.5315 9.5315 10.4746 10.4746 k = 0.0000 0.3857-0.0000 ( 13068 PWs) bands (ev): -69.5328 -69.5328 -69.5293 -69.5293 -39.3839 -39.3839 -39.3771 -39.3771 -38.2325 -38.2325 -38.2204 -38.2204 -38.1412 -38.1412 -38.1401 -38.1401 -18.6777 -18.6777 -18.6422 -18.6422 -5.7142 -5.7142 -5.6536 -5.6536 -4.0003 -4.0003 -3.9530 -3.9530 -3.6351 -3.6351 -3.5515 -3.5515 1.0159 1.0159 1.1865 1.1865 6.3312 6.3312 6.3937 6.3937 6.4093 6.4093 6.8188 6.8188 6.8470 6.8470 6.9816 6.9816 7.4510 7.4510 7.6385 7.6385 8.1023 8.1023 8.1503 8.1503 8.2113 8.2113 8.4118 8.4118 8.6056 8.6056 9.1119 9.1119 9.4557 9.4557 9.5259 9.5259 10.5255 10.5255 k = 0.0000 0.4000-0.0000 ( 13072 PWs) bands (ev): -69.5324 -69.5324 -69.5300 -69.5300 -39.3835 -39.3835 -39.3775 -39.3775 -38.2319 -38.2319 -38.2211 -38.2211 -38.1412 -38.1412 -38.1402 -38.1402 -18.6748 -18.6748 -18.6436 -18.6436 -5.7134 -5.7134 -5.6603 -5.6603 -4.0026 -4.0026 -3.9607 -3.9607 -3.6288 -3.6288 -3.5542 -3.5542 1.0429 1.0429 1.1912 1.1912 6.3536 6.3536 6.3713 6.3713 6.3814 6.3814 6.8091 6.8091 6.8387 6.8387 6.9295 6.9295 7.4515 7.4515 7.6014 7.6014 8.1101 8.1101 8.1620 8.1620 8.2138 8.2138 8.4204 8.4204 8.6142 8.6142 9.0730 9.0730 9.4595 9.4595 9.5211 9.5211 10.5779 10.5779 k = 0.0000 0.4143-0.0000 ( 13074 PWs) bands (ev): -69.5323 -69.5323 -69.5303 -69.5303 -39.3831 -39.3831 -39.3779 -39.3779 -38.2311 -38.2311 -38.2219 -38.2219 -38.1411 -38.1411 -38.1402 -38.1402 -18.6720 -18.6720 -18.6451 -18.6451 -5.7123 -5.7123 -5.6668 -5.6668 -4.0042 -4.0042 -3.9679 -3.9679 -3.6223 -3.6223 -3.5573 -3.5573 1.0678 1.0678 1.1942 1.1942 6.3409 6.3409 6.3556 6.3556 6.3884 6.3884 6.8008 6.8008 6.8310 6.8310 6.8805 6.8805 7.4502 7.4502 7.5718 7.5718 8.1118 8.1118 8.1609 8.1609 8.2397 8.2397 8.4284 8.4284 8.6207 8.6207 9.0312 9.0312 9.4628 9.4628 9.5162 9.5162 10.6327 10.6327 k = 0.0000 0.4286-0.0000 ( 13080 PWs) bands (ev): -69.5322 -69.5322 -69.5308 -69.5308 -39.3827 -39.3827 -39.3783 -39.3783 -38.2304 -38.2304 -38.2227 -38.2227 -38.1410 -38.1410 -38.1403 -38.1403 -18.6692 -18.6692 -18.6467 -18.6467 -5.7108 -5.7108 -5.6728 -5.6728 -4.0050 -4.0050 -3.9746 -3.9746 -3.6157 -3.6157 -3.5608 -3.5608 1.0907 1.0907 1.1955 1.1955 6.3207 6.3207 6.3332 6.3332 6.4187 6.4187 6.7942 6.7942 6.8156 6.8156 6.8404 6.8404 7.4481 7.4481 7.5435 7.5435 8.1134 8.1134 8.1532 8.1532 8.2761 8.2761 8.4344 8.4344 8.6302 8.6302 8.9855 8.9855 9.4669 9.4669 9.5108 9.5108 10.6887 10.6887 k = 0.0000 0.4429-0.0000 ( 13070 PWs) bands (ev): -69.5318 -69.5318 -69.5305 -69.5305 -39.3823 -39.3823 -39.3788 -39.3788 -38.2297 -38.2297 -38.2235 -38.2235 -38.1410 -38.1410 -38.1404 -38.1404 -18.6665 -18.6665 -18.6485 -18.6485 -5.7089 -5.7089 -5.6785 -5.6785 -4.0052 -4.0052 -3.9806 -3.9806 -3.6092 -3.6092 -3.5648 -3.5648 1.1113 1.1113 1.1948 1.1948 6.3035 6.3035 6.3141 6.3141 6.4513 6.4513 6.7716 6.7716 6.7973 6.7973 6.8253 6.8253 7.4482 7.4482 7.5223 7.5223 8.1150 8.1150 8.1466 8.1466 8.3152 8.3152 8.4399 8.4399 8.6447 8.6447 8.9376 8.9376 9.4711 9.4711 9.5069 9.5069 10.7470 10.7470 k = 0.0000 0.4571-0.0000 ( 13062 PWs) bands (ev): -69.5314 -69.5314 -69.5303 -69.5303 -39.3818 -39.3818 -39.3792 -39.3792 -38.2289 -38.2289 -38.2242 -38.2242 -38.1409 -38.1409 -38.1404 -38.1404 -18.6639 -18.6639 -18.6504 -18.6504 -5.7066 -5.7066 -5.6838 -5.6838 -4.0046 -4.0046 -3.9861 -3.9861 -3.6028 -3.6028 -3.5692 -3.5692 1.1298 1.1298 1.1922 1.1922 6.2902 6.2902 6.2984 6.2984 6.4865 6.4865 6.7284 6.7284 6.7957 6.7957 6.8180 6.8180 7.4493 7.4493 7.5030 7.5030 8.1178 8.1178 8.1405 8.1405 8.3516 8.3516 8.4423 8.4423 8.6632 8.6632 8.8896 8.8896 9.4760 9.4760 9.5021 9.5021 10.8061 10.8061 k = 0.0000 0.4714-0.0000 ( 13074 PWs) bands (ev): -69.5315 -69.5315 -69.5310 -69.5310 -39.3814 -39.3814 -39.3796 -39.3796 -38.2281 -38.2281 -38.2250 -38.2250 -38.1408 -38.1408 -38.1405 -38.1405 -18.6614 -18.6614 -18.6524 -18.6524 -5.7039 -5.7039 -5.6887 -5.6887 -4.0033 -4.0033 -3.9909 -3.9909 -3.5966 -3.5966 -3.5740 -3.5740 1.1459 1.1459 1.1874 1.1874 6.2809 6.2809 6.2866 6.2866 6.5226 6.5226 6.6838 6.6838 6.7946 6.7946 6.8106 6.8106 7.4517 7.4517 7.4869 7.4869 8.1198 8.1198 8.1339 8.1339 8.3820 8.3820 8.4397 8.4397 8.6834 8.6834 8.8400 8.8400 9.4801 9.4801 9.4969 9.4969 10.8660 10.8660 k = 0.0000 0.4857-0.0000 ( 13058 PWs) bands (ev): -69.5310 -69.5310 -69.5303 -69.5303 -39.3809 -39.3809 -39.3801 -39.3801 -38.2273 -38.2273 -38.2258 -38.2258 -38.1407 -38.1407 -38.1406 -38.1406 -18.6590 -18.6590 -18.6545 -18.6545 -5.7007 -5.7007 -5.6931 -5.6931 -4.0013 -4.0013 -3.9951 -3.9951 -3.5905 -3.5905 -3.5792 -3.5792 1.1597 1.1597 1.1804 1.1804 6.2759 6.2759 6.2788 6.2788 6.5608 6.5608 6.6419 6.6419 6.7986 6.7986 6.8062 6.8062 7.4566 7.4566 7.4766 7.4766 8.1230 8.1230 8.1303 8.1303 8.4078 8.4078 8.4339 8.4339 8.7168 8.7168 8.7955 8.7955 9.4846 9.4846 9.4928 9.4928 10.9277 10.9277 k = 0.0000 0.5000-0.0000 ( 13072 PWs) bands (ev): -69.5312 -69.5312 -69.5312 -69.5312 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6972 -5.6972 -5.6972 -5.6972 -3.9985 -3.9985 -3.9985 -3.9985 -3.5847 -3.5847 -3.5847 -3.5847 1.1712 1.1712 1.1712 1.1712 6.2752 6.2752 6.2752 6.2752 6.5996 6.5996 6.5996 6.5996 6.8013 6.8013 6.8013 6.8013 7.4640 7.4640 7.4640 7.4640 8.1245 8.1245 8.1245 8.1245 8.4242 8.4242 8.4242 8.4242 8.7523 8.7523 8.7523 8.7523 9.4875 9.4875 9.4875 9.4875 10.9895 10.9895 k = 0.0000 0.5000-0.0000 ( 13072 PWs) bands (ev): -69.5312 -69.5312 -69.5312 -69.5312 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6972 -5.6972 -5.6972 -5.6972 -3.9985 -3.9985 -3.9985 -3.9985 -3.5847 -3.5847 -3.5847 -3.5847 1.1712 1.1712 1.1712 1.1712 6.2752 6.2752 6.2752 6.2752 6.5996 6.5996 6.5996 6.5996 6.8013 6.8013 6.8013 6.8013 7.4640 7.4640 7.4640 7.4640 8.1245 8.1245 8.1245 8.1245 8.4242 8.4242 8.4242 8.4242 8.7523 8.7523 8.7523 8.7523 9.4875 9.4875 9.4875 9.4875 10.9895 10.9895 k = 0.0143 0.5000-0.0000 ( 13062 PWs) bands (ev): -69.5308 -69.5308 -69.5308 -69.5308 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6566 -18.6566 -18.6566 -18.6566 -5.6987 -5.6987 -5.6957 -5.6957 -4.0037 -4.0037 -3.9934 -3.9934 -3.5886 -3.5886 -3.5813 -3.5813 1.1706 1.1706 1.1706 1.1706 6.2746 6.2746 6.2777 6.2777 6.5989 6.5989 6.5999 6.5999 6.7996 6.7996 6.8084 6.8084 7.4594 7.4594 7.4601 7.4601 8.1273 8.1273 8.1310 8.1310 8.4236 8.4236 8.4270 8.4270 8.7519 8.7519 8.7572 8.7572 9.4854 9.4854 9.4869 9.4869 10.9779 10.9779 k = 0.0286 0.5000-0.0000 ( 13072 PWs) bands (ev): -69.5312 -69.5312 -69.5312 -69.5312 -39.3806 -39.3806 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6565 -18.6565 -18.6564 -18.6564 -5.7003 -5.7003 -5.6943 -5.6943 -4.0087 -4.0087 -3.9881 -3.9881 -3.5930 -3.5930 -3.5784 -3.5784 1.1687 1.1687 1.1688 1.1688 6.2757 6.2757 6.2819 6.2819 6.5963 6.5963 6.5977 6.5977 6.8011 6.8011 6.8182 6.8182 7.4465 7.4465 7.4482 7.4482 8.1344 8.1344 8.1417 8.1417 8.4217 8.4217 8.4283 8.4283 8.7524 8.7524 8.7632 8.7632 9.4767 9.4767 9.4798 9.4798 10.9508 10.9508 k = 0.0429 0.5000-0.0000 ( 13084 PWs) bands (ev): -69.5316 -69.5316 -69.5316 -69.5316 -39.3806 -39.3806 -39.3805 -39.3805 -38.2267 -38.2267 -38.2266 -38.2266 -38.1407 -38.1407 -38.1406 -38.1406 -18.6563 -18.6563 -18.6561 -18.6561 -5.7019 -5.7019 -5.6930 -5.6930 -4.0137 -4.0137 -3.9829 -3.9829 -3.5978 -3.5978 -3.5761 -3.5761 1.1656 1.1656 1.1657 1.1657 6.2781 6.2781 6.2874 6.2874 6.5931 6.5931 6.5939 6.5939 6.8057 6.8057 6.8305 6.8305 7.4271 7.4271 7.4300 7.4300 8.1461 8.1461 8.1570 8.1570 8.4213 8.4213 8.4305 8.4305 8.7553 8.7553 8.7719 8.7719 9.4640 9.4640 9.4688 9.4688 10.9114 10.9114 k = 0.0571 0.5000-0.0000 ( 13092 PWs) bands (ev): -69.5319 -69.5319 -69.5319 -69.5319 -39.3806 -39.3806 -39.3805 -39.3805 -38.2267 -38.2267 -38.2266 -38.2266 -38.1407 -38.1407 -38.1406 -38.1406 -18.6560 -18.6560 -18.6558 -18.6558 -5.7035 -5.7035 -5.6919 -5.6919 -4.0185 -4.0185 -3.9777 -3.9777 -3.6031 -3.6031 -3.5742 -3.5742 1.1613 1.1613 1.1614 1.1614 6.2813 6.2813 6.2939 6.2939 6.5907 6.5907 6.5912 6.5912 6.8129 6.8129 6.8446 6.8446 7.4018 7.4018 7.4066 7.4066 8.1629 8.1629 8.1776 8.1776 8.4221 8.4221 8.4330 8.4330 8.7614 8.7614 8.7844 8.7844 9.4475 9.4475 9.4541 9.4541 10.8635 10.8635 k = 0.0714 0.5000-0.0000 ( 13104 PWs) bands (ev): -69.5324 -69.5324 -69.5324 -69.5324 -39.3806 -39.3806 -39.3805 -39.3805 -38.2268 -38.2268 -38.2267 -38.2267 -38.1407 -38.1407 -38.1406 -38.1406 -18.6556 -18.6556 -18.6553 -18.6553 -5.7052 -5.7052 -5.6908 -5.6908 -4.0233 -4.0233 -3.9725 -3.9725 -3.6087 -3.6087 -3.5727 -3.5727 1.1558 1.1558 1.1560 1.1560 6.2847 6.2847 6.3004 6.3004 6.5896 6.5896 6.5921 6.5921 6.8208 6.8208 6.8589 6.8589 7.3734 7.3734 7.3805 7.3805 8.1807 8.1807 8.1991 8.1991 8.4241 8.4241 8.4356 8.4356 8.7700 8.7700 8.8001 8.8001 9.4248 9.4248 9.4334 9.4334 10.8114 10.8114 k = 0.0857 0.5000-0.0000 ( 13100 PWs) bands (ev): -69.5323 -69.5323 -69.5323 -69.5323 -39.3807 -39.3807 -39.3805 -39.3805 -38.2268 -38.2268 -38.2267 -38.2267 -38.1406 -38.1406 -38.1405 -38.1405 -18.6550 -18.6550 -18.6547 -18.6547 -5.7069 -5.7069 -5.6898 -5.6898 -4.0279 -4.0279 -3.9674 -3.9674 -3.6147 -3.6147 -3.5717 -3.5717 1.1492 1.1492 1.1494 1.1494 6.2878 6.2878 6.3062 6.3062 6.5923 6.5923 6.5969 6.5969 6.8298 6.8298 6.8740 6.8740 7.3421 7.3421 7.3520 7.3520 8.2014 8.2014 8.2235 8.2235 8.4293 8.4293 8.4406 8.4406 8.7837 8.7837 8.8209 8.8209 9.3999 9.3999 9.4105 9.4105 10.7574 10.7574 k = 0.1000 0.5000-0.0000 ( 13094 PWs) bands (ev): -69.5320 -69.5320 -69.5320 -69.5320 -39.3807 -39.3807 -39.3805 -39.3805 -38.2269 -38.2269 -38.2267 -38.2267 -38.1406 -38.1406 -38.1405 -38.1405 -18.6544 -18.6544 -18.6541 -18.6541 -5.7087 -5.7087 -5.6890 -5.6890 -4.0323 -4.0323 -3.9624 -3.9624 -3.6209 -3.6209 -3.5711 -3.5711 1.1415 1.1415 1.1418 1.1418 6.2894 6.2894 6.3100 6.3100 6.6002 6.6002 6.6064 6.6064 6.8385 6.8385 6.8888 6.8888 7.3110 7.3110 7.3243 7.3243 8.2223 8.2223 8.2480 8.2480 8.4336 8.4336 8.4442 8.4442 8.8008 8.8008 8.8450 8.8450 9.3707 9.3707 9.3837 9.3837 10.7047 10.7047 k = 0.1143 0.5000-0.0000 ( 13102 PWs) bands (ev): -69.5323 -69.5323 -69.5323 -69.5323 -39.3807 -39.3807 -39.3805 -39.3805 -38.2269 -38.2269 -38.2268 -38.2268 -38.1405 -38.1405 -38.1405 -38.1405 -18.6538 -18.6538 -18.6534 -18.6534 -5.7104 -5.7104 -5.6884 -5.6884 -4.0366 -4.0366 -3.9576 -3.9576 -3.6274 -3.6274 -3.5708 -3.5708 1.1328 1.1328 1.1331 1.1331 6.2890 6.2890 6.3108 6.3108 6.6134 6.6134 6.6204 6.6204 6.8456 6.8456 6.9017 6.9017 7.2793 7.2793 7.2961 7.2961 8.2412 8.2412 8.2701 8.2701 8.4358 8.4358 8.4449 8.4449 8.8210 8.8210 8.8719 8.8719 9.3370 9.3370 9.3527 9.3527 10.6543 10.6543 k = 0.1286 0.5000-0.0000 ( 13110 PWs) bands (ev): -69.5326 -69.5326 -69.5326 -69.5326 -39.3808 -39.3808 -39.3805 -39.3805 -38.2270 -38.2270 -38.2269 -38.2269 -38.1405 -38.1405 -38.1404 -38.1404 -18.6530 -18.6530 -18.6525 -18.6525 -5.7121 -5.7121 -5.6879 -5.6879 -4.0407 -4.0407 -3.9530 -3.9530 -3.6339 -3.6339 -3.5709 -3.5709 1.1231 1.1231 1.1234 1.1234 6.2868 6.2868 6.3090 6.3090 6.6316 6.6316 6.6386 6.6386 6.8504 6.8504 6.9119 6.9119 7.2503 7.2503 7.2707 7.2707 8.2592 8.2592 8.2904 8.2904 8.4381 8.4381 8.4455 8.4455 8.8452 8.8452 8.9012 8.9012 9.2997 9.2997 9.3186 9.3186 10.6073 10.6073 k = 0.1429 0.5000-0.0000 ( 13102 PWs) bands (ev): -69.5323 -69.5323 -69.5323 -69.5323 -39.3808 -39.3808 -39.3805 -39.3805 -38.2271 -38.2271 -38.2269 -38.2269 -38.1404 -38.1404 -38.1403 -38.1403 -18.6522 -18.6522 -18.6517 -18.6517 -5.7139 -5.7139 -5.6876 -5.6876 -4.0446 -4.0446 -3.9487 -3.9487 -3.6405 -3.6405 -3.5713 -3.5713 1.1126 1.1126 1.1129 1.1129 6.2840 6.2840 6.3057 6.3057 6.6547 6.6547 6.6606 6.6606 6.8535 6.8535 6.9198 6.9198 7.2255 7.2255 7.2489 7.2489 8.2767 8.2767 8.3095 8.3095 8.4432 8.4432 8.4485 8.4485 8.8734 8.8734 8.9328 8.9328 9.2613 9.2613 9.2840 9.2840 10.5644 10.5666 k = 0.1571 0.5000-0.0000 ( 13100 PWs) bands (ev): -69.5323 -69.5323 -69.5323 -69.5323 -39.3808 -39.3808 -39.3806 -39.3806 -38.2272 -38.2272 -38.2270 -38.2270 -38.1404 -38.1404 -38.1403 -38.1403 -18.6513 -18.6513 -18.6507 -18.6507 -5.7156 -5.7156 -5.6875 -5.6875 -4.0482 -4.0482 -3.9447 -3.9447 -3.6469 -3.6469 -3.5719 -3.5719 1.1013 1.1013 1.1016 1.1016 6.2790 6.2790 6.2993 6.2993 6.6810 6.6810 6.6851 6.6851 6.8551 6.8551 6.9245 6.9245 7.2045 7.2045 7.2296 7.2296 8.2922 8.2922 8.3255 8.3255 8.4516 8.4516 8.4549 8.4549 8.9005 8.9005 8.9596 8.9596 9.2207 9.2207 9.2496 9.2496 10.5260 10.5261 k = 0.1714 0.5000-0.0000 ( 13100 PWs) bands (ev): -69.5323 -69.5323 -69.5323 -69.5323 -39.3808 -39.3808 -39.3806 -39.3806 -38.2273 -38.2273 -38.2271 -38.2271 -38.1403 -38.1403 -38.1402 -38.1402 -18.6503 -18.6503 -18.6498 -18.6498 -5.7173 -5.7173 -5.6876 -5.6876 -4.0517 -4.0517 -3.9412 -3.9412 -3.6531 -3.6531 -3.5728 -3.5728 1.0892 1.0892 1.0896 1.0896 6.2740 6.2740 6.2926 6.2926 6.7075 6.7075 6.7095 6.7095 6.8553 6.8553 6.9253 6.9253 7.1898 7.1898 7.2147 7.2147 8.3033 8.3033 8.3368 8.3368 8.4597 8.4597 8.4611 8.4611 8.9286 8.9286 8.9829 8.9829 9.1829 9.1829 9.2211 9.2211 10.4892 10.4893 k = 0.1857 0.5000-0.0000 ( 13092 PWs) bands (ev): -69.5320 -69.5320 -69.5320 -69.5320 -39.3809 -39.3809 -39.3806 -39.3806 -38.2274 -38.2274 -38.2272 -38.2272 -38.1402 -38.1402 -38.1401 -38.1401 -18.6493 -18.6493 -18.6487 -18.6487 -5.7190 -5.7190 -5.6880 -5.6880 -4.0548 -4.0548 -3.9381 -3.9381 -3.6590 -3.6590 -3.5739 -3.5739 1.0766 1.0766 1.0769 1.0769 6.2686 6.2686 6.2850 6.2850 6.7311 6.7311 6.7323 6.7323 6.8581 6.8581 6.9247 6.9247 7.1826 7.1826 7.2049 7.2049 8.3113 8.3113 8.3445 8.3445 8.4720 8.4720 8.4722 8.4722 8.9518 8.9518 8.9936 8.9936 9.1511 9.1511 9.2048 9.2048 10.4573 10.4573 k = 0.2000 0.5000-0.0000 ( 13088 PWs) bands (ev): -69.5318 -69.5318 -69.5318 -69.5318 -39.3809 -39.3809 -39.3806 -39.3806 -38.2275 -38.2275 -38.2273 -38.2273 -38.1402 -38.1402 -38.1401 -38.1401 -18.6482 -18.6482 -18.6476 -18.6476 -5.7207 -5.7207 -5.6885 -5.6885 -4.0576 -4.0576 -3.9356 -3.9356 -3.6644 -3.6644 -3.5751 -3.5751 1.0634 1.0634 1.0638 1.0638 6.2636 6.2636 6.2776 6.2776 6.7449 6.7449 6.7485 6.7485 6.8671 6.8671 6.9240 6.9240 7.1818 7.1818 7.1991 7.1991 8.3156 8.3156 8.3477 8.3477 8.4863 8.4863 8.4879 8.4879 8.9649 8.9649 8.9879 8.9879 9.1317 9.1317 9.2057 9.2057 10.4288 10.4288 k = 0.2143 0.5000-0.0000 ( 13090 PWs) bands (ev): -69.5319 -69.5319 -69.5319 -69.5319 -39.3809 -39.3809 -39.3806 -39.3806 -38.2276 -38.2276 -38.2273 -38.2273 -38.1401 -38.1401 -38.1400 -38.1400 -18.6472 -18.6472 -18.6465 -18.6465 -5.7223 -5.7223 -5.6893 -5.6893 -4.0601 -4.0601 -3.9338 -3.9338 -3.6692 -3.6692 -3.5766 -3.5766 1.0498 1.0498 1.0502 1.0502 6.2585 6.2585 6.2700 6.2700 6.7465 6.7465 6.7554 6.7554 6.8850 6.8850 6.9270 6.9270 7.1875 7.1875 7.1981 7.1981 8.3160 8.3160 8.3463 8.3463 8.5024 8.5024 8.5049 8.5049 8.9611 8.9611 8.9670 8.9670 9.1310 9.1310 9.2218 9.2218 10.4041 10.4041 k = 0.2286 0.5000-0.0000 ( 13094 PWs) bands (ev): -69.5321 -69.5321 -69.5321 -69.5321 -39.3810 -39.3810 -39.3807 -39.3807 -38.2277 -38.2277 -38.2274 -38.2274 -38.1400 -38.1400 -38.1399 -38.1399 -18.6460 -18.6460 -18.6454 -18.6454 -5.7239 -5.7239 -5.6903 -5.6903 -4.0623 -4.0623 -3.9328 -3.9328 -3.6734 -3.6734 -3.5781 -3.5781 1.0359 1.0359 1.0363 1.0363 6.2538 6.2538 6.2626 6.2626 6.7386 6.7386 6.7523 6.7523 6.9079 6.9079 6.9339 6.9339 7.1994 7.1994 7.2019 7.2019 8.3120 8.3120 8.3400 8.3400 8.5220 8.5220 8.5250 8.5250 8.9384 8.9384 8.9442 8.9442 9.1465 9.1465 9.2471 9.2471 10.3827 10.3828 k = 0.2429 0.5000-0.0000 ( 13096 PWs) bands (ev): -69.5322 -69.5322 -69.5322 -69.5322 -39.3810 -39.3810 -39.3807 -39.3807 -38.2278 -38.2278 -38.2275 -38.2275 -38.1400 -38.1400 -38.1398 -38.1398 -18.6449 -18.6449 -18.6443 -18.6443 -5.7255 -5.7255 -5.6915 -5.6915 -4.0641 -4.0641 -3.9325 -3.9325 -3.6768 -3.6768 -3.5798 -3.5798 1.0218 1.0218 1.0222 1.0222 6.2496 6.2496 6.2556 6.2556 6.7254 6.7254 6.7410 6.7410 6.9313 6.9313 6.9440 6.9440 7.2121 7.2121 7.2175 7.2175 8.3034 8.3034 8.3284 8.3284 8.5442 8.5442 8.5474 8.5474 8.9091 8.9091 8.9241 8.9241 9.1701 9.1701 9.2762 9.2762 10.3649 10.3649 k = 0.2571 0.5000-0.0000 ( 13104 PWs) bands (ev): -69.5324 -69.5324 -69.5324 -69.5324 -39.3810 -39.3810 -39.3807 -39.3807 -38.2279 -38.2279 -38.2276 -38.2276 -38.1399 -38.1399 -38.1398 -38.1398 -18.6438 -18.6438 -18.6432 -18.6432 -5.7269 -5.7269 -5.6929 -5.6929 -4.0654 -4.0654 -3.9330 -3.9330 -3.6794 -3.6794 -3.5815 -3.5815 1.0077 1.0077 1.0080 1.0080 6.2461 6.2461 6.2493 6.2493 6.7089 6.7089 6.7240 6.7240 6.9512 6.9512 6.9536 6.9536 7.2283 7.2283 7.2407 7.2407 8.2898 8.2898 8.3109 8.3109 8.5670 8.5670 8.5699 8.5699 8.8834 8.8834 8.9073 8.9073 9.1965 9.1965 9.3060 9.3060 10.3497 10.3497 k = 0.2714 0.5000-0.0000 ( 13092 PWs) bands (ev): -69.5320 -69.5320 -69.5320 -69.5320 -39.3811 -39.3811 -39.3807 -39.3807 -38.2280 -38.2280 -38.2277 -38.2277 -38.1398 -38.1398 -38.1397 -38.1397 -18.6426 -18.6426 -18.6420 -18.6420 -5.7283 -5.7283 -5.6945 -5.6945 -4.0664 -4.0664 -3.9344 -3.9344 -3.6810 -3.6810 -3.5834 -3.5834 0.9936 0.9936 0.9939 0.9939 6.2441 6.2441 6.2444 6.2444 6.6919 6.6919 6.7048 6.7048 6.9616 6.9616 6.9663 6.9663 7.2515 7.2515 7.2693 7.2693 8.2745 8.2745 8.2915 8.2915 8.5938 8.5938 8.5959 8.5959 8.8643 8.8643 8.8976 8.8976 9.2237 9.2237 9.3357 9.3357 10.3376 10.3376 k = 0.2857 0.5000-0.0000 ( 13080 PWs) bands (ev): -69.5316 -69.5316 -69.5316 -69.5316 -39.3811 -39.3811 -39.3808 -39.3808 -38.2280 -38.2280 -38.2278 -38.2278 -38.1397 -38.1397 -38.1396 -38.1396 -18.6415 -18.6415 -18.6409 -18.6409 -5.7296 -5.7296 -5.6963 -5.6963 -4.0669 -4.0669 -3.9367 -3.9367 -3.6818 -3.6818 -3.5854 -3.5854 0.9796 0.9796 0.9799 0.9799 6.2404 6.2404 6.2429 6.2429 6.6736 6.6736 6.6835 6.6835 6.9667 6.9667 6.9759 6.9759 7.2804 7.2804 7.3016 7.3016 8.2547 8.2547 8.2673 8.2673 8.6213 8.6213 8.6220 8.6220 8.8537 8.8537 8.8971 8.8971 9.2503 9.2503 9.3642 9.3642 10.3271 10.3271 k = 0.3000 0.5000-0.0000 ( 13084 PWs) bands (ev): -69.5317 -69.5317 -69.5317 -69.5317 -39.3811 -39.3811 -39.3808 -39.3808 -38.2281 -38.2281 -38.2279 -38.2279 -38.1396 -38.1396 -38.1395 -38.1395 -18.6404 -18.6404 -18.6398 -18.6398 -5.7308 -5.7308 -5.6982 -5.6982 -4.0670 -4.0670 -3.9397 -3.9397 -3.6818 -3.6818 -3.5875 -3.5875 0.9659 0.9659 0.9662 0.9662 6.2362 6.2362 6.2415 6.2415 6.6559 6.6559 6.6623 6.6623 6.9687 6.9687 6.9802 6.9802 7.3120 7.3120 7.3350 7.3350 8.2282 8.2282 8.2365 8.2365 8.6460 8.6460 8.6468 8.6468 8.8502 8.8502 8.9043 8.9043 9.2744 9.2744 9.3903 9.3903 10.3190 10.3190 k = 0.3143 0.5000-0.0000 ( 13072 PWs) bands (ev): -69.5313 -69.5313 -69.5313 -69.5313 -39.3811 -39.3811 -39.3808 -39.3808 -38.2282 -38.2282 -38.2280 -38.2280 -38.1396 -38.1396 -38.1394 -38.1394 -18.6393 -18.6393 -18.6388 -18.6388 -5.7319 -5.7319 -5.7004 -5.7004 -4.0666 -4.0666 -3.9434 -3.9434 -3.6809 -3.6809 -3.5897 -3.5897 0.9526 0.9526 0.9528 0.9528 6.2331 6.2331 6.2409 6.2409 6.6398 6.6398 6.6427 6.6427 6.9688 6.9688 6.9813 6.9813 7.3461 7.3461 7.3696 7.3696 8.1988 8.1988 8.2033 8.2033 8.6721 8.6721 8.6745 8.6745 8.8573 8.8573 8.9217 8.9217 9.2970 9.2970 9.4147 9.4147 10.3138 10.3138 k = 0.3286 0.5000-0.0000 ( 13068 PWs) bands (ev): -69.5311 -69.5311 -69.5311 -69.5311 -39.3811 -39.3811 -39.3809 -39.3809 -38.2283 -38.2283 -38.2281 -38.2281 -38.1395 -38.1395 -38.1394 -38.1394 -18.6383 -18.6383 -18.6377 -18.6377 -5.7328 -5.7328 -5.7026 -5.7026 -4.0657 -4.0657 -3.9478 -3.9478 -3.6793 -3.6793 -3.5920 -3.5920 0.9397 0.9397 0.9399 0.9399 6.2303 6.2303 6.2405 6.2405 6.6231 6.6231 6.6237 6.6237 6.9662 6.9662 6.9787 6.9787 7.3815 7.3815 7.4049 7.4049 8.1675 8.1675 8.1686 8.1686 8.6947 8.6947 8.6983 8.6983 8.8733 8.8733 8.9472 8.9472 9.3165 9.3165 9.4358 9.4358 10.3101 10.3101 k = 0.3429 0.5000-0.0000 ( 13068 PWs) bands (ev): -69.5311 -69.5311 -69.5311 -69.5311 -39.3811 -39.3811 -39.3809 -39.3809 -38.2284 -38.2284 -38.2282 -38.2282 -38.1394 -38.1394 -38.1393 -38.1393 -18.6373 -18.6373 -18.6368 -18.6368 -5.7336 -5.7336 -5.7049 -5.7049 -4.0644 -4.0644 -3.9528 -3.9528 -3.6770 -3.6770 -3.5945 -3.5945 0.9275 0.9275 0.9276 0.9276 6.2279 6.2279 6.2402 6.2402 6.6048 6.6048 6.6086 6.6086 6.9627 6.9627 6.9747 6.9747 7.4151 7.4151 7.4377 7.4377 8.1324 8.1324 8.1338 8.1338 8.7158 8.7158 8.7196 8.7196 8.8977 8.8977 8.9796 8.9796 9.3335 9.3335 9.4544 9.4544 10.3085 10.3085 k = 0.3571 0.5000-0.0000 ( 13060 PWs) bands (ev): -69.5308 -69.5308 -69.5308 -69.5308 -39.3812 -39.3812 -39.3809 -39.3809 -38.2284 -38.2284 -38.2283 -38.2283 -38.1393 -38.1393 -38.1392 -38.1392 -18.6364 -18.6364 -18.6359 -18.6359 -5.7342 -5.7342 -5.7074 -5.7074 -4.0626 -4.0626 -3.9582 -3.9582 -3.6742 -3.6742 -3.5971 -3.5971 0.9159 0.9159 0.9161 0.9161 6.2260 6.2260 6.2400 6.2400 6.5881 6.5881 6.5947 6.5947 6.9592 6.9592 6.9704 6.9704 7.4476 7.4476 7.4691 7.4691 8.0972 8.0972 8.1006 8.1006 8.7360 8.7360 8.7391 8.7391 8.9299 8.9299 9.0186 9.0186 9.3484 9.3484 9.4709 9.4709 10.3094 10.3095 k = 0.3714 0.5000-0.0000 ( 13056 PWs) bands (ev): -69.5306 -69.5306 -69.5306 -69.5306 -39.3812 -39.3812 -39.3809 -39.3809 -38.2285 -38.2285 -38.2283 -38.2283 -38.1393 -38.1393 -38.1392 -38.1392 -18.6355 -18.6355 -18.6350 -18.6350 -5.7347 -5.7347 -5.7098 -5.7098 -4.0603 -4.0603 -3.9641 -3.9641 -3.6709 -3.6709 -3.5998 -3.5998 0.9051 0.9051 0.9053 0.9053 6.2250 6.2250 6.2402 6.2402 6.5739 6.5739 6.5828 6.5828 6.9545 6.9545 6.9649 6.9649 7.4774 7.4774 7.4976 7.4976 8.0613 8.0613 8.0661 8.0661 8.7538 8.7538 8.7560 8.7560 8.9676 8.9676 9.0616 9.0616 9.3610 9.3610 9.4844 9.4844 10.3126 10.3126 k = 0.3857 0.5000-0.0000 ( 13074 PWs) bands (ev): -69.5313 -69.5313 -69.5313 -69.5313 -39.3812 -39.3812 -39.3810 -39.3810 -38.2286 -38.2286 -38.2284 -38.2284 -38.1392 -38.1392 -38.1392 -38.1392 -18.6347 -18.6347 -18.6343 -18.6343 -5.7350 -5.7350 -5.7123 -5.7123 -4.0575 -4.0575 -3.9702 -3.9702 -3.6672 -3.6672 -3.6027 -3.6027 0.8952 0.8952 0.8953 0.8953 6.2235 6.2235 6.2394 6.2394 6.5605 6.5605 6.5710 6.5710 6.9494 6.9494 6.9586 6.9586 7.5038 7.5038 7.5226 7.5226 8.0240 8.0240 8.0298 8.0298 8.7685 8.7685 8.7699 8.7699 9.0069 9.0069 9.1058 9.1058 9.3709 9.3709 9.4948 9.4948 10.3162 10.3162 k = 0.4000 0.5000-0.0000 ( 13086 PWs) bands (ev): -69.5317 -69.5317 -69.5317 -69.5317 -39.3812 -39.3812 -39.3810 -39.3810 -38.2286 -38.2286 -38.2285 -38.2285 -38.1392 -38.1392 -38.1391 -38.1391 -18.6339 -18.6339 -18.6336 -18.6336 -5.7350 -5.7350 -5.7148 -5.7148 -4.0543 -4.0543 -3.9765 -3.9765 -3.6631 -3.6631 -3.6058 -3.6058 0.8863 0.8863 0.8864 0.8864 6.2232 6.2232 6.2391 6.2391 6.5500 6.5500 6.5615 6.5615 6.9439 6.9439 6.9520 6.9520 7.5278 7.5278 7.5452 7.5452 7.9897 7.9897 7.9962 7.9962 8.7817 8.7817 8.7823 8.7823 9.0475 9.0475 9.1497 9.1497 9.3790 9.3790 9.5023 9.5023 10.3233 10.3234 k = 0.4143 0.5000-0.0000 ( 13076 PWs) bands (ev): -69.5313 -69.5313 -69.5313 -69.5313 -39.3812 -39.3812 -39.3810 -39.3810 -38.2287 -38.2287 -38.2286 -38.2286 -38.1391 -38.1391 -38.1391 -38.1391 -18.6333 -18.6333 -18.6330 -18.6330 -5.7349 -5.7349 -5.7172 -5.7172 -4.0507 -4.0507 -3.9830 -3.9830 -3.6589 -3.6589 -3.6091 -3.6091 0.8784 0.8784 0.8785 0.8785 6.2240 6.2240 6.2392 6.2392 6.5425 6.5425 6.5543 6.5543 6.9392 6.9392 6.9461 6.9461 7.5510 7.5510 7.5669 7.5669 7.9607 7.9607 7.9676 7.9676 8.7942 8.7942 8.7942 8.7942 9.0885 9.0885 9.1917 9.1917 9.3876 9.3876 9.5082 9.5082 10.3349 10.3349 k = 0.4286 0.5000-0.0000 ( 13080 PWs) bands (ev): -69.5315 -69.5315 -69.5315 -69.5315 -39.3812 -39.3812 -39.3811 -39.3811 -38.2287 -38.2287 -38.2286 -38.2286 -38.1391 -38.1391 -38.1391 -38.1391 -18.6327 -18.6327 -18.6325 -18.6325 -5.7345 -5.7345 -5.7196 -5.7196 -4.0466 -4.0466 -3.9895 -3.9895 -3.6545 -3.6545 -3.6125 -3.6125 0.8716 0.8716 0.8716 0.8716 6.2241 6.2241 6.2380 6.2380 6.5360 6.5360 6.5473 6.5473 6.9341 6.9341 6.9398 6.9398 7.5713 7.5713 7.5855 7.5855 7.9335 7.9335 7.9404 7.9404 8.8057 8.8057 8.8059 8.8059 9.1270 9.1270 9.2278 9.2278 9.3955 9.3955 9.5103 9.5103 10.3464 10.3464 k = 0.4429 0.5000-0.0000 ( 13072 PWs) bands (ev): -69.5312 -69.5312 -69.5312 -69.5312 -39.3812 -39.3812 -39.3811 -39.3811 -38.2287 -38.2287 -38.2287 -38.2287 -38.1391 -38.1391 -38.1390 -38.1390 -18.6323 -18.6323 -18.6320 -18.6320 -5.7339 -5.7339 -5.7218 -5.7218 -4.0422 -4.0422 -3.9960 -3.9960 -3.6500 -3.6500 -3.6161 -3.6161 0.8659 0.8659 0.8660 0.8660 6.2249 6.2249 6.2369 6.2369 6.5320 6.5320 6.5419 6.5419 6.9306 6.9306 6.9352 6.9352 7.5892 7.5892 7.6014 7.6014 7.9110 7.9110 7.9175 7.9175 8.8160 8.8160 8.8164 8.8164 9.1641 9.1641 9.2571 9.2571 9.4062 9.4062 9.5098 9.5098 10.3595 10.3595 k = 0.4571 0.5000-0.0000 ( 13060 PWs) bands (ev): -69.5308 -69.5308 -69.5308 -69.5308 -39.3812 -39.3812 -39.3811 -39.3811 -38.2288 -38.2288 -38.2287 -38.2287 -38.1390 -38.1390 -38.1390 -38.1390 -18.6319 -18.6319 -18.6317 -18.6317 -5.7331 -5.7331 -5.7240 -5.7240 -4.0374 -4.0374 -4.0025 -4.0025 -3.6455 -3.6455 -3.6199 -3.6199 0.8615 0.8615 0.8616 0.8616 6.2266 6.2266 6.2361 6.2361 6.5300 6.5300 6.5381 6.5381 6.9279 6.9279 6.9313 6.9313 7.6038 7.6038 7.6135 7.6135 7.8938 7.8938 7.8994 7.8994 8.8249 8.8249 8.8253 8.8253 9.1976 9.1976 9.2757 9.2757 9.4209 9.4209 9.5065 9.5065 10.3719 10.3721 k = 0.4714 0.5000-0.0000 ( 13056 PWs) bands (ev): -69.5306 -69.5306 -69.5306 -69.5306 -39.3812 -39.3812 -39.3811 -39.3811 -38.2288 -38.2288 -38.2287 -38.2287 -38.1390 -38.1390 -38.1390 -38.1390 -18.6316 -18.6316 -18.6315 -18.6315 -5.7321 -5.7321 -5.7260 -5.7260 -4.0322 -4.0322 -4.0088 -4.0088 -3.6410 -3.6410 -3.6238 -3.6238 0.8583 0.8583 0.8584 0.8584 6.2275 6.2275 6.2340 6.2340 6.5292 6.5292 6.5349 6.5349 6.9260 6.9260 6.9283 6.9283 7.6150 7.6150 7.6219 7.6219 7.8815 7.8815 7.8856 7.8856 8.8303 8.8303 8.8307 8.8307 9.2266 9.2266 9.2827 9.2827 9.4386 9.4386 9.4995 9.4995 10.3823 10.3825 k = 0.4857 0.5000-0.0000 ( 13044 PWs) bands (ev): -69.5302 -69.5302 -69.5302 -69.5302 -39.3812 -39.3812 -39.3811 -39.3811 -38.2288 -38.2288 -38.2287 -38.2287 -38.1390 -38.1390 -38.1390 -38.1390 -18.6314 -18.6314 -18.6314 -18.6314 -5.7309 -5.7309 -5.7278 -5.7278 -4.0267 -4.0267 -4.0150 -4.0150 -3.6365 -3.6365 -3.6279 -3.6279 0.8564 0.8564 0.8564 0.8564 6.2292 6.2292 6.2326 6.2326 6.5299 6.5299 6.5328 6.5328 6.9246 6.9246 6.9258 6.9258 7.6242 7.6242 7.6278 7.6278 7.8740 7.8740 7.8762 7.8762 8.8359 8.8359 8.8361 8.8361 9.2504 9.2504 9.2795 9.2795 9.4575 9.4575 9.4889 9.4889 10.3905 10.3906 k = 0.5000 0.5000-0.0000 ( 13036 PWs) bands (ev): -69.5299 -69.5299 -69.5299 -69.5299 -39.3811 -39.3811 -39.3811 -39.3811 -38.2287 -38.2287 -38.2287 -38.2287 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0210 -4.0210 -4.0210 -4.0210 -3.6322 -3.6322 -3.6322 -3.6322 0.8558 0.8558 0.8558 0.8558 6.2313 6.2313 6.2313 6.2313 6.5314 6.5314 6.5314 6.5314 6.9258 6.9258 6.9258 6.9258 7.6280 7.6280 7.6280 7.6280 7.8726 7.8726 7.8726 7.8726 8.8365 8.8365 8.8365 8.8365 9.2693 9.2693 9.2693 9.2693 9.4753 9.4753 9.4753 9.4753 10.3934 10.3934 k = 0.5000 0.5000-0.0000 ( 13036 PWs) bands (ev): -69.5299 -69.5299 -69.5299 -69.5299 -39.3811 -39.3811 -39.3811 -39.3811 -38.2287 -38.2287 -38.2287 -38.2287 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0210 -4.0210 -4.0210 -4.0210 -3.6322 -3.6322 -3.6322 -3.6322 0.8558 0.8558 0.8558 0.8558 6.2313 6.2313 6.2313 6.2313 6.5314 6.5314 6.5314 6.5314 6.9258 6.9258 6.9258 6.9258 7.6280 7.6280 7.6280 7.6280 7.8726 7.8726 7.8726 7.8726 8.8365 8.8365 8.8365 8.8365 9.2693 9.2693 9.2693 9.2693 9.4753 9.4753 9.4753 9.4753 10.3934 10.3934 k = 0.4900 0.4900-0.0000 ( 13048 PWs) bands (ev): -69.5306 -69.5306 -69.5300 -69.5300 -39.3812 -39.3812 -39.3811 -39.3811 -38.2288 -38.2288 -38.2287 -38.2287 -38.1390 -38.1390 -38.1390 -38.1390 -18.6314 -18.6314 -18.6313 -18.6313 -5.7309 -5.7309 -5.7278 -5.7278 -4.0267 -4.0267 -4.0151 -4.0151 -3.6365 -3.6365 -3.6280 -3.6280 0.8562 0.8562 0.8567 0.8567 6.2286 6.2286 6.2330 6.2330 6.5298 6.5298 6.5328 6.5328 6.9244 6.9244 6.9261 6.9261 7.6226 7.6226 7.6286 7.6286 7.8717 7.8717 7.8785 7.8785 8.8324 8.8324 8.8374 8.8374 9.2502 9.2502 9.2799 9.2799 9.4572 9.4572 9.4890 9.4890 10.3879 10.3879 k = 0.4800 0.4800-0.0000 ( 13044 PWs) bands (ev): -69.5304 -69.5304 -69.5300 -69.5300 -39.3812 -39.3812 -39.3811 -39.3811 -38.2288 -38.2288 -38.2287 -38.2287 -38.1390 -38.1390 -38.1390 -38.1390 -18.6317 -18.6317 -18.6313 -18.6313 -5.7321 -5.7321 -5.7260 -5.7260 -4.0321 -4.0321 -4.0089 -4.0089 -3.6409 -3.6409 -3.6239 -3.6239 0.8573 0.8573 0.8593 0.8593 6.2249 6.2249 6.2372 6.2372 6.5298 6.5298 6.5355 6.5355 6.9246 6.9246 6.9304 6.9304 7.6080 7.6080 7.6325 7.6325 7.8706 7.8706 7.8956 7.8956 8.8268 8.8268 8.8376 8.8376 9.2252 9.2252 9.2876 9.2876 9.4355 9.4355 9.5029 9.5029 10.3773 10.3774 k = 0.4700 0.4700-0.0000 ( 13048 PWs) bands (ev): -69.5310 -69.5310 -69.5297 -69.5297 -39.3812 -39.3812 -39.3811 -39.3811 -38.2288 -38.2288 -38.2286 -38.2286 -38.1390 -38.1390 -38.1390 -38.1390 -18.6322 -18.6322 -18.6313 -18.6313 -5.7331 -5.7331 -5.7240 -5.7240 -4.0372 -4.0372 -4.0026 -4.0026 -3.6455 -3.6455 -3.6199 -3.6199 0.8592 0.8592 0.8636 0.8636 6.2190 6.2190 6.2449 6.2449 6.5297 6.5297 6.5381 6.5381 6.9258 6.9258 6.9349 6.9349 7.5875 7.5875 7.6384 7.6384 7.8676 7.8676 7.9194 7.9194 8.8164 8.8164 8.8381 8.8381 9.1929 9.1929 9.2904 9.2904 9.4074 9.4074 9.5145 9.5145 10.3620 10.3620 k = 0.4600 0.4600-0.0000 ( 13060 PWs) bands (ev): -69.5316 -69.5316 -69.5299 -69.5299 -39.3813 -39.3813 -39.3810 -39.3810 -38.2289 -38.2289 -38.2285 -38.2285 -38.1391 -38.1391 -38.1390 -38.1390 -18.6329 -18.6329 -18.6313 -18.6313 -5.7340 -5.7340 -5.7218 -5.7218 -4.0419 -4.0419 -3.9962 -3.9962 -3.6502 -3.6502 -3.6160 -3.6160 0.8618 0.8618 0.8695 0.8695 6.2108 6.2108 6.2542 6.2542 6.5304 6.5304 6.5415 6.5415 6.9252 6.9252 6.9420 6.9420 7.5628 7.5628 7.6458 7.6458 7.8642 7.8642 7.9493 7.9493 8.7991 8.7991 8.8380 8.8380 9.1533 9.1533 9.2912 9.2912 9.3717 9.3717 9.5260 9.5260 10.3446 10.3446 k = 0.4500 0.4500-0.0000 ( 13074 PWs) bands (ev): -69.5324 -69.5324 -69.5302 -69.5302 -39.3814 -39.3814 -39.3809 -39.3809 -38.2290 -38.2290 -38.2283 -38.2283 -38.1391 -38.1391 -38.1390 -38.1390 -18.6338 -18.6338 -18.6313 -18.6313 -5.7347 -5.7347 -5.7194 -5.7194 -4.0463 -4.0463 -3.9897 -3.9897 -3.6550 -3.6550 -3.6122 -3.6122 0.8650 0.8650 0.8770 0.8770 6.2013 6.2013 6.2652 6.2652 6.5314 6.5314 6.5453 6.5453 6.9261 6.9261 6.9508 6.9508 7.5359 7.5359 7.6559 7.6559 7.8591 7.8591 7.9806 7.9806 8.7803 8.7803 8.8369 8.8369 9.1094 9.1094 9.2901 9.2901 9.3292 9.3292 9.5366 9.5366 10.3286 10.3286 k = 0.4400 0.4400-0.0000 ( 13075 PWs) bands (ev): -69.5322 -69.5322 -69.5304 -69.5304 -39.3815 -39.3815 -39.3808 -39.3808 -38.2292 -38.2292 -38.2280 -38.2280 -38.1392 -38.1392 -38.1391 -38.1391 -18.6349 -18.6349 -18.6313 -18.6313 -5.7351 -5.7351 -5.7168 -5.7168 -4.0502 -4.0502 -3.9831 -3.9831 -3.6599 -3.6599 -3.6085 -3.6085 0.8687 0.8687 0.8860 0.8860 6.1906 6.1906 6.2791 6.2791 6.5338 6.5338 6.5510 6.5510 6.9251 6.9251 6.9630 6.9630 7.5079 7.5079 7.6688 7.6688 7.8574 7.8574 8.0157 8.0157 8.7604 8.7604 8.8354 8.8354 9.0609 9.0609 9.2810 9.2810 9.2896 9.2896 9.5480 9.5480 10.3165 10.3165 k = 0.4300 0.4300-0.0000 ( 13077 PWs) bands (ev): -69.5318 -69.5318 -69.5310 -69.5310 -39.3816 -39.3816 -39.3806 -39.3806 -38.2294 -38.2294 -38.2278 -38.2278 -38.1393 -38.1393 -38.1391 -38.1391 -18.6362 -18.6362 -18.6313 -18.6313 -5.7354 -5.7354 -5.7140 -5.7140 -4.0536 -4.0536 -3.9765 -3.9765 -3.6649 -3.6649 -3.6049 -3.6049 0.8728 0.8728 0.8963 0.8963 6.1795 6.1795 6.2956 6.2956 6.5361 6.5361 6.5586 6.5586 6.9252 6.9252 6.9768 6.9768 7.4801 7.4801 7.6808 7.6808 7.8534 7.8534 8.0532 8.0532 8.7375 8.7375 8.8336 8.8336 9.0102 9.0102 9.2266 9.2266 9.2872 9.2872 9.5598 9.5598 10.3078 10.3078 k = 0.4200 0.4200-0.0000 ( 13071 PWs) bands (ev): -69.5314 -69.5314 -69.5309 -69.5309 -39.3817 -39.3817 -39.3805 -39.3805 -38.2296 -38.2296 -38.2274 -38.2274 -38.1393 -38.1393 -38.1391 -38.1391 -18.6376 -18.6376 -18.6313 -18.6313 -5.7355 -5.7355 -5.7110 -5.7110 -4.0565 -4.0565 -3.9698 -3.9698 -3.6701 -3.6701 -3.6014 -3.6014 0.8773 0.8773 0.9077 0.9077 6.1684 6.1684 6.3154 6.3154 6.5391 6.5391 6.5676 6.5676 6.9260 6.9260 6.9924 6.9924 7.4534 7.4534 7.6924 7.6924 7.8504 7.8504 8.0928 8.0928 8.7122 8.7122 8.8302 8.8302 8.9584 8.9584 9.1705 9.1705 9.2839 9.2839 9.5711 9.5711 10.3040 10.3040 k = 0.4100 0.4100-0.0000 ( 13079 PWs) bands (ev): -69.5317 -69.5317 -69.5312 -69.5312 -39.3818 -39.3818 -39.3803 -39.3803 -38.2298 -38.2298 -38.2271 -38.2271 -38.1394 -38.1394 -38.1391 -38.1391 -18.6392 -18.6392 -18.6313 -18.6313 -5.7354 -5.7354 -5.7079 -5.7079 -4.0588 -4.0588 -3.9631 -3.9631 -3.6753 -3.6753 -3.5979 -3.5979 0.8820 0.8820 0.9202 0.9202 6.1571 6.1571 6.3362 6.3362 6.5419 6.5419 6.5763 6.5763 6.9279 6.9279 7.0086 7.0086 7.4274 7.4274 7.7017 7.7017 7.8430 7.8430 8.1326 8.1326 8.6825 8.6825 8.8292 8.8292 8.9062 8.9062 9.1123 9.1123 9.2778 9.2778 9.5800 9.5800 10.3058 10.3058 k = 0.4000 0.4000-0.0000 ( 13077 PWs) bands (ev): -69.5319 -69.5319 -69.5309 -69.5309 -39.3820 -39.3820 -39.3801 -39.3801 -38.2300 -38.2300 -38.2268 -38.2268 -38.1395 -38.1395 -38.1391 -38.1391 -18.6410 -18.6410 -18.6314 -18.6314 -5.7352 -5.7352 -5.7045 -5.7045 -4.0606 -4.0606 -3.9563 -3.9563 -3.6806 -3.6806 -3.5946 -3.5946 0.8867 0.8867 0.9334 0.9334 6.1452 6.1452 6.3605 6.3605 6.5439 6.5439 6.5858 6.5858 6.9318 6.9318 7.0281 7.0281 7.4037 7.4037 7.7085 7.7085 7.8375 7.8375 8.1738 8.1738 8.6529 8.6529 8.8256 8.8256 8.8562 8.8562 9.0538 9.0538 9.2717 9.2717 9.5878 9.5878 10.3030 10.3030 k = 0.3900 0.3900-0.0000 ( 13077 PWs) bands (ev): -69.5320 -69.5320 -69.5309 -69.5309 -39.3822 -39.3822 -39.3799 -39.3799 -38.2302 -38.2302 -38.2263 -38.2263 -38.1396 -38.1396 -38.1391 -38.1391 -18.6430 -18.6430 -18.6314 -18.6314 -5.7347 -5.7347 -5.7009 -5.7009 -4.0617 -4.0617 -3.9496 -3.9496 -3.6859 -3.6859 -3.5913 -3.5913 0.8912 0.8912 0.9473 0.9473 6.1333 6.1333 6.3865 6.3865 6.5464 6.5464 6.5971 6.5971 6.9366 6.9366 7.0493 7.0493 7.3812 7.3812 7.7114 7.7114 7.8283 7.8283 8.2151 8.2151 8.6225 8.6225 8.8035 8.8035 8.8289 8.8289 8.9973 8.9973 9.2639 9.2639 9.5953 9.5953 10.2855 10.2855 k = 0.3800 0.3800-0.0000 ( 13073 PWs) bands (ev): -69.5320 -69.5320 -69.5305 -69.5305 -39.3823 -39.3823 -39.3797 -39.3797 -38.2305 -38.2305 -38.2259 -38.2259 -38.1397 -38.1397 -38.1391 -38.1391 -18.6451 -18.6451 -18.6314 -18.6314 -5.7342 -5.7342 -5.6972 -5.6972 -4.0622 -4.0622 -3.9429 -3.9429 -3.6912 -3.6912 -3.5881 -3.5881 0.8954 0.8954 0.9615 0.9615 6.1217 6.1217 6.4144 6.4144 6.5493 6.5493 6.6094 6.6094 6.9416 6.9416 7.0720 7.0720 7.3606 7.3606 7.7092 7.7092 7.8246 7.8246 8.2566 8.2566 8.5915 8.5915 8.7563 8.7563 8.8259 8.8259 8.9455 8.9455 9.2547 9.2547 9.6015 9.6015 10.2672 10.2672 k = 0.3700 0.3700-0.0000 ( 13083 PWs) bands (ev): -69.5327 -69.5327 -69.5306 -69.5306 -39.3825 -39.3825 -39.3794 -39.3794 -38.2308 -38.2308 -38.2255 -38.2255 -38.1398 -38.1398 -38.1392 -38.1392 -18.6474 -18.6474 -18.6314 -18.6314 -5.7335 -5.7335 -5.6932 -5.6932 -4.0620 -4.0620 -3.9363 -3.9363 -3.6966 -3.6966 -3.5850 -3.5850 0.8991 0.8991 0.9759 0.9759 6.1103 6.1103 6.4430 6.4430 6.5522 6.5522 6.6215 6.6215 6.9468 6.9468 7.0962 7.0962 7.3413 7.3413 7.7003 7.7003 7.8195 7.8195 8.2968 8.2968 8.5584 8.5584 8.7092 8.7092 8.8234 8.8234 8.9001 8.9001 9.2435 9.2435 9.6047 9.6047 10.2464 10.2464 k = 0.3600 0.3600-0.0000 ( 13075 PWs) bands (ev): -69.5327 -69.5327 -69.5300 -69.5300 -39.3827 -39.3827 -39.3792 -39.3792 -38.2311 -38.2311 -38.2250 -38.2250 -38.1399 -38.1399 -38.1392 -38.1392 -18.6498 -18.6498 -18.6314 -18.6314 -5.7327 -5.7327 -5.6890 -5.6890 -4.0611 -4.0611 -3.9296 -3.9296 -3.7019 -3.7019 -3.5819 -3.5819 0.9021 0.9021 0.9903 0.9903 6.0995 6.0995 6.4737 6.4737 6.5569 6.5569 6.6358 6.6358 6.9544 6.9544 7.1218 7.1218 7.3261 7.3261 7.6840 7.6840 7.8195 7.8195 8.3398 8.3398 8.5233 8.5233 8.6663 8.6663 8.8195 8.8195 8.8656 8.8656 9.2312 9.2312 9.6076 9.6076 10.2261 10.2261 k = 0.3500 0.3500-0.0000 ( 13067 PWs) bands (ev): -69.5325 -69.5325 -69.5296 -69.5296 -39.3829 -39.3829 -39.3789 -39.3789 -38.2314 -38.2314 -38.2244 -38.2244 -38.1400 -38.1400 -38.1392 -38.1392 -18.6523 -18.6523 -18.6314 -18.6314 -5.7317 -5.7317 -5.6845 -5.6845 -4.0596 -4.0596 -3.9231 -3.9231 -3.7071 -3.7071 -3.5790 -3.5790 0.9041 0.9041 1.0045 1.0045 6.0890 6.0890 6.5060 6.5060 6.5632 6.5632 6.6518 6.6518 6.9635 6.9635 7.1498 7.1498 7.3136 7.3136 7.6602 7.6602 7.8175 7.8175 8.3821 8.3821 8.4857 8.4857 8.6265 8.6265 8.8112 8.8112 8.8441 8.8441 9.2179 9.2179 9.6097 9.6097 10.2049 10.2049 k = 0.3400 0.3400-0.0000 ( 13081 PWs) bands (ev): -69.5327 -69.5327 -69.5305 -69.5305 -39.3832 -39.3832 -39.3786 -39.3786 -38.2318 -38.2318 -38.2239 -38.2239 -38.1401 -38.1401 -38.1392 -38.1392 -18.6549 -18.6549 -18.6314 -18.6314 -5.7307 -5.7307 -5.6799 -5.6799 -4.0573 -4.0573 -3.9166 -3.9166 -3.7121 -3.7121 -3.5762 -3.5762 0.9051 0.9051 1.0182 1.0182 6.0781 6.0781 6.5365 6.5365 6.5705 6.5705 6.6682 6.6682 6.9739 6.9739 7.1804 7.1804 7.3039 7.3039 7.6285 7.6285 7.8123 7.8123 8.4227 8.4227 8.4420 8.4420 8.5878 8.5878 8.7989 8.7989 8.8321 8.8321 9.2031 9.2031 9.6091 9.6091 10.1807 10.1807 k = 0.3300 0.3300-0.0000 ( 13083 PWs) bands (ev): -69.5326 -69.5326 -69.5307 -69.5307 -39.3834 -39.3834 -39.3783 -39.3783 -38.2322 -38.2322 -38.2233 -38.2233 -38.1403 -38.1403 -38.1393 -38.1393 -18.6577 -18.6577 -18.6314 -18.6314 -5.7296 -5.7296 -5.6750 -5.6750 -4.0543 -4.0543 -3.9103 -3.9103 -3.7170 -3.7170 -3.5735 -3.5735 0.9047 0.9047 1.0312 1.0312 6.0689 6.0689 6.5676 6.5676 6.5797 6.5797 6.6855 6.6855 6.9871 6.9871 7.2119 7.2119 7.2990 7.2990 7.5904 7.5904 7.8095 7.8095 8.3967 8.3967 8.4653 8.4653 8.5527 8.5527 8.7922 8.7922 8.8278 8.8278 9.1865 9.1865 9.6063 9.6063 10.1558 10.1558 k = 0.3200 0.3200-0.0000 ( 13079 PWs) bands (ev): -69.5326 -69.5326 -69.5303 -69.5303 -39.3836 -39.3836 -39.3780 -39.3780 -38.2325 -38.2325 -38.2227 -38.2227 -38.1404 -38.1404 -38.1393 -38.1393 -18.6605 -18.6605 -18.6315 -18.6315 -5.7285 -5.7285 -5.6698 -5.6698 -4.0505 -4.0505 -3.9041 -3.9041 -3.7215 -3.7215 -3.5710 -3.5710 0.9028 0.9028 1.0433 1.0433 6.0606 6.0606 6.5900 6.5900 6.6002 6.6002 6.7039 6.7039 7.0027 7.0027 7.2437 7.2437 7.2989 7.2989 7.5466 7.5466 7.8106 7.8106 8.3500 8.3500 8.5061 8.5061 8.5207 8.5207 8.7910 8.7910 8.8277 8.8277 9.1681 9.1681 9.6019 9.6019 10.1312 10.1312 k = 0.3100 0.3100-0.0000 ( 13071 PWs) bands (ev): -69.5330 -69.5330 -69.5294 -69.5294 -39.3839 -39.3839 -39.3777 -39.3777 -38.2329 -38.2329 -38.2221 -38.2221 -38.1405 -38.1405 -38.1393 -38.1393 -18.6635 -18.6635 -18.6315 -18.6315 -5.7273 -5.7273 -5.6645 -5.6645 -4.0461 -4.0461 -3.8980 -3.8980 -3.7257 -3.7257 -3.5686 -3.5686 0.8993 0.8993 1.0544 1.0544 6.0535 6.0535 6.6030 6.6030 6.6311 6.6311 6.7228 6.7228 7.0221 7.0221 7.2764 7.2764 7.3046 7.3046 7.4982 7.4982 7.8134 7.8134 8.3010 8.3010 8.4936 8.4936 8.5459 8.5459 8.7932 8.7932 8.8319 8.8319 9.1482 9.1482 9.5951 9.5951 10.1066 10.1066 k = 0.3000 0.3000-0.0000 ( 13071 PWs) bands (ev): -69.5328 -69.5328 -69.5296 -69.5296 -39.3841 -39.3841 -39.3774 -39.3774 -38.2333 -38.2333 -38.2215 -38.2215 -38.1406 -38.1406 -38.1393 -38.1393 -18.6665 -18.6665 -18.6315 -18.6315 -5.7260 -5.7260 -5.6589 -5.6589 -4.0409 -4.0409 -3.8923 -3.8923 -3.7293 -3.7293 -3.5664 -3.5664 0.8939 0.8939 1.0644 1.0644 6.0475 6.0475 6.6189 6.6189 6.6591 6.6591 6.7425 6.7425 7.0425 7.0425 7.3076 7.3076 7.3175 7.3175 7.4470 7.4470 7.8157 7.8157 8.2560 8.2560 8.4661 8.4661 8.5830 8.5830 8.7957 8.7957 8.8389 8.8389 9.1262 9.1262 9.5869 9.5869 10.0800 10.0800 k = 0.2900 0.2900-0.0000 ( 13087 PWs) bands (ev): -69.5331 -69.5331 -69.5304 -69.5304 -39.3844 -39.3844 -39.3771 -39.3771 -38.2338 -38.2338 -38.2209 -38.2209 -38.1407 -38.1407 -38.1393 -38.1393 -18.6695 -18.6695 -18.6315 -18.6315 -5.7247 -5.7247 -5.6531 -5.6531 -4.0352 -4.0352 -3.8869 -3.8869 -3.7324 -3.7324 -3.5643 -3.5643 0.8866 0.8866 1.0729 1.0729 6.0424 6.0424 6.6361 6.6361 6.6842 6.6842 6.7624 6.7624 7.0658 7.0658 7.3279 7.3279 7.3437 7.3437 7.3941 7.3941 7.8190 7.8190 8.2101 8.2101 8.4418 8.4418 8.6143 8.6143 8.7988 8.7988 8.8486 8.8486 9.1007 9.1007 9.5769 9.5769 10.0509 10.0509 k = 0.2800 0.2800-0.0000 ( 13111 PWs) bands (ev): -69.5344 -69.5344 -69.5310 -69.5310 -39.3847 -39.3847 -39.3768 -39.3768 -38.2342 -38.2342 -38.2203 -38.2203 -38.1408 -38.1408 -38.1394 -38.1394 -18.6727 -18.6727 -18.6316 -18.6316 -5.7234 -5.7234 -5.6472 -5.6472 -4.0287 -4.0287 -3.8820 -3.8820 -3.7347 -3.7347 -3.5625 -3.5625 0.8771 0.8771 1.0800 1.0800 6.0373 6.0373 6.6530 6.6530 6.7074 6.7074 6.7800 6.7800 7.0925 7.0925 7.3336 7.3336 7.3559 7.3559 7.3767 7.3767 7.8261 7.8261 8.1636 8.1636 8.4205 8.4205 8.6395 8.6395 8.8068 8.8068 8.8597 8.8597 9.0747 9.0747 9.5616 9.5616 10.0230 10.0230 k = 0.2700 0.2700-0.0000 ( 13119 PWs) bands (ev): -69.5347 -69.5347 -69.5312 -69.5312 -39.3850 -39.3850 -39.3764 -39.3764 -38.2347 -38.2347 -38.2197 -38.2197 -38.1409 -38.1409 -38.1394 -38.1394 -18.6758 -18.6758 -18.6316 -18.6316 -5.7221 -5.7221 -5.6410 -5.6410 -4.0217 -4.0217 -3.8775 -3.8775 -3.7361 -3.7361 -3.5609 -3.5609 0.8655 0.8655 1.0856 1.0856 6.0351 6.0351 6.6734 6.6734 6.7276 6.7276 6.7991 6.7991 7.1226 7.1226 7.2833 7.2833 7.3813 7.3813 7.4098 7.4098 7.8378 7.8378 8.1208 8.1208 8.4039 8.4039 8.6552 8.6552 8.8213 8.8213 8.8734 8.8734 9.0486 9.0486 9.5479 9.5479 9.9947 9.9947 k = 0.2600 0.2600-0.0000 ( 13119 PWs) bands (ev): -69.5351 -69.5351 -69.5308 -69.5308 -39.3852 -39.3852 -39.3761 -39.3761 -38.2351 -38.2351 -38.2190 -38.2190 -38.1410 -38.1410 -38.1394 -38.1394 -18.6790 -18.6790 -18.6316 -18.6316 -5.7208 -5.7208 -5.6347 -5.6347 -4.0141 -4.0141 -3.8736 -3.8736 -3.7364 -3.7364 -3.5594 -3.5594 0.8517 0.8517 1.0896 1.0896 6.0335 6.0335 6.6946 6.6946 6.7467 6.7467 6.8177 6.8177 7.1565 7.1565 7.2323 7.2323 7.4170 7.4170 7.4436 7.4436 7.8518 7.8518 8.0790 8.0790 8.3944 8.3944 8.6629 8.6629 8.8439 8.8439 8.8884 8.8884 9.0216 9.0216 9.5324 9.5324 9.9673 9.9673 k = 0.2500 0.2500-0.0000 ( 13107 PWs) bands (ev): -69.5346 -69.5346 -69.5305 -69.5305 -39.3855 -39.3855 -39.3757 -39.3757 -38.2356 -38.2356 -38.2184 -38.2184 -38.1411 -38.1411 -38.1394 -38.1394 -18.6822 -18.6822 -18.6317 -18.6317 -5.7195 -5.7195 -5.6282 -5.6282 -4.0061 -4.0061 -3.8704 -3.8704 -3.7357 -3.7357 -3.5583 -3.5583 0.8357 0.8357 1.0920 1.0920 6.0342 6.0342 6.7163 6.7163 6.7640 6.7640 6.8380 6.8380 7.1773 7.1773 7.2002 7.2002 7.4571 7.4571 7.4776 7.4776 7.8717 7.8717 8.0423 8.0423 8.3887 8.3887 8.6620 8.6620 8.8703 8.8703 8.9040 8.9040 8.9943 8.9943 9.5213 9.5213 9.9409 9.9409 k = 0.2400 0.2400-0.0000 ( 13101 PWs) bands (ev): -69.5339 -69.5339 -69.5307 -69.5307 -39.3858 -39.3858 -39.3754 -39.3754 -38.2360 -38.2360 -38.2177 -38.2177 -38.1412 -38.1412 -38.1393 -38.1393 -18.6854 -18.6854 -18.6317 -18.6317 -5.7182 -5.7182 -5.6215 -5.6215 -3.9976 -3.9976 -3.8679 -3.8679 -3.7337 -3.7337 -3.5573 -3.5573 0.8176 0.8176 1.0929 1.0929 6.0366 6.0366 6.7356 6.7356 6.7792 6.7792 6.8572 6.8572 7.1379 7.1379 7.2359 7.2359 7.4960 7.4960 7.5164 7.5164 7.8946 7.8946 8.0099 8.0099 8.3851 8.3851 8.6543 8.6543 8.8935 8.8935 8.9236 8.9236 8.9675 8.9675 9.5108 9.5108 9.9145 9.9145 k = 0.2300 0.2300-0.0000 ( 13097 PWs) bands (ev): -69.5337 -69.5337 -69.5306 -69.5306 -39.3861 -39.3861 -39.3751 -39.3751 -38.2365 -38.2365 -38.2171 -38.2171 -38.1413 -38.1413 -38.1393 -38.1393 -18.6886 -18.6886 -18.6317 -18.6317 -5.7169 -5.7169 -5.6148 -5.6148 -3.9888 -3.9888 -3.8660 -3.8660 -3.7305 -3.7305 -3.5567 -3.5567 0.7973 0.7973 1.0921 1.0921 6.0393 6.0393 6.7509 6.7509 6.7926 6.7926 6.8746 6.8746 7.1028 7.1028 7.2778 7.2778 7.5288 7.5288 7.5651 7.5651 7.9217 7.9217 7.9811 7.9811 8.3851 8.3851 8.6422 8.6422 8.9076 8.9076 8.9325 8.9325 8.9611 8.9611 9.5003 9.5003 9.8901 9.8901 k = 0.2200 0.2200-0.0000 ( 13081 PWs) bands (ev): -69.5335 -69.5335 -69.5296 -69.5296 -39.3863 -39.3863 -39.3747 -39.3747 -38.2369 -38.2369 -38.2164 -38.2164 -38.1414 -38.1414 -38.1393 -38.1393 -18.6918 -18.6918 -18.6318 -18.6318 -5.7157 -5.7157 -5.6080 -5.6080 -3.9798 -3.9798 -3.8646 -3.8646 -3.7262 -3.7262 -3.5563 -3.5563 0.7750 0.7750 1.0898 1.0898 6.0435 6.0435 6.7614 6.7614 6.8031 6.8031 6.8907 6.8907 7.0810 7.0810 7.3224 7.3224 7.5569 7.5569 7.6219 7.6219 7.9368 7.9368 7.9752 7.9752 8.3908 8.3908 8.6267 8.6267 8.9018 8.9018 8.9228 8.9228 8.9934 8.9934 9.4927 9.4927 9.8682 9.8682 k = 0.2100 0.2100-0.0000 ( 13087 PWs) bands (ev): -69.5335 -69.5335 -69.5300 -69.5300 -39.3866 -39.3866 -39.3744 -39.3744 -38.2374 -38.2374 -38.2158 -38.2158 -38.1415 -38.1415 -38.1393 -38.1393 -18.6949 -18.6949 -18.6318 -18.6318 -5.7145 -5.7145 -5.6012 -5.6012 -3.9708 -3.9708 -3.8635 -3.8635 -3.7207 -3.7207 -3.5563 -3.5563 0.7508 0.7508 1.0861 1.0861 6.0484 6.0484 6.7632 6.7632 6.8088 6.8088 6.9042 6.9042 7.0746 7.0746 7.3682 7.3682 7.5793 7.5793 7.6802 7.6802 7.9198 7.9198 8.0070 8.0070 8.3967 8.3967 8.6083 8.6083 8.8724 8.8724 8.9277 8.9277 9.0286 9.0286 9.4894 9.4894 9.8465 9.8465 k = 0.2000 0.2000-0.0000 ( 13079 PWs) bands (ev): -69.5330 -69.5330 -69.5299 -69.5299 -39.3869 -39.3869 -39.3741 -39.3741 -38.2378 -38.2378 -38.2152 -38.2152 -38.1416 -38.1416 -38.1393 -38.1393 -18.6980 -18.6980 -18.6318 -18.6318 -5.7133 -5.7133 -5.5944 -5.5944 -3.9618 -3.9618 -3.8626 -3.8626 -3.7143 -3.7143 -3.5565 -3.5565 0.7250 0.7250 1.0810 1.0810 6.0548 6.0548 6.7530 6.7530 6.8145 6.8145 6.9164 6.9164 7.0866 7.0866 7.4154 7.4154 7.6012 7.6012 7.7415 7.7415 7.9022 7.9022 8.0497 8.0497 8.4083 8.4083 8.5891 8.5891 8.8421 8.8421 8.9333 8.9333 9.0653 9.0653 9.4902 9.4902 9.8271 9.8271 k = 0.1900 0.1900-0.0000 ( 13079 PWs) bands (ev): -69.5336 -69.5336 -69.5293 -69.5293 -39.3871 -39.3871 -39.3738 -39.3738 -38.2382 -38.2382 -38.2146 -38.2146 -38.1416 -38.1416 -38.1393 -38.1393 -18.7010 -18.7010 -18.6319 -18.6319 -5.7121 -5.7121 -5.5876 -5.5876 -3.9532 -3.9532 -3.8615 -3.8615 -3.7070 -3.7070 -3.5570 -3.5570 0.6977 0.6977 1.0748 1.0748 6.0610 6.0610 6.7311 6.7311 6.8221 6.8221 6.9268 6.9268 7.1101 7.1101 7.4624 7.4624 7.6197 7.6197 7.8037 7.8037 7.8900 7.8900 8.0974 8.0974 8.4224 8.4224 8.5686 8.5686 8.8107 8.8107 8.9394 8.9394 9.1016 9.1016 9.4936 9.4936 9.8103 9.8103 k = 0.1800 0.1800-0.0000 ( 13079 PWs) bands (ev): -69.5337 -69.5337 -69.5292 -69.5292 -39.3874 -39.3874 -39.3734 -39.3734 -38.2387 -38.2387 -38.2140 -38.2140 -38.1417 -38.1417 -38.1393 -38.1393 -18.7039 -18.7039 -18.6319 -18.6319 -5.7110 -5.7110 -5.5808 -5.5808 -3.9451 -3.9451 -3.8600 -3.8600 -3.6990 -3.6990 -3.5579 -3.5579 0.6692 0.6692 1.0675 1.0675 6.0673 6.0673 6.7020 6.7020 6.8312 6.8312 6.9374 6.9374 7.1420 7.1420 7.5093 7.5093 7.6385 7.6385 7.8517 7.8517 7.8949 7.8949 8.1484 8.1484 8.4403 8.4403 8.5490 8.5490 8.7805 8.7805 8.9432 8.9432 9.1366 9.1366 9.5040 9.5040 9.7958 9.7958 k = 0.1700 0.1700-0.0000 ( 13079 PWs) bands (ev): -69.5343 -69.5343 -69.5285 -69.5285 -39.3876 -39.3876 -39.3732 -39.3732 -38.2391 -38.2391 -38.2135 -38.2135 -38.1417 -38.1417 -38.1393 -38.1393 -18.7068 -18.7068 -18.6320 -18.6320 -5.7099 -5.7099 -5.5742 -5.5742 -3.9379 -3.9379 -3.8578 -3.8578 -3.6904 -3.6904 -3.5590 -3.5590 0.6397 0.6397 1.0593 1.0593 6.0729 6.0729 6.6695 6.6695 6.8417 6.8417 6.9481 6.9481 7.1783 7.1783 7.5549 7.5549 7.6560 7.6560 7.8623 7.8623 7.9403 7.9403 8.2019 8.2019 8.4628 8.4628 8.5312 8.5312 8.7514 8.7514 8.9474 8.9474 9.1700 9.1700 9.5203 9.5203 9.7844 9.7844 k = 0.1600 0.1600-0.0000 ( 13083 PWs) bands (ev): -69.5350 -69.5350 -69.5281 -69.5281 -39.3879 -39.3879 -39.3729 -39.3729 -38.2395 -38.2395 -38.2130 -38.2130 -38.1418 -38.1418 -38.1393 -38.1393 -18.7095 -18.7095 -18.6320 -18.6320 -5.7089 -5.7089 -5.5676 -5.5676 -3.9318 -3.9318 -3.8544 -3.8544 -3.6814 -3.6814 -3.5604 -3.5604 0.6096 0.6096 1.0503 1.0503 6.0777 6.0777 6.6360 6.6360 6.8531 6.8531 6.9589 6.9589 7.2147 7.2147 7.5992 7.5992 7.6735 7.6735 7.8650 7.8650 7.9937 7.9937 8.2552 8.2552 8.4889 8.4889 8.5184 8.5184 8.7245 8.7245 8.9514 8.9514 9.2017 9.2017 9.5440 9.5440 9.7756 9.7756 k = 0.1500 0.1500-0.0000 ( 13085 PWs) bands (ev): -69.5357 -69.5357 -69.5275 -69.5275 -39.3881 -39.3881 -39.3726 -39.3726 -38.2398 -38.2398 -38.2125 -38.2125 -38.1418 -38.1418 -38.1392 -38.1392 -18.7122 -18.7122 -18.6320 -18.6320 -5.7079 -5.7079 -5.5613 -5.5613 -3.9270 -3.9270 -3.8499 -3.8499 -3.6721 -3.6721 -3.5621 -3.5621 0.5791 0.5791 1.0408 1.0408 6.0813 6.0813 6.6028 6.6028 6.8660 6.8660 6.9681 6.9681 7.2526 7.2526 7.6396 7.6396 7.6910 7.6910 7.8723 7.8723 8.0428 8.0428 8.3076 8.3076 8.5083 8.5083 8.5237 8.5237 8.7018 8.7018 8.9563 8.9563 9.2339 9.2339 9.5715 9.5715 9.7712 9.7712 k = 0.1400 0.1400-0.0000 ( 13069 PWs) bands (ev): -69.5349 -69.5349 -69.5271 -69.5271 -39.3883 -39.3883 -39.3723 -39.3723 -38.2402 -38.2402 -38.2120 -38.2120 -38.1419 -38.1419 -38.1392 -38.1392 -18.7147 -18.7147 -18.6321 -18.6321 -5.7070 -5.7070 -5.5551 -5.5551 -3.9235 -3.9235 -3.8441 -3.8441 -3.6626 -3.6626 -3.5641 -3.5641 0.5486 0.5486 1.0310 1.0310 6.0890 6.0890 6.5709 6.5709 6.8808 6.8808 6.9771 6.9771 7.2903 7.2903 7.6778 7.6778 7.7103 7.7103 7.8875 7.8875 8.0802 8.0802 8.3554 8.3554 8.5183 8.5183 8.5533 8.5533 8.6868 8.6868 8.9636 8.9636 9.2636 9.2636 9.6062 9.6062 9.7735 9.7735 k = 0.1300 0.1300-0.0000 ( 13073 PWs) bands (ev): -69.5349 -69.5349 -69.5273 -69.5273 -39.3885 -39.3885 -39.3721 -39.3721 -38.2406 -38.2406 -38.2115 -38.2115 -38.1419 -38.1419 -38.1392 -38.1392 -18.7171 -18.7171 -18.6321 -18.6321 -5.7061 -5.7061 -5.5493 -5.5493 -3.9212 -3.9212 -3.8373 -3.8373 -3.6531 -3.6531 -3.5664 -3.5664 0.5184 0.5184 1.0209 1.0209 6.0933 6.0933 6.5406 6.5406 6.8954 6.8954 6.9847 6.9847 7.3248 7.3248 7.7115 7.7115 7.7286 7.7286 7.9075 7.9075 8.1006 8.1006 8.3909 8.3909 8.5406 8.5406 8.5873 8.5873 8.6842 8.6842 8.9732 8.9732 9.2906 9.2906 9.6425 9.6425 9.7802 9.7802 k = 0.1200 0.1200-0.0000 ( 13067 PWs) bands (ev): -69.5345 -69.5345 -69.5272 -69.5272 -39.3887 -39.3887 -39.3719 -39.3719 -38.2409 -38.2409 -38.2111 -38.2111 -38.1420 -38.1420 -38.1391 -38.1391 -18.7194 -18.7194 -18.6321 -18.6321 -5.7052 -5.7052 -5.5436 -5.5436 -3.9198 -3.9198 -3.8296 -3.8296 -3.6438 -3.6438 -3.5688 -3.5688 0.4888 0.4888 1.0107 1.0107 6.0985 6.0985 6.5121 6.5121 6.9110 6.9110 6.9922 6.9922 7.3564 7.3564 7.7420 7.7420 7.7479 7.7479 7.9333 7.9333 8.1053 8.1053 8.4103 8.4103 8.5784 8.5784 8.6260 8.6260 8.7008 8.7008 8.9866 8.9866 9.3156 9.3156 9.6789 9.6789 9.7986 9.7986 k = 0.1100 0.1100-0.0000 ( 13075 PWs) bands (ev): -69.5346 -69.5346 -69.5277 -69.5277 -39.3889 -39.3889 -39.3716 -39.3716 -38.2413 -38.2413 -38.2106 -38.2106 -38.1420 -38.1420 -38.1391 -38.1391 -18.7215 -18.7215 -18.6322 -18.6322 -5.7045 -5.7045 -5.5384 -5.5384 -3.9191 -3.9191 -3.8215 -3.8215 -3.6346 -3.6346 -3.5714 -3.5714 0.4601 0.4601 1.0007 1.0007 6.1015 6.1015 6.4858 6.4858 6.9273 6.9273 6.9986 6.9986 7.3833 7.3833 7.7634 7.7634 7.7710 7.7710 7.9627 7.9627 8.0973 8.0973 8.4092 8.4092 8.6255 8.6255 8.6677 8.6677 8.7379 8.7379 9.0044 9.0044 9.3371 9.3371 9.7061 9.7061 9.8301 9.8301 k = 0.1000 0.1000-0.0000 ( 13077 PWs) bands (ev): -69.5347 -69.5347 -69.5276 -69.5276 -39.3891 -39.3891 -39.3714 -39.3714 -38.2416 -38.2416 -38.2103 -38.2103 -38.1420 -38.1420 -38.1391 -38.1391 -18.7235 -18.7235 -18.6322 -18.6322 -5.7037 -5.7037 -5.5334 -5.5334 -3.9189 -3.9189 -3.8131 -3.8131 -3.6259 -3.6259 -3.5740 -3.5740 0.4327 0.4327 0.9910 0.9910 6.1039 6.1039 6.4616 6.4616 6.9443 6.9443 7.0039 7.0039 7.4067 7.4067 7.7821 7.7821 7.7936 7.7936 7.9931 7.9931 8.0815 8.0815 8.3973 8.3973 8.6818 8.6818 8.7143 8.7143 8.7901 8.7901 9.0269 9.0269 9.3577 9.3577 9.7272 9.7272 9.8738 9.8738 k = 0.0900 0.0900-0.0000 ( 13069 PWs) bands (ev): -69.5345 -69.5345 -69.5273 -69.5273 -39.3892 -39.3892 -39.3712 -39.3712 -38.2418 -38.2418 -38.2099 -38.2099 -38.1421 -38.1421 -38.1391 -38.1391 -18.7253 -18.7253 -18.6322 -18.6322 -5.7031 -5.7031 -5.5288 -5.5288 -3.9189 -3.9189 -3.8047 -3.8047 -3.6179 -3.6179 -3.5765 -3.5765 0.4068 0.4068 0.9817 0.9817 6.1061 6.1061 6.4398 6.4398 6.9618 6.9618 7.0093 7.0093 7.4278 7.4278 7.8032 7.8032 7.8135 7.8135 8.0204 8.0204 8.0643 8.0643 8.3802 8.3802 8.7393 8.7393 8.7682 8.7682 8.8516 8.8516 9.0560 9.0560 9.3761 9.3761 9.7453 9.7453 9.9183 9.9183 k = 0.0800 0.0800-0.0000 ( 13075 PWs) bands (ev): -69.5346 -69.5346 -69.5275 -69.5275 -39.3894 -39.3894 -39.3711 -39.3711 -38.2421 -38.2421 -38.2096 -38.2096 -38.1421 -38.1421 -38.1391 -38.1391 -18.7269 -18.7269 -18.6323 -18.6323 -5.7025 -5.7025 -5.5247 -5.5247 -3.9192 -3.9192 -3.7965 -3.7965 -3.6108 -3.6108 -3.5788 -3.5788 0.3828 0.3828 0.9730 0.9730 6.1062 6.1062 6.4204 6.4204 6.9797 6.9797 7.0134 7.0134 7.4451 7.4451 7.8214 7.8214 7.8302 7.8302 8.0211 8.0211 8.0680 8.0680 8.3570 8.3570 8.7946 8.7946 8.8273 8.8273 8.9178 8.9178 9.0911 9.0911 9.3922 9.3922 9.7614 9.7614 9.9436 9.9436 k = 0.0700 0.0700-0.0000 ( 13075 PWs) bands (ev): -69.5351 -69.5351 -69.5270 -69.5270 -39.3895 -39.3895 -39.3709 -39.3709 -38.2423 -38.2423 -38.2094 -38.2094 -38.1421 -38.1421 -38.1390 -38.1390 -18.7284 -18.7284 -18.6323 -18.6323 -5.7020 -5.7020 -5.5209 -5.5209 -3.9196 -3.9196 -3.7888 -3.7888 -3.6050 -3.6050 -3.5802 -3.5802 0.3608 0.3608 0.9651 0.9651 6.1058 6.1058 6.4033 6.4033 6.9967 6.9967 7.0178 7.0178 7.4607 7.4607 7.8339 7.8339 7.8482 7.8482 7.9993 7.9993 8.0934 8.0934 8.3338 8.3338 8.8501 8.8501 8.8889 8.8889 8.9864 8.9864 9.1353 9.1353 9.4060 9.4060 9.7757 9.7757 9.9284 9.9284 k = 0.0600 0.0600-0.0000 ( 13055 PWs) bands (ev): -69.5343 -69.5343 -69.5262 -69.5262 -39.3896 -39.3896 -39.3708 -39.3708 -38.2425 -38.2425 -38.2091 -38.2091 -38.1421 -38.1421 -38.1390 -38.1390 -18.7296 -18.7296 -18.6323 -18.6323 -5.7015 -5.7015 -5.5176 -5.5176 -3.9200 -3.9200 -3.7816 -3.7816 -3.6012 -3.6012 -3.5803 -3.5803 0.3413 0.3413 0.9579 0.9579 6.1085 6.1085 6.3888 6.3888 7.0134 7.0134 7.0224 7.0224 7.4743 7.4743 7.8432 7.8432 7.8715 7.8715 7.9768 7.9768 8.1174 8.1174 8.3146 8.3146 8.9077 8.9077 8.9492 8.9492 9.0553 9.0553 9.1864 9.1864 9.4190 9.4190 9.7843 9.7843 9.8837 9.8837 k = 0.0500 0.0500-0.0000 ( 13055 PWs) bands (ev): -69.5348 -69.5348 -69.5257 -69.5257 -39.3897 -39.3897 -39.3707 -39.3707 -38.2426 -38.2426 -38.2089 -38.2089 -38.1421 -38.1421 -38.1390 -38.1390 -18.7307 -18.7307 -18.6323 -18.6323 -5.7011 -5.7011 -5.5147 -5.5147 -3.9205 -3.9205 -3.7751 -3.7751 -3.5998 -3.5998 -3.5787 -3.5787 0.3244 0.3244 0.9517 0.9517 6.1077 6.1077 6.3764 6.3764 7.0256 7.0256 7.0285 7.0285 7.4847 7.4847 7.8477 7.8477 7.8876 7.8876 7.9576 7.9576 8.1379 8.1379 8.2940 8.2940 8.9644 8.9644 9.0049 9.0049 9.1220 9.1220 9.2433 9.2433 9.4301 9.4301 9.7613 9.7613 9.8542 9.8542 k = 0.0400 0.0400-0.0000 ( 13081 PWs) bands (ev): -69.5354 -69.5354 -69.5270 -69.5270 -39.3898 -39.3898 -39.3706 -39.3706 -38.2428 -38.2428 -38.2087 -38.2087 -38.1422 -38.1422 -38.1390 -38.1390 -18.7316 -18.7316 -18.6324 -18.6324 -5.7008 -5.7008 -5.5124 -5.5124 -3.9208 -3.9208 -3.7695 -3.7695 -3.6002 -3.6002 -3.5761 -3.5761 0.3103 0.3103 0.9464 0.9464 6.1065 6.1065 6.3662 6.3662 7.0260 7.0260 7.0405 7.0405 7.4908 7.4908 7.8502 7.8502 7.8971 7.8971 7.9457 7.9457 8.1495 8.1495 8.2711 8.2711 9.0151 9.0151 9.0550 9.0550 9.1842 9.1842 9.3027 9.3027 9.4384 9.4384 9.6986 9.6986 9.8582 9.8582 k = 0.0300 0.0300-0.0000 ( 13085 PWs) bands (ev): -69.5351 -69.5351 -69.5276 -69.5276 -39.3899 -39.3899 -39.3705 -39.3705 -38.2429 -38.2429 -38.2086 -38.2086 -38.1422 -38.1422 -38.1390 -38.1390 -18.7323 -18.7323 -18.6324 -18.6324 -5.7005 -5.7005 -5.5106 -5.5106 -3.9211 -3.9211 -3.7650 -3.7650 -3.6012 -3.6012 -3.5734 -3.5734 0.2991 0.2991 0.9423 0.9423 6.1075 6.1075 6.3585 6.3585 7.0271 7.0271 7.0513 7.0513 7.4979 7.4979 7.8500 7.8500 7.9008 7.9008 7.9471 7.9471 8.1549 8.1549 8.2565 8.2565 9.0554 9.0554 9.1068 9.1068 9.2408 9.2408 9.3615 9.3615 9.4441 9.4441 9.6297 9.6297 9.8747 9.8747 k = 0.0200 0.0200-0.0000 ( 13089 PWs) bands (ev): -69.5351 -69.5351 -69.5279 -69.5279 -39.3899 -39.3899 -39.3705 -39.3705 -38.2430 -38.2430 -38.2085 -38.2085 -38.1422 -38.1422 -38.1390 -38.1390 -18.7328 -18.7328 -18.6324 -18.6324 -5.7004 -5.7004 -5.5093 -5.5093 -3.9213 -3.9213 -3.7617 -3.7617 -3.6022 -3.6022 -3.5712 -3.5712 0.2910 0.2910 0.9393 0.9393 6.1069 6.1069 6.3529 6.3529 7.0287 7.0287 7.0598 7.0598 7.5029 7.5029 7.8473 7.8473 7.8998 7.8998 7.9551 7.9551 8.1538 8.1538 8.2472 8.2472 9.0833 9.0833 9.1616 9.1616 9.2884 9.2884 9.4127 9.4127 9.4439 9.4439 9.5685 9.5685 9.8909 9.8909 k = 0.0100 0.0100-0.0000 ( 13103 PWs) bands (ev): -69.5356 -69.5356 -69.5284 -69.5284 -39.3900 -39.3900 -39.3705 -39.3705 -38.2431 -38.2431 -38.2085 -38.2085 -38.1422 -38.1422 -38.1390 -38.1390 -18.7331 -18.7331 -18.6324 -18.6324 -5.7002 -5.7002 -5.5085 -5.5085 -3.9215 -3.9215 -3.7596 -3.7596 -3.6030 -3.6030 -3.5698 -3.5698 0.2861 0.2861 0.9375 0.9375 6.1040 6.1040 6.3495 6.3495 7.0283 7.0283 7.0644 7.0644 7.5053 7.5053 7.8440 7.8440 7.8976 7.8976 7.9630 7.9630 8.1500 8.1500 8.2421 8.2421 9.1000 9.1000 9.2070 9.2070 9.3237 9.3237 9.4238 9.4238 9.4529 9.4529 9.5296 9.5296 9.9019 9.9019 k = 0.0000 0.0000 0.0000 ( 13115 PWs) bands (ev): -69.5358 -69.5358 -69.5290 -69.5290 -39.3900 -39.3900 -39.3705 -39.3705 -38.2431 -38.2431 -38.2085 -38.2085 -38.1422 -38.1422 -38.1390 -38.1390 -18.7332 -18.7332 -18.6324 -18.6324 -5.7002 -5.7002 -5.5082 -5.5082 -3.9215 -3.9215 -3.7589 -3.7589 -3.6032 -3.6032 -3.5693 -3.5693 0.2845 0.2845 0.9369 0.9369 6.1023 6.1023 6.3483 6.3483 7.0275 7.0275 7.0652 7.0652 7.5063 7.5063 7.8432 7.8432 7.8970 7.8970 7.9644 7.9644 8.1484 8.1484 8.2410 8.2410 9.1019 9.1019 9.2255 9.2255 9.3399 9.3399 9.4089 9.4089 9.4660 9.4660 9.5187 9.5187 9.9055 9.9055 k = 0.0000 0.0000 0.0000 ( 13115 PWs) bands (ev): -69.5358 -69.5358 -69.5290 -69.5290 -39.3900 -39.3900 -39.3705 -39.3705 -38.2431 -38.2431 -38.2085 -38.2085 -38.1422 -38.1422 -38.1390 -38.1390 -18.7332 -18.7332 -18.6324 -18.6324 -5.7002 -5.7002 -5.5082 -5.5082 -3.9215 -3.9215 -3.7589 -3.7589 -3.6032 -3.6032 -3.5693 -3.5693 0.2845 0.2845 0.9369 0.9369 6.1023 6.1023 6.3483 6.3483 7.0275 7.0275 7.0652 7.0652 7.5063 7.5063 7.8432 7.8432 7.8970 7.8970 7.9644 7.9644 8.1484 8.1484 8.2410 8.2410 9.1019 9.1019 9.2255 9.2255 9.3399 9.3399 9.4089 9.4089 9.4660 9.4660 9.5187 9.5187 9.9055 9.9055 k = 0.0000 0.0000 0.0142 ( 13103 PWs) bands (ev): -69.5356 -69.5356 -69.5284 -69.5284 -39.3900 -39.3900 -39.3705 -39.3705 -38.2431 -38.2431 -38.2085 -38.2085 -38.1422 -38.1422 -38.1390 -38.1390 -18.7332 -18.7332 -18.6324 -18.6324 -5.7002 -5.7002 -5.5083 -5.5083 -3.9214 -3.9214 -3.7589 -3.7589 -3.6034 -3.6034 -3.5693 -3.5693 0.2857 0.2857 0.9362 0.9362 6.1031 6.1031 6.3440 6.3440 7.0294 7.0294 7.0657 7.0657 7.5086 7.5086 7.8435 7.8435 7.8973 7.8973 7.9651 7.9651 8.1509 8.1509 8.2437 8.2437 9.1018 9.1018 9.2193 9.2193 9.3185 9.3185 9.4318 9.4318 9.4365 9.4365 9.5483 9.5483 9.9074 9.9074 k = 0.0000 0.0000 0.0284 ( 13099 PWs) bands (ev): -69.5359 -69.5359 -69.5279 -69.5279 -39.3900 -39.3900 -39.3705 -39.3705 -38.2431 -38.2431 -38.2085 -38.2085 -38.1422 -38.1422 -38.1390 -38.1390 -18.7332 -18.7332 -18.6324 -18.6324 -5.7001 -5.7001 -5.5084 -5.5084 -3.9211 -3.9211 -3.7589 -3.7589 -3.6041 -3.6041 -3.5693 -3.5693 0.2893 0.2893 0.9341 0.9341 6.1031 6.1031 6.3312 6.3312 7.0341 7.0341 7.0679 7.0679 7.5073 7.5073 7.8448 7.8448 7.8983 7.8983 7.9652 7.9652 8.1519 8.1519 8.2450 8.2450 9.1007 9.1007 9.2009 9.2009 9.2808 9.2808 9.3906 9.3906 9.4730 9.4730 9.5945 9.5945 9.9129 9.9129 k = 0.0000 0.0000 0.0426 ( 13107 PWs) bands (ev): -69.5359 -69.5359 -69.5284 -69.5284 -39.3900 -39.3900 -39.3705 -39.3705 -38.2431 -38.2431 -38.2085 -38.2085 -38.1422 -38.1422 -38.1390 -38.1390 -18.7332 -18.7332 -18.6324 -18.6324 -5.6999 -5.6999 -5.5087 -5.5087 -3.9206 -3.9206 -3.7588 -3.7588 -3.6051 -3.6051 -3.5694 -3.5694 0.2953 0.2953 0.9306 0.9306 6.1031 6.1031 6.3110 6.3110 7.0408 7.0408 7.0664 7.0664 7.5089 7.5089 7.8477 7.8477 7.9006 7.9006 7.9655 7.9655 8.1514 8.1514 8.2447 8.2447 9.0983 9.0983 9.1739 9.1739 9.2414 9.2414 9.3432 9.3432 9.5181 9.5181 9.6423 9.6423 9.9055 9.9055 k = 0.0000 0.0000 0.0568 ( 13083 PWs) bands (ev): -69.5359 -69.5359 -69.5267 -69.5267 -39.3899 -39.3899 -39.3705 -39.3705 -38.2431 -38.2431 -38.2085 -38.2085 -38.1421 -38.1421 -38.1390 -38.1390 -18.7332 -18.7332 -18.6324 -18.6324 -5.6996 -5.6996 -5.5090 -5.5090 -3.9199 -3.9199 -3.7587 -3.7587 -3.6065 -3.6065 -3.5695 -3.5695 0.3036 0.3036 0.9257 0.9257 6.1031 6.1031 6.2848 6.2848 7.0482 7.0482 7.0694 7.0694 7.5117 7.5117 7.8519 7.8519 7.9038 7.9038 7.9660 7.9660 8.1577 8.1577 8.2518 8.2518 9.0946 9.0946 9.1434 9.1434 9.2041 9.2041 9.2965 9.2965 9.5644 9.5644 9.6903 9.6903 9.9128 9.9128 k = 0.0000 0.0000 0.0710 ( 13099 PWs) bands (ev): -69.5350 -69.5350 -69.5288 -69.5288 -39.3900 -39.3900 -39.3704 -39.3704 -38.2431 -38.2431 -38.2085 -38.2085 -38.1422 -38.1422 -38.1390 -38.1390 -18.7332 -18.7332 -18.6324 -18.6324 -5.6992 -5.6992 -5.5095 -5.5095 -3.9189 -3.9189 -3.7586 -3.7586 -3.6084 -3.6084 -3.5697 -3.5697 0.3141 0.3141 0.9193 0.9193 6.1036 6.1036 6.2538 6.2538 7.0526 7.0526 7.0701 7.0701 7.5196 7.5196 7.8594 7.8594 7.9096 7.9096 7.9675 7.9675 8.1489 8.1489 8.2428 8.2428 9.0797 9.0797 9.1118 9.1118 9.1680 9.1680 9.2500 9.2500 9.6110 9.6110 9.7379 9.7379 9.9100 9.9100 k = 0.0000 0.0000 0.0852 ( 13091 PWs) bands (ev): -69.5344 -69.5344 -69.5288 -69.5288 -39.3900 -39.3900 -39.3704 -39.3704 -38.2431 -38.2431 -38.2084 -38.2084 -38.1422 -38.1422 -38.1389 -38.1389 -18.7331 -18.7331 -18.6325 -18.6325 -5.6988 -5.6988 -5.5100 -5.5100 -3.9178 -3.9178 -3.7584 -3.7584 -3.6105 -3.6105 -3.5698 -3.5698 0.3268 0.3268 0.9116 0.9116 6.1037 6.1037 6.2200 6.2200 7.0565 7.0565 7.0717 7.0717 7.5256 7.5256 7.8677 7.8677 7.9159 7.9159 7.9706 7.9706 8.1483 8.1483 8.2428 8.2428 9.0549 9.0549 9.0851 9.0851 9.1438 9.1438 9.2051 9.2051 9.6571 9.6571 9.7844 9.7844 9.9095 9.9095 k = 0.0000 0.0000 0.0994 ( 13051 PWs) bands (ev): -69.5326 -69.5326 -69.5276 -69.5276 -39.3900 -39.3900 -39.3704 -39.3704 -38.2431 -38.2431 -38.2084 -38.2084 -38.1422 -38.1422 -38.1389 -38.1389 -18.7331 -18.7331 -18.6325 -18.6325 -5.6984 -5.6984 -5.5106 -5.5106 -3.9166 -3.9166 -3.7582 -3.7582 -3.6129 -3.6129 -3.5700 -3.5700 0.3416 0.3416 0.9024 0.9024 6.1076 6.1076 6.1850 6.1850 7.0583 7.0583 7.0744 7.0744 7.5384 7.5384 7.8777 7.8777 7.9235 7.9235 7.9760 7.9760 8.1502 8.1502 8.2457 8.2457 9.0250 9.0250 9.0594 9.0594 9.1354 9.1354 9.1617 9.1617 9.7026 9.7026 9.8296 9.8296 9.9098 9.9098 k = 0.0000 0.0000 0.1136 ( 13043 PWs) bands (ev): -69.5326 -69.5326 -69.5271 -69.5271 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1422 -38.1422 -38.1389 -38.1389 -18.7331 -18.7331 -18.6325 -18.6325 -5.6979 -5.6979 -5.5112 -5.5112 -3.9152 -3.9152 -3.7581 -3.7581 -3.6155 -3.6155 -3.5702 -3.5702 0.3582 0.3582 0.8917 0.8917 6.1082 6.1082 6.1492 6.1492 7.0560 7.0560 7.0788 7.0788 7.5469 7.5469 7.8869 7.8869 7.9274 7.9274 7.9778 7.9778 8.1462 8.1462 8.2424 8.2424 8.9904 8.9904 9.0344 9.0344 9.1192 9.1192 9.1379 9.1379 9.7458 9.7458 9.8715 9.8715 9.9116 9.9116 k = 0.0000 0.0000 0.1278 ( 13051 PWs) bands (ev): -69.5326 -69.5326 -69.5277 -69.5277 -39.3900 -39.3900 -39.3704 -39.3704 -38.2431 -38.2431 -38.2084 -38.2084 -38.1422 -38.1422 -38.1389 -38.1389 -18.7331 -18.7331 -18.6326 -18.6326 -5.6974 -5.6974 -5.5119 -5.5119 -3.9138 -3.9138 -3.7579 -3.7579 -3.6183 -3.6183 -3.5704 -3.5704 0.3766 0.3766 0.8796 0.8796 6.1097 6.1097 6.1132 6.1132 7.0489 7.0489 7.0807 7.0807 7.5528 7.5528 7.8966 7.8966 7.9318 7.9318 7.9828 7.9828 8.1430 8.1430 8.2401 8.2401 8.9540 8.9540 9.0071 9.0071 9.0784 9.0784 9.1340 9.1340 9.7872 9.7872 9.9011 9.9011 9.9219 9.9219 k = 0.0000 0.0000 0.1420 ( 13035 PWs) bands (ev): -69.5321 -69.5321 -69.5271 -69.5271 -39.3899 -39.3899 -39.3704 -39.3704 -38.2431 -38.2431 -38.2084 -38.2084 -38.1422 -38.1422 -38.1389 -38.1389 -18.7330 -18.7330 -18.6326 -18.6326 -5.6968 -5.6968 -5.5125 -5.5125 -3.9123 -3.9123 -3.7577 -3.7577 -3.6211 -3.6211 -3.5706 -3.5706 0.3965 0.3965 0.8661 0.8661 6.0787 6.0787 6.1103 6.1103 7.0395 7.0395 7.0841 7.0841 7.5636 7.5636 7.9083 7.9083 7.9365 7.9365 7.9900 7.9900 8.1430 8.1430 8.2415 8.2415 8.9192 8.9192 8.9857 8.9857 9.0402 9.0402 9.1325 9.1325 9.8270 9.8270 9.9075 9.9075 9.9563 9.9563 k = 0.0000 0.0000 0.1562 ( 13047 PWs) bands (ev): -69.5323 -69.5323 -69.5278 -69.5278 -39.3900 -39.3900 -39.3704 -39.3704 -38.2431 -38.2431 -38.2084 -38.2084 -38.1422 -38.1422 -38.1389 -38.1389 -18.7330 -18.7330 -18.6326 -18.6326 -5.6963 -5.6963 -5.5132 -5.5132 -3.9108 -3.9108 -3.7575 -3.7575 -3.6240 -3.6240 -3.5708 -3.5708 0.4179 0.4179 0.8511 0.8511 6.0458 6.0458 6.1100 6.1100 7.0277 7.0277 7.0856 7.0856 7.5743 7.5743 7.9182 7.9182 7.9373 7.9373 7.9958 7.9958 8.1392 8.1392 8.2389 8.2389 8.8849 8.8849 8.9673 8.9673 9.0036 9.0036 9.1311 9.1311 9.8634 9.8634 9.9045 9.9045 9.9711 9.9711 k = 0.0000 0.0000 0.1705 ( 13039 PWs) bands (ev): -69.5324 -69.5324 -69.5272 -69.5272 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1422 -38.1422 -38.1389 -38.1389 -18.7330 -18.7330 -18.6327 -18.6327 -5.6957 -5.6957 -5.5139 -5.5139 -3.9093 -3.9093 -3.7573 -3.7573 -3.6268 -3.6268 -3.5710 -3.5710 0.4404 0.4404 0.8348 0.8348 6.0152 6.0152 6.1097 6.1097 7.0145 7.0145 7.0880 7.0880 7.5847 7.5847 7.9297 7.9297 7.9376 7.9376 8.0038 8.0038 8.1398 8.1398 8.2415 8.2415 8.8535 8.8535 8.9526 8.9526 8.9702 8.9702 9.1318 9.1318 9.8976 9.8976 9.9030 9.9030 9.9641 9.9641 k = 0.0000 0.0000 0.1847 ( 13030 PWs) bands (ev): -69.5317 -69.5317 -69.5272 -69.5272 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1422 -38.1422 -38.1388 -38.1388 -18.7329 -18.7329 -18.6327 -18.6327 -5.6952 -5.6952 -5.5145 -5.5145 -3.9078 -3.9078 -3.7571 -3.7571 -3.6295 -3.6295 -3.5712 -3.5712 0.4639 0.4639 0.8173 0.8173 5.9874 5.9874 6.1097 6.1097 7.0009 7.0009 7.0900 7.0900 7.5988 7.5988 7.9388 7.9388 7.9418 7.9418 8.0131 8.0131 8.1377 8.1377 8.2412 8.2412 8.8242 8.8242 8.9394 8.9394 8.9410 8.9410 9.1314 9.1314 9.9002 9.9002 9.9288 9.9288 9.9580 9.9580 k = 0.0000 0.0000 0.1989 ( 13030 PWs) bands (ev): -69.5323 -69.5323 -69.5266 -69.5266 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1421 -38.1421 -38.1389 -38.1389 -18.7329 -18.7329 -18.6327 -18.6327 -5.6948 -5.6948 -5.5151 -5.5151 -3.9064 -3.9064 -3.7570 -3.7570 -3.6321 -3.6321 -3.5714 -3.5714 0.4880 0.4880 0.7986 0.7986 5.9626 5.9626 6.1095 6.1095 6.9868 6.9868 7.0938 7.0938 7.6051 7.6051 7.9390 7.9390 7.9507 7.9507 8.0197 8.0197 8.1361 8.1361 8.2418 8.2418 8.7977 8.7977 8.9117 8.9117 8.9319 8.9319 9.1312 9.1312 9.8987 9.8987 9.9555 9.9555 9.9572 9.9572 k = 0.0000 0.0000 0.2131 ( 13018 PWs) bands (ev): -69.5318 -69.5318 -69.5264 -69.5264 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1421 -38.1421 -38.1388 -38.1388 -18.7329 -18.7329 -18.6327 -18.6327 -5.6943 -5.6943 -5.5157 -5.5157 -3.9052 -3.9052 -3.7568 -3.7568 -3.6343 -3.6343 -3.5715 -3.5715 0.5126 0.5126 0.7789 0.7789 5.9413 5.9413 6.1103 6.1103 6.9740 6.9740 7.0944 7.0944 7.6132 7.6132 7.9400 7.9400 7.9630 7.9630 8.0297 8.0297 8.1358 8.1358 8.2438 8.2438 8.7751 8.7751 8.8879 8.8879 8.9256 8.9256 9.1334 9.1334 9.8943 9.8943 9.9512 9.9512 9.9799 9.9799 k = 0.0000 0.0000 0.2273 ( 13006 PWs) bands (ev): -69.5318 -69.5318 -69.5255 -69.5255 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1421 -38.1421 -38.1388 -38.1388 -18.7329 -18.7329 -18.6328 -18.6328 -5.6940 -5.6940 -5.5161 -5.5161 -3.9041 -3.9041 -3.7567 -3.7567 -3.6363 -3.6363 -3.5716 -3.5716 0.5370 0.5370 0.7586 0.7586 5.9238 5.9238 6.1103 6.1103 6.9626 6.9626 7.0961 7.0961 7.6198 7.6198 7.9402 7.9402 7.9722 7.9722 8.0368 8.0368 8.1365 8.1365 8.2472 8.2472 8.7564 8.7564 8.8680 8.8680 8.9221 8.9221 9.1352 9.1352 9.8910 9.8910 9.9494 9.9494 9.9997 9.9997 k = 0.0000 0.0000 0.2415 ( 12998 PWs) bands (ev): -69.5327 -69.5327 -69.5240 -69.5240 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1420 -38.1420 -38.1389 -38.1389 -18.7328 -18.7328 -18.6328 -18.6328 -5.6937 -5.6937 -5.5165 -5.5165 -3.9032 -3.9032 -3.7566 -3.7566 -3.6378 -3.6378 -3.5717 -3.5717 0.5608 0.5608 0.7381 0.7381 5.9099 5.9099 6.1085 6.1085 6.9530 6.9530 7.1001 7.1001 7.6241 7.6241 7.9391 7.9391 7.9772 7.9772 8.0399 8.0399 8.1379 8.1379 8.2512 8.2512 8.7418 8.7418 8.8523 8.8523 8.9190 8.9190 9.1354 9.1354 9.8882 9.8882 9.9569 9.9569 10.0142 10.0142 k = 0.0000 0.0000 0.2557 ( 13014 PWs) bands (ev): -69.5338 -69.5338 -69.5241 -69.5241 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1420 -38.1420 -38.1389 -38.1389 -18.7328 -18.7328 -18.6328 -18.6328 -5.6935 -5.6935 -5.5167 -5.5167 -3.9026 -3.9026 -3.7565 -3.7565 -3.6390 -3.6390 -3.5718 -3.5718 0.5828 0.5828 0.7186 0.7186 5.9001 5.9001 6.1081 6.1081 6.9453 6.9453 7.1014 7.1014 7.6216 7.6216 7.9385 7.9385 7.9802 7.9802 8.0416 8.0416 8.1349 8.1349 8.2497 8.2497 8.7303 8.7303 8.8403 8.8403 8.9189 8.9189 9.1340 9.1340 9.8854 9.8854 9.9564 9.9564 10.0244 10.0244 k = 0.0000 0.0000 0.2699 ( 13014 PWs) bands (ev): -69.5338 -69.5338 -69.5241 -69.5241 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1420 -38.1420 -38.1389 -38.1389 -18.7328 -18.7328 -18.6328 -18.6328 -5.6933 -5.6933 -5.5169 -5.5169 -3.9022 -3.9022 -3.7565 -3.7565 -3.6397 -3.6397 -3.5718 -3.5718 0.6001 0.6001 0.7027 0.7027 5.8941 5.8941 6.1081 6.1081 6.9409 6.9409 7.1019 7.1019 7.6238 7.6238 7.9386 7.9386 7.9840 7.9840 8.0443 8.0443 8.1335 8.1335 8.2495 8.2495 8.7235 8.7235 8.8332 8.8332 8.9176 8.9176 9.1340 9.1340 9.8837 9.8837 9.9558 9.9558 10.0312 10.0312 k = 0.0000 0.0000 0.2841 ( 13010 PWs) bands (ev): -69.5335 -69.5335 -69.5241 -69.5241 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1420 -38.1420 -38.1389 -38.1389 -18.7328 -18.7328 -18.6328 -18.6328 -5.6933 -5.6933 -5.5169 -5.5169 -3.9021 -3.9021 -3.7565 -3.7565 -3.6399 -3.6399 -3.5718 -3.5718 0.6073 0.6073 0.6960 0.6960 5.8920 5.8920 6.1084 6.1084 6.9393 6.9393 7.1021 7.1021 7.6233 7.6233 7.9406 7.9406 7.9863 7.9863 8.0465 8.0465 8.1331 8.1331 8.2494 8.2494 8.7212 8.7212 8.8308 8.8308 8.9172 8.9172 9.1340 9.1340 9.8837 9.8837 9.9556 9.9556 10.0339 10.0339 k = 0.0000 0.0000 0.2841 ( 13010 PWs) bands (ev): -69.5335 -69.5335 -69.5241 -69.5241 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1420 -38.1420 -38.1389 -38.1389 -18.7328 -18.7328 -18.6328 -18.6328 -5.6933 -5.6933 -5.5169 -5.5169 -3.9021 -3.9021 -3.7565 -3.7565 -3.6399 -3.6399 -3.5718 -3.5718 0.6073 0.6073 0.6960 0.6960 5.8920 5.8920 6.1084 6.1084 6.9393 6.9393 7.1021 7.1021 7.6233 7.6233 7.9406 7.9406 7.9863 7.9863 8.0465 8.0465 8.1331 8.1331 8.2494 8.2494 8.7212 8.7212 8.8308 8.8308 8.9172 8.9172 9.1340 9.1340 9.8837 9.8837 9.9556 9.9556 10.0339 10.0339 k = 0.0000 0.0143 0.2841 ( 13020 PWs) bands (ev): -69.5340 -69.5340 -69.5244 -69.5244 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1420 -38.1420 -38.1389 -38.1389 -18.7327 -18.7327 -18.6328 -18.6328 -5.6934 -5.6934 -5.5172 -5.5172 -3.9021 -3.9021 -3.7574 -3.7574 -3.6394 -3.6394 -3.5723 -3.5723 0.6081 0.6081 0.6976 0.6976 5.8925 5.8925 6.1071 6.1071 6.9363 6.9363 7.1005 7.1005 7.6212 7.6212 7.9356 7.9356 7.9864 7.9864 8.0460 8.0460 8.1352 8.1352 8.2506 8.2506 8.7195 8.7195 8.8286 8.8286 8.9146 8.9146 9.1286 9.1286 9.8936 9.8936 9.9403 9.9403 10.0345 10.0345 k = 0.0000 0.0286 0.2841 ( 13022 PWs) bands (ev): -69.5335 -69.5335 -69.5250 -69.5250 -39.3899 -39.3899 -39.3705 -39.3705 -38.2430 -38.2430 -38.2085 -38.2085 -38.1420 -38.1420 -38.1389 -38.1389 -18.7324 -18.7324 -18.6328 -18.6328 -5.6935 -5.6935 -5.5180 -5.5180 -3.9022 -3.9022 -3.7601 -3.7601 -3.6379 -3.6379 -3.5735 -3.5735 0.6103 0.6103 0.7024 0.7024 5.8939 5.8939 6.1088 6.1088 6.9273 6.9273 7.0958 7.0958 7.6164 7.6164 7.9286 7.9286 7.9878 7.9878 8.0486 8.0486 8.1419 8.1419 8.2556 8.2556 8.7144 8.7144 8.8234 8.8234 8.9072 8.9072 9.1138 9.1138 9.9033 9.9033 9.9253 9.9253 10.0310 10.0310 k = 0.0000 0.0429 0.2841 ( 13018 PWs) bands (ev): -69.5335 -69.5335 -69.5247 -69.5247 -39.3898 -39.3898 -39.3705 -39.3705 -38.2429 -38.2429 -38.2086 -38.2086 -38.1420 -38.1420 -38.1389 -38.1389 -18.7319 -18.7319 -18.6328 -18.6328 -5.6938 -5.6938 -5.5193 -5.5193 -3.9022 -3.9022 -3.7644 -3.7644 -3.6356 -3.6356 -3.5754 -3.5754 0.6141 0.6141 0.7103 0.7103 5.8975 5.8975 6.1101 6.1101 6.9121 6.9121 7.0905 7.0905 7.6077 7.6077 7.9159 7.9159 7.9849 7.9849 8.0550 8.0550 8.1508 8.1508 8.2645 8.2645 8.7051 8.7051 8.8180 8.8180 8.9041 8.9041 9.0935 9.0935 9.8594 9.8594 9.9738 9.9738 10.0156 10.0156 k = 0.0000 0.0571 0.2841 ( 13002 PWs) bands (ev): -69.5326 -69.5326 -69.5244 -69.5244 -39.3898 -39.3898 -39.3706 -39.3706 -38.2428 -38.2428 -38.2087 -38.2087 -38.1420 -38.1420 -38.1389 -38.1389 -18.7312 -18.7312 -18.6328 -18.6328 -5.6941 -5.6941 -5.5211 -5.5211 -3.9024 -3.9024 -3.7701 -3.7701 -3.6329 -3.6329 -3.5779 -3.5779 0.6194 0.6194 0.7212 0.7212 5.9019 5.9019 6.1117 6.1117 6.8912 6.8912 7.0844 7.0844 7.5963 7.5963 7.9033 7.9033 7.9792 7.9792 8.0707 8.0707 8.1588 8.1588 8.2755 8.2755 8.6909 8.6909 8.8146 8.8146 8.8959 8.8959 9.0739 9.0739 9.8130 9.8130 9.9852 9.9852 10.0388 10.0388 k = 0.0000 0.0714 0.2841 ( 12996 PWs) bands (ev): -69.5325 -69.5325 -69.5242 -69.5242 -39.3897 -39.3897 -39.3707 -39.3707 -38.2426 -38.2426 -38.2088 -38.2088 -38.1420 -38.1420 -38.1389 -38.1389 -18.7303 -18.7303 -18.6327 -18.6327 -5.6946 -5.6946 -5.5234 -5.5234 -3.9027 -3.9027 -3.7768 -3.7768 -3.6301 -3.6301 -3.5807 -3.5807 0.6262 0.6262 0.7349 0.7349 5.9080 5.9080 6.1128 6.1128 6.8643 6.8643 7.0763 7.0763 7.5793 7.5793 7.8833 7.8833 7.9688 7.9688 8.0921 8.0921 8.1661 8.1661 8.2915 8.2915 8.6734 8.6734 8.8149 8.8149 8.8883 8.8883 9.0430 9.0430 9.7658 9.7658 9.9383 9.9383 10.1145 10.1145 k = 0.0000 0.0857 0.2841 ( 13010 PWs) bands (ev): -69.5329 -69.5329 -69.5248 -69.5248 -39.3896 -39.3896 -39.3708 -39.3708 -38.2424 -38.2424 -38.2091 -38.2091 -38.1420 -38.1420 -38.1390 -38.1390 -18.7292 -18.7292 -18.6327 -18.6327 -5.6952 -5.6952 -5.5263 -5.5263 -3.9033 -3.9033 -3.7843 -3.7843 -3.6278 -3.6278 -3.5833 -3.5833 0.6346 0.6346 0.7512 0.7512 5.9146 5.9146 6.1125 6.1125 6.8318 6.8318 7.0662 7.0662 7.5591 7.5591 7.8645 7.8645 7.9529 7.9529 8.1107 8.1107 8.1712 8.1712 8.3073 8.3073 8.6541 8.6541 8.8184 8.8184 8.8749 8.8749 9.0091 9.0091 9.7180 9.7180 9.8753 9.8753 10.1565 10.1565 k = 0.0000 0.1000 0.2841 ( 13016 PWs) bands (ev): -69.5335 -69.5335 -69.5247 -69.5247 -39.3895 -39.3895 -39.3709 -39.3709 -38.2422 -38.2422 -38.2093 -38.2093 -38.1420 -38.1420 -38.1390 -38.1390 -18.7279 -18.7279 -18.6327 -18.6327 -5.6958 -5.6958 -5.5296 -5.5296 -3.9042 -3.9042 -3.7924 -3.7924 -3.6265 -3.6265 -3.5852 -3.5852 0.6445 0.6445 0.7700 0.7700 5.9226 5.9226 6.1115 6.1115 6.7941 6.7941 7.0557 7.0557 7.5354 7.5354 7.8443 7.8443 7.9336 7.9336 8.1315 8.1315 8.1773 8.1773 8.3284 8.3284 8.6364 8.6364 8.8247 8.8247 8.8625 8.8625 8.9723 8.9723 9.6704 9.6704 9.8056 9.8056 10.1390 10.1390 k = 0.0000 0.1143 0.2841 ( 13012 PWs) bands (ev): -69.5330 -69.5330 -69.5248 -69.5248 -39.3893 -39.3893 -39.3711 -39.3711 -38.2420 -38.2420 -38.2096 -38.2096 -38.1420 -38.1420 -38.1390 -38.1390 -18.7264 -18.7264 -18.6328 -18.6328 -5.6966 -5.6966 -5.5334 -5.5334 -3.9055 -3.9055 -3.8009 -3.8009 -3.6267 -3.6267 -3.5859 -3.5859 0.6559 0.6559 0.7910 0.7910 5.9316 5.9316 6.1128 6.1128 6.7516 6.7516 7.0441 7.0441 7.5105 7.5105 7.8290 7.8290 7.9130 7.9130 8.1487 8.1487 8.1864 8.1864 8.3521 8.3521 8.6220 8.6220 8.8324 8.8324 8.8481 8.8481 8.9314 8.9314 9.6165 9.6165 9.7389 9.7389 10.1153 10.1153 k = 0.0000 0.1286 0.2841 ( 13034 PWs) bands (ev): -69.5339 -69.5339 -69.5256 -69.5256 -39.3892 -39.3892 -39.3713 -39.3713 -38.2418 -38.2418 -38.2099 -38.2099 -38.1420 -38.1420 -38.1391 -38.1391 -18.7248 -18.7248 -18.6328 -18.6328 -5.6975 -5.6975 -5.5377 -5.5377 -3.9074 -3.9074 -3.8095 -3.8095 -3.6285 -3.6285 -3.5852 -3.5852 0.6688 0.6688 0.8139 0.8139 5.9415 5.9415 6.1118 6.1118 6.7048 6.7048 7.0313 7.0313 7.4822 7.4822 7.8115 7.8115 7.8858 7.8858 8.1553 8.1553 8.1968 8.1968 8.3748 8.3748 8.6110 8.6110 8.8299 8.8299 8.8427 8.8427 8.8903 8.8903 9.5455 9.5455 9.6863 9.6863 10.0852 10.0852 k = 0.0000 0.1429 0.2841 ( 13036 PWs) bands (ev): -69.5335 -69.5335 -69.5261 -69.5261 -39.3890 -39.3890 -39.3714 -39.3714 -38.2415 -38.2415 -38.2103 -38.2103 -38.1420 -38.1420 -38.1391 -38.1391 -18.7230 -18.7230 -18.6328 -18.6328 -5.6984 -5.6984 -5.5424 -5.5424 -3.9098 -3.9098 -3.8182 -3.8182 -3.6316 -3.6316 -3.5833 -3.5833 0.6830 0.6830 0.8385 0.8385 5.9531 5.9531 6.1134 6.1134 6.6546 6.6546 7.0194 7.0194 7.4543 7.4543 7.7974 7.7974 7.8556 7.8556 8.1571 8.1571 8.2103 8.2103 8.3990 8.3990 8.6052 8.6052 8.8063 8.8063 8.8424 8.8424 8.8702 8.8702 9.4606 9.4606 9.6528 9.6528 10.0525 10.0525 k = 0.0000 0.1571 0.2841 ( 13056 PWs) bands (ev): -69.5347 -69.5347 -69.5264 -69.5264 -39.3888 -39.3888 -39.3717 -39.3717 -38.2411 -38.2411 -38.2107 -38.2107 -38.1420 -38.1420 -38.1391 -38.1391 -18.7210 -18.7210 -18.6329 -18.6329 -5.6995 -5.6995 -5.5475 -5.5475 -3.9130 -3.9130 -3.8268 -3.8268 -3.6355 -3.6355 -3.5804 -3.5804 0.6986 0.6986 0.8645 0.8645 5.9655 5.9655 6.1123 6.1123 6.6015 6.6015 7.0065 7.0065 7.4220 7.4220 7.7771 7.7771 7.8226 7.8226 8.1558 8.1558 8.2185 8.2185 8.4212 8.4212 8.6047 8.6047 8.7658 8.7658 8.8382 8.8382 8.8772 8.8772 9.3664 9.3664 9.6323 9.6323 10.0186 10.0186 k = 0.0000 0.1714 0.2841 ( 13064 PWs) bands (ev): -69.5351 -69.5351 -69.5267 -69.5267 -39.3886 -39.3886 -39.3719 -39.3719 -38.2408 -38.2408 -38.2111 -38.2111 -38.1419 -38.1419 -38.1392 -38.1392 -18.7189 -18.7189 -18.6330 -18.6330 -5.7006 -5.7006 -5.5530 -5.5530 -3.9171 -3.9171 -3.8353 -3.8353 -3.6396 -3.6396 -3.5771 -3.5771 0.7155 0.7155 0.8917 0.8917 5.9782 5.9782 6.1167 6.1167 6.5462 6.5462 6.9940 6.9940 7.3894 7.3894 7.7600 7.7600 7.7855 7.7855 8.1546 8.1546 8.2190 8.2190 8.4410 8.4410 8.6105 8.6105 8.7224 8.7224 8.8387 8.8387 8.8911 8.8911 9.2689 9.2689 9.6220 9.6220 9.9837 9.9837 k = 0.0000 0.1857 0.2841 ( 13068 PWs) bands (ev): -69.5347 -69.5347 -69.5273 -69.5273 -39.3884 -39.3884 -39.3722 -39.3722 -38.2404 -38.2404 -38.2116 -38.2116 -38.1419 -38.1419 -38.1392 -38.1392 -18.7167 -18.7167 -18.6331 -18.6331 -5.7018 -5.7018 -5.5589 -5.5589 -3.9218 -3.9218 -3.8437 -3.8437 -3.6436 -3.6436 -3.5736 -3.5736 0.7335 0.7335 0.9197 0.9197 5.9917 5.9917 6.1212 6.1212 6.4899 6.4899 6.9812 6.9812 7.3568 7.3568 7.7406 7.7406 7.7513 7.7513 8.1512 8.1512 8.2125 8.2125 8.4592 8.4592 8.6214 8.6214 8.6779 8.6779 8.8446 8.8446 8.9069 8.9069 9.1729 9.1729 9.6198 9.6198 9.9506 9.9506 k = 0.0000 0.2000 0.2841 ( 13072 PWs) bands (ev): -69.5347 -69.5347 -69.5277 -69.5277 -39.3882 -39.3882 -39.3724 -39.3724 -38.2400 -38.2400 -38.2120 -38.2120 -38.1419 -38.1419 -38.1393 -38.1393 -18.7143 -18.7143 -18.6333 -18.6333 -5.7030 -5.7030 -5.5651 -5.5651 -3.9273 -3.9273 -3.8521 -3.8521 -3.6470 -3.6470 -3.5701 -3.5701 0.7527 0.7527 0.9483 0.9483 6.0056 6.0056 6.1272 6.1272 6.4332 6.4332 6.9684 6.9684 7.3234 7.3234 7.7021 7.7021 7.7329 7.7329 8.1460 8.1460 8.1971 8.1971 8.4728 8.4728 8.6200 8.6200 8.6564 8.6564 8.8560 8.8560 8.9242 8.9242 9.0785 9.0785 9.6251 9.6251 9.9176 9.9176 k = 0.0000 0.2143 0.2841 ( 13076 PWs) bands (ev): -69.5343 -69.5343 -69.5283 -69.5283 -39.3880 -39.3880 -39.3727 -39.3727 -38.2396 -38.2396 -38.2125 -38.2125 -38.1419 -38.1419 -38.1393 -38.1393 -18.7118 -18.7118 -18.6335 -18.6335 -5.7043 -5.7043 -5.5716 -5.5716 -3.9335 -3.9335 -3.8604 -3.8604 -3.6497 -3.6497 -3.5667 -3.5667 0.7728 0.7728 0.9770 0.9770 6.0198 6.0198 6.1344 6.1344 6.3769 6.3769 6.9550 6.9550 7.2908 7.2908 7.6574 7.6574 7.7162 7.7162 8.1348 8.1348 8.1784 8.1784 8.4841 8.4841 8.5855 8.5855 8.6757 8.6757 8.8670 8.8670 8.9413 8.9413 8.9941 8.9941 9.6372 9.6372 9.8861 9.8861 k = 0.0000 0.2286 0.2841 ( 13080 PWs) bands (ev): -69.5348 -69.5348 -69.5281 -69.5281 -39.3877 -39.3877 -39.3730 -39.3730 -38.2392 -38.2392 -38.2131 -38.2131 -38.1418 -38.1418 -38.1394 -38.1394 -18.7092 -18.7092 -18.6338 -18.6338 -5.7056 -5.7056 -5.5784 -5.5784 -3.9400 -3.9400 -3.8687 -3.8687 -3.6514 -3.6514 -3.5635 -3.5635 0.7939 0.7939 1.0057 1.0057 6.0345 6.0345 6.1404 6.1404 6.3217 6.3217 6.9416 6.9416 7.2580 7.2580 7.6089 7.6089 7.6991 7.6991 8.1129 8.1129 8.1662 8.1662 8.4940 8.4940 8.5465 8.5465 8.7046 8.7046 8.8561 8.8561 8.9329 8.9329 8.9658 8.9658 9.6567 9.6567 9.8553 9.8553 k = 0.0000 0.2429 0.2841 ( 13084 PWs) bands (ev): -69.5345 -69.5345 -69.5288 -69.5288 -39.3874 -39.3874 -39.3733 -39.3733 -38.2387 -38.2387 -38.2137 -38.2137 -38.1418 -38.1418 -38.1395 -38.1395 -18.7066 -18.7066 -18.6342 -18.6342 -5.7069 -5.7069 -5.5854 -5.5854 -3.9469 -3.9469 -3.8772 -3.8772 -3.6523 -3.6523 -3.5605 -3.5605 0.8158 0.8158 1.0340 1.0340 6.0494 6.0494 6.1490 6.1490 6.2684 6.2684 6.9274 6.9274 7.2245 7.2245 7.5586 7.5586 7.6838 7.6838 8.0797 8.0797 8.1581 8.1581 8.5010 8.5010 8.5085 8.5085 8.7368 8.7368 8.7948 8.7948 8.9359 8.9359 8.9842 8.9842 9.6818 9.6818 9.8265 9.8265 k = 0.0000 0.2571 0.2841 ( 13092 PWs) bands (ev): -69.5350 -69.5350 -69.5288 -69.5288 -39.3871 -39.3871 -39.3736 -39.3736 -38.2382 -38.2382 -38.2143 -38.2143 -38.1417 -38.1417 -38.1395 -38.1395 -18.7038 -18.7038 -18.6346 -18.6346 -5.7082 -5.7082 -5.5926 -5.5926 -3.9540 -3.9540 -3.8859 -3.8859 -3.6521 -3.6521 -3.5578 -3.5578 0.8385 0.8385 1.0615 1.0615 6.0639 6.0639 6.1569 6.1569 6.2178 6.2178 6.9129 6.9129 7.1914 7.1914 7.5047 7.5047 7.6673 7.6673 8.0404 8.0404 8.1531 8.1531 8.4735 8.4735 8.5075 8.5075 8.7195 8.7195 8.7743 8.7743 8.9527 8.9527 9.0044 9.0044 9.7119 9.7119 9.7978 9.7978 k = 0.0000 0.2714 0.2841 ( 13096 PWs) bands (ev): -69.5352 -69.5352 -69.5289 -69.5289 -39.3868 -39.3868 -39.3740 -39.3740 -38.2376 -38.2376 -38.2149 -38.2149 -38.1417 -38.1417 -38.1396 -38.1396 -18.7010 -18.7010 -18.6351 -18.6351 -5.7095 -5.7095 -5.6000 -5.6000 -3.9610 -3.9610 -3.8947 -3.8947 -3.6510 -3.6510 -3.5554 -3.5554 0.8618 0.8618 1.0880 1.0880 6.0775 6.0775 6.1638 6.1638 6.1735 6.1735 6.8975 6.8975 7.1588 7.1588 7.4489 7.4489 7.6517 7.6517 7.9968 7.9968 8.1500 8.1500 8.4419 8.4419 8.5124 8.5124 8.6533 8.6533 8.8099 8.8099 8.9713 8.9713 9.0256 9.0256 9.7431 9.7431 9.7736 9.7736 k = 0.0000 0.2857 0.2841 ( 13112 PWs) bands (ev): -69.5357 -69.5357 -69.5296 -69.5296 -39.3865 -39.3865 -39.3743 -39.3743 -38.2371 -38.2371 -38.2155 -38.2155 -38.1416 -38.1416 -38.1397 -38.1397 -18.6981 -18.6981 -18.6356 -18.6356 -5.7106 -5.7106 -5.6074 -5.6074 -3.9679 -3.9679 -3.9037 -3.9037 -3.6490 -3.6490 -3.5533 -3.5533 0.8855 0.8855 1.1132 1.1132 6.0870 6.0870 6.1287 6.1287 6.1786 6.1786 6.8803 6.8803 7.1277 7.1277 7.3914 7.3914 7.6342 7.6342 7.9488 7.9488 8.1471 8.1471 8.4094 8.4094 8.5165 8.5165 8.5930 8.5930 8.8463 8.8463 8.9865 8.9865 9.0470 9.0470 9.7368 9.7368 9.7912 9.7912 k = 0.0000 0.3000 0.2841 ( 13106 PWs) bands (ev): -69.5353 -69.5353 -69.5295 -69.5295 -39.3862 -39.3862 -39.3747 -39.3747 -38.2365 -38.2365 -38.2162 -38.2162 -38.1416 -38.1416 -38.1397 -38.1397 -18.6952 -18.6952 -18.6363 -18.6363 -5.7117 -5.7117 -5.6149 -5.6149 -3.9745 -3.9745 -3.9127 -3.9127 -3.6461 -3.6461 -3.5517 -3.5517 0.9097 0.9097 1.1368 1.1368 6.0745 6.0745 6.1138 6.1138 6.1921 6.1921 6.8633 6.8633 7.0974 7.0974 7.3340 7.3340 7.6201 7.6201 7.9025 7.9025 8.1448 8.1448 8.3816 8.3816 8.5178 8.5178 8.5452 8.5452 8.8827 8.8827 9.0035 9.0035 9.0690 9.0690 9.7124 9.7124 9.8319 9.8319 k = 0.0000 0.3143 0.2841 ( 13094 PWs) bands (ev): -69.5347 -69.5347 -69.5293 -69.5293 -39.3858 -39.3858 -39.3751 -39.3751 -38.2359 -38.2359 -38.2168 -38.2168 -38.1415 -38.1415 -38.1398 -38.1398 -18.6922 -18.6922 -18.6370 -18.6370 -5.7127 -5.7127 -5.6224 -5.6224 -3.9807 -3.9807 -3.9216 -3.9216 -3.6426 -3.6426 -3.5504 -3.5504 0.9342 0.9342 1.1585 1.1585 6.0420 6.0420 6.1218 6.1218 6.2084 6.2084 6.8454 6.8454 7.0684 7.0684 7.2766 7.2766 7.6041 7.6041 7.8540 7.8540 8.1453 8.1453 8.3575 8.3575 8.4938 8.4938 8.5317 8.5317 8.9183 8.9183 9.0191 9.0191 9.0924 9.0924 9.6884 9.6884 9.8751 9.8751 k = 0.0000 0.3286 0.2841 ( 13086 PWs) bands (ev): -69.5334 -69.5334 -69.5299 -69.5299 -39.3855 -39.3855 -39.3754 -39.3754 -38.2353 -38.2353 -38.2175 -38.2175 -38.1415 -38.1415 -38.1398 -38.1398 -18.6893 -18.6893 -18.6379 -18.6379 -5.7135 -5.7135 -5.6298 -5.6298 -3.9865 -3.9865 -3.9305 -3.9305 -3.6384 -3.6384 -3.5496 -3.5496 0.9588 0.9588 1.1781 1.1781 6.0110 6.0110 6.1311 6.1311 6.2279 6.2279 6.8265 6.8265 7.0403 7.0403 7.2180 7.2180 7.5902 7.5902 7.8069 7.8069 8.1452 8.1452 8.3312 8.3312 8.4606 8.4606 8.5332 8.5332 8.9522 8.9522 9.0320 9.0320 9.1157 9.1157 9.6649 9.6649 9.9190 9.9191 k = 0.0000 0.3429 0.2841 ( 13086 PWs) bands (ev): -69.5338 -69.5338 -69.5296 -69.5296 -39.3851 -39.3851 -39.3758 -39.3758 -38.2346 -38.2346 -38.2182 -38.2182 -38.1414 -38.1414 -38.1399 -38.1399 -18.6863 -18.6863 -18.6388 -18.6388 -5.7141 -5.7141 -5.6371 -5.6371 -3.9917 -3.9917 -3.9392 -3.9392 -3.6338 -3.6338 -3.5492 -3.5492 0.9835 0.9835 1.1954 1.1954 5.9841 5.9841 6.1388 6.1388 6.2461 6.2461 6.8083 6.8083 7.0119 7.0119 7.1595 7.1595 7.5730 7.5730 7.7645 7.7645 8.1436 8.1436 8.3100 8.3100 8.4314 8.4314 8.5337 8.5337 8.9824 8.9824 9.0442 9.0442 9.1383 9.1383 9.6404 9.6404 9.9628 9.9628 k = 0.0000 0.3571 0.2841 ( 13082 PWs) bands (ev): -69.5337 -69.5337 -69.5294 -69.5294 -39.3847 -39.3847 -39.3762 -39.3762 -38.2340 -38.2340 -38.2189 -38.2189 -38.1413 -38.1413 -38.1400 -38.1400 -18.6834 -18.6834 -18.6399 -18.6399 -5.7144 -5.7144 -5.6443 -5.6443 -3.9964 -3.9964 -3.9476 -3.9476 -3.6288 -3.6288 -3.5492 -3.5492 1.0080 1.0080 1.2103 1.2103 5.9620 5.9620 6.1432 6.1432 6.2664 6.2664 6.7914 6.7914 6.9846 6.9846 7.1017 7.1017 7.5589 7.5589 7.7213 7.7213 8.1429 8.1429 8.2905 8.2905 8.4106 8.4106 8.5330 8.5330 9.0092 9.0092 9.0575 9.0575 9.1613 9.1613 9.6170 9.6170 10.0045 10.0045 k = 0.0000 0.3714 0.2841 ( 13080 PWs) bands (ev): -69.5333 -69.5333 -69.5296 -69.5296 -39.3843 -39.3843 -39.3766 -39.3766 -38.2333 -38.2333 -38.2197 -38.2197 -38.1413 -38.1413 -38.1400 -38.1400 -18.6804 -18.6804 -18.6410 -18.6410 -5.7146 -5.7146 -5.6513 -5.6513 -4.0004 -4.0004 -3.9557 -3.9557 -3.6234 -3.6234 -3.5497 -3.5497 1.0323 1.0323 1.2225 1.2225 5.9450 5.9450 6.1436 6.1436 6.2897 6.2897 6.7758 6.7758 6.9582 6.9582 7.0448 7.0448 7.5463 7.5463 7.6802 7.6802 8.1432 8.1432 8.2727 8.2727 8.3942 8.3942 8.5308 8.5308 9.0322 9.0322 9.0688 9.0688 9.1846 9.1846 9.5941 9.5941 10.0434 10.0434 k = 0.0000 0.3857 0.2841 ( 13088 PWs) bands (ev): -69.5338 -69.5338 -69.5297 -69.5297 -39.3839 -39.3839 -39.3771 -39.3771 -38.2326 -38.2326 -38.2204 -38.2204 -38.1412 -38.1412 -38.1401 -38.1401 -18.6775 -18.6775 -18.6423 -18.6423 -5.7144 -5.7144 -5.6581 -5.6581 -4.0038 -4.0038 -3.9634 -3.9634 -3.6179 -3.6179 -3.5507 -3.5507 1.0561 1.0561 1.2320 1.2320 5.9330 5.9330 6.1404 6.1404 6.3131 6.3131 6.7619 6.7619 6.9325 6.9325 6.9891 6.9891 7.5322 7.5322 7.6429 7.6429 8.1427 8.1427 8.2561 8.2561 8.3823 8.3823 8.5280 8.5280 9.0492 9.0492 9.0787 9.0787 9.2075 9.2075 9.5708 9.5708 10.0800 10.0800 k = 0.0000 0.4000 0.2841 ( 13092 PWs) bands (ev): -69.5340 -69.5340 -69.5299 -69.5299 -39.3835 -39.3835 -39.3775 -39.3775 -38.2319 -38.2319 -38.2212 -38.2212 -38.1412 -38.1412 -38.1402 -38.1402 -18.6747 -18.6747 -18.6437 -18.6437 -5.7139 -5.7139 -5.6645 -5.6645 -4.0065 -4.0065 -3.9707 -3.9707 -3.6122 -3.6122 -3.5522 -3.5522 1.0793 1.0793 1.2386 1.2386 5.9261 5.9261 6.1332 6.1332 6.3387 6.3387 6.7513 6.7513 6.9052 6.9052 6.9367 6.9367 7.5191 7.5191 7.6117 7.6117 8.1424 8.1424 8.2412 8.2412 8.3773 8.3773 8.5222 8.5222 9.0616 9.0616 9.0889 9.0889 9.2304 9.2304 9.5483 9.5483 10.1137 10.1137 k = 0.0000 0.4143 0.2841 ( 13096 PWs) bands (ev): -69.5342 -69.5342 -69.5300 -69.5300 -39.3831 -39.3831 -39.3779 -39.3779 -38.2311 -38.2311 -38.2220 -38.2220 -38.1411 -38.1411 -38.1403 -38.1403 -18.6719 -18.6719 -18.6452 -18.6452 -5.7131 -5.7131 -5.6707 -5.6707 -4.0085 -4.0085 -3.9774 -3.9774 -3.6065 -3.6065 -3.5541 -3.5541 1.1017 1.1017 1.2425 1.2425 5.9242 5.9242 6.1217 6.1217 6.3677 6.3677 6.7440 6.7440 6.8692 6.8692 6.8951 6.8951 7.5074 7.5074 7.5838 7.5838 8.1440 8.1440 8.2271 8.2271 8.3766 8.3766 8.5142 8.5142 9.0704 9.0704 9.0975 9.0975 9.2539 9.2539 9.5255 9.5255 10.1440 10.1440 k = 0.0000 0.4286 0.2841 ( 13088 PWs) bands (ev): -69.5342 -69.5342 -69.5295 -69.5295 -39.3827 -39.3827 -39.3784 -39.3784 -38.2304 -38.2304 -38.2227 -38.2227 -38.1410 -38.1410 -38.1404 -38.1404 -18.6691 -18.6691 -18.6468 -18.6468 -5.7119 -5.7119 -5.6765 -5.6765 -4.0098 -4.0098 -3.9836 -3.9836 -3.6007 -3.6007 -3.5564 -3.5564 1.1232 1.1232 1.2436 1.2436 5.9272 5.9272 6.1066 6.1066 6.3988 6.3988 6.7408 6.7408 6.8218 6.8218 6.8690 6.8690 7.4984 7.4984 7.5618 7.5618 8.1471 8.1471 8.2154 8.2154 8.3808 8.3808 8.5061 8.5061 9.0780 9.0780 9.1040 9.1040 9.2780 9.2780 9.5035 9.5035 10.1710 10.1710 k = 0.0000 0.4429 0.2841 ( 13092 PWs) bands (ev): -69.5343 -69.5343 -69.5296 -69.5296 -39.3822 -39.3822 -39.3788 -39.3788 -38.2296 -38.2296 -38.2235 -38.2235 -38.1409 -38.1409 -38.1404 -38.1404 -18.6665 -18.6665 -18.6485 -18.6485 -5.7103 -5.7103 -5.6820 -5.6820 -4.0103 -4.0103 -3.9892 -3.9892 -3.5951 -3.5951 -3.5592 -3.5592 1.1435 1.1435 1.2419 1.2419 5.9346 5.9346 6.0879 6.0879 6.4315 6.4315 6.7414 6.7414 6.7725 6.7725 6.8468 6.8468 7.4910 7.4910 7.5392 7.5392 8.1499 8.1499 8.2043 8.2043 8.3886 8.3886 8.4953 8.4953 9.0840 9.0840 9.1064 9.1064 9.3015 9.3015 9.4815 9.4815 10.1938 10.1938 k = 0.0000 0.4571 0.2841 ( 13076 PWs) bands (ev): -69.5331 -69.5331 -69.5297 -69.5297 -39.3818 -39.3818 -39.3792 -39.3792 -38.2289 -38.2289 -38.2243 -38.2243 -38.1409 -38.1409 -38.1405 -38.1405 -18.6639 -18.6639 -18.6504 -18.6504 -5.7083 -5.7083 -5.6870 -5.6870 -4.0102 -4.0102 -3.9942 -3.9942 -3.5896 -3.5896 -3.5625 -3.5625 1.1625 1.1625 1.2375 1.2375 5.9462 5.9462 6.0672 6.0672 6.4673 6.4673 6.7241 6.7241 6.7467 6.7467 6.8277 6.8277 7.4891 7.4891 7.5224 7.5224 8.1539 8.1539 8.1958 8.1958 8.4013 8.4013 8.4853 8.4853 9.0900 9.0900 9.1090 9.1090 9.3250 9.3250 9.4608 9.4608 10.2140 10.2140 k = 0.0000 0.4714 0.2841 ( 13082 PWs) bands (ev): -69.5324 -69.5324 -69.5309 -69.5309 -39.3814 -39.3814 -39.3797 -39.3797 -38.2281 -38.2281 -38.2251 -38.2251 -38.1408 -38.1408 -38.1405 -38.1405 -18.6614 -18.6614 -18.6524 -18.6524 -5.7058 -5.7058 -5.6917 -5.6917 -4.0093 -4.0093 -3.9986 -3.9986 -3.5844 -3.5844 -3.5661 -3.5661 1.1799 1.1799 1.2305 1.2305 5.9613 5.9613 6.0448 6.0448 6.5055 6.5055 6.6757 6.6757 6.7543 6.7543 6.8083 6.8083 7.4866 7.4866 7.5080 7.5080 8.1588 8.1588 8.1848 8.1848 8.4153 8.4153 8.4700 8.4700 9.0947 9.0947 9.1084 9.1084 9.3483 9.3483 9.4382 9.4382 10.2307 10.2307 k = 0.0000 0.4857 0.2841 ( 13072 PWs) bands (ev): -69.5315 -69.5315 -69.5310 -69.5310 -39.3810 -39.3810 -39.3801 -39.3801 -38.2274 -38.2274 -38.2258 -38.2258 -38.1407 -38.1407 -38.1406 -38.1406 -18.6590 -18.6590 -18.6545 -18.6545 -5.7030 -5.7030 -5.6959 -5.6959 -4.0077 -4.0077 -4.0023 -4.0023 -3.5793 -3.5793 -3.5702 -3.5702 1.1957 1.1957 1.2211 1.2211 5.9795 5.9795 6.0223 6.0223 6.5458 6.5458 6.6302 6.6302 6.7649 6.7649 6.7923 6.7923 7.4880 7.4880 7.4989 7.4989 8.1649 8.1649 8.1774 8.1774 8.4299 8.4299 8.4577 8.4577 9.0994 9.0994 9.1065 9.1065 9.3716 9.3716 9.4166 9.4166 10.2456 10.2456 k = 0.0000 0.5000 0.2841 ( 13068 PWs) bands (ev): -69.5311 -69.5311 -69.5311 -69.5311 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6996 -5.6996 -5.6996 -5.6996 -4.0053 -4.0053 -4.0053 -4.0053 -3.5746 -3.5746 -3.5746 -3.5746 1.2094 1.2094 1.2094 1.2094 6.0001 6.0001 6.0001 6.0001 6.5872 6.5872 6.5872 6.5872 6.7779 6.7779 6.7779 6.7779 7.4913 7.4913 7.4913 7.4913 8.1713 8.1713 8.1713 8.1713 8.4444 8.4444 8.4444 8.4444 9.1040 9.1040 9.1040 9.1040 9.3947 9.3947 9.3947 9.3947 10.2584 10.2584 k = 0.0000 0.5000 0.2841 ( 13068 PWs) bands (ev): -69.5311 -69.5311 -69.5311 -69.5311 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6996 -5.6996 -5.6996 -5.6996 -4.0053 -4.0053 -4.0053 -4.0053 -3.5746 -3.5746 -3.5746 -3.5746 1.2094 1.2094 1.2094 1.2094 6.0001 6.0001 6.0001 6.0001 6.5872 6.5872 6.5872 6.5872 6.7779 6.7779 6.7779 6.7779 7.4913 7.4913 7.4913 7.4913 8.1713 8.1713 8.1713 8.1713 8.4444 8.4444 8.4444 8.4444 9.1040 9.1040 9.1040 9.1040 9.3947 9.3947 9.3947 9.3947 10.2584 10.2584 k = 0.0143 0.5000 0.2841 ( 13068 PWs) bands (ev): -69.5311 -69.5311 -69.5311 -69.5311 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6566 -18.6566 -18.6566 -18.6566 -5.7012 -5.7012 -5.6982 -5.6982 -4.0106 -4.0106 -3.9999 -3.9999 -3.5787 -3.5787 -3.5710 -3.5710 1.2088 1.2088 1.2089 1.2089 6.0010 6.0010 6.0022 6.0022 6.5842 6.5842 6.5857 6.5857 6.7784 6.7784 6.7818 6.7818 7.4875 7.4875 7.4876 7.4876 8.1731 8.1731 8.1735 8.1735 8.4449 8.4449 8.4456 8.4456 9.1027 9.1027 9.1093 9.1093 9.3914 9.3914 9.3965 9.3965 10.2546 10.2546 k = 0.0286 0.5000 0.2841 ( 13084 PWs) bands (ev): -69.5317 -69.5317 -69.5317 -69.5317 -39.3806 -39.3806 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6565 -18.6565 -18.6564 -18.6564 -5.7028 -5.7028 -5.6967 -5.6967 -4.0159 -4.0159 -3.9945 -3.9945 -3.5833 -3.5833 -3.5680 -3.5680 1.2069 1.2069 1.2072 1.2072 6.0047 6.0047 6.0071 6.0071 6.5786 6.5786 6.5815 6.5815 6.7803 6.7803 6.7870 6.7870 7.4756 7.4756 7.4757 7.4757 8.1801 8.1801 8.1809 8.1809 8.4438 8.4438 8.4451 8.4451 9.0994 9.0994 9.1127 9.1127 9.3876 9.3876 9.3979 9.3979 10.2491 10.2491 k = 0.0429 0.5000 0.2841 ( 13084 PWs) bands (ev): -69.5317 -69.5317 -69.5317 -69.5317 -39.3806 -39.3806 -39.3805 -39.3805 -38.2267 -38.2267 -38.2266 -38.2266 -38.1407 -38.1407 -38.1406 -38.1406 -18.6563 -18.6563 -18.6561 -18.6561 -5.7044 -5.7044 -5.6954 -5.6954 -4.0210 -4.0210 -3.9891 -3.9891 -3.5885 -3.5885 -3.5656 -3.5656 1.2039 1.2039 1.2043 1.2043 6.0112 6.0112 6.0149 6.0149 6.5717 6.5717 6.5759 6.5759 6.7856 6.7856 6.7956 6.7956 7.4570 7.4570 7.4574 7.4574 8.1929 8.1929 8.1937 8.1937 8.4461 8.4461 8.4479 8.4479 9.0990 9.0990 9.1191 9.1191 9.3856 9.3856 9.4008 9.4008 10.2416 10.2416 k = 0.0571 0.5000 0.2841 ( 13080 PWs) bands (ev): -69.5316 -69.5316 -69.5316 -69.5316 -39.3806 -39.3806 -39.3805 -39.3805 -38.2267 -38.2267 -38.2266 -38.2266 -38.1406 -38.1406 -38.1406 -38.1406 -18.6560 -18.6560 -18.6558 -18.6558 -5.7060 -5.7060 -5.6941 -5.6941 -4.0260 -4.0260 -3.9837 -3.9837 -3.5941 -3.5941 -3.5636 -3.5636 1.1997 1.1997 1.2003 1.2003 6.0201 6.0201 6.0253 6.0253 6.5637 6.5637 6.5693 6.5693 6.7929 6.7929 6.8060 6.8060 7.4335 7.4335 7.4347 7.4347 8.2089 8.2089 8.2093 8.2093 8.4501 8.4501 8.4520 8.4520 9.0995 9.0995 9.1265 9.1265 9.3846 9.3846 9.4043 9.4043 10.2326 10.2326 k = 0.0714 0.5000 0.2841 ( 13088 PWs) bands (ev): -69.5319 -69.5319 -69.5319 -69.5319 -39.3806 -39.3806 -39.3805 -39.3805 -38.2267 -38.2267 -38.2267 -38.2267 -38.1406 -38.1406 -38.1406 -38.1406 -18.6556 -18.6556 -18.6553 -18.6553 -5.7077 -5.7077 -5.6930 -5.6930 -4.0308 -4.0308 -3.9782 -3.9782 -3.6002 -3.6002 -3.5622 -3.5622 1.1944 1.1944 1.1952 1.1952 6.0308 6.0308 6.0377 6.0377 6.5554 6.5554 6.5627 6.5627 6.8001 6.8001 6.8163 6.8163 7.4050 7.4050 7.4074 7.4074 8.2232 8.2232 8.2236 8.2236 8.4554 8.4554 8.4569 8.4569 9.1003 9.1003 9.1340 9.1340 9.3850 9.3850 9.4084 9.4084 10.2217 10.2217 k = 0.0857 0.5000 0.2841 ( 13092 PWs) bands (ev): -69.5320 -69.5320 -69.5320 -69.5320 -39.3807 -39.3807 -39.3805 -39.3805 -38.2268 -38.2268 -38.2267 -38.2267 -38.1406 -38.1406 -38.1405 -38.1405 -18.6550 -18.6550 -18.6547 -18.6547 -5.7094 -5.7094 -5.6920 -5.6920 -4.0356 -4.0356 -3.9729 -3.9729 -3.6067 -3.6067 -3.5613 -3.5613 1.1880 1.1880 1.1889 1.1889 6.0429 6.0429 6.0517 6.0517 6.5486 6.5486 6.5578 6.5578 6.8065 6.8065 6.8262 6.8262 7.3744 7.3744 7.3785 7.3785 8.2359 8.2359 8.2369 8.2369 8.4646 8.4646 8.4651 8.4651 9.1002 9.1002 9.1403 9.1403 9.3891 9.3891 9.4153 9.4153 10.2095 10.2095 k = 0.1000 0.5000 0.2841 ( 13088 PWs) bands (ev): -69.5319 -69.5319 -69.5319 -69.5319 -39.3807 -39.3807 -39.3805 -39.3805 -38.2269 -38.2269 -38.2267 -38.2267 -38.1406 -38.1406 -38.1405 -38.1405 -18.6544 -18.6544 -18.6541 -18.6541 -5.7111 -5.7111 -5.6911 -5.6911 -4.0401 -4.0401 -3.9676 -3.9676 -3.6135 -3.6135 -3.5608 -3.5608 1.1806 1.1806 1.1816 1.1816 6.0557 6.0557 6.0667 6.0667 6.5441 6.5441 6.5557 6.5557 6.8125 6.8125 6.8356 6.8356 7.3423 7.3423 7.3485 7.3485 8.2458 8.2458 8.2473 8.2473 8.4774 8.4774 8.4787 8.4787 9.1015 9.1015 9.1469 9.1469 9.3979 9.3979 9.4254 9.4254 10.1958 10.1958 k = 0.1143 0.5000 0.2841 ( 13096 PWs) bands (ev): -69.5322 -69.5322 -69.5322 -69.5322 -39.3807 -39.3807 -39.3805 -39.3805 -38.2269 -38.2269 -38.2268 -38.2268 -38.1405 -38.1405 -38.1405 -38.1405 -18.6538 -18.6538 -18.6533 -18.6533 -5.7127 -5.7127 -5.6903 -5.6903 -4.0445 -4.0445 -3.9624 -3.9624 -3.6205 -3.6205 -3.5607 -3.5607 1.1722 1.1722 1.1733 1.1733 6.0685 6.0685 6.0819 6.0819 6.5431 6.5431 6.5574 6.5574 6.8152 6.8152 6.8423 6.8423 7.3083 7.3083 7.3171 7.3171 8.2499 8.2499 8.2515 8.2515 8.4929 8.4929 8.4968 8.4968 9.1000 9.1000 9.1495 9.1495 9.4121 9.4121 9.4390 9.4390 10.1808 10.1808 k = 0.1286 0.5000 0.2841 ( 13104 PWs) bands (ev): -69.5324 -69.5324 -69.5324 -69.5324 -39.3808 -39.3808 -39.3805 -39.3805 -38.2270 -38.2270 -38.2269 -38.2269 -38.1405 -38.1405 -38.1404 -38.1404 -18.6530 -18.6530 -18.6525 -18.6525 -5.7144 -5.7144 -5.6897 -5.6897 -4.0486 -4.0486 -3.9575 -3.9575 -3.6277 -3.6277 -3.5610 -3.5610 1.1628 1.1628 1.1641 1.1641 6.0805 6.0805 6.0965 6.0965 6.5455 6.5455 6.5631 6.5631 6.8163 6.8163 6.8477 6.8477 7.2754 7.2754 7.2869 7.2869 8.2506 8.2506 8.2522 8.2522 8.5084 8.5084 8.5158 8.5158 9.0971 9.0971 9.1494 9.1494 9.4324 9.4324 9.4566 9.4566 10.1653 10.1653 k = 0.1429 0.5000 0.2841 ( 13096 PWs) bands (ev): -69.5321 -69.5321 -69.5321 -69.5321 -39.3808 -39.3808 -39.3805 -39.3805 -38.2271 -38.2271 -38.2269 -38.2269 -38.1404 -38.1404 -38.1403 -38.1403 -18.6522 -18.6522 -18.6517 -18.6517 -5.7161 -5.7161 -5.6893 -5.6893 -4.0526 -4.0526 -3.9528 -3.9528 -3.6349 -3.6349 -3.5617 -3.5617 1.1526 1.1526 1.1541 1.1541 6.0913 6.0913 6.1100 6.1100 6.5526 6.5526 6.5741 6.5741 6.8171 6.8171 6.8530 6.8530 7.2431 7.2431 7.2576 7.2576 8.2502 8.2502 8.2518 8.2518 8.5261 8.5261 8.5375 8.5375 9.0935 9.0935 9.1474 9.1474 9.4600 9.4600 9.4799 9.4799 10.1497 10.1497 k = 0.1571 0.5000 0.2841 ( 13088 PWs) bands (ev): -69.5318 -69.5318 -69.5318 -69.5318 -39.3808 -39.3808 -39.3805 -39.3805 -38.2272 -38.2272 -38.2270 -38.2270 -38.1404 -38.1404 -38.1403 -38.1403 -18.6513 -18.6513 -18.6507 -18.6507 -5.7177 -5.7177 -5.6891 -5.6891 -4.0562 -4.0562 -3.9483 -3.9483 -3.6422 -3.6422 -3.5626 -3.5626 1.1417 1.1417 1.1432 1.1432 6.1005 6.1005 6.1217 6.1217 6.5645 6.5645 6.5900 6.5900 6.8154 6.8154 6.8562 6.8562 7.2117 7.2117 7.2294 7.2294 8.2465 8.2465 8.2479 8.2479 8.5451 8.5451 8.5607 8.5607 9.0883 9.0883 9.1428 9.1428 9.4939 9.4939 9.5082 9.5082 10.1341 10.1341 k = 0.1714 0.5000 0.2841 ( 13084 PWs) bands (ev): -69.5317 -69.5317 -69.5317 -69.5317 -39.3808 -39.3808 -39.3806 -39.3806 -38.2273 -38.2273 -38.2271 -38.2271 -38.1403 -38.1403 -38.1402 -38.1402 -18.6503 -18.6503 -18.6497 -18.6497 -5.7193 -5.7193 -5.6891 -5.6891 -4.0596 -4.0596 -3.9443 -3.9443 -3.6492 -3.6492 -3.5639 -3.5639 1.1300 1.1300 1.1316 1.1316 6.1077 6.1077 6.1314 6.1314 6.5796 6.5796 6.6095 6.6095 6.8111 6.8111 6.8570 6.8570 7.1827 7.1827 7.2035 7.2035 8.2420 8.2420 8.2433 8.2433 8.5619 8.5619 8.5818 8.5818 9.0813 9.0813 9.1360 9.1360 9.5325 9.5325 9.5401 9.5401 10.1192 10.1192 k = 0.1857 0.5000 0.2841 ( 13084 PWs) bands (ev): -69.5317 -69.5317 -69.5317 -69.5317 -39.3809 -39.3809 -39.3806 -39.3806 -38.2273 -38.2273 -38.2272 -38.2272 -38.1402 -38.1402 -38.1401 -38.1401 -18.6493 -18.6493 -18.6487 -18.6487 -5.7209 -5.7209 -5.6893 -5.6893 -4.0627 -4.0627 -3.9407 -3.9407 -3.6560 -3.6560 -3.5654 -3.5654 1.1177 1.1177 1.1194 1.1194 6.1133 6.1133 6.1390 6.1390 6.5960 6.5960 6.6300 6.6300 6.8072 6.8072 6.8576 6.8576 7.1567 7.1567 7.1801 7.1801 8.2367 8.2367 8.2378 8.2378 8.5750 8.5750 8.5992 8.5992 9.0738 9.0738 9.1285 9.1285 9.5729 9.5729 9.5730 9.5730 10.1064 10.1064 k = 0.2000 0.5000 0.2841 ( 13092 PWs) bands (ev): -69.5320 -69.5320 -69.5320 -69.5320 -39.3809 -39.3809 -39.3806 -39.3806 -38.2275 -38.2275 -38.2273 -38.2273 -38.1402 -38.1402 -38.1401 -38.1401 -18.6482 -18.6482 -18.6476 -18.6476 -5.7225 -5.7225 -5.6897 -5.6897 -4.0655 -4.0655 -3.9377 -3.9377 -3.6624 -3.6624 -3.5671 -3.5671 1.1050 1.1050 1.1067 1.1067 6.1177 6.1177 6.1452 6.1452 6.6127 6.6127 6.6496 6.6496 6.8044 6.8044 6.8576 6.8576 7.1343 7.1343 7.1595 7.1595 8.2275 8.2275 8.2283 8.2283 8.5854 8.5854 8.6138 8.6138 9.0661 9.0661 9.1205 9.1205 9.6070 9.6070 9.6150 9.6150 10.0965 10.0965 k = 0.2143 0.5000 0.2841 ( 13088 PWs) bands (ev): -69.5318 -69.5318 -69.5318 -69.5318 -39.3809 -39.3809 -39.3806 -39.3806 -38.2275 -38.2275 -38.2273 -38.2273 -38.1401 -38.1401 -38.1400 -38.1400 -18.6472 -18.6472 -18.6465 -18.6465 -5.7240 -5.7240 -5.6903 -5.6903 -4.0679 -4.0679 -3.9353 -3.9353 -3.6682 -3.6682 -3.5691 -3.5691 1.0918 1.0918 1.0936 1.0936 6.1213 6.1213 6.1503 6.1503 6.6271 6.6271 6.6641 6.6641 6.8061 6.8061 6.8579 6.8579 7.1194 7.1194 7.1451 7.1451 8.2191 8.2191 8.2197 8.2197 8.5938 8.5938 8.6258 8.6258 9.0609 9.0609 9.1146 9.1146 9.6397 9.6397 9.6564 9.6564 10.0914 10.0914 k = 0.2286 0.5000 0.2841 ( 13088 PWs) bands (ev): -69.5318 -69.5318 -69.5318 -69.5318 -39.3810 -39.3810 -39.3807 -39.3807 -38.2276 -38.2276 -38.2274 -38.2274 -38.1400 -38.1400 -38.1399 -38.1399 -18.6460 -18.6460 -18.6454 -18.6454 -5.7255 -5.7255 -5.6912 -5.6912 -4.0699 -4.0699 -3.9336 -3.9336 -3.6734 -3.6734 -3.5712 -3.5712 1.0783 1.0783 1.0801 1.0801 6.1245 6.1245 6.1546 6.1546 6.6360 6.6360 6.6688 6.6688 6.8116 6.8116 6.8559 6.8559 7.1143 7.1143 7.1384 7.1384 8.2120 8.2120 8.2122 8.2122 8.5984 8.5984 8.6335 8.6335 9.0564 9.0564 9.1094 9.1094 9.6681 9.6681 9.6941 9.6941 10.0922 10.0922 k = 0.2429 0.5000 0.2841 ( 13072 PWs) bands (ev): -69.5312 -69.5312 -69.5312 -69.5312 -39.3810 -39.3810 -39.3807 -39.3807 -38.2277 -38.2277 -38.2275 -38.2275 -38.1399 -38.1399 -38.1398 -38.1398 -18.6449 -18.6449 -18.6443 -18.6443 -5.7269 -5.7269 -5.6923 -5.6923 -4.0714 -4.0714 -3.9326 -3.9326 -3.6779 -3.6779 -3.5734 -3.5734 1.0646 1.0646 1.0665 1.0665 6.1277 6.1277 6.1588 6.1588 6.6394 6.6394 6.6650 6.6650 6.8211 6.8211 6.8528 6.8528 7.1212 7.1212 7.1417 7.1417 8.2055 8.2055 8.2057 8.2057 8.6025 8.6025 8.6400 8.6400 9.0537 9.0537 9.1055 9.1055 9.6907 9.6907 9.7259 9.7259 10.1020 10.1020 k = 0.2571 0.5000 0.2841 ( 13068 PWs) bands (ev): -69.5311 -69.5311 -69.5311 -69.5311 -39.3810 -39.3810 -39.3807 -39.3807 -38.2278 -38.2278 -38.2276 -38.2276 -38.1399 -38.1399 -38.1397 -38.1397 -18.6438 -18.6438 -18.6431 -18.6431 -5.7283 -5.7283 -5.6935 -5.6935 -4.0726 -4.0726 -3.9325 -3.9325 -3.6815 -3.6815 -3.5758 -3.5758 1.0508 1.0508 1.0527 1.0527 6.1313 6.1313 6.1631 6.1631 6.6360 6.6360 6.6535 6.6535 6.8264 6.8264 6.8438 6.8438 7.1418 7.1418 7.1576 7.1576 8.1976 8.1976 8.1982 8.1982 8.6013 8.6013 8.6409 8.6409 9.0532 9.0532 9.1034 9.1034 9.7037 9.7037 9.7469 9.7469 10.1164 10.1165 k = 0.2714 0.5000 0.2841 ( 13088 PWs) bands (ev): -69.5319 -69.5319 -69.5319 -69.5319 -39.3810 -39.3810 -39.3807 -39.3807 -38.2279 -38.2279 -38.2277 -38.2277 -38.1398 -38.1398 -38.1397 -38.1397 -18.6426 -18.6426 -18.6420 -18.6420 -5.7296 -5.7296 -5.6951 -5.6951 -4.0733 -4.0733 -3.9333 -3.9333 -3.6842 -3.6842 -3.5784 -3.5784 1.0370 1.0370 1.0390 1.0390 6.1348 6.1348 6.1673 6.1673 6.6267 6.6267 6.6377 6.6377 6.8249 6.8249 6.8300 6.8300 7.1727 7.1727 7.1842 7.1842 8.1862 8.1862 8.1876 8.1876 8.5945 8.5945 8.6355 8.6355 9.0535 9.0535 9.1020 9.1020 9.7047 9.7047 9.7533 9.7533 10.1371 10.1371 k = 0.2857 0.5000 0.2841 ( 13092 PWs) bands (ev): -69.5320 -69.5320 -69.5320 -69.5320 -39.3811 -39.3811 -39.3808 -39.3808 -38.2280 -38.2280 -38.2278 -38.2278 -38.1397 -38.1397 -38.1396 -38.1396 -18.6415 -18.6415 -18.6409 -18.6409 -5.7308 -5.7308 -5.6968 -5.6968 -4.0736 -4.0736 -3.9350 -3.9350 -3.6860 -3.6860 -3.5810 -3.5810 1.0234 1.0234 1.0253 1.0253 6.1395 6.1395 6.1724 6.1724 6.6139 6.6139 6.6197 6.6197 6.8126 6.8126 6.8173 6.8173 7.2142 7.2142 7.2227 7.2227 8.1775 8.1775 8.1795 8.1795 8.5878 8.5878 8.6300 8.6300 9.0556 9.0556 9.1023 9.1023 9.6989 9.6989 9.7505 9.7505 10.1659 10.1659 k = 0.3000 0.5000 0.2841 ( 13084 PWs) bands (ev): -69.5318 -69.5318 -69.5318 -69.5318 -39.3811 -39.3811 -39.3808 -39.3808 -38.2281 -38.2281 -38.2279 -38.2279 -38.1397 -38.1397 -38.1395 -38.1395 -18.6404 -18.6404 -18.6398 -18.6398 -5.7318 -5.7318 -5.6986 -5.6986 -4.0733 -4.0733 -3.9375 -3.9375 -3.6868 -3.6868 -3.5838 -3.5838 1.0101 1.0101 1.0119 1.0119 6.1456 6.1456 6.1789 6.1789 6.5988 6.5988 6.6009 6.6009 6.7929 6.7929 6.8047 6.8047 7.2633 7.2633 7.2698 7.2698 8.1690 8.1690 8.1717 8.1717 8.5818 8.5818 8.6248 8.6248 9.0600 9.0600 9.1047 9.1047 9.6875 9.6875 9.7397 9.7397 10.2002 10.2002 k = 0.3143 0.5000 0.2841 ( 13096 PWs) bands (ev): -69.5322 -69.5322 -69.5322 -69.5322 -39.3811 -39.3811 -39.3808 -39.3808 -38.2282 -38.2282 -38.2280 -38.2280 -38.1396 -38.1396 -38.1395 -38.1395 -18.6393 -18.6393 -18.6388 -18.6388 -5.7328 -5.7328 -5.7006 -5.7006 -4.0726 -4.0726 -3.9409 -3.9409 -3.6867 -3.6867 -3.5868 -3.5868 0.9970 0.9970 0.9988 0.9988 6.1523 6.1523 6.1858 6.1858 6.5801 6.5801 6.5807 6.5807 6.7702 6.7702 6.7870 6.7870 7.3159 7.3159 7.3213 7.3213 8.1592 8.1592 8.1627 8.1627 8.5745 8.5745 8.6181 8.6181 9.0637 9.0637 9.1066 9.1066 9.6694 9.6694 9.7206 9.7206 10.2354 10.2354 k = 0.3286 0.5000 0.2841 ( 13100 PWs) bands (ev): -69.5324 -69.5324 -69.5324 -69.5324 -39.3812 -39.3812 -39.3809 -39.3809 -38.2283 -38.2283 -38.2281 -38.2281 -38.1395 -38.1395 -38.1394 -38.1394 -18.6383 -18.6383 -18.6377 -18.6377 -5.7337 -5.7337 -5.7028 -5.7028 -4.0713 -4.0713 -3.9450 -3.9450 -3.6857 -3.6857 -3.5899 -3.5899 0.9845 0.9845 0.9862 0.9862 6.1606 6.1606 6.1943 6.1943 6.5610 6.5610 6.5630 6.5630 6.7468 6.7468 6.7669 6.7669 7.3712 7.3712 7.3761 7.3761 8.1494 8.1494 8.1536 8.1536 8.5669 8.5669 8.6110 8.6110 9.0674 9.0674 9.1086 9.1086 9.6481 9.6481 9.6973 9.6973 10.2715 10.2716 k = 0.3429 0.5000 0.2841 ( 13092 PWs) bands (ev): -69.5321 -69.5321 -69.5321 -69.5321 -39.3812 -39.3812 -39.3809 -39.3809 -38.2284 -38.2284 -38.2282 -38.2282 -38.1394 -38.1394 -38.1393 -38.1393 -18.6373 -18.6373 -18.6368 -18.6368 -5.7343 -5.7343 -5.7051 -5.7051 -4.0696 -4.0696 -3.9497 -3.9497 -3.6840 -3.6840 -3.5931 -3.5931 0.9725 0.9725 0.9742 0.9742 6.1704 6.1704 6.2041 6.2041 6.5425 6.5425 6.5453 6.5453 6.7231 6.7231 6.7455 6.7455 7.4291 7.4291 7.4338 7.4338 8.1401 8.1401 8.1450 8.1450 8.5618 8.5618 8.6061 8.6061 9.0729 9.0729 9.1125 9.1125 9.6243 9.6243 9.6707 9.6707 10.3058 10.3058 k = 0.3571 0.5000 0.2841 ( 13092 PWs) bands (ev): -69.5321 -69.5321 -69.5321 -69.5321 -39.3812 -39.3812 -39.3809 -39.3809 -38.2285 -38.2285 -38.2283 -38.2283 -38.1394 -38.1394 -38.1393 -38.1393 -18.6364 -18.6364 -18.6359 -18.6359 -5.7349 -5.7349 -5.7074 -5.7074 -4.0673 -4.0673 -3.9551 -3.9551 -3.6816 -3.6816 -3.5964 -3.5964 0.9612 0.9612 0.9628 0.9628 6.1812 6.1812 6.2149 6.2149 6.5243 6.5243 6.5273 6.5273 6.6992 6.6992 6.7230 6.7230 7.4863 7.4863 7.4910 7.4910 8.1287 8.1287 8.1342 8.1342 8.5584 8.5584 8.6028 8.6028 9.0779 9.0779 9.1162 9.1162 9.5979 9.5979 9.6410 9.6410 10.3364 10.3365 k = 0.3714 0.5000 0.2841 ( 13100 PWs) bands (ev): -69.5324 -69.5324 -69.5324 -69.5324 -39.3812 -39.3812 -39.3810 -39.3810 -38.2285 -38.2285 -38.2284 -38.2284 -38.1393 -38.1393 -38.1392 -38.1392 -18.6355 -18.6355 -18.6350 -18.6350 -5.7352 -5.7352 -5.7099 -5.7099 -4.0646 -4.0646 -3.9609 -3.9609 -3.6785 -3.6785 -3.5999 -3.5999 0.9507 0.9507 0.9521 0.9521 6.1928 6.1928 6.2263 6.2263 6.5069 6.5069 6.5095 6.5095 6.6748 6.6748 6.6993 6.6993 7.5421 7.5421 7.5468 7.5468 8.1165 8.1165 8.1224 8.1224 8.5568 8.5568 8.6010 8.6010 9.0821 9.0821 9.1193 9.1193 9.5690 9.5690 9.6082 9.6082 10.3635 10.3635 k = 0.3857 0.5000 0.2841 ( 13108 PWs) bands (ev): -69.5327 -69.5327 -69.5327 -69.5327 -39.3812 -39.3812 -39.3810 -39.3810 -38.2286 -38.2286 -38.2285 -38.2285 -38.1393 -38.1393 -38.1392 -38.1392 -18.6347 -18.6347 -18.6343 -18.6343 -5.7354 -5.7354 -5.7123 -5.7123 -4.0614 -4.0614 -3.9671 -3.9671 -3.6750 -3.6750 -3.6036 -3.6036 0.9410 0.9410 0.9424 0.9424 6.2058 6.2058 6.2389 6.2389 6.4905 6.4905 6.4924 6.4924 6.6513 6.6513 6.6759 6.6759 7.5956 7.5956 7.6002 7.6002 8.1031 8.1031 8.1091 8.1091 8.5585 8.5585 8.6022 8.6022 9.0852 9.0852 9.1213 9.1213 9.5399 9.5399 9.5749 9.5749 10.3861 10.3861 k = 0.4000 0.5000 0.2841 ( 13100 PWs) bands (ev): -69.5324 -69.5324 -69.5324 -69.5324 -39.3812 -39.3812 -39.3810 -39.3810 -38.2286 -38.2286 -38.2285 -38.2285 -38.1392 -38.1392 -38.1392 -38.1392 -18.6339 -18.6339 -18.6336 -18.6336 -5.7354 -5.7354 -5.7147 -5.7147 -4.0576 -4.0576 -3.9736 -3.9736 -3.6711 -3.6711 -3.6074 -3.6074 0.9323 0.9323 0.9335 0.9335 6.2200 6.2200 6.2524 6.2524 6.4760 6.4760 6.4768 6.4768 6.6289 6.6289 6.6529 6.6529 7.6474 7.6474 7.6518 7.6518 8.0909 8.0909 8.0970 8.0970 8.5642 8.5642 8.6064 8.6064 9.0896 9.0896 9.1246 9.1246 9.5126 9.5126 9.5428 9.5428 10.4060 10.4060 k = 0.4143 0.5000 0.2841 ( 13104 PWs) bands (ev): -69.5325 -69.5325 -69.5325 -69.5325 -39.3812 -39.3812 -39.3811 -39.3811 -38.2287 -38.2287 -38.2286 -38.2286 -38.1392 -38.1392 -38.1391 -38.1391 -18.6333 -18.6333 -18.6330 -18.6330 -5.7352 -5.7352 -5.7171 -5.7171 -4.0535 -4.0535 -3.9803 -3.9803 -3.6668 -3.6668 -3.6114 -3.6114 0.9246 0.9246 0.9256 0.9256 6.2348 6.2348 6.2662 6.2662 6.4610 6.4610 6.4616 6.4616 6.6076 6.6076 6.6304 6.6304 7.6955 7.6955 7.6996 7.6996 8.0780 8.0780 8.0838 8.0838 8.5717 8.5717 8.6116 8.6116 9.0915 9.0915 9.1251 9.1251 9.4851 9.4851 9.5103 9.5103 10.4213 10.4214 k = 0.4286 0.5000 0.2841 ( 13104 PWs) bands (ev): -69.5325 -69.5325 -69.5325 -69.5325 -39.3812 -39.3812 -39.3811 -39.3811 -38.2287 -38.2287 -38.2286 -38.2286 -38.1391 -38.1391 -38.1391 -38.1391 -18.6327 -18.6327 -18.6325 -18.6325 -5.7347 -5.7347 -5.7195 -5.7195 -4.0489 -4.0489 -3.9872 -3.9872 -3.6623 -3.6623 -3.6155 -3.6155 0.9180 0.9180 0.9189 0.9189 6.2500 6.2500 6.2799 6.2799 6.4467 6.4467 6.4491 6.4491 6.5891 6.5891 6.6100 6.6100 7.7392 7.7392 7.7430 7.7430 8.0637 8.0637 8.0689 8.0689 8.5841 8.5841 8.6209 8.6209 9.0918 9.0918 9.1235 9.1235 9.4591 9.4591 9.4794 9.4794 10.4339 10.4339 k = 0.4429 0.5000 0.2841 ( 13108 PWs) bands (ev): -69.5326 -69.5326 -69.5326 -69.5326 -39.3812 -39.3812 -39.3811 -39.3811 -38.2288 -38.2288 -38.2287 -38.2287 -38.1391 -38.1391 -38.1391 -38.1391 -18.6323 -18.6323 -18.6320 -18.6320 -5.7341 -5.7341 -5.7217 -5.7217 -4.0440 -4.0440 -3.9940 -3.9940 -3.6576 -3.6576 -3.6198 -3.6198 0.9125 0.9125 0.9132 0.9132 6.2654 6.2654 6.2930 6.2930 6.4333 6.4333 6.4373 6.4373 6.5727 6.5727 6.5909 6.5909 7.7779 7.7779 7.7812 7.7812 8.0496 8.0496 8.0541 8.0541 8.5968 8.5968 8.6291 8.6291 9.0918 9.0918 9.1204 9.1204 9.4367 9.4367 9.4521 9.4521 10.4437 10.4439 k = 0.4571 0.5000 0.2841 ( 13116 PWs) bands (ev): -69.5329 -69.5329 -69.5329 -69.5329 -39.3812 -39.3812 -39.3811 -39.3811 -38.2288 -38.2288 -38.2287 -38.2287 -38.1391 -38.1391 -38.1391 -38.1391 -18.6319 -18.6319 -18.6317 -18.6317 -5.7332 -5.7332 -5.7239 -5.7239 -4.0386 -4.0386 -4.0009 -4.0009 -3.6528 -3.6528 -3.6243 -3.6243 0.9082 0.9082 0.9087 0.9087 6.2803 6.2803 6.3043 6.3043 6.4219 6.4219 6.4273 6.4273 6.5591 6.5591 6.5737 6.5737 7.8101 7.8101 7.8126 7.8126 8.0360 8.0360 8.0396 8.0396 8.6090 8.6090 8.6355 8.6355 9.0911 9.0911 9.1154 9.1154 9.4183 9.4183 9.4290 9.4290 10.4521 10.4521 k = 0.4714 0.5000 0.2841 ( 13124 PWs) bands (ev): -69.5332 -69.5332 -69.5332 -69.5332 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6316 -18.6316 -18.6315 -18.6315 -5.7322 -5.7322 -5.7259 -5.7259 -4.0330 -4.0330 -4.0077 -4.0077 -3.6479 -3.6479 -3.6288 -3.6288 0.9051 0.9051 0.9055 0.9055 6.2939 6.2939 6.3125 6.3125 6.4117 6.4117 6.4174 6.4174 6.5496 6.5496 6.5599 6.5599 7.8359 7.8359 7.8376 7.8376 8.0249 8.0249 8.0275 8.0275 8.6214 8.6214 8.6402 8.6402 9.0903 9.0903 9.1081 9.1081 9.4063 9.4063 9.4129 9.4129 10.4567 10.4567 k = 0.4857 0.5000 0.2841 ( 13132 PWs) bands (ev): -69.5335 -69.5335 -69.5335 -69.5335 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6314 -18.6314 -18.6314 -18.6314 -5.7309 -5.7309 -5.7277 -5.7277 -4.0270 -4.0270 -4.0143 -4.0143 -3.6431 -3.6431 -3.6335 -3.6335 0.9033 0.9033 0.9035 0.9035 6.3058 6.3058 6.3164 6.3164 6.4061 6.4061 6.4100 6.4100 6.5446 6.5446 6.5499 6.5499 7.8524 7.8524 7.8532 7.8532 8.0164 8.0164 8.0178 8.0178 8.6311 8.6311 8.6410 8.6410 9.0919 9.0919 9.1014 9.1014 9.3987 9.3987 9.4018 9.4018 10.4601 10.4601 k = 0.5000 0.5000 0.2841 ( 13136 PWs) bands (ev): -69.5336 -69.5336 -69.5336 -69.5336 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0208 -4.0208 -4.0208 -4.0208 -3.6383 -3.6383 -3.6383 -3.6383 0.9027 0.9027 0.9027 0.9027 6.3133 6.3133 6.3133 6.3133 6.4065 6.4065 6.4065 6.4065 6.5442 6.5442 6.5442 6.5442 7.8593 7.8593 7.8593 7.8593 8.0140 8.0140 8.0140 8.0140 8.6367 8.6367 8.6367 8.6367 9.0942 9.0942 9.0942 9.0942 9.3968 9.3968 9.3968 9.3968 10.4640 10.4640 k = 0.5000 0.5000 0.2841 ( 13136 PWs) bands (ev): -69.5336 -69.5336 -69.5336 -69.5336 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0208 -4.0208 -4.0208 -4.0208 -3.6383 -3.6383 -3.6383 -3.6383 0.9027 0.9027 0.9027 0.9027 6.3133 6.3133 6.3133 6.3133 6.4065 6.4065 6.4065 6.4065 6.5442 6.5442 6.5442 6.5442 7.8593 7.8593 7.8593 7.8593 8.0140 8.0140 8.0140 8.0140 8.6367 8.6367 8.6367 8.6367 9.0942 9.0942 9.0942 9.0942 9.3968 9.3968 9.3968 9.3968 10.4640 10.4640 k = 0.4900 0.4900 0.2841 ( 13126 PWs) bands (ev): -69.5336 -69.5336 -69.5329 -69.5329 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1390 -38.1390 -18.6314 -18.6314 -18.6313 -18.6313 -5.7309 -5.7309 -5.7277 -5.7277 -4.0269 -4.0269 -4.0144 -4.0144 -3.6430 -3.6430 -3.6335 -3.6335 0.9033 0.9033 0.9035 0.9035 6.3059 6.3059 6.3164 6.3164 6.4061 6.4061 6.4111 6.4111 6.5444 6.5444 6.5501 6.5501 7.8503 7.8503 7.8573 7.8573 8.0095 8.0095 8.0255 8.0255 8.6303 8.6303 8.6422 8.6422 9.0867 9.0867 9.1066 9.1066 9.3979 9.3979 9.4032 9.4032 10.4608 10.4608 k = 0.4800 0.4800 0.2841 ( 13114 PWs) bands (ev): -69.5330 -69.5330 -69.5326 -69.5326 -39.3812 -39.3812 -39.3811 -39.3811 -38.2289 -38.2289 -38.2287 -38.2287 -38.1391 -38.1391 -38.1390 -38.1390 -18.6317 -18.6317 -18.6313 -18.6313 -5.7321 -5.7321 -5.7259 -5.7259 -4.0328 -4.0328 -4.0078 -4.0078 -3.6479 -3.6479 -3.6289 -3.6289 0.9048 0.9048 0.9058 0.9058 6.2937 6.2937 6.3140 6.3140 6.4112 6.4112 6.4201 6.4201 6.5480 6.5480 6.5613 6.5613 7.8247 7.8247 7.8574 7.8574 7.9961 7.9961 8.0502 8.0502 8.6165 8.6165 8.6474 8.6474 9.0711 9.0711 9.1304 9.1304 9.3980 9.3980 9.4188 9.4188 10.4575 10.4576 k = 0.4700 0.4700 0.2841 ( 13110 PWs) bands (ev): -69.5327 -69.5327 -69.5326 -69.5326 -39.3813 -39.3813 -39.3811 -39.3811 -38.2289 -38.2289 -38.2286 -38.2286 -38.1391 -38.1391 -38.1390 -38.1390 -18.6322 -18.6322 -18.6313 -18.6313 -5.7332 -5.7332 -5.7239 -5.7239 -4.0385 -4.0385 -4.0011 -4.0011 -3.6527 -3.6527 -3.6243 -3.6243 0.9073 0.9073 0.9094 0.9094 6.2777 6.2777 6.3079 6.3079 6.4192 6.4192 6.4326 6.4326 6.5538 6.5538 6.5772 6.5772 7.7910 7.7910 7.8536 7.8536 7.9722 7.9722 8.0834 8.0834 8.5969 8.5969 8.6527 8.6527 9.0445 9.0445 9.1675 9.1675 9.3992 9.3992 9.4397 9.4397 10.4526 10.4527 k = 0.4600 0.4600 0.2841 ( 13104 PWs) bands (ev): -69.5327 -69.5327 -69.5322 -69.5322 -39.3813 -39.3813 -39.3810 -39.3810 -38.2290 -38.2290 -38.2285 -38.2285 -38.1391 -38.1391 -38.1390 -38.1390 -18.6329 -18.6329 -18.6313 -18.6313 -5.7341 -5.7341 -5.7217 -5.7217 -4.0437 -4.0437 -3.9943 -3.9943 -3.6576 -3.6576 -3.6198 -3.6198 0.9106 0.9106 0.9145 0.9145 6.2582 6.2582 6.3004 6.3004 6.4297 6.4297 6.4477 6.4477 6.5621 6.5621 6.5954 6.5954 7.7554 7.7554 7.8481 7.8481 7.9432 7.9432 8.1203 8.1203 8.5718 8.5718 8.6598 8.6598 9.0124 9.0124 9.2117 9.2117 9.4026 9.4026 9.4667 9.4667 10.4459 10.4460 k = 0.4500 0.4500 0.2841 ( 13092 PWs) bands (ev): -69.5324 -69.5324 -69.5316 -69.5316 -39.3814 -39.3814 -39.3809 -39.3809 -38.2291 -38.2291 -38.2282 -38.2282 -38.1392 -38.1392 -38.1390 -38.1390 -18.6338 -18.6338 -18.6313 -18.6313 -5.7348 -5.7348 -5.7193 -5.7193 -4.0485 -4.0485 -3.9874 -3.9874 -3.6625 -3.6625 -3.6155 -3.6155 0.9148 0.9148 0.9209 0.9209 6.2366 6.2366 6.2935 6.2935 6.4433 6.4433 6.4645 6.4645 6.5729 6.5729 6.6155 6.6155 7.7194 7.7194 7.8436 7.8436 7.9064 7.9064 8.1590 8.1590 8.5456 8.5456 8.6691 8.6691 8.9773 8.9773 9.2608 9.2608 9.4072 9.4072 9.4951 9.4951 10.4384 10.4384 k = 0.4400 0.4400 0.2841 ( 13084 PWs) bands (ev): -69.5320 -69.5320 -69.5315 -69.5315 -39.3815 -39.3815 -39.3808 -39.3808 -38.2292 -38.2292 -38.2280 -38.2280 -38.1392 -38.1392 -38.1391 -38.1391 -18.6349 -18.6349 -18.6313 -18.6313 -5.7353 -5.7353 -5.7167 -5.7167 -4.0529 -4.0529 -3.9805 -3.9805 -3.6674 -3.6674 -3.6112 -3.6112 0.9196 0.9196 0.9286 0.9286 6.2136 6.2136 6.2887 6.2887 6.4601 6.4601 6.4807 6.4807 6.5855 6.5855 6.6377 6.6377 7.6828 7.6828 7.8369 7.8369 7.8599 7.8599 8.1982 8.1982 8.5216 8.5216 8.6787 8.6787 8.9398 8.9398 9.3120 9.3120 9.4137 9.4137 9.5233 9.5233 10.4289 10.4289 k = 0.4300 0.4300 0.2841 ( 13092 PWs) bands (ev): -69.5323 -69.5323 -69.5318 -69.5318 -39.3816 -39.3816 -39.3806 -39.3806 -38.2294 -38.2294 -38.2278 -38.2278 -38.1393 -38.1393 -38.1391 -38.1391 -18.6362 -18.6362 -18.6314 -18.6314 -5.7357 -5.7357 -5.7140 -5.7140 -4.0568 -4.0568 -3.9736 -3.9736 -3.6723 -3.6723 -3.6071 -3.6071 0.9249 0.9249 0.9374 0.9374 6.1900 6.1900 6.2846 6.2846 6.4792 6.4792 6.4981 6.4981 6.5994 6.5994 6.6584 6.6584 7.6453 7.6453 7.8087 7.8087 7.8266 7.8266 8.2364 8.2364 8.4947 8.4947 8.6868 8.6868 8.9000 8.9000 9.3606 9.3606 9.4224 9.4224 9.5514 9.5514 10.4179 10.4179 k = 0.4200 0.4200 0.2841 ( 13096 PWs) bands (ev): -69.5327 -69.5327 -69.5317 -69.5317 -39.3817 -39.3817 -39.3805 -39.3805 -38.2296 -38.2296 -38.2275 -38.2275 -38.1394 -38.1394 -38.1391 -38.1391 -18.6376 -18.6376 -18.6314 -18.6314 -5.7358 -5.7358 -5.7111 -5.7111 -4.0602 -4.0602 -3.9668 -3.9668 -3.6772 -3.6772 -3.6031 -3.6031 0.9306 0.9306 0.9474 0.9474 6.1668 6.1668 6.2823 6.2823 6.5001 6.5001 6.5150 6.5150 6.6157 6.6157 6.6802 6.6802 7.6075 7.6075 7.7527 7.7527 7.8170 7.8170 8.2734 8.2734 8.4715 8.4715 8.6970 8.6970 8.8598 8.8598 9.4005 9.4005 9.4396 9.4396 9.5787 9.5787 10.4042 10.4042 k = 0.4100 0.4100 0.2841 ( 13090 PWs) bands (ev): -69.5323 -69.5323 -69.5317 -69.5317 -39.3818 -39.3818 -39.3803 -39.3803 -38.2298 -38.2298 -38.2271 -38.2271 -38.1394 -38.1394 -38.1391 -38.1391 -18.6392 -18.6392 -18.6314 -18.6314 -5.7357 -5.7357 -5.7080 -5.7080 -4.0630 -4.0630 -3.9600 -3.9600 -3.6820 -3.6820 -3.5992 -3.5992 0.9365 0.9365 0.9583 0.9583 6.1446 6.1446 6.2819 6.2819 6.5233 6.5233 6.5318 6.5318 6.6350 6.6350 6.7021 6.7021 7.5716 7.5716 7.6939 7.6939 7.8069 7.8069 8.3107 8.3107 8.4507 8.4507 8.7099 8.7099 8.8214 8.8214 9.4219 9.4219 9.4735 9.4735 9.6061 9.6061 10.3884 10.3884 k = 0.4000 0.4000 0.2841 ( 13090 PWs) bands (ev): -69.5324 -69.5324 -69.5316 -69.5316 -39.3820 -39.3820 -39.3801 -39.3801 -38.2300 -38.2300 -38.2267 -38.2267 -38.1395 -38.1395 -38.1391 -38.1391 -18.6410 -18.6410 -18.6314 -18.6314 -5.7355 -5.7355 -5.7048 -5.7048 -4.0652 -4.0652 -3.9532 -3.9532 -3.6867 -3.6867 -3.5955 -3.5955 0.9425 0.9425 0.9700 0.9700 6.1240 6.1240 6.2832 6.2832 6.5467 6.5467 6.5492 6.5492 6.6546 6.6546 6.7241 6.7241 7.5366 7.5366 7.6321 7.6321 7.7963 7.7963 8.3467 8.3467 8.4331 8.4331 8.7193 8.7193 8.7833 8.7833 9.4342 9.4342 9.5116 9.5116 9.6320 9.6320 10.3712 10.3712 k = 0.3900 0.3900 0.2841 ( 13090 PWs) bands (ev): -69.5327 -69.5327 -69.5313 -69.5313 -39.3822 -39.3822 -39.3799 -39.3799 -38.2303 -38.2303 -38.2263 -38.2263 -38.1396 -38.1396 -38.1392 -38.1392 -18.6430 -18.6430 -18.6314 -18.6314 -5.7351 -5.7351 -5.7013 -5.7013 -4.0668 -4.0668 -3.9466 -3.9466 -3.6913 -3.6913 -3.5919 -3.5919 0.9482 0.9482 0.9823 0.9823 6.1045 6.1045 6.2857 6.2857 6.5597 6.5597 6.5775 6.5775 6.6765 6.6765 6.7460 6.7460 7.5033 7.5033 7.5687 7.5687 7.7865 7.7865 8.3837 8.3837 8.4172 8.4172 8.7291 8.7291 8.7443 8.7443 9.4474 9.4474 9.5430 9.5430 9.6559 9.6559 10.3529 10.3529 k = 0.3800 0.3800 0.2841 ( 13094 PWs) bands (ev): -69.5334 -69.5334 -69.5309 -69.5309 -39.3823 -39.3823 -39.3797 -39.3797 -38.2305 -38.2305 -38.2259 -38.2259 -38.1397 -38.1397 -38.1392 -38.1392 -18.6451 -18.6451 -18.6314 -18.6314 -5.7345 -5.7345 -5.6977 -5.6977 -4.0677 -4.0677 -3.9401 -3.9401 -3.6958 -3.6958 -3.5885 -3.5885 0.9535 0.9535 0.9952 0.9952 6.0869 6.0869 6.2904 6.2904 6.5699 6.5699 6.6069 6.6069 6.7003 6.7003 6.7688 6.7688 7.4696 7.4696 7.5064 7.5064 7.7759 7.7759 8.4046 8.4046 8.4186 8.4186 8.7032 8.7032 8.7404 8.7404 9.4591 9.4591 9.5661 9.5661 9.6794 9.6794 10.3310 10.3310 k = 0.3700 0.3700 0.2841 ( 13092 PWs) bands (ev): -69.5333 -69.5333 -69.5309 -69.5309 -39.3825 -39.3825 -39.3794 -39.3794 -38.2308 -38.2308 -38.2255 -38.2255 -38.1398 -38.1398 -38.1392 -38.1392 -18.6473 -18.6473 -18.6314 -18.6314 -5.7338 -5.7338 -5.6939 -5.6939 -4.0679 -4.0679 -3.9337 -3.9337 -3.7001 -3.7001 -3.5852 -3.5852 0.9582 0.9582 1.0083 1.0083 6.0721 6.0721 6.2953 6.2953 6.5787 6.5787 6.6396 6.6396 6.7261 6.7261 6.7919 6.7919 7.4292 7.4292 7.4547 7.4547 7.7645 7.7645 8.3960 8.3960 8.4505 8.4505 8.6667 8.6667 8.7497 8.7497 9.4710 9.4710 9.5806 9.5806 9.7010 9.7010 10.3089 10.3089 k = 0.3600 0.3600 0.2841 ( 13074 PWs) bands (ev): -69.5332 -69.5332 -69.5296 -69.5296 -39.3827 -39.3827 -39.3792 -39.3792 -38.2311 -38.2311 -38.2250 -38.2250 -38.1399 -38.1399 -38.1392 -38.1392 -18.6497 -18.6497 -18.6315 -18.6315 -5.7330 -5.7330 -5.6899 -5.6899 -4.0673 -4.0673 -3.9275 -3.9275 -3.7042 -3.7042 -3.5821 -3.5821 0.9622 0.9622 1.0214 1.0214 6.0598 6.0598 6.3009 6.3009 6.5848 6.5848 6.6764 6.6764 6.7540 6.7540 6.8158 6.8158 7.3754 7.3754 7.4213 7.4213 7.7591 7.7591 8.3907 8.3907 8.4819 8.4819 8.6309 8.6309 8.7599 8.7599 9.4837 9.4837 9.5852 9.5852 9.7216 9.7216 10.2888 10.2888 k = 0.3500 0.3500 0.2841 ( 13082 PWs) bands (ev): -69.5333 -69.5333 -69.5301 -69.5301 -39.3829 -39.3829 -39.3789 -39.3789 -38.2314 -38.2314 -38.2244 -38.2244 -38.1400 -38.1400 -38.1393 -38.1393 -18.6522 -18.6522 -18.6315 -18.6315 -5.7320 -5.7320 -5.6857 -5.6857 -4.0661 -4.0661 -3.9214 -3.9214 -3.7081 -3.7081 -3.5791 -3.5791 0.9653 0.9653 1.0344 1.0344 6.0494 6.0494 6.3050 6.3050 6.5882 6.5882 6.7122 6.7122 6.7837 6.7837 6.8403 6.8403 7.3207 7.3207 7.3947 7.3947 7.7440 7.7440 8.3871 8.3871 8.5097 8.5097 8.5965 8.5965 8.7663 8.7663 9.4947 9.4947 9.5789 9.5789 9.7398 9.7398 10.2630 10.2630 k = 0.3400 0.3400 0.2841 ( 13086 PWs) bands (ev): -69.5336 -69.5336 -69.5301 -69.5301 -39.3832 -39.3832 -39.3786 -39.3786 -38.2318 -38.2318 -38.2239 -38.2239 -38.1401 -38.1401 -38.1393 -38.1393 -18.6548 -18.6548 -18.6315 -18.6315 -5.7309 -5.7309 -5.6812 -5.6812 -4.0641 -4.0641 -3.9156 -3.9156 -3.7117 -3.7117 -3.5764 -3.5764 0.9672 0.9672 1.0470 1.0470 6.0415 6.0415 6.3075 6.3075 6.5900 6.5900 6.7484 6.7484 6.8146 6.8146 6.8656 6.8656 7.2697 7.2697 7.3720 7.3720 7.7345 7.7345 8.3855 8.3855 8.5362 8.5362 8.5634 8.5634 8.7712 8.7712 9.5034 9.5034 9.5660 9.5660 9.7569 9.7569 10.2359 10.2359 k = 0.3300 0.3300 0.2841 ( 13082 PWs) bands (ev): -69.5334 -69.5334 -69.5300 -69.5300 -39.3834 -39.3834 -39.3783 -39.3783 -38.2321 -38.2321 -38.2233 -38.2233 -38.1402 -38.1402 -38.1393 -38.1393 -18.6576 -18.6576 -18.6315 -18.6315 -5.7297 -5.7297 -5.6766 -5.6766 -4.0613 -4.0613 -3.9099 -3.9099 -3.7150 -3.7150 -3.5739 -3.5739 0.9679 0.9679 1.0589 1.0589 6.0362 6.0362 6.3069 6.3069 6.5913 6.5913 6.7853 6.7853 6.8483 6.8483 6.8931 6.8931 7.2236 7.2236 7.3538 7.3538 7.7251 7.7251 8.3878 8.3878 8.5320 8.5320 8.5617 8.5617 8.7765 8.7765 9.4993 9.4993 9.5590 9.5590 9.7724 9.7724 10.2077 10.2077 k = 0.3200 0.3200 0.2841 ( 13090 PWs) bands (ev): -69.5340 -69.5340 -69.5299 -69.5299 -39.3836 -39.3836 -39.3780 -39.3780 -38.2325 -38.2325 -38.2228 -38.2228 -38.1403 -38.1403 -38.1393 -38.1393 -18.6604 -18.6604 -18.6316 -18.6316 -5.7284 -5.7284 -5.6717 -5.6717 -4.0578 -4.0578 -3.9045 -3.9045 -3.7179 -3.7179 -3.5715 -3.5715 0.9672 0.9672 1.0699 1.0699 6.0322 6.0322 6.3010 6.3010 6.5930 6.5930 6.8212 6.8212 6.8829 6.8829 6.9223 6.9223 7.1829 7.1829 7.3398 7.3398 7.7173 7.7173 8.3898 8.3898 8.5013 8.5013 8.5839 8.5839 8.7793 8.7793 9.4721 9.4721 9.5663 9.5663 9.7858 9.7858 10.1782 10.1782 k = 0.3100 0.3100 0.2841 ( 13098 PWs) bands (ev): -69.5344 -69.5344 -69.5301 -69.5301 -39.3839 -39.3839 -39.3777 -39.3777 -38.2329 -38.2329 -38.2222 -38.2222 -38.1405 -38.1405 -38.1393 -38.1393 -18.6633 -18.6633 -18.6316 -18.6316 -5.7271 -5.7271 -5.6667 -5.6667 -4.0536 -4.0536 -3.8993 -3.8993 -3.7203 -3.7203 -3.5694 -3.5694 0.9650 0.9650 1.0797 1.0797 6.0301 6.0301 6.2895 6.2895 6.5982 6.5982 6.8567 6.8567 6.9187 6.9187 6.9537 6.9537 7.1477 7.1477 7.3308 7.3308 7.7112 7.7112 8.3926 8.3926 8.4751 8.4751 8.6009 8.6009 8.7809 8.7809 9.4312 9.4312 9.5810 9.5810 9.7966 9.7966 10.1484 10.1484 k = 0.3000 0.3000 0.2841 ( 13110 PWs) bands (ev): -69.5353 -69.5353 -69.5300 -69.5300 -39.3841 -39.3841 -39.3774 -39.3774 -38.2334 -38.2334 -38.2216 -38.2216 -38.1406 -38.1406 -38.1394 -38.1394 -18.6663 -18.6663 -18.6316 -18.6316 -5.7256 -5.7256 -5.6614 -5.6614 -4.0487 -4.0487 -3.8945 -3.8945 -3.7222 -3.7222 -3.5675 -3.5675 0.9613 0.9613 1.0881 1.0881 6.0296 6.0296 6.2715 6.2715 6.6066 6.6066 6.8870 6.8870 6.9554 6.9554 6.9886 6.9886 7.1176 7.1176 7.3297 7.3297 7.7054 7.7054 8.3941 8.3941 8.4506 8.4506 8.6192 8.6192 8.7803 8.7803 9.3843 9.3843 9.6002 9.6002 9.8051 9.8051 10.1166 10.1166 k = 0.2900 0.2900 0.2841 ( 13082 PWs) bands (ev): -69.5342 -69.5342 -69.5291 -69.5291 -39.3844 -39.3844 -39.3771 -39.3771 -38.2338 -38.2338 -38.2209 -38.2209 -38.1406 -38.1406 -38.1394 -38.1394 -18.6694 -18.6694 -18.6317 -18.6317 -5.7242 -5.7242 -5.6559 -5.6559 -4.0430 -4.0430 -3.8900 -3.8900 -3.7236 -3.7236 -3.5659 -3.5659 0.9561 0.9561 1.0949 1.0949 6.0307 6.0307 6.2511 6.2511 6.6217 6.6217 6.9143 6.9143 6.9937 6.9937 7.0279 7.0279 7.0944 7.0944 7.3380 7.3380 7.7060 7.7060 8.3930 8.3930 8.4440 8.4440 8.6362 8.6362 8.7824 8.7824 9.3352 9.3352 9.6218 9.6218 9.8121 9.8121 10.0864 10.0864 k = 0.2800 0.2800 0.2841 ( 13082 PWs) bands (ev): -69.5345 -69.5345 -69.5287 -69.5287 -39.3847 -39.3847 -39.3767 -39.3767 -38.2342 -38.2342 -38.2203 -38.2203 -38.1408 -38.1408 -38.1394 -38.1394 -18.6725 -18.6725 -18.6317 -18.6317 -5.7227 -5.7227 -5.6502 -5.6502 -4.0366 -4.0366 -3.8859 -3.8859 -3.7242 -3.7242 -3.5645 -3.5645 0.9493 0.9493 1.0997 1.0997 6.0324 6.0324 6.2259 6.2259 6.6384 6.6384 6.9344 6.9344 7.0306 7.0306 7.0655 7.0655 7.0805 7.0805 7.3542 7.3542 7.7041 7.7041 8.3802 8.3802 8.4486 8.4486 8.6481 8.6481 8.7783 8.7783 9.2839 9.2839 9.6436 9.6436 9.8150 9.8150 10.0546 10.0546 k = 0.2700 0.2700 0.2841 ( 13088 PWs) bands (ev): -69.5347 -69.5347 -69.5289 -69.5289 -39.3849 -39.3849 -39.3764 -39.3764 -38.2346 -38.2346 -38.2196 -38.2196 -38.1409 -38.1409 -38.1394 -38.1394 -18.6756 -18.6756 -18.6318 -18.6318 -5.7212 -5.7212 -5.6444 -5.6444 -4.0296 -4.0296 -3.8822 -3.8822 -3.7242 -3.7242 -3.5634 -3.5634 0.9409 0.9409 1.1025 1.1025 6.0341 6.0341 6.1985 6.1985 6.6570 6.6570 6.9490 6.9490 7.0471 7.0471 7.0841 7.0841 7.1165 7.1165 7.3802 7.3802 7.7015 7.7015 8.3622 8.3622 8.4601 8.4601 8.6572 8.6572 8.7722 8.7722 9.2311 9.2311 9.6667 9.6667 9.8127 9.8127 10.0231 10.0231 k = 0.2600 0.2600 0.2841 ( 13098 PWs) bands (ev): -69.5355 -69.5355 -69.5288 -69.5288 -39.3852 -39.3852 -39.3761 -39.3761 -38.2351 -38.2351 -38.2190 -38.2190 -38.1410 -38.1410 -38.1394 -38.1394 -18.6788 -18.6788 -18.6318 -18.6318 -5.7197 -5.7197 -5.6384 -5.6384 -4.0220 -4.0220 -3.8790 -3.8790 -3.7233 -3.7233 -3.5626 -3.5626 0.9310 0.9310 1.1030 1.1030 6.0361 6.0361 6.1699 6.1699 6.6765 6.6765 6.9585 6.9585 7.0396 7.0396 7.1254 7.1254 7.1623 7.1623 7.4162 7.4162 7.6991 7.6991 8.3410 8.3410 8.4774 8.4774 8.6637 8.6637 8.7616 8.7616 9.1800 9.1800 9.6908 9.6908 9.8066 9.8066 9.9924 9.9924 k = 0.2500 0.2500 0.2841 ( 13106 PWs) bands (ev): -69.5356 -69.5356 -69.5294 -69.5294 -39.3855 -39.3855 -39.3758 -39.3758 -38.2355 -38.2355 -38.2184 -38.2184 -38.1411 -38.1411 -38.1394 -38.1394 -18.6820 -18.6820 -18.6319 -18.6319 -5.7181 -5.7181 -5.6322 -5.6322 -4.0138 -4.0138 -3.8762 -3.8762 -3.7216 -3.7216 -3.5621 -3.5621 0.9198 0.9198 1.1011 1.1011 6.0379 6.0379 6.1433 6.1433 6.6954 6.6954 6.9623 6.9623 7.0345 7.0345 7.1727 7.1727 7.2109 7.2109 7.4589 7.4589 7.6975 7.6975 8.3234 8.3234 8.4987 8.4987 8.6678 8.6678 8.7491 8.7491 9.1309 9.1309 9.7152 9.7152 9.7966 9.7966 9.9608 9.9608 k = 0.2400 0.2400 0.2841 ( 13096 PWs) bands (ev): -69.5355 -69.5355 -69.5287 -69.5287 -39.3858 -39.3858 -39.3754 -39.3754 -38.2360 -38.2360 -38.2177 -38.2177 -38.1412 -38.1412 -38.1394 -38.1394 -18.6852 -18.6852 -18.6319 -18.6319 -5.7166 -5.7166 -5.6259 -5.6259 -4.0051 -4.0051 -3.8739 -3.8739 -3.7191 -3.7191 -3.5619 -3.5619 0.9072 0.9072 1.0967 1.0967 6.0389 6.0389 6.1202 6.1202 6.7112 6.7112 6.9639 6.9639 7.0343 7.0343 7.2243 7.2243 7.2621 7.2621 7.5093 7.5093 7.7029 7.7029 8.3080 8.3080 8.5231 8.5231 8.6702 8.6702 8.7386 8.7386 9.0848 9.0848 9.7390 9.7390 9.7841 9.7841 9.9328 9.9328 k = 0.2300 0.2300 0.2841 ( 13088 PWs) bands (ev): -69.5355 -69.5355 -69.5281 -69.5281 -39.3860 -39.3860 -39.3751 -39.3751 -38.2364 -38.2364 -38.2171 -38.2171 -38.1412 -38.1412 -38.1394 -38.1394 -18.6884 -18.6884 -18.6320 -18.6320 -5.7150 -5.7150 -5.6195 -5.6195 -3.9960 -3.9960 -3.8719 -3.8719 -3.7157 -3.7157 -3.5620 -3.5620 0.8934 0.8934 1.0898 1.0898 6.0391 6.0391 6.0993 6.0993 6.7237 6.7237 6.9643 6.9643 7.0409 7.0409 7.2794 7.2794 7.3145 7.3145 7.5641 7.5641 7.7084 7.7084 8.2927 8.2927 8.5515 8.5515 8.6709 8.6709 8.7244 8.7244 9.0430 9.0430 9.7525 9.7525 9.7785 9.7785 9.9049 9.9049 k = 0.2200 0.2200 0.2841 ( 13072 PWs) bands (ev): -69.5353 -69.5353 -69.5271 -69.5271 -39.3863 -39.3863 -39.3747 -39.3747 -38.2368 -38.2368 -38.2165 -38.2165 -38.1413 -38.1413 -38.1394 -38.1394 -18.6915 -18.6915 -18.6320 -18.6320 -5.7135 -5.7135 -5.6130 -5.6130 -3.9865 -3.9865 -3.8703 -3.8703 -3.7115 -3.7115 -3.5624 -3.5624 0.8786 0.8786 1.0803 1.0803 6.0386 6.0386 6.0822 6.0822 6.7312 6.7312 6.9651 6.9651 7.0547 7.0547 7.3372 7.3372 7.3681 7.3681 7.6220 7.6220 7.7182 7.7182 8.2792 8.2792 8.5838 8.5838 8.6695 8.6695 8.7096 8.7096 9.0066 9.0066 9.7365 9.7365 9.7967 9.7967 9.8798 9.8798 k = 0.2100 0.2100 0.2841 ( 13064 PWs) bands (ev): -69.5345 -69.5345 -69.5274 -69.5274 -39.3866 -39.3866 -39.3744 -39.3744 -38.2373 -38.2373 -38.2158 -38.2158 -38.1414 -38.1414 -38.1393 -38.1393 -18.6946 -18.6946 -18.6320 -18.6320 -5.7120 -5.7120 -5.6065 -5.6065 -3.9768 -3.9768 -3.8689 -3.8689 -3.7065 -3.7065 -3.5632 -3.5632 0.8629 0.8629 1.0683 1.0683 6.0367 6.0367 6.0698 6.0698 6.7339 6.7339 6.9653 6.9653 7.0749 7.0749 7.3962 7.3962 7.4225 7.4225 7.6783 7.6783 7.7321 7.7321 8.2665 8.2665 8.6172 8.6172 8.6667 8.6667 8.6935 8.6935 8.9745 8.9745 9.7099 9.7099 9.8140 9.8140 9.8612 9.8612 k = 0.2000 0.2000 0.2841 ( 13070 PWs) bands (ev): -69.5350 -69.5350 -69.5273 -69.5273 -39.3868 -39.3868 -39.3741 -39.3741 -38.2378 -38.2378 -38.2153 -38.2153 -38.1415 -38.1415 -38.1393 -38.1393 -18.6977 -18.6977 -18.6321 -18.6321 -5.7106 -5.7106 -5.5999 -5.5999 -3.9670 -3.9670 -3.8677 -3.8677 -3.7009 -3.7009 -3.5643 -3.5643 0.8464 0.8464 1.0539 1.0539 6.0325 6.0325 6.0578 6.0578 6.7326 6.7326 6.9657 6.9657 7.1008 7.1008 7.4553 7.4553 7.4767 7.4767 7.7220 7.7220 7.7655 7.7655 8.2524 8.2524 8.6392 8.6392 8.6608 8.6608 8.6877 8.6877 8.9456 8.9456 9.6782 9.6782 9.8094 9.8094 9.8662 9.8662 k = 0.1900 0.1900 0.2841 ( 13050 PWs) bands (ev): -69.5342 -69.5342 -69.5266 -69.5266 -39.3871 -39.3871 -39.3738 -39.3738 -38.2382 -38.2382 -38.2146 -38.2146 -38.1415 -38.1415 -38.1393 -38.1393 -18.7007 -18.7007 -18.6322 -18.6322 -5.7091 -5.7091 -5.5934 -5.5934 -3.9573 -3.9573 -3.8663 -3.8663 -3.6946 -3.6946 -3.5657 -3.5657 0.8294 0.8294 1.0372 1.0372 6.0277 6.0277 6.0518 6.0518 6.7292 6.7292 6.9680 6.9680 7.1312 7.1312 7.5145 7.5145 7.5331 7.5331 7.7499 7.7499 7.8226 7.8226 8.2419 8.2419 8.6436 8.6436 8.6486 8.6486 8.7133 8.7133 8.9264 8.9264 9.6428 9.6428 9.7910 9.7910 9.8891 9.8891 k = 0.1800 0.1800 0.2841 ( 13050 PWs) bands (ev): -69.5339 -69.5339 -69.5269 -69.5269 -39.3873 -39.3873 -39.3734 -39.3734 -38.2386 -38.2386 -38.2140 -38.2140 -38.1416 -38.1416 -38.1393 -38.1393 -18.7036 -18.7036 -18.6322 -18.6322 -5.7077 -5.7077 -5.5869 -5.5869 -3.9478 -3.9478 -3.8647 -3.8647 -3.6878 -3.6878 -3.5674 -3.5674 0.8120 0.8120 1.0186 1.0186 6.0212 6.0212 6.0502 6.0502 6.7248 6.7248 6.9692 6.9692 7.1650 7.1650 7.5669 7.5669 7.5881 7.5881 7.7775 7.7775 7.8813 7.8813 8.2328 8.2328 8.6262 8.6262 8.6406 8.6406 8.7476 8.7476 8.9158 8.9158 9.6029 9.6029 9.7706 9.7706 9.9136 9.9136 k = 0.1700 0.1700 0.2841 ( 13054 PWs) bands (ev): -69.5340 -69.5340 -69.5271 -69.5271 -39.3876 -39.3876 -39.3732 -39.3732 -38.2390 -38.2390 -38.2135 -38.2135 -38.1417 -38.1417 -38.1393 -38.1393 -18.7065 -18.7065 -18.6323 -18.6323 -5.7063 -5.7063 -5.5805 -5.5805 -3.9388 -3.9388 -3.8626 -3.8626 -3.6807 -3.6807 -3.5695 -3.5695 0.7944 0.7944 0.9981 0.9981 6.0138 6.0138 6.0501 6.0501 6.7207 6.7207 6.9722 6.9722 7.2015 7.2015 7.6104 7.6104 7.6438 7.6438 7.8109 7.8109 7.9404 7.9404 8.2240 8.2240 8.6015 8.6015 8.6356 8.6356 8.7783 8.7783 8.9222 8.9222 9.5588 9.5588 9.7506 9.7506 9.9392 9.9392 k = 0.1600 0.1600 0.2841 ( 13042 PWs) bands (ev): -69.5335 -69.5335 -69.5267 -69.5267 -39.3878 -39.3878 -39.3729 -39.3729 -38.2394 -38.2394 -38.2129 -38.2129 -38.1417 -38.1417 -38.1392 -38.1392 -18.7092 -18.7092 -18.6323 -18.6323 -5.7050 -5.7050 -5.5743 -5.5743 -3.9305 -3.9305 -3.8597 -3.8597 -3.6732 -3.6732 -3.5718 -3.5718 0.7767 0.7767 0.9762 0.9762 6.0060 6.0060 6.0532 6.0532 6.7177 6.7177 6.9763 6.9763 7.2399 7.2399 7.6478 7.6478 7.6987 7.6987 7.8546 7.8546 7.9958 7.9958 8.2173 8.2173 8.5783 8.5783 8.6334 8.6334 8.7987 8.7987 8.9563 8.9563 9.5113 9.5113 9.7334 9.7334 9.9647 9.9647 k = 0.1500 0.1500 0.2841 ( 13046 PWs) bands (ev): -69.5335 -69.5335 -69.5270 -69.5270 -39.3881 -39.3881 -39.3726 -39.3726 -38.2399 -38.2399 -38.2124 -38.2124 -38.1418 -38.1418 -38.1392 -38.1392 -18.7119 -18.7119 -18.6324 -18.6324 -5.7037 -5.7037 -5.5682 -5.5682 -3.9233 -3.9233 -3.8558 -3.8558 -3.6656 -3.6656 -3.5744 -3.5744 0.7592 0.7592 0.9530 0.9530 5.9969 5.9969 6.0581 6.0581 6.7168 6.7168 6.9811 6.9811 7.2779 7.2779 7.6763 7.6763 7.7492 7.7492 7.9058 7.9058 8.0444 8.0444 8.2105 8.2105 8.5515 8.5515 8.6352 8.6352 8.8061 8.8061 9.0119 9.0119 9.4595 9.4595 9.7189 9.7189 9.9893 9.9893 k = 0.1400 0.1400 0.2841 ( 13042 PWs) bands (ev): -69.5330 -69.5330 -69.5272 -69.5272 -39.3883 -39.3883 -39.3723 -39.3723 -38.2402 -38.2402 -38.2119 -38.2119 -38.1418 -38.1418 -38.1391 -38.1391 -18.7144 -18.7144 -18.6324 -18.6324 -5.7025 -5.7025 -5.5623 -5.5623 -3.9174 -3.9174 -3.8506 -3.8506 -3.6580 -3.6580 -3.5773 -3.5773 0.7420 0.7420 0.9290 0.9290 5.9876 5.9876 6.0653 6.0653 6.7189 6.7189 6.9874 6.9874 7.3166 7.3166 7.6996 7.6996 7.7967 7.7967 7.9626 7.9626 8.0851 8.0851 8.2064 8.2064 8.5227 8.5227 8.6447 8.6447 8.8111 8.8111 9.0858 9.0858 9.4051 9.4051 9.7065 9.7065 10.0133 10.0133 k = 0.1300 0.1300 0.2841 ( 13038 PWs) bands (ev): -69.5333 -69.5333 -69.5265 -69.5265 -39.3885 -39.3885 -39.3721 -39.3721 -38.2406 -38.2406 -38.2115 -38.2115 -38.1419 -38.1419 -38.1391 -38.1391 -18.7168 -18.7168 -18.6324 -18.6324 -5.7013 -5.7013 -5.5566 -5.5566 -3.9128 -3.9128 -3.8442 -3.8442 -3.6505 -3.6505 -3.5802 -3.5802 0.7253 0.7253 0.9045 0.9045 5.9778 5.9778 6.0716 6.0716 6.7242 6.7242 6.9951 6.9951 7.3541 7.3541 7.7217 7.7217 7.8362 7.8362 8.0239 8.0239 8.1159 8.1159 8.2042 8.2042 8.4959 8.4959 8.6644 8.6644 8.8178 8.8178 9.1662 9.1662 9.3483 9.3483 9.6986 9.6986 10.0365 10.0365 k = 0.1200 0.1200 0.2841 ( 13044 PWs) bands (ev): -69.5332 -69.5332 -69.5271 -69.5271 -39.3887 -39.3887 -39.3718 -39.3718 -38.2409 -38.2409 -38.2110 -38.2110 -38.1419 -38.1419 -38.1391 -38.1391 -18.7190 -18.7190 -18.6325 -18.6325 -5.7002 -5.7002 -5.5512 -5.5512 -3.9094 -3.9094 -3.8367 -3.8367 -3.6433 -3.6433 -3.5831 -3.5831 0.7092 0.7092 0.8799 0.8799 5.9671 5.9671 6.0788 6.0788 6.7332 6.7332 7.0036 7.0036 7.3906 7.3906 7.7427 7.7427 7.8701 7.8701 8.0830 8.0830 8.1354 8.1354 8.2037 8.2037 8.4671 8.4671 8.6930 8.6930 8.8218 8.8218 9.2548 9.2548 9.2908 9.2908 9.6940 9.6940 10.0589 10.0589 k = 0.1100 0.1100 0.2841 ( 13042 PWs) bands (ev): -69.5331 -69.5331 -69.5270 -69.5270 -39.3889 -39.3889 -39.3716 -39.3716 -38.2413 -38.2413 -38.2106 -38.2106 -38.1420 -38.1420 -38.1391 -38.1391 -18.7211 -18.7211 -18.6325 -18.6325 -5.6991 -5.6991 -5.5461 -5.5461 -3.9070 -3.9070 -3.8284 -3.8284 -3.6368 -3.6368 -3.5858 -3.5858 0.6939 0.6939 0.8555 0.8555 5.9573 5.9573 6.0854 6.0854 6.7459 6.7459 7.0126 7.0126 7.4261 7.4261 7.7630 7.7630 7.8999 7.8999 8.1208 8.1208 8.1584 8.1584 8.2132 8.2132 8.4391 8.4391 8.7296 8.7296 8.8332 8.8332 9.2282 9.2282 9.3557 9.3557 9.6927 9.6927 10.0795 10.0795 k = 0.1000 0.1000 0.2841 ( 13042 PWs) bands (ev): -69.5334 -69.5334 -69.5267 -69.5267 -39.3891 -39.3891 -39.3714 -39.3714 -38.2416 -38.2416 -38.2102 -38.2102 -38.1420 -38.1420 -38.1391 -38.1391 -18.7231 -18.7231 -18.6326 -18.6326 -5.6982 -5.6982 -5.5413 -5.5413 -3.9053 -3.9053 -3.8195 -3.8195 -3.6313 -3.6313 -3.5880 -3.5880 0.6796 0.6796 0.8318 0.8318 5.9477 5.9477 6.0923 6.0923 6.7623 6.7623 7.0228 7.0228 7.4569 7.4569 7.7815 7.7815 7.9236 7.9236 8.1263 8.1263 8.1763 8.1763 8.2540 8.2540 8.4112 8.4112 8.7725 8.7725 8.8478 8.8478 9.1687 9.1687 9.4575 9.4575 9.6961 9.6961 10.0999 10.0999 k = 0.0900 0.0900 0.2841 ( 13030 PWs) bands (ev): -69.5334 -69.5334 -69.5257 -69.5257 -39.3892 -39.3892 -39.3712 -39.3712 -38.2418 -38.2418 -38.2099 -38.2099 -38.1420 -38.1420 -38.1390 -38.1390 -18.7249 -18.7249 -18.6326 -18.6326 -5.6973 -5.6973 -5.5369 -5.5369 -3.9042 -3.9042 -3.8105 -3.8105 -3.6274 -3.6274 -3.5891 -3.5891 0.6663 0.6663 0.8089 0.8089 5.9384 5.9384 6.0961 6.0961 6.7818 6.7818 7.0341 7.0341 7.4871 7.4871 7.8017 7.8017 7.9446 7.9446 8.1220 8.1220 8.1795 8.1795 8.3153 8.3153 8.3874 8.3874 8.8163 8.8163 8.8678 8.8678 9.1101 9.1101 9.5633 9.5633 9.7050 9.7050 10.1193 10.1193 k = 0.0800 0.0800 0.2841 ( 13030 PWs) bands (ev): -69.5337 -69.5337 -69.5254 -69.5254 -39.3893 -39.3893 -39.3711 -39.3711 -38.2421 -38.2421 -38.2096 -38.2096 -38.1420 -38.1420 -38.1390 -38.1390 -18.7265 -18.7265 -18.6327 -18.6327 -5.6965 -5.6965 -5.5328 -5.5328 -3.9035 -3.9035 -3.8015 -3.8015 -3.6254 -3.6254 -3.5888 -3.5888 0.6541 0.6541 0.7874 0.7874 5.9295 5.9295 6.0998 6.0998 6.8037 6.8037 7.0452 7.0452 7.5145 7.5145 7.8214 7.8214 7.9597 7.9597 8.1103 8.1103 8.1768 8.1768 8.3483 8.3483 8.3965 8.3965 8.8462 8.8462 8.9012 8.9012 9.0524 9.0524 9.6670 9.6670 9.7192 9.7192 10.1370 10.1370 k = 0.0700 0.0700 0.2841 ( 13022 PWs) bands (ev): -69.5335 -69.5335 -69.5251 -69.5251 -39.3895 -39.3895 -39.3709 -39.3709 -38.2423 -38.2423 -38.2093 -38.2093 -38.1420 -38.1420 -38.1390 -38.1390 -18.7280 -18.7280 -18.6327 -18.6327 -5.6957 -5.6957 -5.5292 -5.5292 -3.9030 -3.9030 -3.7927 -3.7927 -3.6256 -3.6256 -3.5870 -3.5870 0.6433 0.6433 0.7676 0.7676 5.9212 5.9212 6.1035 6.1035 6.8272 6.8272 7.0566 7.0566 7.5396 7.5396 7.8424 7.8424 7.9730 7.9730 8.0959 8.0959 8.1731 8.1731 8.3285 8.3285 8.4587 8.4587 8.8648 8.8648 8.9492 8.9492 8.9977 8.9977 9.7367 9.7367 9.7678 9.7678 10.1535 10.1535 k = 0.0600 0.0600 0.2841 ( 13020 PWs) bands (ev): -69.5336 -69.5336 -69.5248 -69.5248 -39.3896 -39.3896 -39.3708 -39.3708 -38.2425 -38.2425 -38.2091 -38.2091 -38.1420 -38.1420 -38.1390 -38.1390 -18.7292 -18.7292 -18.6327 -18.6327 -5.6951 -5.6951 -5.5260 -5.5260 -3.9026 -3.9026 -3.7844 -3.7844 -3.6273 -3.6273 -3.5842 -3.5842 0.6338 0.6338 0.7496 0.7496 5.9136 5.9136 6.1057 6.1057 6.8513 6.8513 7.0670 7.0670 7.5612 7.5612 7.8614 7.8614 7.9824 7.9824 8.0813 8.0813 8.1686 8.1686 8.3085 8.3085 8.5242 8.5242 8.8773 8.8773 8.9466 8.9466 8.9949 8.9949 9.7616 9.7616 9.8573 9.8573 10.1672 10.1672 k = 0.0500 0.0500 0.2841 ( 13000 PWs) bands (ev): -69.5325 -69.5325 -69.5245 -69.5245 -39.3897 -39.3897 -39.3707 -39.3707 -38.2426 -38.2426 -38.2088 -38.2088 -38.1420 -38.1420 -38.1389 -38.1389 -18.7303 -18.7303 -18.6327 -18.6327 -5.6946 -5.6946 -5.5233 -5.5233 -3.9024 -3.9024 -3.7767 -3.7767 -3.6299 -3.6299 -3.5811 -3.5811 0.6257 0.6257 0.7339 0.7339 5.9070 5.9070 6.1092 6.1092 6.8746 6.8746 7.0763 7.0763 7.5820 7.5820 7.8849 7.8849 7.9910 7.9910 8.0690 8.0690 8.1643 8.1643 8.2919 8.2919 8.5862 8.5862 8.8871 8.8871 8.9024 8.9024 9.0379 9.0379 9.7918 9.7918 9.9317 9.9317 10.1046 10.1046 k = 0.0400 0.0400 0.2841 ( 13008 PWs) bands (ev): -69.5328 -69.5328 -69.5247 -69.5247 -39.3898 -39.3898 -39.3706 -39.3706 -38.2428 -38.2428 -38.2087 -38.2087 -38.1420 -38.1420 -38.1389 -38.1389 -18.7312 -18.7312 -18.6328 -18.6328 -5.6941 -5.6941 -5.5210 -5.5210 -3.9023 -3.9023 -3.7700 -3.7700 -3.6328 -3.6328 -3.5780 -3.5780 0.6191 0.6191 0.7206 0.7206 5.9015 5.9015 6.1102 6.1102 6.8959 6.8959 7.0844 7.0844 7.5980 7.5980 7.9022 7.9022 7.9911 7.9911 8.0578 8.0578 8.1575 8.1575 8.2753 8.2753 8.6401 8.6401 8.8659 8.8659 8.8964 8.8964 9.0693 9.0693 9.8274 9.8274 9.9829 9.9829 10.0328 10.0328 k = 0.0300 0.0300 0.2841 ( 13020 PWs) bands (ev): -69.5334 -69.5334 -69.5250 -69.5250 -39.3898 -39.3898 -39.3705 -39.3705 -38.2429 -38.2429 -38.2086 -38.2086 -38.1420 -38.1420 -38.1389 -38.1389 -18.7319 -18.7319 -18.6328 -18.6328 -5.6938 -5.6938 -5.5193 -5.5193 -3.9022 -3.9022 -3.7643 -3.7643 -3.6357 -3.6357 -3.5754 -3.5754 0.6139 0.6139 0.7100 0.7100 5.8965 5.8965 6.1091 6.1091 6.9140 6.9140 7.0905 7.0905 7.6090 7.6090 7.9168 7.9168 7.9896 7.9896 8.0504 8.0504 8.1499 8.1499 8.2641 8.2641 8.6829 8.6829 8.8406 8.8406 8.8994 8.8994 9.0973 9.0973 9.8661 9.8661 9.9710 9.9710 10.0147 10.0147 k = 0.0200 0.0200 0.2841 ( 13028 PWs) bands (ev): -69.5340 -69.5340 -69.5250 -69.5250 -39.3899 -39.3899 -39.3705 -39.3705 -38.2430 -38.2430 -38.2085 -38.2085 -38.1420 -38.1420 -38.1389 -38.1389 -18.7324 -18.7324 -18.6328 -18.6328 -5.6935 -5.6935 -5.5180 -5.5180 -3.9021 -3.9021 -3.7601 -3.7601 -3.6379 -3.6379 -3.5735 -3.5735 0.6103 0.6103 0.7023 0.7023 5.8938 5.8938 6.1078 6.1078 6.9278 6.9278 7.0959 7.0959 7.6167 7.6167 7.9265 7.9265 7.9877 7.9877 8.0468 8.0468 8.1417 8.1417 8.2556 8.2556 8.7091 8.7091 8.8291 8.8291 8.9074 8.9074 9.1138 9.1138 9.9057 9.9057 9.9235 9.9235 10.0301 10.0301 k = 0.0100 0.0100 0.2841 ( 13022 PWs) bands (ev): -69.5341 -69.5341 -69.5244 -69.5244 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1420 -38.1420 -38.1389 -38.1389 -18.7327 -18.7327 -18.6328 -18.6328 -5.6934 -5.6934 -5.5172 -5.5172 -3.9021 -3.9021 -3.7574 -3.7574 -3.6394 -3.6394 -3.5722 -3.5722 0.6081 0.6081 0.6976 0.6976 5.8925 5.8925 6.1070 6.1070 6.9365 6.9365 7.1005 7.1005 7.6219 7.6219 7.9346 7.9346 7.9859 7.9859 8.0454 8.0454 8.1352 8.1352 8.2505 8.2505 8.7191 8.7191 8.8291 8.8291 8.9146 8.9146 9.1287 9.1287 9.8931 9.8931 9.9408 9.9408 10.0342 10.0342 k = 0.0000 0.0000 0.2841 ( 13010 PWs) bands (ev): -69.5335 -69.5335 -69.5241 -69.5241 -39.3899 -39.3899 -39.3704 -39.3704 -38.2430 -38.2430 -38.2084 -38.2084 -38.1420 -38.1420 -38.1389 -38.1389 -18.7328 -18.7328 -18.6328 -18.6328 -5.6933 -5.6933 -5.5169 -5.5169 -3.9021 -3.9021 -3.7565 -3.7565 -3.6399 -3.6399 -3.5718 -3.5718 0.6073 0.6073 0.6960 0.6960 5.8920 5.8920 6.1084 6.1084 6.9393 6.9393 7.1021 7.1021 7.6233 7.6233 7.9406 7.9406 7.9863 7.9863 8.0465 8.0465 8.1331 8.1331 8.2494 8.2494 8.7212 8.7212 8.8308 8.8308 8.9172 8.9172 9.1340 9.1340 9.8837 9.8837 9.9556 9.9556 10.0339 10.0339 k = 0.0000 0.5000-0.0000 ( 13072 PWs) bands (ev): -69.5312 -69.5312 -69.5312 -69.5312 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6972 -5.6972 -5.6972 -5.6972 -3.9985 -3.9985 -3.9985 -3.9985 -3.5847 -3.5847 -3.5847 -3.5847 1.1712 1.1712 1.1712 1.1712 6.2752 6.2752 6.2752 6.2752 6.5996 6.5996 6.5996 6.5996 6.8013 6.8013 6.8013 6.8013 7.4640 7.4640 7.4640 7.4640 8.1245 8.1245 8.1245 8.1245 8.4242 8.4242 8.4242 8.4242 8.7523 8.7523 8.7523 8.7523 9.4875 9.4875 9.4875 9.4875 10.9895 10.9895 k = 0.0000 0.5000 0.0142 ( 13062 PWs) bands (ev): -69.5308 -69.5308 -69.5308 -69.5308 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6972 -5.6972 -5.6972 -5.6972 -3.9986 -3.9986 -3.9986 -3.9986 -3.5846 -3.5846 -3.5846 -3.5846 1.1715 1.1715 1.1715 1.1715 6.2733 6.2733 6.2733 6.2733 6.6005 6.6005 6.6005 6.6005 6.8016 6.8016 6.8016 6.8016 7.4637 7.4637 7.4637 7.4637 8.1267 8.1267 8.1267 8.1267 8.4249 8.4249 8.4249 8.4249 8.7549 8.7549 8.7549 8.7549 9.4883 9.4883 9.4883 9.4883 10.9769 10.9769 k = 0.0000 0.5000 0.0284 ( 13072 PWs) bands (ev): -69.5312 -69.5312 -69.5312 -69.5312 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6972 -5.6972 -5.6972 -5.6972 -3.9987 -3.9987 -3.9987 -3.9987 -3.5845 -3.5845 -3.5845 -3.5845 1.1722 1.1722 1.1722 1.1722 6.2677 6.2677 6.2677 6.2677 6.5998 6.5998 6.5998 6.5998 6.8007 6.8007 6.8007 6.8007 7.4641 7.4641 7.4641 7.4641 8.1258 8.1258 8.1258 8.1258 8.4263 8.4263 8.4263 8.4263 8.7596 8.7596 8.7596 8.7596 9.4845 9.4845 9.4845 9.4845 10.9427 10.9427 k = 0.0000 0.5000 0.0426 ( 13080 PWs) bands (ev): -69.5315 -69.5315 -69.5315 -69.5315 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6973 -5.6973 -5.6973 -5.6973 -3.9989 -3.9989 -3.9989 -3.9989 -3.5841 -3.5841 -3.5841 -3.5841 1.1733 1.1733 1.1733 1.1733 6.2584 6.2584 6.2584 6.2584 6.5985 6.5985 6.5985 6.5985 6.8002 6.8002 6.8002 6.8002 7.4644 7.4644 7.4644 7.4644 8.1258 8.1258 8.1258 8.1258 8.4270 8.4270 8.4270 8.4270 8.7697 8.7697 8.7697 8.7697 9.4810 9.4810 9.4810 9.4810 10.8943 10.8943 k = 0.0000 0.5000 0.0568 ( 13068 PWs) bands (ev): -69.5310 -69.5310 -69.5310 -69.5310 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6974 -5.6974 -5.6974 -5.6974 -3.9992 -3.9992 -3.9992 -3.9992 -3.5837 -3.5837 -3.5837 -3.5837 1.1748 1.1748 1.1748 1.1748 6.2460 6.2460 6.2460 6.2460 6.5982 6.5982 6.5982 6.5982 6.8001 6.8001 6.8001 6.8001 7.4670 7.4670 7.4670 7.4670 8.1283 8.1283 8.1283 8.1283 8.4301 8.4301 8.4301 8.4301 8.7838 8.7838 8.7838 8.7838 9.4777 9.4777 9.4777 9.4777 10.8392 10.8392 k = 0.0000 0.5000 0.0710 ( 13080 PWs) bands (ev): -69.5315 -69.5315 -69.5315 -69.5315 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6975 -5.6975 -5.6975 -5.6975 -3.9996 -3.9996 -3.9996 -3.9996 -3.5832 -3.5832 -3.5832 -3.5832 1.1767 1.1767 1.1767 1.1767 6.2307 6.2307 6.2307 6.2307 6.5973 6.5973 6.5973 6.5973 6.7982 6.7982 6.7982 6.7982 7.4675 7.4675 7.4675 7.4675 8.1298 8.1298 8.1298 8.1298 8.4320 8.4320 8.4320 8.4320 8.7985 8.7985 8.7985 8.7985 9.4719 9.4719 9.4719 9.4719 10.7811 10.7811 k = 0.0000 0.5000 0.0852 ( 13086 PWs) bands (ev): -69.5317 -69.5317 -69.5317 -69.5317 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6977 -5.6977 -5.6977 -5.6977 -4.0000 -4.0000 -4.0000 -4.0000 -3.5826 -3.5826 -3.5826 -3.5826 1.1790 1.1790 1.1790 1.1790 6.2131 6.2131 6.2131 6.2131 6.5960 6.5960 6.5960 6.5960 6.7962 6.7962 6.7962 6.7962 7.4703 7.4703 7.4703 7.4703 8.1316 8.1316 8.1316 8.1316 8.4336 8.4336 8.4336 8.4336 8.8171 8.8171 8.8171 8.8171 9.4656 9.4656 9.4656 9.4656 10.7228 10.7228 k = 0.0000 0.5000 0.0994 ( 13082 PWs) bands (ev): -69.5315 -69.5315 -69.5315 -69.5315 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6978 -5.6978 -5.6978 -5.6978 -4.0004 -4.0004 -4.0004 -4.0004 -3.5819 -3.5819 -3.5819 -3.5819 1.1815 1.1815 1.1815 1.1815 6.1936 6.1936 6.1936 6.1936 6.5953 6.5953 6.5953 6.5953 6.7955 6.7955 6.7955 6.7955 7.4716 7.4716 7.4716 7.4716 8.1348 8.1348 8.1348 8.1348 8.4360 8.4360 8.4360 8.4360 8.8408 8.8408 8.8408 8.8408 9.4593 9.4593 9.4593 9.4593 10.6660 10.6660 k = 0.0000 0.5000 0.1136 ( 13078 PWs) bands (ev): -69.5314 -69.5314 -69.5314 -69.5314 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6980 -5.6980 -5.6980 -5.6980 -4.0009 -4.0009 -4.0009 -4.0009 -3.5812 -3.5812 -3.5812 -3.5812 1.1843 1.1843 1.1843 1.1843 6.1730 6.1730 6.1730 6.1730 6.5944 6.5944 6.5944 6.5944 6.7941 6.7941 6.7941 6.7941 7.4743 7.4743 7.4743 7.4743 8.1380 8.1380 8.1380 8.1380 8.4382 8.4382 8.4382 8.4382 8.8661 8.8661 8.8661 8.8661 9.4522 9.4522 9.4522 9.4522 10.6114 10.6114 k = 0.0000 0.5000 0.1278 ( 13058 PWs) bands (ev): -69.5307 -69.5307 -69.5307 -69.5307 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1406 -38.1406 -38.1406 -38.1406 -18.6567 -18.6567 -18.6567 -18.6567 -5.6982 -5.6982 -5.6982 -5.6982 -4.0014 -4.0014 -4.0014 -4.0014 -3.5804 -3.5804 -3.5804 -3.5804 1.1872 1.1872 1.1872 1.1872 6.1518 6.1518 6.1518 6.1518 6.5941 6.5941 6.5941 6.5941 6.7933 6.7933 6.7933 6.7933 7.4784 7.4784 7.4784 7.4784 8.1432 8.1432 8.1432 8.1432 8.4416 8.4416 8.4416 8.4416 8.8937 8.8937 8.8937 8.8937 9.4464 9.4464 9.4464 9.4464 10.5599 10.5599 k = 0.0000 0.5000 0.1420 ( 13078 PWs) bands (ev): -69.5314 -69.5314 -69.5314 -69.5314 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6984 -5.6984 -5.6984 -5.6984 -4.0020 -4.0020 -4.0020 -4.0020 -3.5796 -3.5796 -3.5796 -3.5796 1.1901 1.1901 1.1901 1.1901 6.1301 6.1301 6.1301 6.1301 6.5920 6.5920 6.5920 6.5920 6.7908 6.7908 6.7908 6.7908 7.4786 7.4786 7.4786 7.4786 8.1443 8.1443 8.1443 8.1443 8.4425 8.4425 8.4425 8.4425 8.9195 8.9195 8.9195 8.9195 9.4372 9.4372 9.4372 9.4372 10.5113 10.5113 k = 0.0000 0.5000 0.1562 ( 13086 PWs) bands (ev): -69.5317 -69.5317 -69.5317 -69.5317 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6986 -5.6986 -5.6986 -5.6986 -4.0025 -4.0025 -4.0025 -4.0025 -3.5788 -3.5788 -3.5788 -3.5788 1.1931 1.1931 1.1931 1.1931 6.1089 6.1089 6.1089 6.1089 6.5907 6.5907 6.5907 6.5907 6.7883 6.7883 6.7883 6.7883 7.4806 7.4806 7.4806 7.4806 8.1474 8.1474 8.1474 8.1474 8.4422 8.4422 8.4422 8.4422 8.9466 8.9466 8.9466 8.9466 9.4295 9.4295 9.4295 9.4295 10.4661 10.4661 k = 0.0000 0.5000 0.1705 ( 13106 PWs) bands (ev): -69.5325 -69.5325 -69.5325 -69.5325 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6988 -5.6988 -5.6988 -5.6988 -4.0030 -4.0030 -4.0030 -4.0030 -3.5781 -3.5781 -3.5781 -3.5781 1.1961 1.1961 1.1961 1.1961 6.0885 6.0885 6.0885 6.0885 6.5891 6.5891 6.5891 6.5891 6.7854 6.7854 6.7854 6.7854 7.4810 7.4810 7.4810 7.4810 8.1490 8.1490 8.1490 8.1490 8.4407 8.4407 8.4407 8.4407 8.9730 8.9730 8.9730 8.9730 9.4209 9.4209 9.4209 9.4209 10.4245 10.4245 k = 0.0000 0.5000 0.1847 ( 13090 PWs) bands (ev): -69.5319 -69.5319 -69.5319 -69.5319 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6990 -5.6990 -5.6990 -5.6990 -4.0035 -4.0035 -4.0035 -4.0035 -3.5773 -3.5773 -3.5773 -3.5773 1.1989 1.1989 1.1989 1.1989 6.0695 6.0695 6.0695 6.0695 6.5890 6.5890 6.5890 6.5890 6.7843 6.7843 6.7843 6.7843 7.4840 7.4840 7.4840 7.4840 8.1541 8.1541 8.1541 8.1541 8.4429 8.4429 8.4429 8.4429 9.0001 9.0001 9.0001 9.0001 9.4156 9.4156 9.4156 9.4156 10.3875 10.3875 k = 0.0000 0.5000 0.1989 ( 13100 PWs) bands (ev): -69.5323 -69.5323 -69.5323 -69.5323 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6992 -5.6992 -5.6992 -5.6992 -4.0040 -4.0040 -4.0040 -4.0040 -3.5767 -3.5767 -3.5767 -3.5767 1.2014 1.2014 1.2014 1.2014 6.0521 6.0521 6.0521 6.0521 6.5879 6.5879 6.5879 6.5879 6.7823 6.7823 6.7823 6.7823 7.4845 7.4845 7.4845 7.4845 8.1568 8.1568 8.1568 8.1568 8.4413 8.4413 8.4413 8.4413 9.0247 9.0247 9.0247 9.0247 9.4091 9.4091 9.4091 9.4091 10.3541 10.3541 k = 0.0000 0.5000 0.2131 ( 13108 PWs) bands (ev): -69.5326 -69.5326 -69.5326 -69.5326 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6993 -5.6993 -5.6993 -5.6993 -4.0044 -4.0044 -4.0044 -4.0044 -3.5761 -3.5761 -3.5761 -3.5761 1.2037 1.2037 1.2037 1.2037 6.0367 6.0367 6.0367 6.0367 6.5872 6.5872 6.5872 6.5872 6.7798 6.7798 6.7798 6.7798 7.4853 7.4853 7.4853 7.4853 8.1603 8.1603 8.1603 8.1603 8.4395 8.4395 8.4395 8.4395 9.0459 9.0459 9.0459 9.0459 9.4047 9.4047 9.4047 9.4047 10.3252 10.3252 k = 0.0000 0.5000 0.2273 ( 13108 PWs) bands (ev): -69.5326 -69.5326 -69.5326 -69.5326 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6994 -5.6994 -5.6994 -5.6994 -4.0047 -4.0047 -4.0047 -4.0047 -3.5756 -3.5756 -3.5756 -3.5756 1.2057 1.2057 1.2057 1.2057 6.0237 6.0237 6.0237 6.0237 6.5867 6.5867 6.5867 6.5867 6.7785 6.7785 6.7785 6.7785 7.4860 7.4860 7.4860 7.4860 8.1630 8.1630 8.1630 8.1630 8.4398 8.4398 8.4398 8.4398 9.0649 9.0649 9.0649 9.0649 9.4005 9.4005 9.4005 9.4005 10.3013 10.3013 k = 0.0000 0.5000 0.2415 ( 13100 PWs) bands (ev): -69.5323 -69.5323 -69.5323 -69.5323 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6995 -5.6995 -5.6995 -5.6995 -4.0050 -4.0050 -4.0050 -4.0050 -3.5751 -3.5751 -3.5751 -3.5751 1.2073 1.2073 1.2073 1.2073 6.0135 6.0135 6.0135 6.0135 6.5864 6.5864 6.5864 6.5864 6.7779 6.7779 6.7779 6.7779 7.4878 7.4878 7.4878 7.4878 8.1653 8.1653 8.1653 8.1653 8.4409 8.4409 8.4409 8.4409 9.0813 9.0813 9.0813 9.0813 9.3971 9.3971 9.3971 9.3971 10.2827 10.2827 k = 0.0000 0.5000 0.2557 ( 13092 PWs) bands (ev): -69.5320 -69.5320 -69.5320 -69.5320 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6996 -5.6996 -5.6996 -5.6996 -4.0052 -4.0052 -4.0052 -4.0052 -3.5748 -3.5748 -3.5748 -3.5748 1.2085 1.2085 1.2085 1.2085 6.0061 6.0061 6.0061 6.0061 6.5864 6.5864 6.5864 6.5864 6.7777 6.7777 6.7777 6.7777 7.4886 7.4886 7.4886 7.4886 8.1675 8.1675 8.1675 8.1675 8.4425 8.4425 8.4425 8.4425 9.0931 9.0931 9.0931 9.0931 9.3949 9.3949 9.3949 9.3949 10.2692 10.2692 k = 0.0000 0.5000 0.2699 ( 13084 PWs) bands (ev): -69.5317 -69.5317 -69.5317 -69.5317 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6996 -5.6996 -5.6996 -5.6996 -4.0053 -4.0053 -4.0053 -4.0053 -3.5747 -3.5747 -3.5747 -3.5747 1.2092 1.2092 1.2092 1.2092 6.0016 6.0016 6.0016 6.0016 6.5865 6.5865 6.5865 6.5865 6.7775 6.7775 6.7775 6.7775 7.4901 7.4901 7.4901 7.4901 8.1691 8.1691 8.1691 8.1691 8.4432 8.4432 8.4432 8.4432 9.1006 9.1006 9.1006 9.1006 9.3939 9.3939 9.3939 9.3939 10.2611 10.2611 k = 0.0000 0.5000 0.2841 ( 13068 PWs) bands (ev): -69.5311 -69.5311 -69.5311 -69.5311 -39.3805 -39.3805 -39.3805 -39.3805 -38.2266 -38.2266 -38.2266 -38.2266 -38.1407 -38.1407 -38.1407 -38.1407 -18.6567 -18.6567 -18.6567 -18.6567 -5.6996 -5.6996 -5.6996 -5.6996 -4.0053 -4.0053 -4.0053 -4.0053 -3.5746 -3.5746 -3.5746 -3.5746 1.2094 1.2094 1.2094 1.2094 6.0001 6.0001 6.0001 6.0001 6.5872 6.5872 6.5872 6.5872 6.7779 6.7779 6.7779 6.7779 7.4913 7.4913 7.4913 7.4913 8.1713 8.1713 8.1713 8.1713 8.4444 8.4444 8.4444 8.4444 9.1040 9.1040 9.1040 9.1040 9.3947 9.3947 9.3947 9.3947 10.2584 10.2584 k = 0.5000 0.5000-0.0000 ( 13036 PWs) bands (ev): -69.5299 -69.5299 -69.5299 -69.5299 -39.3811 -39.3811 -39.3811 -39.3811 -38.2287 -38.2287 -38.2287 -38.2287 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0210 -4.0210 -4.0210 -4.0210 -3.6322 -3.6322 -3.6322 -3.6322 0.8558 0.8558 0.8558 0.8558 6.2313 6.2313 6.2313 6.2313 6.5314 6.5314 6.5314 6.5314 6.9258 6.9258 6.9258 6.9258 7.6280 7.6280 7.6280 7.6280 7.8726 7.8726 7.8726 7.8726 8.8365 8.8365 8.8365 8.8365 9.2693 9.2693 9.2693 9.2693 9.4753 9.4753 9.4753 9.4753 10.3934 10.3934 k = 0.5000 0.5000 0.0142 ( 13056 PWs) bands (ev): -69.5306 -69.5306 -69.5306 -69.5306 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0210 -4.0210 -4.0210 -4.0210 -3.6322 -3.6322 -3.6322 -3.6322 0.8561 0.8561 0.8561 0.8561 6.2308 6.2308 6.2308 6.2308 6.5293 6.5293 6.5293 6.5293 6.9219 6.9219 6.9219 6.9219 7.6301 7.6301 7.6301 7.6301 7.8721 7.8721 7.8721 7.8721 8.8328 8.8328 8.8328 8.8328 9.2679 9.2679 9.2679 9.2679 9.4716 9.4716 9.4716 9.4716 10.3928 10.3928 k = 0.5000 0.5000 0.0284 ( 13080 PWs) bands (ev): -69.5315 -69.5315 -69.5315 -69.5315 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0210 -4.0210 -4.0210 -4.0210 -3.6323 -3.6323 -3.6323 -3.6323 0.8569 0.8569 0.8569 0.8569 6.2307 6.2307 6.2307 6.2307 6.5233 6.5233 6.5233 6.5233 6.9149 6.9149 6.9149 6.9149 7.6381 7.6381 7.6381 7.6381 7.8700 7.8700 7.8700 7.8700 8.8271 8.8271 8.8271 8.8271 9.2668 9.2668 9.2668 9.2668 9.4624 9.4624 9.4624 9.4624 10.3936 10.3936 k = 0.5000 0.5000 0.0426 ( 13104 PWs) bands (ev): -69.5324 -69.5324 -69.5324 -69.5324 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0210 -4.0210 -4.0210 -4.0210 -3.6325 -3.6325 -3.6325 -3.6325 0.8582 0.8582 0.8582 0.8582 6.2333 6.2333 6.2333 6.2333 6.5148 6.5148 6.5148 6.5148 6.9022 6.9022 6.9022 6.9022 7.6508 7.6508 7.6508 7.6508 7.8669 7.8669 7.8669 7.8669 8.8215 8.8215 8.8215 8.8215 9.2643 9.2643 9.2643 9.2643 9.4492 9.4492 9.4492 9.4492 10.3950 10.3950 k = 0.5000 0.5000 0.0568 ( 13112 PWs) bands (ev): -69.5327 -69.5327 -69.5327 -69.5327 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0210 -4.0210 -4.0210 -4.0210 -3.6328 -3.6328 -3.6328 -3.6328 0.8601 0.8601 0.8601 0.8601 6.2367 6.2367 6.2367 6.2367 6.5061 6.5061 6.5061 6.5061 6.8866 6.8866 6.8866 6.8866 7.6684 7.6684 7.6684 7.6684 7.8656 7.8656 7.8656 7.8656 8.8124 8.8124 8.8124 8.8124 9.2626 9.2626 9.2626 9.2626 9.4357 9.4357 9.4357 9.4357 10.3975 10.3975 k = 0.5000 0.5000 0.0710 ( 13100 PWs) bands (ev): -69.5322 -69.5322 -69.5322 -69.5322 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0210 -4.0210 -4.0210 -4.0210 -3.6331 -3.6331 -3.6331 -3.6331 0.8625 0.8625 0.8625 0.8625 6.2432 6.2432 6.2432 6.2432 6.4960 6.4960 6.4960 6.4960 6.8689 6.8689 6.8689 6.8689 7.6898 7.6898 7.6898 7.6898 7.8636 7.8636 7.8636 7.8636 8.8066 8.8066 8.8066 8.8066 9.2607 9.2607 9.2607 9.2607 9.4226 9.4226 9.4226 9.4226 10.4005 10.4005 k = 0.5000 0.5000 0.0852 ( 13080 PWs) bands (ev): -69.5315 -69.5315 -69.5315 -69.5315 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0209 -4.0209 -4.0209 -4.0209 -3.6334 -3.6334 -3.6334 -3.6334 0.8653 0.8653 0.8653 0.8653 6.2500 6.2500 6.2500 6.2500 6.4846 6.4846 6.4846 6.4846 6.8479 6.8479 6.8479 6.8479 7.7142 7.7142 7.7142 7.7142 7.8678 7.8678 7.8678 7.8678 8.7973 8.7973 8.7973 8.7973 9.2565 9.2565 9.2565 9.2565 9.4103 9.4103 9.4103 9.4103 10.4046 10.4046 k = 0.5000 0.5000 0.0994 ( 13088 PWs) bands (ev): -69.5318 -69.5318 -69.5318 -69.5318 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0209 -4.0209 -4.0209 -4.0209 -3.6338 -3.6338 -3.6338 -3.6338 0.8684 0.8684 0.8684 0.8684 6.2564 6.2564 6.2564 6.2564 6.4704 6.4704 6.4704 6.4704 6.8245 6.8245 6.8245 6.8245 7.7406 7.7406 7.7406 7.7406 7.8676 7.8676 7.8676 7.8676 8.7837 8.7837 8.7837 8.7837 9.2475 9.2475 9.2475 9.2475 9.3987 9.3987 9.3987 9.3987 10.4090 10.4090 k = 0.5000 0.5000 0.1136 ( 13072 PWs) bands (ev): -69.5312 -69.5312 -69.5312 -69.5312 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0209 -4.0209 -4.0209 -4.0209 -3.6343 -3.6343 -3.6343 -3.6343 0.8718 0.8718 0.8718 0.8718 6.2651 6.2651 6.2651 6.2651 6.4557 6.4557 6.4557 6.4557 6.8002 6.8002 6.8002 6.8002 7.7689 7.7689 7.7689 7.7689 7.8718 7.8718 7.8718 7.8718 8.7716 8.7716 8.7716 8.7716 9.2365 9.2365 9.2365 9.2365 9.3912 9.3912 9.3912 9.3912 10.4150 10.4150 k = 0.5000 0.5000 0.1278 ( 13088 PWs) bands (ev): -69.5318 -69.5318 -69.5318 -69.5318 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0209 -4.0209 -4.0209 -4.0209 -3.6347 -3.6347 -3.6347 -3.6347 0.8754 0.8754 0.8754 0.8754 6.2743 6.2743 6.2743 6.2743 6.4394 6.4394 6.4394 6.4394 6.7743 6.7743 6.7743 6.7743 7.7976 7.7976 7.7976 7.7976 7.8676 7.8676 7.8676 7.8676 8.7570 8.7570 8.7570 8.7570 9.2212 9.2212 9.2212 9.2212 9.3855 9.3855 9.3855 9.3855 10.4201 10.4201 k = 0.5000 0.5000 0.1420 ( 13088 PWs) bands (ev): -69.5318 -69.5318 -69.5318 -69.5318 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0209 -4.0209 -4.0209 -4.0209 -3.6352 -3.6352 -3.6352 -3.6352 0.8791 0.8791 0.8791 0.8791 6.2840 6.2840 6.2840 6.2840 6.4231 6.4231 6.4231 6.4231 6.7479 6.7479 6.7479 6.7479 7.8267 7.8267 7.8267 7.8267 7.8698 7.8698 7.8698 7.8698 8.7428 8.7428 8.7428 8.7428 9.2045 9.2045 9.2045 9.2045 9.3829 9.3829 9.3829 9.3829 10.4258 10.4258 k = 0.5000 0.5000 0.1562 ( 13080 PWs) bands (ev): -69.5315 -69.5315 -69.5315 -69.5315 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0208 -4.0208 -4.0208 -4.0208 -3.6357 -3.6357 -3.6357 -3.6357 0.8828 0.8828 0.8828 0.8828 6.2960 6.2960 6.2960 6.2960 6.4078 6.4078 6.4078 6.4078 6.7221 6.7221 6.7221 6.7221 7.8549 7.8549 7.8549 7.8549 7.8693 7.8693 7.8693 7.8693 8.7299 8.7299 8.7299 8.7299 9.1888 9.1888 9.1888 9.1888 9.3835 9.3835 9.3835 9.3835 10.4315 10.4315 k = 0.5000 0.5000 0.1705 ( 13080 PWs) bands (ev): -69.5315 -69.5315 -69.5315 -69.5315 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0208 -4.0208 -4.0208 -4.0208 -3.6361 -3.6361 -3.6361 -3.6361 0.8864 0.8864 0.8864 0.8864 6.3084 6.3084 6.3084 6.3084 6.3928 6.3928 6.3928 6.3928 6.6958 6.6958 6.6958 6.6958 7.8651 7.8651 7.8651 7.8651 7.8856 7.8856 7.8856 7.8856 8.7158 8.7158 8.7158 8.7158 9.1726 9.1726 9.1726 9.1726 9.3848 9.3848 9.3848 9.3848 10.4372 10.4372 k = 0.5000 0.5000 0.1847 ( 13104 PWs) bands (ev): -69.5324 -69.5324 -69.5324 -69.5324 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0208 -4.0208 -4.0208 -4.0208 -3.6366 -3.6366 -3.6366 -3.6366 0.8898 0.8898 0.8898 0.8898 6.3192 6.3192 6.3192 6.3192 6.3784 6.3784 6.3784 6.3784 6.6693 6.6693 6.6693 6.6693 7.8622 7.8622 7.8622 7.8622 7.9109 7.9109 7.9109 7.9109 8.7005 8.7005 8.7005 8.7005 9.1554 9.1554 9.1554 9.1554 9.3847 9.3847 9.3847 9.3847 10.4417 10.4417 k = 0.5000 0.5000 0.1989 ( 13084 PWs) bands (ev): -69.5317 -69.5317 -69.5317 -69.5317 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1390 -38.1390 -38.1390 -38.1390 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0208 -4.0208 -4.0208 -4.0208 -3.6370 -3.6370 -3.6370 -3.6370 0.8930 0.8930 0.8930 0.8930 6.3311 6.3311 6.3311 6.3311 6.3685 6.3685 6.3685 6.3685 6.6449 6.6449 6.6449 6.6449 7.8627 7.8627 7.8627 7.8627 7.9375 7.9375 7.9375 7.9375 8.6885 8.6885 8.6885 8.6885 9.1423 9.1423 9.1423 9.1423 9.3883 9.3883 9.3883 9.3883 10.4494 10.4494 k = 0.5000 0.5000 0.2131 ( 13108 PWs) bands (ev): -69.5326 -69.5326 -69.5326 -69.5326 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0208 -4.0208 -4.0208 -4.0208 -3.6374 -3.6374 -3.6374 -3.6374 0.8958 0.8958 0.8958 0.8958 6.3345 6.3345 6.3345 6.3345 6.3649 6.3649 6.3649 6.3649 6.6200 6.6200 6.6200 6.6200 7.8608 7.8608 7.8608 7.8608 7.9591 7.9591 7.9591 7.9591 8.6744 8.6744 8.6744 8.6744 9.1268 9.1268 9.1268 9.1268 9.3900 9.3900 9.3900 9.3900 10.4530 10.4530 k = 0.5000 0.5000 0.2273 ( 13104 PWs) bands (ev): -69.5324 -69.5324 -69.5324 -69.5324 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0208 -4.0208 -4.0208 -4.0208 -3.6377 -3.6377 -3.6377 -3.6377 0.8982 0.8982 0.8982 0.8982 6.3307 6.3307 6.3307 6.3307 6.3734 6.3734 6.3734 6.3734 6.5978 6.5978 6.5978 6.5978 7.8601 7.8601 7.8601 7.8601 7.9786 7.9786 7.9786 7.9786 8.6636 8.6636 8.6636 8.6636 9.1167 9.1167 9.1167 9.1167 9.3931 9.3931 9.3931 9.3931 10.4572 10.4572 k = 0.5000 0.5000 0.2415 ( 13120 PWs) bands (ev): -69.5330 -69.5330 -69.5330 -69.5330 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0208 -4.0208 -4.0208 -4.0208 -3.6379 -3.6379 -3.6379 -3.6379 0.9002 0.9002 0.9002 0.9002 6.3243 6.3243 6.3243 6.3243 6.3837 6.3837 6.3837 6.3837 6.5770 6.5770 6.5770 6.5770 7.8585 7.8585 7.8585 7.8585 7.9940 7.9940 7.9940 7.9940 8.6526 8.6526 8.6526 8.6526 9.1081 9.1081 9.1081 9.1081 9.3945 9.3945 9.3945 9.3945 10.4586 10.4586 k = 0.5000 0.5000 0.2557 ( 13116 PWs) bands (ev): -69.5329 -69.5329 -69.5329 -69.5329 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0207 -4.0207 -4.0207 -4.0207 -3.6381 -3.6381 -3.6381 -3.6381 0.9016 0.9016 0.9016 0.9016 6.3198 6.3198 6.3198 6.3198 6.3954 6.3954 6.3954 6.3954 6.5604 6.5604 6.5604 6.5604 7.8580 7.8580 7.8580 7.8580 8.0057 8.0057 8.0057 8.0057 8.6449 8.6449 8.6449 8.6449 9.1037 9.1037 9.1037 9.1037 9.3968 9.3968 9.3968 9.3968 10.4607 10.4607 k = 0.5000 0.5000 0.2699 ( 13116 PWs) bands (ev): -69.5329 -69.5329 -69.5329 -69.5329 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0207 -4.0207 -4.0207 -4.0207 -3.6382 -3.6382 -3.6382 -3.6382 0.9025 0.9025 0.9025 0.9025 6.3158 6.3158 6.3158 6.3158 6.4033 6.4033 6.4033 6.4033 6.5491 6.5491 6.5491 6.5491 7.8597 7.8597 7.8597 7.8597 8.0133 8.0133 8.0133 8.0133 8.6404 8.6404 8.6404 8.6404 9.0985 9.0985 9.0985 9.0985 9.3988 9.3988 9.3988 9.3988 10.4621 10.4621 k = 0.5000 0.5000 0.2841 ( 13136 PWs) bands (ev): -69.5336 -69.5336 -69.5336 -69.5336 -39.3812 -39.3812 -39.3812 -39.3812 -38.2288 -38.2288 -38.2288 -38.2288 -38.1391 -38.1391 -38.1391 -38.1391 -18.6313 -18.6313 -18.6313 -18.6313 -5.7294 -5.7294 -5.7294 -5.7294 -4.0208 -4.0208 -4.0208 -4.0208 -3.6383 -3.6383 -3.6383 -3.6383 0.9027 0.9027 0.9027 0.9027 6.3133 6.3133 6.3133 6.3133 6.4065 6.4065 6.4065 6.4065 6.5442 6.5442 6.5442 6.5442 7.8593 7.8593 7.8593 7.8593 8.0140 8.0140 8.0140 8.0140 8.6367 8.6367 8.6367 8.6367 9.0942 9.0942 9.0942 9.0942 9.3968 9.3968 9.3968 9.3968 10.4640 10.4640 Writing output data file BaMnGe.save init_run : 0.47s CPU 0.62s WALL ( 1 calls) electrons : 432.14s CPU 436.26s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 432.12s CPU 436.24s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.08s CPU 0.11s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.11s CPU 0.23s WALL ( 309 calls) cegterg : 397.80s CPU 400.79s WALL ( 474 calls) Called by sum_band: Called by *egterg: h_psi : 250.59s CPU 252.60s WALL ( 7824 calls) s_psi : 12.25s CPU 12.35s WALL ( 7824 calls) g_psi : 1.07s CPU 1.02s WALL ( 7041 calls) cdiaghg : 82.66s CPU 83.56s WALL ( 7350 calls) cegterg:over : 26.72s CPU 26.89s WALL ( 7041 calls) cegterg:upda : 27.08s CPU 27.12s WALL ( 7041 calls) cegterg:last : 13.39s CPU 13.39s WALL ( 1272 calls) cdiaghg:chol : 5.21s CPU 4.93s WALL ( 7350 calls) cdiaghg:inve : 3.41s CPU 3.44s WALL ( 7350 calls) cdiaghg:para : 5.95s CPU 6.02s WALL ( 14700 calls) Called by h_psi: h_psi:vloc : 218.68s CPU 220.42s WALL ( 7824 calls) h_psi:vnl : 30.76s CPU 31.02s WALL ( 7824 calls) add_vuspsi : 15.93s CPU 15.95s WALL ( 7824 calls) General routines calbec : 14.80s CPU 15.04s WALL ( 7824 calls) fft : 0.01s CPU 0.01s WALL ( 15 calls) fftw : 208.11s CPU 209.53s WALL ( 1080792 calls) davcio : 0.36s CPU 0.76s WALL ( 618 calls) Parallel routines fft_scatter : 64.85s CPU 65.76s WALL ( 1080807 calls) PWSCF : 7m54.55s CPU 8m24.24s WALL This run was terminated on: 14:27:32 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=