Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 13: 8:34 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: ./KMgAs.save/ file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2P 2P 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 62 38 11 3822 1808 281 Max 63 39 12 3833 1839 286 Sum 2249 1373 401 137715 65795 10175 bravais-lattice index = 14 lattice parameter (alat) = 8.5907 a.u. unit-cell volume = 1076.0875 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 386.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.590694 celldm(2)= 1.000000 celldm(3)= 1.697316 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 1.697316 ) 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 0.589165 ) PseudoPot. # 1 for As read from file: /users/gautes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1209 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 K read from file: /users/gautes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Mg read from file: /users/gautes/Pseudo/Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 99618f2d1dea131ec68d28ce241ef835 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 1129 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential As 5.00 74.92160 As( 1.00) K 9.00 39.09830 K( 1.00) Mg 10.00 24.30500 Mg( 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= 310 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032258 k( 2) = ( 0.0000000 0.0142857 -0.0000000), wk = 0.0032258 k( 3) = ( 0.0000000 0.0285714 -0.0000000), wk = 0.0032258 k( 4) = ( 0.0000000 0.0428571 -0.0000000), wk = 0.0032258 k( 5) = ( 0.0000000 0.0571429 -0.0000000), wk = 0.0032258 k( 6) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0032258 k( 7) = ( 0.0000000 0.0857143 -0.0000000), wk = 0.0032258 k( 8) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0032258 k( 9) = ( 0.0000000 0.1142857 -0.0000000), wk = 0.0032258 k( 10) = ( 0.0000000 0.1285714 -0.0000000), wk = 0.0032258 k( 11) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0032258 k( 12) = ( 0.0000000 0.1571429 -0.0000000), wk = 0.0032258 k( 13) = ( 0.0000000 0.1714286 -0.0000000), wk = 0.0032258 k( 14) = ( 0.0000000 0.1857143 -0.0000000), wk = 0.0032258 k( 15) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0032258 k( 16) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0032258 k( 17) = ( 0.0000000 0.2285714 -0.0000000), wk = 0.0032258 k( 18) = ( 0.0000000 0.2428571 -0.0000000), wk = 0.0032258 k( 19) = ( 0.0000000 0.2571429 -0.0000000), wk = 0.0032258 k( 20) = ( 0.0000000 0.2714286 -0.0000000), wk = 0.0032258 k( 21) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0032258 k( 22) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0032258 k( 23) = ( 0.0000000 0.3142857 -0.0000000), wk = 0.0032258 k( 24) = ( 0.0000000 0.3285714 -0.0000000), wk = 0.0032258 k( 25) = ( 0.0000000 0.3428571 -0.0000000), wk = 0.0032258 k( 26) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0032258 k( 27) = ( 0.0000000 0.3714286 -0.0000000), wk = 0.0032258 k( 28) = ( 0.0000000 0.3857143 -0.0000000), wk = 0.0032258 k( 29) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0032258 k( 30) = ( 0.0000000 0.4142857 -0.0000000), wk = 0.0032258 k( 31) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0032258 k( 32) = ( 0.0000000 0.4428571 -0.0000000), wk = 0.0032258 k( 33) = ( 0.0000000 0.4571429 -0.0000000), wk = 0.0032258 k( 34) = ( 0.0000000 0.4714286 -0.0000000), wk = 0.0032258 k( 35) = ( 0.0000000 0.4857143 -0.0000000), wk = 0.0032258 k( 36) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032258 k( 37) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032258 k( 38) = ( 0.0142857 0.5000000 -0.0000000), wk = 0.0032258 k( 39) = ( 0.0285714 0.5000000 -0.0000000), wk = 0.0032258 k( 40) = ( 0.0428571 0.5000000 -0.0000000), wk = 0.0032258 k( 41) = ( 0.0571429 0.5000000 -0.0000000), wk = 0.0032258 k( 42) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0032258 k( 43) = ( 0.0857143 0.5000000 -0.0000000), wk = 0.0032258 k( 44) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0032258 k( 45) = ( 0.1142857 0.5000000 -0.0000000), wk = 0.0032258 k( 46) = ( 0.1285714 0.5000000 -0.0000000), wk = 0.0032258 k( 47) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0032258 k( 48) = ( 0.1571429 0.5000000 -0.0000000), wk = 0.0032258 k( 49) = ( 0.1714286 0.5000000 -0.0000000), wk = 0.0032258 k( 50) = ( 0.1857143 0.5000000 -0.0000000), wk = 0.0032258 k( 51) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0032258 k( 52) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0032258 k( 53) = ( 0.2285714 0.5000000 -0.0000000), wk = 0.0032258 k( 54) = ( 0.2428571 0.5000000 -0.0000000), wk = 0.0032258 k( 55) = ( 0.2571429 0.5000000 -0.0000000), wk = 0.0032258 k( 56) = ( 0.2714286 0.5000000 -0.0000000), wk = 0.0032258 k( 57) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0032258 k( 58) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0032258 k( 59) = ( 0.3142857 0.5000000 -0.0000000), wk = 0.0032258 k( 60) = ( 0.3285714 0.5000000 -0.0000000), wk = 0.0032258 k( 61) = ( 0.3428571 0.5000000 -0.0000000), wk = 0.0032258 k( 62) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0032258 k( 63) = ( 0.3714286 0.5000000 -0.0000000), wk = 0.0032258 k( 64) = ( 0.3857143 0.5000000 -0.0000000), wk = 0.0032258 k( 65) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0032258 k( 66) = ( 0.4142857 0.5000000 -0.0000000), wk = 0.0032258 k( 67) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0032258 k( 68) = ( 0.4428571 0.5000000 -0.0000000), wk = 0.0032258 k( 69) = ( 0.4571429 0.5000000 -0.0000000), wk = 0.0032258 k( 70) = ( 0.4714286 0.5000000 -0.0000000), wk = 0.0032258 k( 71) = ( 0.4857143 0.5000000 -0.0000000), wk = 0.0032258 k( 72) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032258 k( 73) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032258 k( 74) = ( 0.4897959 0.4897959 -0.0000000), wk = 0.0032258 k( 75) = ( 0.4795918 0.4795918 -0.0000000), wk = 0.0032258 k( 76) = ( 0.4693878 0.4693878 -0.0000000), wk = 0.0032258 k( 77) = ( 0.4591837 0.4591837 -0.0000000), wk = 0.0032258 k( 78) = ( 0.4489796 0.4489796 -0.0000000), wk = 0.0032258 k( 79) = ( 0.4387755 0.4387755 -0.0000000), wk = 0.0032258 k( 80) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0032258 k( 81) = ( 0.4183674 0.4183673 -0.0000000), wk = 0.0032258 k( 82) = ( 0.4081633 0.4081633 -0.0000000), wk = 0.0032258 k( 83) = ( 0.3979592 0.3979592 -0.0000000), wk = 0.0032258 k( 84) = ( 0.3877551 0.3877551 -0.0000000), wk = 0.0032258 k( 85) = ( 0.3775510 0.3775510 -0.0000000), wk = 0.0032258 k( 86) = ( 0.3673469 0.3673469 -0.0000000), wk = 0.0032258 k( 87) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0032258 k( 88) = ( 0.3469388 0.3469388 -0.0000000), wk = 0.0032258 k( 89) = ( 0.3367347 0.3367347 -0.0000000), wk = 0.0032258 k( 90) = ( 0.3265306 0.3265306 -0.0000000), wk = 0.0032258 k( 91) = ( 0.3163265 0.3163265 -0.0000000), wk = 0.0032258 k( 92) = ( 0.3061224 0.3061224 -0.0000000), wk = 0.0032258 k( 93) = ( 0.2959184 0.2959184 -0.0000000), wk = 0.0032258 k( 94) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0032258 k( 95) = ( 0.2755102 0.2755102 -0.0000000), wk = 0.0032258 k( 96) = ( 0.2653061 0.2653061 -0.0000000), wk = 0.0032258 k( 97) = ( 0.2551020 0.2551020 -0.0000000), wk = 0.0032258 k( 98) = ( 0.2448980 0.2448980 -0.0000000), wk = 0.0032258 k( 99) = ( 0.2346939 0.2346939 -0.0000000), wk = 0.0032258 k( 100) = ( 0.2244898 0.2244898 -0.0000000), wk = 0.0032258 k( 101) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0032258 k( 102) = ( 0.2040816 0.2040816 -0.0000000), wk = 0.0032258 k( 103) = ( 0.1938776 0.1938775 -0.0000000), wk = 0.0032258 k( 104) = ( 0.1836735 0.1836735 -0.0000000), wk = 0.0032258 k( 105) = ( 0.1734694 0.1734694 -0.0000000), wk = 0.0032258 k( 106) = ( 0.1632653 0.1632653 -0.0000000), wk = 0.0032258 k( 107) = ( 0.1530612 0.1530612 -0.0000000), wk = 0.0032258 k( 108) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0032258 k( 109) = ( 0.1326531 0.1326531 -0.0000000), wk = 0.0032258 k( 110) = ( 0.1224490 0.1224490 -0.0000000), wk = 0.0032258 k( 111) = ( 0.1122449 0.1122449 -0.0000000), wk = 0.0032258 k( 112) = ( 0.1020408 0.1020408 -0.0000000), wk = 0.0032258 k( 113) = ( 0.0918367 0.0918367 -0.0000000), wk = 0.0032258 k( 114) = ( 0.0816327 0.0816326 -0.0000000), wk = 0.0032258 k( 115) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0032258 k( 116) = ( 0.0612245 0.0612245 -0.0000000), wk = 0.0032258 k( 117) = ( 0.0510204 0.0510204 -0.0000000), wk = 0.0032258 k( 118) = ( 0.0408163 0.0408163 -0.0000000), wk = 0.0032258 k( 119) = ( 0.0306122 0.0306122 -0.0000000), wk = 0.0032258 k( 120) = ( 0.0204082 0.0204082 -0.0000000), wk = 0.0032258 k( 121) = ( 0.0102041 0.0102041 -0.0000000), wk = 0.0032258 k( 122) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032258 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032258 k( 124) = ( 0.0000000 0.0000000 0.0140277), wk = 0.0032258 k( 125) = ( 0.0000000 0.0000000 0.0280555), wk = 0.0032258 k( 126) = ( 0.0000000 0.0000000 0.0420832), wk = 0.0032258 k( 127) = ( 0.0000000 0.0000000 0.0561110), wk = 0.0032258 k( 128) = ( 0.0000000 0.0000000 0.0701387), wk = 0.0032258 k( 129) = ( 0.0000000 0.0000000 0.0841665), wk = 0.0032258 k( 130) = ( 0.0000000 0.0000000 0.0981942), wk = 0.0032258 k( 131) = ( 0.0000000 0.0000000 0.1122220), wk = 0.0032258 k( 132) = ( 0.0000000 0.0000000 0.1262497), wk = 0.0032258 k( 133) = ( 0.0000000 0.0000000 0.1402775), wk = 0.0032258 k( 134) = ( 0.0000000 0.0000000 0.1543052), wk = 0.0032258 k( 135) = ( 0.0000000 0.0000000 0.1683330), wk = 0.0032258 k( 136) = ( 0.0000000 0.0000000 0.1823607), wk = 0.0032258 k( 137) = ( 0.0000000 0.0000000 0.1963885), wk = 0.0032258 k( 138) = ( 0.0000000 0.0000000 0.2104162), wk = 0.0032258 k( 139) = ( 0.0000000 0.0000000 0.2244440), wk = 0.0032258 k( 140) = ( 0.0000000 0.0000000 0.2384717), wk = 0.0032258 k( 141) = ( 0.0000000 0.0000000 0.2524994), wk = 0.0032258 k( 142) = ( 0.0000000 0.0000000 0.2665272), wk = 0.0032258 k( 143) = ( 0.0000000 0.0000000 0.2805549), wk = 0.0032258 k( 144) = ( 0.0000000 0.0000000 0.2945827), wk = 0.0032258 k( 145) = ( 0.0000000 0.0000000 0.2945827), wk = 0.0032258 k( 146) = ( 0.0000000 0.0142857 0.2945827), wk = 0.0032258 k( 147) = ( 0.0000000 0.0285714 0.2945827), wk = 0.0032258 k( 148) = ( 0.0000000 0.0428571 0.2945827), wk = 0.0032258 k( 149) = ( 0.0000000 0.0571429 0.2945827), wk = 0.0032258 k( 150) = ( 0.0000000 0.0714286 0.2945827), wk = 0.0032258 k( 151) = ( 0.0000000 0.0857143 0.2945827), wk = 0.0032258 k( 152) = ( 0.0000000 0.1000000 0.2945827), wk = 0.0032258 k( 153) = ( 0.0000000 0.1142857 0.2945827), wk = 0.0032258 k( 154) = ( 0.0000000 0.1285714 0.2945827), wk = 0.0032258 k( 155) = ( 0.0000000 0.1428571 0.2945827), wk = 0.0032258 k( 156) = ( 0.0000000 0.1571429 0.2945827), wk = 0.0032258 k( 157) = ( 0.0000000 0.1714286 0.2945827), wk = 0.0032258 k( 158) = ( 0.0000000 0.1857143 0.2945827), wk = 0.0032258 k( 159) = ( 0.0000000 0.2000000 0.2945827), wk = 0.0032258 k( 160) = ( 0.0000000 0.2142857 0.2945827), wk = 0.0032258 k( 161) = ( 0.0000000 0.2285714 0.2945827), wk = 0.0032258 k( 162) = ( 0.0000000 0.2428571 0.2945827), wk = 0.0032258 k( 163) = ( 0.0000000 0.2571429 0.2945827), wk = 0.0032258 k( 164) = ( 0.0000000 0.2714286 0.2945827), wk = 0.0032258 k( 165) = ( 0.0000000 0.2857143 0.2945827), wk = 0.0032258 k( 166) = ( 0.0000000 0.3000000 0.2945827), wk = 0.0032258 k( 167) = ( 0.0000000 0.3142857 0.2945827), wk = 0.0032258 k( 168) = ( 0.0000000 0.3285714 0.2945827), wk = 0.0032258 k( 169) = ( 0.0000000 0.3428571 0.2945827), wk = 0.0032258 k( 170) = ( 0.0000000 0.3571429 0.2945827), wk = 0.0032258 k( 171) = ( 0.0000000 0.3714286 0.2945827), wk = 0.0032258 k( 172) = ( 0.0000000 0.3857143 0.2945827), wk = 0.0032258 k( 173) = ( 0.0000000 0.4000000 0.2945827), wk = 0.0032258 k( 174) = ( 0.0000000 0.4142857 0.2945827), wk = 0.0032258 k( 175) = ( 0.0000000 0.4285714 0.2945827), wk = 0.0032258 k( 176) = ( 0.0000000 0.4428571 0.2945827), wk = 0.0032258 k( 177) = ( 0.0000000 0.4571429 0.2945827), wk = 0.0032258 k( 178) = ( 0.0000000 0.4714286 0.2945827), wk = 0.0032258 k( 179) = ( 0.0000000 0.4857143 0.2945827), wk = 0.0032258 k( 180) = ( 0.0000000 0.5000000 0.2945827), wk = 0.0032258 k( 181) = ( 0.0000000 0.5000000 0.2945827), wk = 0.0032258 k( 182) = ( 0.0142857 0.5000000 0.2945827), wk = 0.0032258 k( 183) = ( 0.0285714 0.5000000 0.2945827), wk = 0.0032258 k( 184) = ( 0.0428571 0.5000000 0.2945827), wk = 0.0032258 k( 185) = ( 0.0571429 0.5000000 0.2945827), wk = 0.0032258 k( 186) = ( 0.0714286 0.5000000 0.2945827), wk = 0.0032258 k( 187) = ( 0.0857143 0.5000000 0.2945827), wk = 0.0032258 k( 188) = ( 0.1000000 0.5000000 0.2945827), wk = 0.0032258 k( 189) = ( 0.1142857 0.5000000 0.2945827), wk = 0.0032258 k( 190) = ( 0.1285714 0.5000000 0.2945827), wk = 0.0032258 k( 191) = ( 0.1428571 0.5000000 0.2945827), wk = 0.0032258 k( 192) = ( 0.1571429 0.5000000 0.2945827), wk = 0.0032258 k( 193) = ( 0.1714286 0.5000000 0.2945827), wk = 0.0032258 k( 194) = ( 0.1857143 0.5000000 0.2945827), wk = 0.0032258 k( 195) = ( 0.2000000 0.5000000 0.2945827), wk = 0.0032258 k( 196) = ( 0.2142857 0.5000000 0.2945827), wk = 0.0032258 k( 197) = ( 0.2285714 0.5000000 0.2945827), wk = 0.0032258 k( 198) = ( 0.2428571 0.5000000 0.2945827), wk = 0.0032258 k( 199) = ( 0.2571429 0.5000000 0.2945827), wk = 0.0032258 k( 200) = ( 0.2714286 0.5000000 0.2945827), wk = 0.0032258 k( 201) = ( 0.2857143 0.5000000 0.2945827), wk = 0.0032258 k( 202) = ( 0.3000000 0.5000000 0.2945827), wk = 0.0032258 k( 203) = ( 0.3142857 0.5000000 0.2945827), wk = 0.0032258 k( 204) = ( 0.3285714 0.5000000 0.2945827), wk = 0.0032258 k( 205) = ( 0.3428571 0.5000000 0.2945827), wk = 0.0032258 k( 206) = ( 0.3571429 0.5000000 0.2945827), wk = 0.0032258 k( 207) = ( 0.3714286 0.5000000 0.2945827), wk = 0.0032258 k( 208) = ( 0.3857143 0.5000000 0.2945827), wk = 0.0032258 k( 209) = ( 0.4000000 0.5000000 0.2945827), wk = 0.0032258 k( 210) = ( 0.4142857 0.5000000 0.2945827), wk = 0.0032258 k( 211) = ( 0.4285714 0.5000000 0.2945827), wk = 0.0032258 k( 212) = ( 0.4428571 0.5000000 0.2945827), wk = 0.0032258 k( 213) = ( 0.4571429 0.5000000 0.2945827), wk = 0.0032258 k( 214) = ( 0.4714286 0.5000000 0.2945827), wk = 0.0032258 k( 215) = ( 0.4857143 0.5000000 0.2945827), wk = 0.0032258 k( 216) = ( 0.5000000 0.5000000 0.2945827), wk = 0.0032258 k( 217) = ( 0.5000000 0.5000000 0.2945827), wk = 0.0032258 k( 218) = ( 0.4897959 0.4897959 0.2945827), wk = 0.0032258 k( 219) = ( 0.4795918 0.4795918 0.2945827), wk = 0.0032258 k( 220) = ( 0.4693878 0.4693878 0.2945827), wk = 0.0032258 k( 221) = ( 0.4591837 0.4591837 0.2945827), wk = 0.0032258 k( 222) = ( 0.4489796 0.4489796 0.2945827), wk = 0.0032258 k( 223) = ( 0.4387755 0.4387755 0.2945827), wk = 0.0032258 k( 224) = ( 0.4285714 0.4285714 0.2945827), wk = 0.0032258 k( 225) = ( 0.4183674 0.4183673 0.2945827), wk = 0.0032258 k( 226) = ( 0.4081633 0.4081633 0.2945827), wk = 0.0032258 k( 227) = ( 0.3979592 0.3979592 0.2945827), wk = 0.0032258 k( 228) = ( 0.3877551 0.3877551 0.2945827), wk = 0.0032258 k( 229) = ( 0.3775510 0.3775510 0.2945827), wk = 0.0032258 k( 230) = ( 0.3673469 0.3673469 0.2945827), wk = 0.0032258 k( 231) = ( 0.3571429 0.3571429 0.2945827), wk = 0.0032258 k( 232) = ( 0.3469388 0.3469388 0.2945827), wk = 0.0032258 k( 233) = ( 0.3367347 0.3367347 0.2945827), wk = 0.0032258 k( 234) = ( 0.3265306 0.3265306 0.2945827), wk = 0.0032258 k( 235) = ( 0.3163265 0.3163265 0.2945827), wk = 0.0032258 k( 236) = ( 0.3061224 0.3061224 0.2945827), wk = 0.0032258 k( 237) = ( 0.2959184 0.2959184 0.2945827), wk = 0.0032258 k( 238) = ( 0.2857143 0.2857143 0.2945827), wk = 0.0032258 k( 239) = ( 0.2755102 0.2755102 0.2945827), wk = 0.0032258 k( 240) = ( 0.2653061 0.2653061 0.2945827), wk = 0.0032258 k( 241) = ( 0.2551020 0.2551020 0.2945827), wk = 0.0032258 k( 242) = ( 0.2448980 0.2448980 0.2945827), wk = 0.0032258 k( 243) = ( 0.2346939 0.2346939 0.2945827), wk = 0.0032258 k( 244) = ( 0.2244898 0.2244898 0.2945827), wk = 0.0032258 k( 245) = ( 0.2142857 0.2142857 0.2945827), wk = 0.0032258 k( 246) = ( 0.2040816 0.2040816 0.2945827), wk = 0.0032258 k( 247) = ( 0.1938776 0.1938775 0.2945827), wk = 0.0032258 k( 248) = ( 0.1836735 0.1836735 0.2945827), wk = 0.0032258 k( 249) = ( 0.1734694 0.1734694 0.2945827), wk = 0.0032258 k( 250) = ( 0.1632653 0.1632653 0.2945827), wk = 0.0032258 k( 251) = ( 0.1530612 0.1530612 0.2945827), wk = 0.0032258 k( 252) = ( 0.1428571 0.1428571 0.2945827), wk = 0.0032258 k( 253) = ( 0.1326531 0.1326531 0.2945827), wk = 0.0032258 k( 254) = ( 0.1224490 0.1224490 0.2945827), wk = 0.0032258 k( 255) = ( 0.1122449 0.1122449 0.2945827), wk = 0.0032258 k( 256) = ( 0.1020408 0.1020408 0.2945827), wk = 0.0032258 k( 257) = ( 0.0918367 0.0918367 0.2945827), wk = 0.0032258 k( 258) = ( 0.0816327 0.0816326 0.2945827), wk = 0.0032258 k( 259) = ( 0.0714286 0.0714286 0.2945827), wk = 0.0032258 k( 260) = ( 0.0612245 0.0612245 0.2945827), wk = 0.0032258 k( 261) = ( 0.0510204 0.0510204 0.2945827), wk = 0.0032258 k( 262) = ( 0.0408163 0.0408163 0.2945827), wk = 0.0032258 k( 263) = ( 0.0306122 0.0306122 0.2945827), wk = 0.0032258 k( 264) = ( 0.0204082 0.0204082 0.2945827), wk = 0.0032258 k( 265) = ( 0.0102041 0.0102041 0.2945827), wk = 0.0032258 k( 266) = ( 0.0000000 0.0000000 0.2945827), wk = 0.0032258 k( 267) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032258 k( 268) = ( 0.0000000 0.5000000 0.0140277), wk = 0.0032258 k( 269) = ( 0.0000000 0.5000000 0.0280555), wk = 0.0032258 k( 270) = ( 0.0000000 0.5000000 0.0420832), wk = 0.0032258 k( 271) = ( 0.0000000 0.5000000 0.0561110), wk = 0.0032258 k( 272) = ( 0.0000000 0.5000000 0.0701387), wk = 0.0032258 k( 273) = ( 0.0000000 0.5000000 0.0841665), wk = 0.0032258 k( 274) = ( 0.0000000 0.5000000 0.0981942), wk = 0.0032258 k( 275) = ( 0.0000000 0.5000000 0.1122220), wk = 0.0032258 k( 276) = ( 0.0000000 0.5000000 0.1262497), wk = 0.0032258 k( 277) = ( 0.0000000 0.5000000 0.1402775), wk = 0.0032258 k( 278) = ( 0.0000000 0.5000000 0.1543052), wk = 0.0032258 k( 279) = ( 0.0000000 0.5000000 0.1683330), wk = 0.0032258 k( 280) = ( 0.0000000 0.5000000 0.1823607), wk = 0.0032258 k( 281) = ( 0.0000000 0.5000000 0.1963885), wk = 0.0032258 k( 282) = ( 0.0000000 0.5000000 0.2104162), wk = 0.0032258 k( 283) = ( 0.0000000 0.5000000 0.2244440), wk = 0.0032258 k( 284) = ( 0.0000000 0.5000000 0.2384717), wk = 0.0032258 k( 285) = ( 0.0000000 0.5000000 0.2524994), wk = 0.0032258 k( 286) = ( 0.0000000 0.5000000 0.2665272), wk = 0.0032258 k( 287) = ( 0.0000000 0.5000000 0.2805549), wk = 0.0032258 k( 288) = ( 0.0000000 0.5000000 0.2945827), wk = 0.0032258 k( 289) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032258 k( 290) = ( 0.5000000 0.5000000 0.0140277), wk = 0.0032258 k( 291) = ( 0.5000000 0.5000000 0.0280555), wk = 0.0032258 k( 292) = ( 0.5000000 0.5000000 0.0420832), wk = 0.0032258 k( 293) = ( 0.5000000 0.5000000 0.0561110), wk = 0.0032258 k( 294) = ( 0.5000000 0.5000000 0.0701387), wk = 0.0032258 k( 295) = ( 0.5000000 0.5000000 0.0841665), wk = 0.0032258 k( 296) = ( 0.5000000 0.5000000 0.0981942), wk = 0.0032258 k( 297) = ( 0.5000000 0.5000000 0.1122220), wk = 0.0032258 k( 298) = ( 0.5000000 0.5000000 0.1262497), wk = 0.0032258 k( 299) = ( 0.5000000 0.5000000 0.1402775), wk = 0.0032258 k( 300) = ( 0.5000000 0.5000000 0.1543052), wk = 0.0032258 k( 301) = ( 0.5000000 0.5000000 0.1683330), wk = 0.0032258 k( 302) = ( 0.5000000 0.5000000 0.1823607), wk = 0.0032258 k( 303) = ( 0.5000000 0.5000000 0.1963885), wk = 0.0032258 k( 304) = ( 0.5000000 0.5000000 0.2104162), wk = 0.0032258 k( 305) = ( 0.5000000 0.5000000 0.2244440), wk = 0.0032258 k( 306) = ( 0.5000000 0.5000000 0.2384717), wk = 0.0032258 k( 307) = ( 0.5000000 0.5000000 0.2524994), wk = 0.0032258 k( 308) = ( 0.5000000 0.5000000 0.2665272), wk = 0.0032258 k( 309) = ( 0.5000000 0.5000000 0.2805549), wk = 0.0032258 k( 310) = ( 0.5000000 0.5000000 0.2945827), wk = 0.0032258 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032258 k( 2) = ( 0.0000000 0.0142857 0.0000000), wk = 0.0032258 k( 3) = ( 0.0000000 0.0285714 0.0000000), wk = 0.0032258 k( 4) = ( 0.0000000 0.0428571 -0.0000000), wk = 0.0032258 k( 5) = ( 0.0000000 0.0571429 0.0000000), wk = 0.0032258 k( 6) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0032258 k( 7) = ( 0.0000000 0.0857143 0.0000000), wk = 0.0032258 k( 8) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0032258 k( 9) = ( 0.0000000 0.1142857 -0.0000000), wk = 0.0032258 k( 10) = ( 0.0000000 0.1285714 -0.0000000), wk = 0.0032258 k( 11) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0032258 k( 12) = ( 0.0000000 0.1571429 0.0000000), wk = 0.0032258 k( 13) = ( 0.0000000 0.1714286 0.0000000), wk = 0.0032258 k( 14) = ( 0.0000000 0.1857143 0.0000000), wk = 0.0032258 k( 15) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0032258 k( 16) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0032258 k( 17) = ( 0.0000000 0.2285714 0.0000000), wk = 0.0032258 k( 18) = ( 0.0000000 0.2428571 0.0000000), wk = 0.0032258 k( 19) = ( 0.0000000 0.2571429 -0.0000000), wk = 0.0032258 k( 20) = ( 0.0000000 0.2714286 -0.0000000), wk = 0.0032258 k( 21) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0032258 k( 22) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0032258 k( 23) = ( 0.0000000 0.3142857 0.0000000), wk = 0.0032258 k( 24) = ( 0.0000000 0.3285714 0.0000000), wk = 0.0032258 k( 25) = ( 0.0000000 0.3428571 0.0000000), wk = 0.0032258 k( 26) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0032258 k( 27) = ( 0.0000000 0.3714286 0.0000000), wk = 0.0032258 k( 28) = ( 0.0000000 0.3857143 0.0000000), wk = 0.0032258 k( 29) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0032258 k( 30) = ( 0.0000000 0.4142857 0.0000000), wk = 0.0032258 k( 31) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0032258 k( 32) = ( 0.0000000 0.4428571 0.0000000), wk = 0.0032258 k( 33) = ( 0.0000000 0.4571429 0.0000000), wk = 0.0032258 k( 34) = ( 0.0000000 0.4714286 0.0000000), wk = 0.0032258 k( 35) = ( 0.0000000 0.4857143 -0.0000000), wk = 0.0032258 k( 36) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032258 k( 37) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032258 k( 38) = ( 0.0142857 0.5000000 0.0000000), wk = 0.0032258 k( 39) = ( 0.0285714 0.5000000 0.0000000), wk = 0.0032258 k( 40) = ( 0.0428571 0.5000000 0.0000000), wk = 0.0032258 k( 41) = ( 0.0571429 0.5000000 0.0000000), wk = 0.0032258 k( 42) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0032258 k( 43) = ( 0.0857143 0.5000000 0.0000000), wk = 0.0032258 k( 44) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0032258 k( 45) = ( 0.1142857 0.5000000 0.0000000), wk = 0.0032258 k( 46) = ( 0.1285714 0.5000000 0.0000000), wk = 0.0032258 k( 47) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0032258 k( 48) = ( 0.1571429 0.5000000 0.0000000), wk = 0.0032258 k( 49) = ( 0.1714286 0.5000000 0.0000000), wk = 0.0032258 k( 50) = ( 0.1857143 0.5000000 0.0000000), wk = 0.0032258 k( 51) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0032258 k( 52) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0032258 k( 53) = ( 0.2285714 0.5000000 0.0000000), wk = 0.0032258 k( 54) = ( 0.2428571 0.5000000 0.0000000), wk = 0.0032258 k( 55) = ( 0.2571429 0.5000000 0.0000000), wk = 0.0032258 k( 56) = ( 0.2714286 0.5000000 0.0000000), wk = 0.0032258 k( 57) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0032258 k( 58) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0032258 k( 59) = ( 0.3142857 0.5000000 0.0000000), wk = 0.0032258 k( 60) = ( 0.3285714 0.5000000 0.0000000), wk = 0.0032258 k( 61) = ( 0.3428571 0.5000000 -0.0000000), wk = 0.0032258 k( 62) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0032258 k( 63) = ( 0.3714286 0.5000000 0.0000000), wk = 0.0032258 k( 64) = ( 0.3857143 0.5000000 0.0000000), wk = 0.0032258 k( 65) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0032258 k( 66) = ( 0.4142857 0.5000000 -0.0000000), wk = 0.0032258 k( 67) = ( 0.4285714 0.5000000 0.0000000), wk = 0.0032258 k( 68) = ( 0.4428571 0.5000000 -0.0000000), wk = 0.0032258 k( 69) = ( 0.4571429 0.5000000 -0.0000000), wk = 0.0032258 k( 70) = ( 0.4714286 0.5000000 0.0000000), wk = 0.0032258 k( 71) = ( 0.4857143 0.5000000 0.0000000), wk = 0.0032258 k( 72) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032258 k( 73) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032258 k( 74) = ( 0.4897959 0.4897959 -0.0000000), wk = 0.0032258 k( 75) = ( 0.4795918 0.4795918 -0.0000000), wk = 0.0032258 k( 76) = ( 0.4693878 0.4693878 0.0000000), wk = 0.0032258 k( 77) = ( 0.4591837 0.4591837 0.0000000), wk = 0.0032258 k( 78) = ( 0.4489796 0.4489796 -0.0000000), wk = 0.0032258 k( 79) = ( 0.4387755 0.4387755 -0.0000000), wk = 0.0032258 k( 80) = ( 0.4285714 0.4285714 0.0000000), wk = 0.0032258 k( 81) = ( 0.4183674 0.4183674 -0.0000000), wk = 0.0032258 k( 82) = ( 0.4081633 0.4081633 -0.0000000), wk = 0.0032258 k( 83) = ( 0.3979592 0.3979592 -0.0000000), wk = 0.0032258 k( 84) = ( 0.3877551 0.3877551 -0.0000000), wk = 0.0032258 k( 85) = ( 0.3775510 0.3775510 0.0000000), wk = 0.0032258 k( 86) = ( 0.3673469 0.3673469 -0.0000000), wk = 0.0032258 k( 87) = ( 0.3571429 0.3571429 0.0000000), wk = 0.0032258 k( 88) = ( 0.3469388 0.3469388 -0.0000000), wk = 0.0032258 k( 89) = ( 0.3367347 0.3367347 0.0000000), wk = 0.0032258 k( 90) = ( 0.3265306 0.3265306 0.0000000), wk = 0.0032258 k( 91) = ( 0.3163265 0.3163265 0.0000000), wk = 0.0032258 k( 92) = ( 0.3061224 0.3061224 -0.0000000), wk = 0.0032258 k( 93) = ( 0.2959184 0.2959184 0.0000000), wk = 0.0032258 k( 94) = ( 0.2857143 0.2857143 0.0000000), wk = 0.0032258 k( 95) = ( 0.2755102 0.2755102 0.0000000), wk = 0.0032258 k( 96) = ( 0.2653061 0.2653061 0.0000000), wk = 0.0032258 k( 97) = ( 0.2551020 0.2551020 0.0000000), wk = 0.0032258 k( 98) = ( 0.2448980 0.2448980 -0.0000000), wk = 0.0032258 k( 99) = ( 0.2346939 0.2346939 0.0000000), wk = 0.0032258 k( 100) = ( 0.2244898 0.2244898 -0.0000000), wk = 0.0032258 k( 101) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0032258 k( 102) = ( 0.2040816 0.2040816 0.0000000), wk = 0.0032258 k( 103) = ( 0.1938776 0.1938776 -0.0000000), wk = 0.0032258 k( 104) = ( 0.1836735 0.1836735 -0.0000000), wk = 0.0032258 k( 105) = ( 0.1734694 0.1734694 -0.0000000), wk = 0.0032258 k( 106) = ( 0.1632653 0.1632653 0.0000000), wk = 0.0032258 k( 107) = ( 0.1530612 0.1530612 -0.0000000), wk = 0.0032258 k( 108) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0032258 k( 109) = ( 0.1326531 0.1326531 0.0000000), wk = 0.0032258 k( 110) = ( 0.1224490 0.1224490 -0.0000000), wk = 0.0032258 k( 111) = ( 0.1122449 0.1122449 -0.0000000), wk = 0.0032258 k( 112) = ( 0.1020408 0.1020408 0.0000000), wk = 0.0032258 k( 113) = ( 0.0918367 0.0918367 -0.0000000), wk = 0.0032258 k( 114) = ( 0.0816327 0.0816327 -0.0000000), wk = 0.0032258 k( 115) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0032258 k( 116) = ( 0.0612245 0.0612245 -0.0000000), wk = 0.0032258 k( 117) = ( 0.0510204 0.0510204 0.0000000), wk = 0.0032258 k( 118) = ( 0.0408163 0.0408163 0.0000000), wk = 0.0032258 k( 119) = ( 0.0306122 0.0306122 0.0000000), wk = 0.0032258 k( 120) = ( 0.0204082 0.0204082 -0.0000000), wk = 0.0032258 k( 121) = ( 0.0102041 0.0102041 -0.0000000), wk = 0.0032258 k( 122) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032258 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032258 k( 124) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0032258 k( 125) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0032258 k( 126) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0032258 k( 127) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0032258 k( 128) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0032258 k( 129) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0032258 k( 130) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0032258 k( 131) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0032258 k( 132) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0032258 k( 133) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0032258 k( 134) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0032258 k( 135) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0032258 k( 136) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0032258 k( 137) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0032258 k( 138) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0032258 k( 139) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0032258 k( 140) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0032258 k( 141) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0032258 k( 142) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0032258 k( 143) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0032258 k( 144) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032258 k( 145) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032258 k( 146) = ( 0.0000000 0.0142857 0.5000000), wk = 0.0032258 k( 147) = ( 0.0000000 0.0285714 0.5000000), wk = 0.0032258 k( 148) = ( 0.0000000 0.0428571 0.5000000), wk = 0.0032258 k( 149) = ( 0.0000000 0.0571429 0.5000000), wk = 0.0032258 k( 150) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0032258 k( 151) = ( 0.0000000 0.0857143 0.5000000), wk = 0.0032258 k( 152) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0032258 k( 153) = ( 0.0000000 0.1142857 0.5000000), wk = 0.0032258 k( 154) = ( 0.0000000 0.1285714 0.5000000), wk = 0.0032258 k( 155) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0032258 k( 156) = ( 0.0000000 0.1571429 0.5000000), wk = 0.0032258 k( 157) = ( 0.0000000 0.1714286 0.5000000), wk = 0.0032258 k( 158) = ( 0.0000000 0.1857143 0.5000000), wk = 0.0032258 k( 159) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0032258 k( 160) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0032258 k( 161) = ( 0.0000000 0.2285714 0.5000000), wk = 0.0032258 k( 162) = ( 0.0000000 0.2428571 0.5000000), wk = 0.0032258 k( 163) = ( 0.0000000 0.2571429 0.5000000), wk = 0.0032258 k( 164) = ( 0.0000000 0.2714286 0.5000000), wk = 0.0032258 k( 165) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0032258 k( 166) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0032258 k( 167) = ( 0.0000000 0.3142857 0.5000000), wk = 0.0032258 k( 168) = ( 0.0000000 0.3285714 0.5000000), wk = 0.0032258 k( 169) = ( 0.0000000 0.3428571 0.5000000), wk = 0.0032258 k( 170) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0032258 k( 171) = ( 0.0000000 0.3714286 0.5000000), wk = 0.0032258 k( 172) = ( 0.0000000 0.3857143 0.5000000), wk = 0.0032258 k( 173) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0032258 k( 174) = ( 0.0000000 0.4142857 0.5000000), wk = 0.0032258 k( 175) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0032258 k( 176) = ( 0.0000000 0.4428571 0.5000000), wk = 0.0032258 k( 177) = ( 0.0000000 0.4571429 0.5000000), wk = 0.0032258 k( 178) = ( 0.0000000 0.4714286 0.5000000), wk = 0.0032258 k( 179) = ( 0.0000000 0.4857143 0.5000000), wk = 0.0032258 k( 180) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032258 k( 181) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032258 k( 182) = ( 0.0142857 0.5000000 0.5000000), wk = 0.0032258 k( 183) = ( 0.0285714 0.5000000 0.5000000), wk = 0.0032258 k( 184) = ( 0.0428571 0.5000000 0.5000000), wk = 0.0032258 k( 185) = ( 0.0571429 0.5000000 0.5000000), wk = 0.0032258 k( 186) = ( 0.0714286 0.5000000 0.5000000), wk = 0.0032258 k( 187) = ( 0.0857143 0.5000000 0.5000000), wk = 0.0032258 k( 188) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0032258 k( 189) = ( 0.1142857 0.5000000 0.5000000), wk = 0.0032258 k( 190) = ( 0.1285714 0.5000000 0.5000000), wk = 0.0032258 k( 191) = ( 0.1428571 0.5000000 0.5000000), wk = 0.0032258 k( 192) = ( 0.1571429 0.5000000 0.5000000), wk = 0.0032258 k( 193) = ( 0.1714286 0.5000000 0.5000000), wk = 0.0032258 k( 194) = ( 0.1857143 0.5000000 0.5000000), wk = 0.0032258 k( 195) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0032258 k( 196) = ( 0.2142857 0.5000000 0.5000000), wk = 0.0032258 k( 197) = ( 0.2285714 0.5000000 0.5000000), wk = 0.0032258 k( 198) = ( 0.2428571 0.5000000 0.5000000), wk = 0.0032258 k( 199) = ( 0.2571429 0.5000000 0.5000000), wk = 0.0032258 k( 200) = ( 0.2714286 0.5000000 0.5000000), wk = 0.0032258 k( 201) = ( 0.2857143 0.5000000 0.5000000), wk = 0.0032258 k( 202) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0032258 k( 203) = ( 0.3142857 0.5000000 0.5000000), wk = 0.0032258 k( 204) = ( 0.3285714 0.5000000 0.5000000), wk = 0.0032258 k( 205) = ( 0.3428571 0.5000000 0.5000000), wk = 0.0032258 k( 206) = ( 0.3571429 0.5000000 0.5000000), wk = 0.0032258 k( 207) = ( 0.3714286 0.5000000 0.5000000), wk = 0.0032258 k( 208) = ( 0.3857143 0.5000000 0.5000000), wk = 0.0032258 k( 209) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0032258 k( 210) = ( 0.4142857 0.5000000 0.5000000), wk = 0.0032258 k( 211) = ( 0.4285714 0.5000000 0.5000000), wk = 0.0032258 k( 212) = ( 0.4428571 0.5000000 0.5000000), wk = 0.0032258 k( 213) = ( 0.4571429 0.5000000 0.5000000), wk = 0.0032258 k( 214) = ( 0.4714286 0.5000000 0.5000000), wk = 0.0032258 k( 215) = ( 0.4857143 0.5000000 0.5000000), wk = 0.0032258 k( 216) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032258 k( 217) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032258 k( 218) = ( 0.4897959 0.4897959 0.5000000), wk = 0.0032258 k( 219) = ( 0.4795918 0.4795918 0.5000000), wk = 0.0032258 k( 220) = ( 0.4693878 0.4693878 0.5000000), wk = 0.0032258 k( 221) = ( 0.4591837 0.4591837 0.5000000), wk = 0.0032258 k( 222) = ( 0.4489796 0.4489796 0.5000000), wk = 0.0032258 k( 223) = ( 0.4387755 0.4387755 0.5000000), wk = 0.0032258 k( 224) = ( 0.4285714 0.4285714 0.5000000), wk = 0.0032258 k( 225) = ( 0.4183674 0.4183674 0.5000000), wk = 0.0032258 k( 226) = ( 0.4081633 0.4081633 0.5000000), wk = 0.0032258 k( 227) = ( 0.3979592 0.3979592 0.5000000), wk = 0.0032258 k( 228) = ( 0.3877551 0.3877551 0.5000000), wk = 0.0032258 k( 229) = ( 0.3775510 0.3775510 0.5000000), wk = 0.0032258 k( 230) = ( 0.3673469 0.3673469 0.5000000), wk = 0.0032258 k( 231) = ( 0.3571429 0.3571429 0.5000000), wk = 0.0032258 k( 232) = ( 0.3469388 0.3469388 0.5000000), wk = 0.0032258 k( 233) = ( 0.3367347 0.3367347 0.5000000), wk = 0.0032258 k( 234) = ( 0.3265306 0.3265306 0.5000000), wk = 0.0032258 k( 235) = ( 0.3163265 0.3163265 0.5000000), wk = 0.0032258 k( 236) = ( 0.3061224 0.3061224 0.5000000), wk = 0.0032258 k( 237) = ( 0.2959184 0.2959184 0.5000000), wk = 0.0032258 k( 238) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0032258 k( 239) = ( 0.2755102 0.2755102 0.5000000), wk = 0.0032258 k( 240) = ( 0.2653061 0.2653061 0.5000000), wk = 0.0032258 k( 241) = ( 0.2551020 0.2551020 0.5000000), wk = 0.0032258 k( 242) = ( 0.2448980 0.2448980 0.5000000), wk = 0.0032258 k( 243) = ( 0.2346939 0.2346939 0.5000000), wk = 0.0032258 k( 244) = ( 0.2244898 0.2244898 0.5000000), wk = 0.0032258 k( 245) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0032258 k( 246) = ( 0.2040816 0.2040816 0.5000000), wk = 0.0032258 k( 247) = ( 0.1938776 0.1938776 0.5000000), wk = 0.0032258 k( 248) = ( 0.1836735 0.1836735 0.5000000), wk = 0.0032258 k( 249) = ( 0.1734694 0.1734694 0.5000000), wk = 0.0032258 k( 250) = ( 0.1632653 0.1632653 0.5000000), wk = 0.0032258 k( 251) = ( 0.1530612 0.1530612 0.5000000), wk = 0.0032258 k( 252) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0032258 k( 253) = ( 0.1326531 0.1326531 0.5000000), wk = 0.0032258 k( 254) = ( 0.1224490 0.1224490 0.5000000), wk = 0.0032258 k( 255) = ( 0.1122449 0.1122449 0.5000000), wk = 0.0032258 k( 256) = ( 0.1020408 0.1020408 0.5000000), wk = 0.0032258 k( 257) = ( 0.0918367 0.0918367 0.5000000), wk = 0.0032258 k( 258) = ( 0.0816327 0.0816327 0.5000000), wk = 0.0032258 k( 259) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0032258 k( 260) = ( 0.0612245 0.0612245 0.5000000), wk = 0.0032258 k( 261) = ( 0.0510204 0.0510204 0.5000000), wk = 0.0032258 k( 262) = ( 0.0408163 0.0408163 0.5000000), wk = 0.0032258 k( 263) = ( 0.0306122 0.0306122 0.5000000), wk = 0.0032258 k( 264) = ( 0.0204082 0.0204082 0.5000000), wk = 0.0032258 k( 265) = ( 0.0102041 0.0102041 0.5000000), wk = 0.0032258 k( 266) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032258 k( 267) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032258 k( 268) = ( 0.0000000 0.5000000 0.0238095), wk = 0.0032258 k( 269) = ( 0.0000000 0.5000000 0.0476191), wk = 0.0032258 k( 270) = ( 0.0000000 0.5000000 0.0714286), wk = 0.0032258 k( 271) = ( 0.0000000 0.5000000 0.0952381), wk = 0.0032258 k( 272) = ( 0.0000000 0.5000000 0.1190476), wk = 0.0032258 k( 273) = ( 0.0000000 0.5000000 0.1428571), wk = 0.0032258 k( 274) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0032258 k( 275) = ( 0.0000000 0.5000000 0.1904762), wk = 0.0032258 k( 276) = ( 0.0000000 0.5000000 0.2142857), wk = 0.0032258 k( 277) = ( 0.0000000 0.5000000 0.2380952), wk = 0.0032258 k( 278) = ( 0.0000000 0.5000000 0.2619048), wk = 0.0032258 k( 279) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0032258 k( 280) = ( 0.0000000 0.5000000 0.3095238), wk = 0.0032258 k( 281) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0032258 k( 282) = ( 0.0000000 0.5000000 0.3571429), wk = 0.0032258 k( 283) = ( 0.0000000 0.5000000 0.3809524), wk = 0.0032258 k( 284) = ( 0.0000000 0.5000000 0.4047619), wk = 0.0032258 k( 285) = ( 0.0000000 0.5000000 0.4285714), wk = 0.0032258 k( 286) = ( 0.0000000 0.5000000 0.4523810), wk = 0.0032258 k( 287) = ( 0.0000000 0.5000000 0.4761905), wk = 0.0032258 k( 288) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032258 k( 289) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032258 k( 290) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0032258 k( 291) = ( 0.5000000 0.5000000 0.0476191), wk = 0.0032258 k( 292) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0032258 k( 293) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0032258 k( 294) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0032258 k( 295) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0032258 k( 296) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0032258 k( 297) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0032258 k( 298) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0032258 k( 299) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0032258 k( 300) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0032258 k( 301) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0032258 k( 302) = ( 0.5000000 0.5000000 0.3095238), wk = 0.0032258 k( 303) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0032258 k( 304) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0032258 k( 305) = ( 0.5000000 0.5000000 0.3809524), wk = 0.0032258 k( 306) = ( 0.5000000 0.5000000 0.4047619), wk = 0.0032258 k( 307) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0032258 k( 308) = ( 0.5000000 0.5000000 0.4523810), wk = 0.0032258 k( 309) = ( 0.5000000 0.5000000 0.4761905), wk = 0.0032258 k( 310) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032258 Dense grid: 137715 G-vectors FFT dimensions: ( 54, 54, 96) Smooth grid: 65795 G-vectors FFT dimensions: ( 45, 45, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.42 Mb ( 476, 58) NL pseudopotentials 0.45 Mb ( 238, 124) Each V/rho on FFT grid 0.13 Mb ( 8748) Each G-vector array 0.03 Mb ( 3824) G-vector shells 0.01 Mb ( 1860) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.69 Mb ( 476, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.22 Mb ( 124, 2, 58) Check: negative/imaginary core charge= -0.000007 0.000000 The potential is recalculated from file : ./KMgAs.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.7 secs Computing kpt #: 2 total cpu time spent up to now is 3.5 secs Computing kpt #: 3 total cpu time spent up to now is 4.3 secs Computing kpt #: 4 total cpu time spent up to now is 5.0 secs Computing kpt #: 5 total cpu time spent up to now is 5.7 secs Computing kpt #: 6 total cpu time spent up to now is 6.4 secs Computing kpt #: 7 total cpu time spent up to now is 7.1 secs Computing kpt #: 8 total cpu time spent up to now is 7.8 secs Computing kpt #: 9 total cpu time spent up to now is 8.6 secs Computing kpt #: 10 total cpu time spent up to now is 9.2 secs Computing kpt #: 11 total cpu time spent up to now is 9.9 secs Computing kpt #: 12 total cpu time spent up to now is 10.6 secs Computing kpt #: 13 total cpu time spent up to now is 11.3 secs Computing kpt #: 14 total cpu time spent up to now is 12.1 secs Computing kpt #: 15 total cpu time spent up to now is 12.8 secs Computing kpt #: 16 total cpu time spent up to now is 13.5 secs Computing kpt #: 17 total cpu time spent up to now is 14.2 secs Computing kpt #: 18 total cpu time spent up to now is 15.0 secs Computing kpt #: 19 total cpu time spent up to now is 15.7 secs Computing kpt #: 20 total cpu time spent up to now is 16.4 secs Computing kpt #: 21 total cpu time spent up to now is 17.2 secs Computing kpt #: 22 total cpu time spent up to now is 17.9 secs Computing kpt #: 23 total cpu time spent up to now is 18.6 secs Computing kpt #: 24 total cpu time spent up to now is 19.3 secs Computing kpt #: 25 total cpu time spent up to now is 20.1 secs Computing kpt #: 26 total cpu time spent up to now is 20.8 secs Computing kpt #: 27 total cpu time spent up to now is 21.5 secs Computing kpt #: 28 total cpu time spent up to now is 22.2 secs Computing kpt #: 29 total cpu time spent up to now is 22.9 secs Computing kpt #: 30 total cpu time spent up to now is 23.6 secs Computing kpt #: 31 total cpu time spent up to now is 24.4 secs Computing kpt #: 32 total cpu time spent up to now is 25.1 secs Computing kpt #: 33 total cpu time spent up to now is 25.8 secs Computing kpt #: 34 total cpu time spent up to now is 26.6 secs Computing kpt #: 35 total cpu time spent up to now is 27.3 secs Computing kpt #: 36 total cpu time spent up to now is 28.0 secs Computing kpt #: 37 total cpu time spent up to now is 28.7 secs Computing kpt #: 38 total cpu time spent up to now is 29.5 secs Computing kpt #: 39 total cpu time spent up to now is 30.3 secs Computing kpt #: 40 total cpu time spent up to now is 31.0 secs Computing kpt #: 41 total cpu time spent up to now is 31.7 secs Computing kpt #: 42 total cpu time spent up to now is 32.4 secs Computing kpt #: 43 total cpu time spent up to now is 33.1 secs Computing kpt #: 44 total cpu time spent up to now is 33.8 secs Computing kpt #: 45 total cpu time spent up to now is 34.6 secs Computing kpt #: 46 total cpu time spent up to now is 35.3 secs Computing kpt #: 47 total cpu time spent up to now is 36.1 secs Computing kpt #: 48 total cpu time spent up to now is 36.8 secs Computing kpt #: 49 total cpu time spent up to now is 37.5 secs Computing kpt #: 50 total cpu time spent up to now is 38.3 secs Computing kpt #: 51 total cpu time spent up to now is 39.0 secs Computing kpt #: 52 total cpu time spent up to now is 39.8 secs Computing kpt #: 53 total cpu time spent up to now is 40.5 secs Computing kpt #: 54 total cpu time spent up to now is 41.3 secs Computing kpt #: 55 total cpu time spent up to now is 42.0 secs Computing kpt #: 56 total cpu time spent up to now is 42.8 secs Computing kpt #: 57 total cpu time spent up to now is 43.6 secs Computing kpt #: 58 total cpu time spent up to now is 44.3 secs Computing kpt #: 59 total cpu time spent up to now is 45.1 secs Computing kpt #: 60 total cpu time spent up to now is 45.8 secs Computing kpt #: 61 total cpu time spent up to now is 46.6 secs Computing kpt #: 62 total cpu time spent up to now is 47.7 secs Computing kpt #: 63 total cpu time spent up to now is 48.9 secs Computing kpt #: 64 total cpu time spent up to now is 50.0 secs Computing kpt #: 65 total cpu time spent up to now is 51.0 secs Computing kpt #: 66 total cpu time spent up to now is 51.8 secs Computing kpt #: 67 total cpu time spent up to now is 52.8 secs Computing kpt #: 68 total cpu time spent up to now is 53.8 secs Computing kpt #: 69 total cpu time spent up to now is 54.8 secs Computing kpt #: 70 total cpu time spent up to now is 55.8 secs Computing kpt #: 71 total cpu time spent up to now is 56.5 secs Computing kpt #: 72 total cpu time spent up to now is 57.1 secs Computing kpt #: 73 total cpu time spent up to now is 57.6 secs Computing kpt #: 74 total cpu time spent up to now is 58.6 secs Computing kpt #: 75 total cpu time spent up to now is 59.7 secs Computing kpt #: 76 total cpu time spent up to now is 60.9 secs Computing kpt #: 77 total cpu time spent up to now is 61.6 secs Computing kpt #: 78 total cpu time spent up to now is 62.4 secs Computing kpt #: 79 total cpu time spent up to now is 63.2 secs Computing kpt #: 80 total cpu time spent up to now is 64.0 secs Computing kpt #: 81 total cpu time spent up to now is 64.8 secs Computing kpt #: 82 total cpu time spent up to now is 65.7 secs Computing kpt #: 83 total cpu time spent up to now is 66.5 secs Computing kpt #: 84 total cpu time spent up to now is 67.3 secs Computing kpt #: 85 total cpu time spent up to now is 68.1 secs Computing kpt #: 86 total cpu time spent up to now is 69.0 secs Computing kpt #: 87 total cpu time spent up to now is 70.1 secs Computing kpt #: 88 total cpu time spent up to now is 71.0 secs Computing kpt #: 89 total cpu time spent up to now is 72.1 secs Computing kpt #: 90 total cpu time spent up to now is 72.8 secs Computing kpt #: 91 total cpu time spent up to now is 73.6 secs Computing kpt #: 92 total cpu time spent up to now is 74.3 secs Computing kpt #: 93 total cpu time spent up to now is 75.1 secs Computing kpt #: 94 total cpu time spent up to now is 75.8 secs Computing kpt #: 95 total cpu time spent up to now is 76.5 secs Computing kpt #: 96 total cpu time spent up to now is 77.3 secs Computing kpt #: 97 total cpu time spent up to now is 78.0 secs Computing kpt #: 98 total cpu time spent up to now is 78.7 secs Computing kpt #: 99 total cpu time spent up to now is 79.5 secs Computing kpt #: 100 total cpu time spent up to now is 80.2 secs Computing kpt #: 101 total cpu time spent up to now is 80.8 secs Computing kpt #: 102 total cpu time spent up to now is 81.6 secs Computing kpt #: 103 total cpu time spent up to now is 82.3 secs Computing kpt #: 104 total cpu time spent up to now is 83.0 secs Computing kpt #: 105 total cpu time spent up to now is 83.9 secs Computing kpt #: 106 total cpu time spent up to now is 84.7 secs Computing kpt #: 107 total cpu time spent up to now is 85.4 secs Computing kpt #: 108 total cpu time spent up to now is 86.0 secs Computing kpt #: 109 total cpu time spent up to now is 86.6 secs Computing kpt #: 110 total cpu time spent up to now is 87.2 secs Computing kpt #: 111 total cpu time spent up to now is 87.8 secs Computing kpt #: 112 total cpu time spent up to now is 88.4 secs Computing kpt #: 113 total cpu time spent up to now is 89.1 secs Computing kpt #: 114 total cpu time spent up to now is 89.9 secs Computing kpt #: 115 total cpu time spent up to now is 90.6 secs Computing kpt #: 116 total cpu time spent up to now is 91.3 secs Computing kpt #: 117 total cpu time spent up to now is 92.0 secs Computing kpt #: 118 total cpu time spent up to now is 92.8 secs Computing kpt #: 119 total cpu time spent up to now is 93.6 secs Computing kpt #: 120 total cpu time spent up to now is 94.4 secs Computing kpt #: 121 total cpu time spent up to now is 95.1 secs Computing kpt #: 122 total cpu time spent up to now is 95.8 secs Computing kpt #: 123 total cpu time spent up to now is 96.5 secs Computing kpt #: 124 total cpu time spent up to now is 97.2 secs Computing kpt #: 125 total cpu time spent up to now is 97.9 secs Computing kpt #: 126 total cpu time spent up to now is 98.9 secs Computing kpt #: 127 total cpu time spent up to now is 99.7 secs Computing kpt #: 128 total cpu time spent up to now is 100.6 secs Computing kpt #: 129 total cpu time spent up to now is 101.5 secs Computing kpt #: 130 total cpu time spent up to now is 102.3 secs Computing kpt #: 131 total cpu time spent up to now is 103.3 secs Computing kpt #: 132 total cpu time spent up to now is 104.3 secs Computing kpt #: 133 total cpu time spent up to now is 105.1 secs Computing kpt #: 134 total cpu time spent up to now is 106.0 secs Computing kpt #: 135 total cpu time spent up to now is 106.8 secs Computing kpt #: 136 total cpu time spent up to now is 107.5 secs Computing kpt #: 137 total cpu time spent up to now is 108.2 secs Computing kpt #: 138 total cpu time spent up to now is 108.8 secs Computing kpt #: 139 total cpu time spent up to now is 109.4 secs Computing kpt #: 140 total cpu time spent up to now is 110.0 secs Computing kpt #: 141 total cpu time spent up to now is 110.5 secs Computing kpt #: 142 total cpu time spent up to now is 111.1 secs Computing kpt #: 143 total cpu time spent up to now is 111.7 secs Computing kpt #: 144 total cpu time spent up to now is 112.2 secs Computing kpt #: 145 total cpu time spent up to now is 112.8 secs Computing kpt #: 146 total cpu time spent up to now is 113.3 secs Computing kpt #: 147 total cpu time spent up to now is 113.9 secs Computing kpt #: 148 total cpu time spent up to now is 114.5 secs Computing kpt #: 149 total cpu time spent up to now is 115.0 secs Computing kpt #: 150 total cpu time spent up to now is 115.6 secs Computing kpt #: 151 total cpu time spent up to now is 116.1 secs Computing kpt #: 152 total cpu time spent up to now is 116.7 secs Computing kpt #: 153 total cpu time spent up to now is 117.3 secs Computing kpt #: 154 total cpu time spent up to now is 117.8 secs Computing kpt #: 155 total cpu time spent up to now is 118.4 secs Computing kpt #: 156 total cpu time spent up to now is 118.9 secs Computing kpt #: 157 total cpu time spent up to now is 119.5 secs Computing kpt #: 158 total cpu time spent up to now is 120.1 secs Computing kpt #: 159 total cpu time spent up to now is 120.6 secs Computing kpt #: 160 total cpu time spent up to now is 121.2 secs Computing kpt #: 161 total cpu time spent up to now is 121.8 secs Computing kpt #: 162 total cpu time spent up to now is 122.6 secs Computing kpt #: 163 total cpu time spent up to now is 123.3 secs Computing kpt #: 164 total cpu time spent up to now is 124.1 secs Computing kpt #: 165 total cpu time spent up to now is 124.8 secs Computing kpt #: 166 total cpu time spent up to now is 125.6 secs Computing kpt #: 167 total cpu time spent up to now is 126.3 secs Computing kpt #: 168 total cpu time spent up to now is 127.0 secs Computing kpt #: 169 total cpu time spent up to now is 127.8 secs Computing kpt #: 170 total cpu time spent up to now is 128.5 secs Computing kpt #: 171 total cpu time spent up to now is 129.2 secs Computing kpt #: 172 total cpu time spent up to now is 130.0 secs Computing kpt #: 173 total cpu time spent up to now is 130.7 secs Computing kpt #: 174 total cpu time spent up to now is 131.4 secs Computing kpt #: 175 total cpu time spent up to now is 132.2 secs Computing kpt #: 176 total cpu time spent up to now is 132.9 secs Computing kpt #: 177 total cpu time spent up to now is 133.6 secs Computing kpt #: 178 total cpu time spent up to now is 134.4 secs Computing kpt #: 179 total cpu time spent up to now is 135.1 secs Computing kpt #: 180 total cpu time spent up to now is 135.7 secs Computing kpt #: 181 total cpu time spent up to now is 136.4 secs Computing kpt #: 182 total cpu time spent up to now is 137.1 secs Computing kpt #: 183 total cpu time spent up to now is 137.9 secs Computing kpt #: 184 total cpu time spent up to now is 138.7 secs Computing kpt #: 185 total cpu time spent up to now is 139.4 secs Computing kpt #: 186 total cpu time spent up to now is 140.2 secs Computing kpt #: 187 total cpu time spent up to now is 140.9 secs Computing kpt #: 188 total cpu time spent up to now is 141.7 secs Computing kpt #: 189 total cpu time spent up to now is 142.4 secs Computing kpt #: 190 total cpu time spent up to now is 143.1 secs Computing kpt #: 191 total cpu time spent up to now is 143.9 secs Computing kpt #: 192 total cpu time spent up to now is 144.5 secs Computing kpt #: 193 total cpu time spent up to now is 145.3 secs Computing kpt #: 194 total cpu time spent up to now is 146.0 secs Computing kpt #: 195 total cpu time spent up to now is 146.7 secs Computing kpt #: 196 total cpu time spent up to now is 147.5 secs Computing kpt #: 197 total cpu time spent up to now is 148.1 secs Computing kpt #: 198 total cpu time spent up to now is 148.8 secs Computing kpt #: 199 total cpu time spent up to now is 149.5 secs Computing kpt #: 200 total cpu time spent up to now is 150.1 secs Computing kpt #: 201 total cpu time spent up to now is 150.8 secs Computing kpt #: 202 total cpu time spent up to now is 151.4 secs Computing kpt #: 203 total cpu time spent up to now is 152.1 secs Computing kpt #: 204 total cpu time spent up to now is 152.8 secs Computing kpt #: 205 total cpu time spent up to now is 153.4 secs Computing kpt #: 206 total cpu time spent up to now is 154.1 secs Computing kpt #: 207 total cpu time spent up to now is 154.8 secs Computing kpt #: 208 total cpu time spent up to now is 155.4 secs Computing kpt #: 209 total cpu time spent up to now is 156.1 secs Computing kpt #: 210 total cpu time spent up to now is 156.8 secs Computing kpt #: 211 total cpu time spent up to now is 157.5 secs Computing kpt #: 212 total cpu time spent up to now is 158.2 secs Computing kpt #: 213 total cpu time spent up to now is 158.9 secs Computing kpt #: 214 total cpu time spent up to now is 159.6 secs Computing kpt #: 215 total cpu time spent up to now is 160.3 secs Computing kpt #: 216 total cpu time spent up to now is 161.0 secs Computing kpt #: 217 total cpu time spent up to now is 161.7 secs Computing kpt #: 218 total cpu time spent up to now is 162.4 secs Computing kpt #: 219 total cpu time spent up to now is 163.1 secs Computing kpt #: 220 total cpu time spent up to now is 163.8 secs Computing kpt #: 221 total cpu time spent up to now is 164.4 secs Computing kpt #: 222 total cpu time spent up to now is 165.1 secs Computing kpt #: 223 total cpu time spent up to now is 165.8 secs Computing kpt #: 224 total cpu time spent up to now is 166.4 secs Computing kpt #: 225 total cpu time spent up to now is 167.1 secs Computing kpt #: 226 total cpu time spent up to now is 167.7 secs Computing kpt #: 227 total cpu time spent up to now is 168.4 secs Computing kpt #: 228 total cpu time spent up to now is 169.1 secs Computing kpt #: 229 total cpu time spent up to now is 169.7 secs Computing kpt #: 230 total cpu time spent up to now is 170.4 secs Computing kpt #: 231 total cpu time spent up to now is 171.0 secs Computing kpt #: 232 total cpu time spent up to now is 171.6 secs Computing kpt #: 233 total cpu time spent up to now is 172.2 secs Computing kpt #: 234 total cpu time spent up to now is 172.8 secs Computing kpt #: 235 total cpu time spent up to now is 173.4 secs Computing kpt #: 236 total cpu time spent up to now is 174.0 secs Computing kpt #: 237 total cpu time spent up to now is 174.5 secs Computing kpt #: 238 total cpu time spent up to now is 175.1 secs Computing kpt #: 239 total cpu time spent up to now is 175.7 secs Computing kpt #: 240 total cpu time spent up to now is 176.3 secs Computing kpt #: 241 total cpu time spent up to now is 176.9 secs Computing kpt #: 242 total cpu time spent up to now is 177.6 secs Computing kpt #: 243 total cpu time spent up to now is 178.3 secs Computing kpt #: 244 total cpu time spent up to now is 179.0 secs Computing kpt #: 245 total cpu time spent up to now is 179.6 secs Computing kpt #: 246 total cpu time spent up to now is 180.3 secs Computing kpt #: 247 total cpu time spent up to now is 180.9 secs Computing kpt #: 248 total cpu time spent up to now is 181.5 secs Computing kpt #: 249 total cpu time spent up to now is 182.1 secs Computing kpt #: 250 total cpu time spent up to now is 182.7 secs Computing kpt #: 251 total cpu time spent up to now is 183.3 secs Computing kpt #: 252 total cpu time spent up to now is 183.9 secs Computing kpt #: 253 total cpu time spent up to now is 184.5 secs Computing kpt #: 254 total cpu time spent up to now is 185.1 secs Computing kpt #: 255 total cpu time spent up to now is 185.6 secs Computing kpt #: 256 total cpu time spent up to now is 186.2 secs Computing kpt #: 257 total cpu time spent up to now is 186.8 secs Computing kpt #: 258 total cpu time spent up to now is 187.3 secs Computing kpt #: 259 total cpu time spent up to now is 187.9 secs Computing kpt #: 260 total cpu time spent up to now is 188.4 secs Computing kpt #: 261 total cpu time spent up to now is 189.0 secs Computing kpt #: 262 total cpu time spent up to now is 189.6 secs Computing kpt #: 263 total cpu time spent up to now is 190.1 secs Computing kpt #: 264 total cpu time spent up to now is 190.7 secs Computing kpt #: 265 total cpu time spent up to now is 191.3 secs Computing kpt #: 266 total cpu time spent up to now is 191.8 secs Computing kpt #: 267 total cpu time spent up to now is 192.5 secs Computing kpt #: 268 total cpu time spent up to now is 193.1 secs Computing kpt #: 269 total cpu time spent up to now is 193.8 secs Computing kpt #: 270 total cpu time spent up to now is 194.5 secs Computing kpt #: 271 total cpu time spent up to now is 195.1 secs Computing kpt #: 272 total cpu time spent up to now is 195.9 secs Computing kpt #: 273 total cpu time spent up to now is 196.5 secs Computing kpt #: 274 total cpu time spent up to now is 197.2 secs Computing kpt #: 275 total cpu time spent up to now is 198.0 secs Computing kpt #: 276 total cpu time spent up to now is 198.7 secs Computing kpt #: 277 total cpu time spent up to now is 199.4 secs Computing kpt #: 278 total cpu time spent up to now is 200.2 secs Computing kpt #: 279 total cpu time spent up to now is 200.9 secs Computing kpt #: 280 total cpu time spent up to now is 201.5 secs Computing kpt #: 281 total cpu time spent up to now is 202.2 secs Computing kpt #: 282 total cpu time spent up to now is 202.8 secs Computing kpt #: 283 total cpu time spent up to now is 203.5 secs Computing kpt #: 284 total cpu time spent up to now is 204.1 secs Computing kpt #: 285 total cpu time spent up to now is 204.8 secs Computing kpt #: 286 total cpu time spent up to now is 205.4 secs Computing kpt #: 287 total cpu time spent up to now is 206.1 secs Computing kpt #: 288 total cpu time spent up to now is 206.7 secs Computing kpt #: 289 total cpu time spent up to now is 207.3 secs Computing kpt #: 290 total cpu time spent up to now is 207.8 secs Computing kpt #: 291 total cpu time spent up to now is 208.4 secs Computing kpt #: 292 total cpu time spent up to now is 208.9 secs Computing kpt #: 293 total cpu time spent up to now is 209.5 secs Computing kpt #: 294 total cpu time spent up to now is 210.0 secs Computing kpt #: 295 total cpu time spent up to now is 210.5 secs Computing kpt #: 296 total cpu time spent up to now is 211.1 secs Computing kpt #: 297 total cpu time spent up to now is 211.6 secs Computing kpt #: 298 total cpu time spent up to now is 212.2 secs Computing kpt #: 299 total cpu time spent up to now is 212.7 secs Computing kpt #: 300 total cpu time spent up to now is 213.2 secs Computing kpt #: 301 total cpu time spent up to now is 213.8 secs Computing kpt #: 302 total cpu time spent up to now is 214.4 secs Computing kpt #: 303 total cpu time spent up to now is 214.9 secs Computing kpt #: 304 total cpu time spent up to now is 215.5 secs Computing kpt #: 305 total cpu time spent up to now is 216.1 secs Computing kpt #: 306 total cpu time spent up to now is 216.7 secs Computing kpt #: 307 total cpu time spent up to now is 217.4 secs Computing kpt #: 308 total cpu time spent up to now is 218.0 secs Computing kpt #: 309 total cpu time spent up to now is 218.6 secs Computing kpt #: 310 total cpu time spent up to now is 219.3 secs ethr = 2.08E-08, avg # of iterations = 23.1 total cpu time spent up to now is 219.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8279 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2631 -25.2631 -25.2370 -25.2370 -9.0168 -9.0168 -8.9294 -8.9294 -8.7719 -8.7719 -8.7187 -8.7187 -8.6806 -8.6806 -8.6182 -8.6182 -4.8502 -4.8502 -4.2065 -4.2065 1.8344 1.8344 3.8582 3.8582 3.9777 3.9777 4.4065 4.4065 4.8285 4.8285 4.9649 4.9649 6.1301 6.1301 6.8491 6.8491 6.8661 6.8661 8.5115 8.5115 9.3232 9.3232 k = 0.0000 0.0143-0.0000 ( 8287 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2630 -25.2630 -25.2370 -25.2370 -9.0168 -9.0168 -8.9296 -8.9296 -8.7719 -8.7719 -8.7188 -8.7188 -8.6805 -8.6805 -8.6183 -8.6183 -4.8494 -4.8494 -4.2062 -4.2062 1.8352 1.8352 3.8535 3.8535 3.9729 3.9729 4.4089 4.4089 4.8231 4.8231 4.9587 4.9587 6.1409 6.1409 6.8545 6.8545 6.8716 6.8716 8.5163 8.5163 9.3146 9.3146 k = 0.0000 0.0286-0.0000 ( 8287 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2630 -25.2630 -25.2370 -25.2370 -9.0168 -9.0168 -8.9300 -8.9300 -8.7717 -8.7717 -8.7193 -8.7193 -8.6802 -8.6802 -8.6187 -8.6187 -4.8470 -4.8470 -4.2055 -4.2055 1.8376 1.8376 3.8375 3.8375 3.9617 3.9617 4.4151 4.4151 4.8051 4.8051 4.9432 4.9432 6.1720 6.1720 6.8627 6.8627 6.8960 6.8960 8.5306 8.5306 9.2835 9.2835 k = 0.0000 0.0429-0.0000 ( 8283 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4597 -37.4597 -37.1818 -37.1818 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2629 -25.2629 -25.2371 -25.2371 -9.0169 -9.0169 -8.9306 -8.9306 -8.7715 -8.7715 -8.7200 -8.7200 -8.6798 -8.6798 -8.6194 -8.6194 -4.8430 -4.8430 -4.2042 -4.2042 1.8415 1.8415 3.8060 3.8060 3.9510 3.9510 4.4230 4.4230 4.7711 4.7711 4.9257 4.9257 6.2200 6.2200 6.8706 6.8706 6.9414 6.9414 8.5542 8.5542 9.2282 9.2282 k = 0.0000 0.0571-0.0000 ( 8279 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4598 -37.4598 -37.1818 -37.1818 -37.1774 -37.1774 -37.1748 -37.1748 -37.1682 -37.1682 -25.2628 -25.2628 -25.2371 -25.2371 -9.0170 -9.0170 -8.9316 -8.9316 -8.7712 -8.7712 -8.7210 -8.7210 -8.6794 -8.6794 -8.6202 -8.6202 -4.8373 -4.8373 -4.2024 -4.2024 1.8470 1.8470 3.7575 3.7575 3.9451 3.9451 4.4298 4.4298 4.7208 4.7208 4.9112 4.9112 6.2808 6.2808 6.8802 6.8802 7.0044 7.0044 8.5869 8.5869 9.1562 9.1562 k = 0.0000 0.0714-0.0000 ( 8287 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4598 -37.4598 -37.1817 -37.1817 -37.1774 -37.1774 -37.1748 -37.1748 -37.1683 -37.1683 -25.2626 -25.2626 -25.2372 -25.2372 -9.0171 -9.0171 -8.9328 -8.9328 -8.7708 -8.7708 -8.7221 -8.7221 -8.6788 -8.6788 -8.6213 -8.6213 -4.8302 -4.8302 -4.2001 -4.2001 1.8538 1.8538 3.6951 3.6951 3.9440 3.9440 4.4320 4.4320 4.6598 4.6598 4.9003 4.9003 6.3507 6.3507 6.8923 6.8923 7.0829 7.0829 8.6284 8.6284 9.0740 9.0740 k = 0.0000 0.0857-0.0000 ( 8277 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4674 -37.4674 -37.4598 -37.4598 -37.1816 -37.1816 -37.1774 -37.1774 -37.1748 -37.1748 -37.1683 -37.1683 -25.2624 -25.2624 -25.2373 -25.2373 -9.0172 -9.0172 -8.9342 -8.9342 -8.7703 -8.7703 -8.7234 -8.7234 -8.6782 -8.6782 -8.6226 -8.6226 -4.8214 -4.8214 -4.1975 -4.1975 1.8621 1.8621 3.6226 3.6226 3.9463 3.9463 4.4234 4.4234 4.5982 4.5982 4.8913 4.8913 6.4263 6.4263 6.9069 6.9069 7.1749 7.1749 8.6782 8.6782 8.9857 8.9857 k = 0.0000 0.1000-0.0000 ( 8285 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4674 -37.4674 -37.4599 -37.4599 -37.1816 -37.1816 -37.1774 -37.1774 -37.1748 -37.1748 -37.1684 -37.1684 -25.2622 -25.2622 -25.2374 -25.2374 -9.0174 -9.0174 -8.9359 -8.9359 -8.7698 -8.7698 -8.7249 -8.7249 -8.6775 -8.6775 -8.6240 -8.6240 -4.8112 -4.8112 -4.1944 -4.1944 1.8716 1.8716 3.5429 3.5429 3.9509 3.9509 4.3924 4.3924 4.5509 4.5509 4.8832 4.8832 6.5053 6.5053 6.9239 6.9239 7.2787 7.2787 8.7355 8.7355 8.8944 8.8944 k = 0.0000 0.1143-0.0000 ( 8283 PWs) bands (ev): -70.5239 -70.5239 -70.5223 -70.5223 -37.4673 -37.4673 -37.4599 -37.4599 -37.1815 -37.1815 -37.1773 -37.1773 -37.1749 -37.1749 -37.1685 -37.1685 -25.2619 -25.2619 -25.2375 -25.2375 -9.0176 -9.0176 -8.9378 -8.9378 -8.7692 -8.7692 -8.7264 -8.7264 -8.6770 -8.6770 -8.6256 -8.6256 -4.7996 -4.7996 -4.1910 -4.1910 1.8822 1.8822 3.4582 3.4582 3.9573 3.9573 4.3331 4.3331 4.5264 4.5264 4.8752 4.8752 6.5860 6.5860 6.9435 6.9435 7.3925 7.3925 8.7994 8.7994 8.8023 8.8023 k = 0.0000 0.1286-0.0000 ( 8279 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4673 -37.4673 -37.4600 -37.4600 -37.1813 -37.1813 -37.1773 -37.1773 -37.1749 -37.1749 -37.1686 -37.1686 -25.2616 -25.2616 -25.2376 -25.2376 -9.0179 -9.0179 -8.9399 -8.9399 -8.7686 -8.7686 -8.7280 -8.7280 -8.6764 -8.6764 -8.6273 -8.6273 -4.7865 -4.7865 -4.1873 -4.1873 1.8938 1.8938 3.3703 3.3703 3.9651 3.9651 4.2565 4.2565 4.5155 4.5155 4.8670 4.8670 6.6671 6.6671 6.9654 6.9654 7.5145 7.5145 8.7109 8.7109 8.8685 8.8685 k = 0.0000 0.1429-0.0000 ( 8275 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4672 -37.4672 -37.4601 -37.4601 -37.1812 -37.1812 -37.1773 -37.1773 -37.1749 -37.1749 -37.1688 -37.1688 -25.2613 -25.2613 -25.2378 -25.2378 -9.0181 -9.0181 -8.9422 -8.9422 -8.7680 -8.7680 -8.7296 -8.7296 -8.6760 -8.6760 -8.6290 -8.6290 -4.7722 -4.7722 -4.1833 -4.1833 1.9062 1.9062 3.2804 3.2804 3.9740 3.9740 4.1732 4.1732 4.5092 4.5092 4.8583 4.8583 6.7478 6.7478 6.9898 6.9898 7.6431 7.6431 8.6217 8.6217 8.9410 8.9410 k = 0.0000 0.1571-0.0000 ( 8263 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4671 -37.4671 -37.4601 -37.4601 -37.1811 -37.1811 -37.1772 -37.1772 -37.1749 -37.1749 -37.1689 -37.1689 -25.2609 -25.2609 -25.2380 -25.2380 -9.0185 -9.0185 -8.9447 -8.9447 -8.7673 -8.7673 -8.7312 -8.7312 -8.6756 -8.6756 -8.6308 -8.6308 -4.7565 -4.7565 -4.1792 -4.1792 1.9192 1.9192 3.1896 3.1896 3.9835 3.9835 4.0889 4.0889 4.5035 4.5035 4.8489 4.8489 6.8275 6.8275 7.0164 7.0164 7.7764 7.7764 8.5359 8.5359 9.0145 9.0145 k = 0.0000 0.1714-0.0000 ( 8247 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4670 -37.4670 -37.4602 -37.4602 -37.1809 -37.1809 -37.1772 -37.1772 -37.1749 -37.1749 -37.1690 -37.1690 -25.2605 -25.2605 -25.2382 -25.2382 -9.0188 -9.0188 -8.9473 -8.9473 -8.7667 -8.7667 -8.7327 -8.7327 -8.6754 -8.6754 -8.6326 -8.6326 -4.7397 -4.7397 -4.1751 -4.1751 1.9324 1.9324 3.0987 3.0987 3.9849 3.9849 4.0143 4.0143 4.4970 4.4970 4.8389 4.8389 6.9060 6.9060 7.0452 7.0452 7.9124 7.9124 8.4550 8.4550 9.0860 9.0860 k = 0.0000 0.1857-0.0000 ( 8229 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4669 -37.4669 -37.4603 -37.4603 -37.1807 -37.1807 -37.1772 -37.1772 -37.1750 -37.1750 -37.1692 -37.1692 -25.2601 -25.2601 -25.2384 -25.2384 -9.0192 -9.0192 -8.9501 -8.9501 -8.7661 -8.7661 -8.7342 -8.7342 -8.6753 -8.6753 -8.6344 -8.6344 -4.7217 -4.7217 -4.1709 -4.1709 1.9456 1.9456 3.0085 3.0085 3.9177 3.9177 4.0117 4.0117 4.4889 4.4889 4.8281 4.8281 6.9830 6.9830 7.0761 7.0761 8.0468 8.0468 8.3826 8.3826 9.0854 9.0854 k = 0.0000 0.2000-0.0000 ( 8239 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4668 -37.4668 -37.4604 -37.4604 -37.1806 -37.1806 -37.1772 -37.1772 -37.1750 -37.1750 -37.1694 -37.1694 -25.2597 -25.2597 -25.2386 -25.2386 -9.0196 -9.0196 -8.9530 -8.9530 -8.7656 -8.7656 -8.7356 -8.7356 -8.6753 -8.6753 -8.6362 -8.6362 -4.7027 -4.7027 -4.1667 -4.1667 1.9586 1.9586 2.9197 2.9197 3.8401 3.8401 4.0239 4.0239 4.4788 4.4788 4.8165 4.8165 7.0585 7.0585 7.1090 7.1090 8.1623 8.1623 8.3352 8.3352 9.0575 9.0575 k = 0.0000 0.2143-0.0000 ( 8241 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4667 -37.4667 -37.4605 -37.4605 -37.1804 -37.1804 -37.1771 -37.1771 -37.1750 -37.1750 -37.1696 -37.1696 -25.2592 -25.2592 -25.2388 -25.2388 -9.0201 -9.0201 -8.9561 -8.9561 -8.7652 -8.7652 -8.7369 -8.7369 -8.6754 -8.6754 -8.6379 -8.6379 -4.6827 -4.6827 -4.1628 -4.1628 1.9708 1.9708 2.8326 2.8326 3.7661 3.7661 4.0377 4.0377 4.4664 4.4664 4.8042 4.8042 7.1324 7.1324 7.1438 7.1438 8.1847 8.1847 8.3862 8.3862 9.0306 9.0306 k = 0.0000 0.2286-0.0000 ( 8241 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4666 -37.4666 -37.4606 -37.4606 -37.1802 -37.1802 -37.1771 -37.1771 -37.1751 -37.1751 -37.1698 -37.1698 -25.2587 -25.2587 -25.2391 -25.2391 -9.0206 -9.0206 -8.9592 -8.9592 -8.7648 -8.7648 -8.7381 -8.7381 -8.6755 -8.6755 -8.6395 -8.6395 -4.6619 -4.6619 -4.1590 -4.1590 1.9819 1.9819 2.7478 2.7478 3.6972 3.6972 4.0526 4.0526 4.4516 4.4516 4.7910 4.7910 7.1801 7.1801 7.2048 7.2048 8.1396 8.1396 8.5088 8.5088 9.0051 9.0051 k = 0.0000 0.2429-0.0000 ( 8239 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4665 -37.4665 -37.4607 -37.4607 -37.1800 -37.1800 -37.1771 -37.1771 -37.1751 -37.1751 -37.1700 -37.1700 -25.2582 -25.2582 -25.2394 -25.2394 -9.0211 -9.0211 -8.9625 -8.9625 -8.7645 -8.7645 -8.7392 -8.7392 -8.6758 -8.6758 -8.6410 -8.6410 -4.6403 -4.6403 -4.1556 -4.1556 1.9915 1.9915 2.6658 2.6658 3.6342 3.6342 4.0682 4.0682 4.4342 4.4342 4.7771 4.7771 7.2180 7.2180 7.2756 7.2756 8.0883 8.0883 8.6407 8.6407 8.9812 8.9812 k = 0.0000 0.2571-0.0000 ( 8231 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4664 -37.4664 -37.4609 -37.4609 -37.1798 -37.1798 -37.1770 -37.1770 -37.1752 -37.1752 -37.1702 -37.1702 -25.2577 -25.2577 -25.2397 -25.2397 -9.0216 -9.0216 -8.9658 -8.9658 -8.7643 -8.7643 -8.7402 -8.7402 -8.6760 -8.6760 -8.6425 -8.6425 -4.6180 -4.6180 -4.1527 -4.1527 1.9992 1.9992 2.5868 2.5868 3.5779 3.5779 4.0846 4.0846 4.4140 4.4140 4.7624 4.7624 7.2570 7.2570 7.3447 7.3447 8.0408 8.0408 8.7700 8.7700 8.9597 8.9597 k = 0.0000 0.2714-0.0000 ( 8221 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4662 -37.4662 -37.4610 -37.4610 -37.1795 -37.1795 -37.1770 -37.1770 -37.1752 -37.1752 -37.1704 -37.1704 -25.2572 -25.2572 -25.2400 -25.2400 -9.0220 -9.0220 -8.9691 -8.9691 -8.7641 -8.7641 -8.7411 -8.7411 -8.6763 -8.6763 -8.6438 -8.6438 -4.5952 -4.5952 -4.1503 -4.1503 2.0046 2.0046 2.5111 2.5111 3.5288 3.5288 4.1015 4.1015 4.3912 4.3912 4.7470 4.7470 7.2969 7.2969 7.4120 7.4120 7.9995 7.9995 8.8886 8.8886 8.9449 8.9449 k = 0.0000 0.2857-0.0000 ( 8221 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4661 -37.4661 -37.4611 -37.4611 -37.1793 -37.1793 -37.1769 -37.1769 -37.1753 -37.1753 -37.1707 -37.1707 -25.2566 -25.2566 -25.2403 -25.2403 -9.0225 -9.0225 -8.9725 -8.9725 -8.7640 -8.7640 -8.7420 -8.7420 -8.6765 -8.6765 -8.6452 -8.6452 -4.5719 -4.5719 -4.1485 -4.1485 2.0073 2.0073 2.4391 2.4391 3.4876 3.4876 4.1190 4.1190 4.3656 4.3656 4.7309 4.7309 7.3373 7.3373 7.4773 7.4773 7.9656 7.9656 8.9155 8.9155 9.0153 9.0153 k = 0.0000 0.3000-0.0000 ( 8223 PWs) bands (ev): -70.5235 -70.5235 -70.5225 -70.5225 -37.4659 -37.4659 -37.4612 -37.4612 -37.1791 -37.1791 -37.1769 -37.1769 -37.1753 -37.1753 -37.1709 -37.1709 -25.2560 -25.2560 -25.2407 -25.2407 -9.0229 -9.0229 -8.9759 -8.9759 -8.7639 -8.7639 -8.7428 -8.7428 -8.6767 -8.6767 -8.6465 -8.6465 -4.5483 -4.5483 -4.1474 -4.1474 2.0071 2.0071 2.3710 2.3710 3.4546 3.4546 4.1367 4.1367 4.3373 4.3373 4.7141 4.7141 7.3776 7.3776 7.5402 7.5402 7.9397 7.9397 8.9020 8.9020 9.1172 9.1172 k = 0.0000 0.3143-0.0000 ( 8219 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4658 -37.4658 -37.4614 -37.4614 -37.1788 -37.1788 -37.1768 -37.1768 -37.1754 -37.1754 -37.1712 -37.1712 -25.2554 -25.2554 -25.2411 -25.2411 -9.0233 -9.0233 -8.9793 -8.9793 -8.7639 -8.7639 -8.7435 -8.7435 -8.6767 -8.6767 -8.6477 -8.6477 -4.5245 -4.5245 -4.1471 -4.1471 2.0040 2.0040 2.3069 2.3069 3.4301 3.4301 4.1544 4.1544 4.3068 4.3068 4.6967 4.6967 7.4174 7.4174 7.6002 7.6002 7.9225 7.9225 8.8896 8.8896 9.1410 9.1410 k = 0.0000 0.3286-0.0000 ( 8237 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4656 -37.4656 -37.4616 -37.4616 -37.1786 -37.1786 -37.1768 -37.1768 -37.1754 -37.1754 -37.1714 -37.1714 -25.2548 -25.2548 -25.2415 -25.2415 -9.0236 -9.0236 -8.9827 -8.9827 -8.7638 -8.7638 -8.7443 -8.7443 -8.6767 -8.6767 -8.6490 -8.6490 -4.5006 -4.5006 -4.1477 -4.1477 1.9981 1.9981 2.2472 2.2472 3.4140 3.4140 4.1709 4.1709 4.2750 4.2750 4.6788 4.6788 7.4559 7.4559 7.6568 7.6568 7.9145 7.9145 8.8796 8.8796 9.0934 9.0934 k = 0.0000 0.3429-0.0000 ( 8235 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4655 -37.4655 -37.4617 -37.4617 -37.1783 -37.1783 -37.1767 -37.1767 -37.1755 -37.1755 -37.1717 -37.1717 -25.2542 -25.2542 -25.2419 -25.2419 -9.0238 -9.0238 -8.9861 -8.9861 -8.7636 -8.7636 -8.7452 -8.7452 -8.6764 -8.6764 -8.6503 -8.6503 -4.4766 -4.4766 -4.1493 -4.1493 1.9895 1.9895 2.1918 2.1918 3.4062 3.4062 4.1821 4.1821 4.2464 4.2464 4.6604 4.6604 7.4926 7.4926 7.7091 7.7091 7.9162 7.9162 8.8726 8.8726 9.0441 9.0441 k = 0.0000 0.3571-0.0000 ( 8241 PWs) bands (ev): -70.5234 -70.5234 -70.5227 -70.5227 -37.4653 -37.4653 -37.4619 -37.4619 -37.1780 -37.1780 -37.1767 -37.1767 -37.1755 -37.1755 -37.1720 -37.1720 -25.2536 -25.2536 -25.2423 -25.2423 -9.0239 -9.0239 -8.9894 -8.9894 -8.7635 -8.7635 -8.7460 -8.7460 -8.6761 -8.6761 -8.6515 -8.6515 -4.4528 -4.4528 -4.1520 -4.1520 1.9788 1.9788 2.1409 2.1409 3.4064 3.4064 4.1719 4.1719 4.2369 4.2369 4.6415 4.6415 7.5271 7.5271 7.7562 7.7562 7.9278 7.9278 8.8685 8.8685 8.9944 8.9944 k = 0.0000 0.3714-0.0000 ( 8247 PWs) bands (ev): -70.5234 -70.5234 -70.5227 -70.5227 -37.4652 -37.4652 -37.4621 -37.4621 -37.1778 -37.1778 -37.1766 -37.1766 -37.1756 -37.1756 -37.1723 -37.1723 -25.2530 -25.2530 -25.2427 -25.2427 -9.0239 -9.0239 -8.9926 -8.9926 -8.7632 -8.7632 -8.7469 -8.7469 -8.6755 -8.6755 -8.6528 -8.6528 -4.4293 -4.4293 -4.1558 -4.1558 1.9664 1.9664 2.0947 2.0947 3.4141 3.4141 4.1386 4.1386 4.2486 4.2486 4.6222 4.6222 7.5592 7.5592 7.7970 7.7970 7.9490 7.9490 8.8676 8.8676 8.9445 8.9445 k = 0.0000 0.3857-0.0000 ( 8251 PWs) bands (ev): -70.5233 -70.5233 -70.5228 -70.5228 -37.4650 -37.4650 -37.4622 -37.4622 -37.1775 -37.1775 -37.1766 -37.1766 -37.1757 -37.1757 -37.1726 -37.1726 -25.2524 -25.2524 -25.2432 -25.2432 -9.0237 -9.0237 -8.9957 -8.9957 -8.7628 -8.7628 -8.7479 -8.7479 -8.6749 -8.6749 -8.6541 -8.6541 -4.4061 -4.4061 -4.1607 -4.1607 1.9531 1.9531 2.0532 2.0532 3.4287 3.4287 4.0973 4.0973 4.2666 4.2666 4.6026 4.6026 7.5893 7.5893 7.8305 7.8305 7.9790 7.9790 8.8699 8.8699 8.8939 8.8939 k = 0.0000 0.4000-0.0000 ( 8247 PWs) bands (ev): -70.5233 -70.5233 -70.5228 -70.5228 -37.4649 -37.4649 -37.4624 -37.4624 -37.1772 -37.1772 -37.1765 -37.1765 -37.1757 -37.1757 -37.1729 -37.1729 -25.2518 -25.2518 -25.2437 -25.2437 -9.0234 -9.0234 -8.9988 -8.9988 -8.7624 -8.7624 -8.7490 -8.7490 -8.6740 -8.6740 -8.6555 -8.6555 -4.3834 -4.3834 -4.1669 -4.1669 1.9394 1.9394 2.0164 2.0164 3.4495 3.4495 4.0527 4.0527 4.2864 4.2864 4.5826 4.5826 7.6179 7.6179 7.8558 7.8558 8.0170 8.0170 8.8415 8.8415 8.8758 8.8758 k = 0.0000 0.4143-0.0000 ( 8241 PWs) bands (ev): -70.5233 -70.5233 -70.5228 -70.5228 -37.4647 -37.4647 -37.4625 -37.4625 -37.1769 -37.1769 -37.1765 -37.1765 -37.1758 -37.1758 -37.1732 -37.1732 -25.2511 -25.2511 -25.2442 -25.2442 -9.0229 -9.0229 -9.0017 -9.0017 -8.7618 -8.7618 -8.7500 -8.7500 -8.6731 -8.6731 -8.6568 -8.6568 -4.3613 -4.3613 -4.1744 -4.1744 1.9262 1.9262 1.9844 1.9844 3.4758 3.4758 4.0060 4.0060 4.3071 4.3071 4.5622 4.5622 7.6458 7.6458 7.8723 7.8723 8.0615 8.0615 8.7865 8.7865 8.8849 8.8849 k = 0.0000 0.4286-0.0000 ( 8237 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4645 -37.4645 -37.4627 -37.4627 -37.1766 -37.1766 -37.1764 -37.1764 -37.1758 -37.1758 -37.1735 -37.1735 -25.2505 -25.2505 -25.2447 -25.2447 -9.0222 -9.0222 -9.0045 -9.0045 -8.7612 -8.7612 -8.7511 -8.7511 -8.6720 -8.6720 -8.6582 -8.6582 -4.3399 -4.3399 -4.1832 -4.1832 1.9140 1.9140 1.9572 1.9572 3.5071 3.5071 3.9580 3.9580 4.3281 4.3281 4.5417 4.5417 7.6735 7.6735 7.8797 7.8797 8.1114 8.1114 8.7282 8.7282 8.8975 8.8975 k = 0.0000 0.4429-0.0000 ( 8239 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4643 -37.4643 -37.4629 -37.4629 -37.1764 -37.1764 -37.1763 -37.1763 -37.1759 -37.1759 -37.1738 -37.1738 -25.2499 -25.2499 -25.2452 -25.2452 -9.0213 -9.0213 -9.0071 -9.0071 -8.7605 -8.7605 -8.7523 -8.7523 -8.6708 -8.6708 -8.6596 -8.6596 -4.3193 -4.3193 -4.1933 -4.1933 1.9035 1.9035 1.9346 1.9346 3.5425 3.5425 3.9091 3.9091 4.3495 4.3495 4.5208 4.5208 7.7013 7.7013 7.8786 7.8786 8.1656 8.1656 8.6671 8.6671 8.9136 8.9136 k = 0.0000 0.4571-0.0000 ( 8237 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4641 -37.4641 -37.4631 -37.4631 -37.1763 -37.1763 -37.1760 -37.1760 -37.1759 -37.1759 -37.1741 -37.1741 -25.2493 -25.2493 -25.2458 -25.2458 -9.0202 -9.0202 -9.0095 -9.0095 -8.7596 -8.7596 -8.7534 -8.7534 -8.6695 -8.6695 -8.6611 -8.6611 -4.2996 -4.2996 -4.2048 -4.2048 1.8953 1.8953 1.9166 1.9166 3.5815 3.5815 3.8599 3.8599 4.3710 4.3710 4.4998 4.4998 7.7293 7.7293 7.8698 7.8698 8.2232 8.2232 8.6038 8.6038 8.9333 8.9333 k = 0.0000 0.4714-0.0000 ( 8245 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4640 -37.4640 -37.4633 -37.4633 -37.1763 -37.1763 -37.1760 -37.1760 -37.1756 -37.1756 -37.1744 -37.1744 -25.2487 -25.2487 -25.2463 -25.2463 -9.0190 -9.0190 -9.0118 -9.0118 -8.7587 -8.7587 -8.7545 -8.7545 -8.6682 -8.6682 -8.6625 -8.6625 -4.2809 -4.2809 -4.2175 -4.2175 1.8898 1.8898 1.9031 1.9031 3.6235 3.6235 3.8107 3.8107 4.3925 4.3925 4.4785 4.4785 7.7573 7.7573 7.8547 7.8547 8.2834 8.2834 8.5392 8.5392 8.9566 8.9566 k = 0.0000 0.4857-0.0000 ( 8251 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4638 -37.4638 -37.4634 -37.4634 -37.1762 -37.1762 -37.1761 -37.1761 -37.1753 -37.1753 -37.1747 -37.1747 -25.2481 -25.2481 -25.2469 -25.2469 -9.0175 -9.0175 -9.0139 -9.0139 -8.7578 -8.7578 -8.7557 -8.7557 -8.6668 -8.6668 -8.6640 -8.6640 -4.2633 -4.2633 -4.2315 -4.2315 1.8875 1.8875 1.8939 1.8939 3.6679 3.6679 3.7620 3.7620 4.4141 4.4141 4.4572 4.4572 7.7847 7.7847 7.8345 7.8345 8.3458 8.3458 8.4742 8.4742 8.9834 8.9834 k = 0.0000 0.5000-0.0000 ( 8262 PWs) bands (ev): -70.5231 -70.5231 -70.5231 -70.5231 -37.4636 -37.4636 -37.4636 -37.4636 -37.1762 -37.1762 -37.1762 -37.1762 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0158 -9.0158 -9.0158 -9.0158 -8.7567 -8.7567 -8.7567 -8.7567 -8.6654 -8.6654 -8.6654 -8.6654 -4.2468 -4.2468 -4.2468 -4.2468 1.8888 1.8888 1.8888 1.8888 3.7142 3.7142 3.7142 3.7142 4.4357 4.4357 4.4357 4.4357 7.8108 7.8108 7.8108 7.8108 8.4095 8.4095 8.4095 8.4095 9.0138 9.0138 k = 0.0000 0.5000-0.0000 ( 8262 PWs) bands (ev): -70.5231 -70.5231 -70.5231 -70.5231 -37.4636 -37.4636 -37.4636 -37.4636 -37.1762 -37.1762 -37.1762 -37.1762 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0158 -9.0158 -9.0158 -9.0158 -8.7567 -8.7567 -8.7567 -8.7567 -8.6654 -8.6654 -8.6654 -8.6654 -4.2468 -4.2468 -4.2468 -4.2468 1.8888 1.8888 1.8888 1.8888 3.7142 3.7142 3.7142 3.7142 4.4357 4.4357 4.4357 4.4357 7.8108 7.8108 7.8108 7.8108 8.4095 8.4095 8.4095 8.4095 9.0138 9.0138 k = 0.0143 0.5000-0.0000 ( 8254 PWs) bands (ev): -70.5231 -70.5231 -70.5231 -70.5231 -37.4636 -37.4636 -37.4636 -37.4636 -37.1762 -37.1762 -37.1762 -37.1762 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0161 -9.0161 -9.0154 -9.0154 -8.7589 -8.7589 -8.7546 -8.7546 -8.6673 -8.6673 -8.6637 -8.6637 -4.2466 -4.2466 -4.2466 -4.2466 1.8890 1.8890 1.8897 1.8897 3.7134 3.7134 3.7155 3.7155 4.4282 4.4282 4.4339 4.4339 7.8105 7.8105 7.8176 7.8176 8.4083 8.4083 8.4110 8.4110 8.9802 8.9802 k = 0.0286 0.5000-0.0000 ( 8246 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1763 -37.1763 -37.1763 -37.1763 -37.1749 -37.1749 -37.1749 -37.1749 -25.2475 -25.2475 -25.2475 -25.2475 -9.0164 -9.0164 -9.0149 -9.0149 -8.7611 -8.7611 -8.7525 -8.7525 -8.6693 -8.6693 -8.6621 -8.6621 -4.2460 -4.2460 -4.2460 -4.2460 1.8903 1.8903 1.8918 1.8918 3.7131 3.7131 3.7173 3.7173 4.4117 4.4117 4.4230 4.4230 7.8164 7.8164 7.8304 7.8304 8.4065 8.4065 8.4117 8.4117 8.9164 8.9164 k = 0.0429 0.5000-0.0000 ( 8254 PWs) bands (ev): -70.5231 -70.5231 -70.5231 -70.5231 -37.4636 -37.4636 -37.4636 -37.4636 -37.1765 -37.1765 -37.1764 -37.1764 -37.1748 -37.1748 -37.1747 -37.1747 -25.2474 -25.2474 -25.2474 -25.2474 -9.0165 -9.0165 -9.0143 -9.0143 -8.7633 -8.7633 -8.7505 -8.7505 -8.6714 -8.6714 -8.6607 -8.6607 -4.2451 -4.2451 -4.2450 -4.2450 1.8927 1.8927 1.8949 1.8949 3.7132 3.7132 3.7195 3.7195 4.3865 4.3865 4.4033 4.4033 7.8274 7.8274 7.8479 7.8479 8.4009 8.4009 8.4082 8.4082 8.8536 8.8536 k = 0.0571 0.5000-0.0000 ( 8236 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1767 -37.1767 -37.1766 -37.1766 -37.1746 -37.1746 -37.1745 -37.1745 -25.2474 -25.2474 -25.2474 -25.2474 -9.0166 -9.0166 -9.0137 -9.0137 -8.7655 -8.7655 -8.7485 -8.7485 -8.6736 -8.6736 -8.6594 -8.6594 -4.2437 -4.2437 -4.2437 -4.2437 1.8961 1.8961 1.8991 1.8991 3.7138 3.7138 3.7221 3.7221 4.3536 4.3536 4.3756 4.3756 7.8417 7.8417 7.8684 7.8684 8.3854 8.3854 8.3941 8.3941 8.8069 8.8069 k = 0.0714 0.5000-0.0000 ( 8244 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1769 -37.1769 -37.1768 -37.1768 -37.1744 -37.1744 -37.1743 -37.1743 -25.2474 -25.2474 -25.2474 -25.2474 -9.0167 -9.0167 -9.0130 -9.0130 -8.7677 -8.7677 -8.7466 -8.7466 -8.6760 -8.6760 -8.6583 -8.6583 -4.2420 -4.2420 -4.2420 -4.2420 1.9005 1.9005 1.9043 1.9043 3.7147 3.7147 3.7251 3.7251 4.3138 4.3138 4.3408 4.3408 7.8574 7.8574 7.8894 7.8894 8.3535 8.3535 8.3627 8.3627 8.7877 8.7877 k = 0.0857 0.5000-0.0000 ( 8248 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1770 -37.1770 -37.1770 -37.1770 -37.1742 -37.1742 -37.1741 -37.1741 -25.2473 -25.2473 -25.2473 -25.2473 -9.0166 -9.0166 -9.0123 -9.0123 -8.7699 -8.7699 -8.7448 -8.7448 -8.6784 -8.6784 -8.6574 -8.6574 -4.2399 -4.2399 -4.2399 -4.2399 1.9058 1.9058 1.9105 1.9105 3.7159 3.7159 3.7284 3.7284 4.2681 4.2681 4.2997 4.2997 7.8722 7.8722 7.9087 7.9087 8.3031 8.3031 8.3128 8.3128 8.8004 8.8004 k = 0.1000 0.5000-0.0000 ( 8242 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1772 -37.1772 -37.1771 -37.1771 -37.1740 -37.1740 -37.1740 -37.1740 -25.2472 -25.2472 -25.2472 -25.2472 -9.0165 -9.0165 -9.0115 -9.0115 -8.7721 -8.7721 -8.7430 -8.7430 -8.6809 -8.6809 -8.6566 -8.6566 -4.2375 -4.2375 -4.2375 -4.2375 1.9120 1.9120 1.9176 1.9176 3.7173 3.7173 3.7318 3.7318 4.2177 4.2177 4.2536 4.2536 7.8841 7.8841 7.9242 7.9242 8.2390 8.2390 8.2496 8.2496 8.8420 8.8420 k = 0.1143 0.5000-0.0000 ( 8238 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1774 -37.1774 -37.1773 -37.1773 -37.1738 -37.1738 -37.1737 -37.1737 -25.2472 -25.2472 -25.2472 -25.2472 -9.0163 -9.0163 -9.0107 -9.0107 -8.7742 -8.7742 -8.7413 -8.7413 -8.6834 -8.6834 -8.6560 -8.6560 -4.2348 -4.2348 -4.2348 -4.2348 1.9190 1.9190 1.9254 1.9254 3.7188 3.7188 3.7352 3.7352 4.1637 4.1637 4.2035 4.2035 7.8908 7.8908 7.9339 7.9339 8.1680 8.1680 8.1800 8.1800 8.9072 8.9072 k = 0.1286 0.5000-0.0000 ( 8238 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1776 -37.1776 -37.1775 -37.1775 -37.1736 -37.1736 -37.1736 -37.1736 -25.2471 -25.2471 -25.2471 -25.2471 -9.0161 -9.0161 -9.0098 -9.0098 -8.7763 -8.7763 -8.7398 -8.7398 -8.6860 -8.6860 -8.6555 -8.6555 -4.2317 -4.2317 -4.2317 -4.2317 1.9265 1.9265 1.9340 1.9340 3.7202 3.7202 3.7384 3.7384 4.1073 4.1073 4.1506 4.1506 7.8900 7.8900 7.9346 7.9346 8.0972 8.0972 8.1103 8.1103 8.9910 8.9910 k = 0.1429 0.5000-0.0000 ( 8234 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4636 -37.4636 -37.1778 -37.1778 -37.1777 -37.1777 -37.1734 -37.1734 -37.1734 -37.1734 -25.2470 -25.2470 -25.2470 -25.2470 -9.0158 -9.0158 -9.0090 -9.0090 -8.7783 -8.7783 -8.7383 -8.7383 -8.6886 -8.6886 -8.6551 -8.6551 -4.2284 -4.2284 -4.2284 -4.2284 1.9346 1.9346 1.9431 1.9431 3.7214 3.7214 3.7410 3.7410 4.0497 4.0497 4.0960 4.0960 7.8770 7.8770 7.9186 7.9186 8.0370 8.0370 8.0473 8.0473 9.0899 9.0899 k = 0.1571 0.5000-0.0000 ( 8226 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4636 -37.4636 -37.1780 -37.1780 -37.1779 -37.1779 -37.1732 -37.1732 -37.1732 -37.1732 -25.2469 -25.2469 -25.2469 -25.2469 -9.0155 -9.0155 -9.0082 -9.0082 -8.7802 -8.7802 -8.7370 -8.7370 -8.6911 -8.6911 -8.6550 -8.6550 -4.2248 -4.2248 -4.2248 -4.2248 1.9430 1.9430 1.9526 1.9526 3.7221 3.7221 3.7426 3.7426 3.9922 3.9922 4.0407 4.0407 7.8457 7.8457 7.8748 7.8748 7.9992 7.9992 8.0004 8.0004 9.2013 9.2013 k = 0.1714 0.5000-0.0000 ( 8216 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4636 -37.4636 -37.1782 -37.1782 -37.1781 -37.1781 -37.1730 -37.1730 -37.1730 -37.1730 -25.2468 -25.2468 -25.2468 -25.2468 -9.0152 -9.0152 -9.0073 -9.0073 -8.7820 -8.7820 -8.7358 -8.7358 -8.6936 -8.6936 -8.6549 -8.6549 -4.2210 -4.2210 -4.2210 -4.2210 1.9517 1.9517 1.9624 1.9624 3.7220 3.7220 3.7421 3.7421 3.9366 3.9366 3.9858 3.9858 7.7949 7.7949 7.8106 7.8106 7.9682 7.9682 7.9816 7.9816 9.3226 9.3226 k = 0.1857 0.5000-0.0000 ( 8216 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4636 -37.4636 -37.1783 -37.1783 -37.1783 -37.1783 -37.1729 -37.1729 -37.1728 -37.1728 -25.2467 -25.2467 -25.2467 -25.2467 -9.0148 -9.0148 -9.0066 -9.0066 -8.7836 -8.7836 -8.7348 -8.7348 -8.6960 -8.6960 -8.6550 -8.6550 -4.2170 -4.2170 -4.2169 -4.2169 1.9604 1.9604 1.9722 1.9722 3.7207 3.7207 3.7377 3.7377 3.8855 3.8855 3.9325 3.9325 7.7329 7.7329 7.7400 7.7400 7.9470 7.9470 7.9676 7.9676 9.4520 9.4520 k = 0.2000 0.5000-0.0000 ( 8220 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1785 -37.1785 -37.1784 -37.1784 -37.1727 -37.1727 -37.1726 -37.1726 -25.2466 -25.2466 -25.2466 -25.2466 -9.0144 -9.0144 -9.0058 -9.0058 -8.7852 -8.7852 -8.7341 -8.7341 -8.6981 -8.6981 -8.6553 -8.6553 -4.2128 -4.2128 -4.2127 -4.2127 1.9690 1.9690 1.9820 1.9820 3.7172 3.7172 3.7251 3.7251 3.8435 3.8435 3.8822 3.8822 7.6672 7.6672 7.6689 7.6689 7.9289 7.9289 7.9534 7.9534 9.5876 9.5876 k = 0.2143 0.5000-0.0000 ( 8212 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1787 -37.1787 -37.1786 -37.1786 -37.1725 -37.1725 -37.1724 -37.1724 -25.2465 -25.2465 -25.2465 -25.2465 -9.0140 -9.0140 -9.0051 -9.0051 -8.7865 -8.7865 -8.7336 -8.7336 -8.7000 -8.7000 -8.6556 -8.6556 -4.2084 -4.2084 -4.2084 -4.2084 1.9773 1.9773 1.9915 1.9915 3.6997 3.6997 3.7100 3.7100 3.8160 3.8160 3.8370 3.8370 7.5995 7.5995 7.6016 7.6016 7.9109 7.9109 7.9375 7.9375 9.7276 9.7276 k = 0.2286 0.5000-0.0000 ( 8212 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1788 -37.1788 -37.1788 -37.1788 -37.1723 -37.1723 -37.1723 -37.1723 -25.2464 -25.2464 -25.2464 -25.2464 -9.0136 -9.0136 -9.0045 -9.0045 -8.7877 -8.7877 -8.7334 -8.7334 -8.7017 -8.7017 -8.6561 -8.6561 -4.2039 -4.2039 -4.2039 -4.2039 1.9851 1.9851 2.0005 2.0005 3.6629 3.6629 3.6965 3.6965 3.8001 3.8001 3.8018 3.8018 7.5330 7.5330 7.5379 7.5379 7.8916 7.8916 7.9196 7.9196 9.8703 9.8703 k = 0.2429 0.5000-0.0000 ( 8220 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1790 -37.1790 -37.1789 -37.1789 -37.1722 -37.1722 -37.1721 -37.1721 -25.2463 -25.2463 -25.2463 -25.2463 -9.0132 -9.0132 -9.0040 -9.0040 -8.7887 -8.7887 -8.7337 -8.7337 -8.7029 -8.7029 -8.6568 -8.6568 -4.1994 -4.1994 -4.1994 -4.1994 1.9923 1.9923 2.0088 2.0088 3.6216 3.6216 3.6741 3.6741 3.7742 3.7742 3.7946 3.7946 7.4698 7.4698 7.4771 7.4771 7.8708 7.8708 7.8995 7.8995 10.0138 10.0138 k = 0.2571 0.5000-0.0000 ( 8206 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1791 -37.1791 -37.1791 -37.1791 -37.1720 -37.1720 -37.1720 -37.1720 -25.2462 -25.2462 -25.2462 -25.2462 -9.0128 -9.0128 -9.0035 -9.0035 -8.7895 -8.7895 -8.7343 -8.7343 -8.7037 -8.7037 -8.6575 -8.6575 -4.1948 -4.1948 -4.1948 -4.1948 1.9987 1.9987 2.0162 2.0162 3.5805 3.5805 3.6449 3.6449 3.7578 3.7578 3.7900 3.7900 7.4103 7.4103 7.4198 7.4198 7.8482 7.8482 7.8774 7.8774 10.1557 10.1557 k = 0.2714 0.5000-0.0000 ( 8222 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1793 -37.1793 -37.1792 -37.1792 -37.1719 -37.1719 -37.1718 -37.1718 -25.2461 -25.2461 -25.2461 -25.2461 -9.0124 -9.0124 -9.0031 -9.0031 -8.7900 -8.7900 -8.7353 -8.7353 -8.7041 -8.7041 -8.6584 -8.6584 -4.1902 -4.1902 -4.1902 -4.1902 2.0042 2.0042 2.0225 2.0225 3.5419 3.5419 3.6135 3.6135 3.7464 3.7464 3.7860 3.7860 7.3549 7.3549 7.3662 7.3662 7.8241 7.8241 7.8535 7.8535 10.2932 10.2932 k = 0.2857 0.5000-0.0000 ( 8218 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1794 -37.1794 -37.1794 -37.1794 -37.1717 -37.1717 -37.1717 -37.1717 -25.2460 -25.2460 -25.2460 -25.2460 -9.0120 -9.0120 -9.0028 -9.0028 -8.7904 -8.7904 -8.7367 -8.7367 -8.7042 -8.7042 -8.6593 -8.6593 -4.1856 -4.1856 -4.1856 -4.1856 2.0087 2.0087 2.0277 2.0277 3.5068 3.5068 3.5832 3.5832 3.7369 3.7369 3.7816 3.7816 7.3037 7.3037 7.3166 7.3166 7.7985 7.7985 7.8280 7.8280 10.4226 10.4226 k = 0.3000 0.5000-0.0000 ( 8230 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1796 -37.1796 -37.1795 -37.1795 -37.1716 -37.1716 -37.1716 -37.1716 -25.2459 -25.2459 -25.2459 -25.2459 -9.0117 -9.0117 -9.0027 -9.0027 -8.7905 -8.7905 -8.7385 -8.7385 -8.7038 -8.7038 -8.6604 -8.6604 -4.1812 -4.1812 -4.1811 -4.1811 2.0120 2.0120 2.0315 2.0315 3.4760 3.4760 3.5558 3.5558 3.7276 3.7276 3.7763 3.7763 7.2570 7.2570 7.2713 7.2713 7.7718 7.7718 7.8011 7.8011 10.5390 10.5390 k = 0.3143 0.5000-0.0000 ( 8238 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4637 -37.4637 -37.1797 -37.1797 -37.1796 -37.1796 -37.1715 -37.1715 -37.1715 -37.1715 -25.2458 -25.2458 -25.2458 -25.2458 -9.0113 -9.0113 -9.0026 -9.0026 -8.7904 -8.7904 -8.7405 -8.7405 -8.7031 -8.7031 -8.6616 -8.6616 -4.1768 -4.1768 -4.1767 -4.1767 2.0142 2.0142 2.0340 2.0340 3.4498 3.4498 3.5323 3.5323 3.7178 3.7178 3.7699 3.7699 7.2147 7.2147 7.2302 7.2302 7.7441 7.7441 7.7732 7.7732 10.6367 10.6367 k = 0.3286 0.5000-0.0000 ( 8214 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1798 -37.1798 -37.1797 -37.1797 -37.1714 -37.1714 -37.1713 -37.1713 -25.2457 -25.2457 -25.2457 -25.2457 -9.0110 -9.0110 -9.0026 -9.0026 -8.7901 -8.7901 -8.7426 -8.7426 -8.7022 -8.7022 -8.6628 -8.6628 -4.1725 -4.1725 -4.1725 -4.1725 2.0153 2.0153 2.0350 2.0350 3.4284 3.4284 3.5128 3.5128 3.7071 3.7071 3.7622 3.7622 7.1769 7.1769 7.1934 7.1934 7.7159 7.7159 7.7445 7.7445 10.7116 10.7116 k = 0.3429 0.5000-0.0000 ( 8202 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1799 -37.1799 -37.1798 -37.1798 -37.1712 -37.1712 -37.1712 -37.1712 -25.2456 -25.2456 -25.2456 -25.2456 -9.0107 -9.0107 -9.0027 -9.0027 -8.7896 -8.7896 -8.7449 -8.7449 -8.7011 -8.7011 -8.6642 -8.6642 -4.1685 -4.1685 -4.1684 -4.1684 2.0154 2.0154 2.0348 2.0348 3.4119 3.4119 3.4977 3.4977 3.6952 3.6952 3.7531 3.7531 7.1437 7.1437 7.1609 7.1609 7.6874 7.6874 7.7153 7.7153 10.7644 10.7644 k = 0.3571 0.5000-0.0000 ( 8204 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4637 -37.4637 -37.1800 -37.1800 -37.1799 -37.1799 -37.1711 -37.1711 -37.1711 -37.1711 -25.2455 -25.2455 -25.2455 -25.2455 -9.0103 -9.0103 -9.0029 -9.0029 -8.7888 -8.7888 -8.7473 -8.7473 -8.6999 -8.6999 -8.6656 -8.6656 -4.1646 -4.1646 -4.1646 -4.1646 2.0145 2.0145 2.0333 2.0333 3.4002 3.4002 3.4869 3.4869 3.6821 3.6821 3.7425 3.7425 7.1149 7.1149 7.1326 7.1326 7.6591 7.6591 7.6862 7.6862 10.7999 10.7999 k = 0.3714 0.5000-0.0000 ( 8204 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4637 -37.4637 -37.1801 -37.1801 -37.1800 -37.1800 -37.1711 -37.1711 -37.1710 -37.1710 -25.2454 -25.2454 -25.2454 -25.2454 -9.0100 -9.0100 -9.0031 -9.0031 -8.7878 -8.7878 -8.7498 -8.7498 -8.6985 -8.6985 -8.6671 -8.6671 -4.1610 -4.1610 -4.1610 -4.1610 2.0129 2.0129 2.0308 2.0308 3.3932 3.3932 3.4802 3.4802 3.6679 3.6679 3.7306 3.7306 7.0905 7.0905 7.1082 7.1082 7.6315 7.6315 7.6574 7.6574 10.8235 10.8235 k = 0.3857 0.5000-0.0000 ( 8204 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1801 -37.1801 -37.1801 -37.1801 -37.1710 -37.1710 -37.1709 -37.1709 -25.2453 -25.2453 -25.2453 -25.2453 -9.0097 -9.0097 -9.0034 -9.0034 -8.7867 -8.7867 -8.7523 -8.7523 -8.6970 -8.6970 -8.6687 -8.6687 -4.1577 -4.1577 -4.1577 -4.1577 2.0108 2.0108 2.0274 2.0274 3.3904 3.3904 3.4772 3.4772 3.6526 3.6526 3.7172 3.7172 7.0702 7.0702 7.0877 7.0877 7.6049 7.6049 7.6295 7.6295 10.8394 10.8394 k = 0.4000 0.5000-0.0000 ( 8206 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1802 -37.1802 -37.1802 -37.1802 -37.1709 -37.1709 -37.1709 -37.1709 -25.2453 -25.2453 -25.2453 -25.2453 -9.0094 -9.0094 -9.0038 -9.0038 -8.7854 -8.7854 -8.7549 -8.7549 -8.6954 -8.6954 -8.6703 -8.6703 -4.1547 -4.1547 -4.1547 -4.1547 2.0084 2.0084 2.0235 2.0235 3.3917 3.3917 3.4777 3.4777 3.6365 3.6365 3.7026 3.7026 7.0537 7.0537 7.0706 7.0706 7.5800 7.5800 7.6028 7.6028 10.8503 10.8503 k = 0.4143 0.5000-0.0000 ( 8210 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1803 -37.1803 -37.1802 -37.1802 -37.1708 -37.1708 -37.1708 -37.1708 -25.2452 -25.2452 -25.2452 -25.2452 -9.0091 -9.0091 -9.0042 -9.0042 -8.7838 -8.7838 -8.7574 -8.7574 -8.6938 -8.6938 -8.6720 -8.6720 -4.1521 -4.1521 -4.1520 -4.1520 2.0059 2.0059 2.0193 2.0193 3.3967 3.3967 3.4810 3.4810 3.6199 3.6199 3.6870 3.6870 7.0409 7.0409 7.0567 7.0567 7.5572 7.5572 7.5779 7.5779 10.8580 10.8580 k = 0.4286 0.5000-0.0000 ( 8198 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1803 -37.1803 -37.1803 -37.1803 -37.1708 -37.1708 -37.1707 -37.1707 -25.2452 -25.2452 -25.2452 -25.2452 -9.0087 -9.0087 -9.0046 -9.0046 -8.7822 -8.7822 -8.7599 -8.7599 -8.6920 -8.6920 -8.6738 -8.6738 -4.1498 -4.1498 -4.1497 -4.1497 2.0035 2.0035 2.0150 2.0150 3.4048 3.4048 3.4863 3.4863 3.6035 3.6035 3.6704 3.6704 7.0313 7.0313 7.0455 7.0455 7.5371 7.5371 7.5552 7.5552 10.8633 10.8633 k = 0.4429 0.5000-0.0000 ( 8198 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1803 -37.1803 -37.1707 -37.1707 -37.1707 -37.1707 -25.2451 -25.2451 -25.2451 -25.2451 -9.0084 -9.0084 -9.0050 -9.0050 -8.7804 -8.7804 -8.7624 -8.7624 -8.6903 -8.6903 -8.6756 -8.6756 -4.1479 -4.1479 -4.1478 -4.1478 2.0015 2.0015 2.0108 2.0108 3.4156 3.4156 3.4923 3.4923 3.5884 3.5884 3.6533 3.6533 7.0246 7.0246 7.0367 7.0367 7.5201 7.5201 7.5353 7.5353 10.8672 10.8672 k = 0.4571 0.5000-0.0000 ( 8182 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1707 -37.1707 -37.1706 -37.1706 -25.2451 -25.2451 -25.2451 -25.2451 -9.0080 -9.0080 -9.0055 -9.0055 -8.7784 -8.7784 -8.7649 -8.7649 -8.6885 -8.6885 -8.6774 -8.6774 -4.1464 -4.1464 -4.1463 -4.1463 2.0000 2.0000 2.0071 2.0071 3.4286 3.4286 3.4965 3.4965 3.5770 3.5770 3.6359 3.6359 7.0204 7.0204 7.0300 7.0300 7.5069 7.5069 7.5187 7.5187 10.8699 10.8699 k = 0.4714 0.5000-0.0000 ( 8170 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2451 -25.2451 -25.2451 -25.2451 -9.0076 -9.0076 -9.0059 -9.0059 -8.7764 -8.7764 -8.7673 -8.7673 -8.6866 -8.6866 -8.6792 -8.6792 -4.1453 -4.1453 -4.1453 -4.1453 1.9992 1.9992 2.0040 2.0040 3.4433 3.4433 3.4954 3.4954 3.5726 3.5726 3.6188 3.6188 7.0182 7.0182 7.0249 7.0249 7.4977 7.4977 7.5058 7.5058 10.8718 10.8718 k = 0.4857 0.5000-0.0000 ( 8148 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0072 -9.0072 -9.0064 -9.0064 -8.7742 -8.7742 -8.7697 -8.7697 -8.6848 -8.6848 -8.6811 -8.6811 -4.1446 -4.1446 -4.1446 -4.1446 1.9991 1.9991 2.0015 2.0015 3.4587 3.4587 3.4871 3.4871 3.5770 3.5770 3.6024 3.6024 7.0178 7.0178 7.0212 7.0212 7.4929 7.4929 7.4971 7.4971 10.8732 10.8736 k = 0.5000 0.5000-0.0000 ( 8140 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7720 -8.7720 -8.7720 -8.7720 -8.6829 -8.6829 -8.6829 -8.6829 -4.1444 -4.1444 -4.1444 -4.1444 1.9999 1.9999 1.9999 1.9999 3.4739 3.4739 3.4739 3.4739 3.5879 3.5879 3.5879 3.5879 7.0189 7.0189 7.0189 7.0189 7.4927 7.4927 7.4927 7.4927 10.8736 10.8736 k = 0.5000 0.5000-0.0000 ( 8140 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7720 -8.7720 -8.7720 -8.7720 -8.6829 -8.6829 -8.6829 -8.6829 -4.1444 -4.1444 -4.1444 -4.1444 1.9999 1.9999 1.9999 1.9999 3.4739 3.4739 3.4739 3.4739 3.5879 3.5879 3.5879 3.5879 7.0189 7.0189 7.0189 7.0189 7.4927 7.4927 7.4927 7.4927 10.8736 10.8736 k = 0.4898 0.4898-0.0000 ( 8150 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2451 -25.2451 -25.2450 -25.2450 -9.0072 -9.0072 -9.0064 -9.0064 -8.7743 -8.7743 -8.7697 -8.7697 -8.6848 -8.6848 -8.6810 -8.6810 -4.1450 -4.1450 -4.1442 -4.1442 1.9989 1.9989 2.0018 2.0018 3.4581 3.4581 3.4878 3.4878 3.5766 3.5766 3.6028 3.6028 7.0162 7.0162 7.0228 7.0228 7.4924 7.4924 7.4977 7.4977 10.8724 10.8743 k = 0.4796 0.4796-0.0000 ( 8172 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4637 -37.4637 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2451 -25.2451 -25.2450 -25.2450 -9.0076 -9.0076 -9.0059 -9.0059 -8.7764 -8.7764 -8.7673 -8.7673 -8.6867 -8.6867 -8.6792 -8.6792 -4.1468 -4.1468 -4.1437 -4.1437 1.9978 1.9978 2.0055 2.0055 3.4401 3.4401 3.5002 3.5002 3.5691 3.5691 3.6206 3.6206 7.0102 7.0102 7.0332 7.0332 7.4943 7.4943 7.5094 7.5094 10.8690 10.8690 k = 0.4694 0.4694-0.0000 ( 8190 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4637 -37.4637 -37.1804 -37.1804 -37.1803 -37.1803 -37.1707 -37.1707 -37.1706 -37.1706 -25.2452 -25.2452 -25.2450 -25.2450 -9.0080 -9.0080 -9.0054 -9.0054 -8.7785 -8.7785 -8.7648 -8.7648 -8.6885 -8.6885 -8.6773 -8.6773 -4.1499 -4.1499 -4.1429 -4.1429 1.9963 1.9963 2.0115 2.0115 3.4200 3.4200 3.5118 3.5118 3.5655 3.5655 3.6406 3.6406 7.0014 7.0014 7.0503 7.0503 7.4978 7.4978 7.5276 7.5276 10.8634 10.8634 k = 0.4592 0.4592-0.0000 ( 8202 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4639 -37.4639 -37.4637 -37.4637 -37.1804 -37.1804 -37.1803 -37.1803 -37.1708 -37.1708 -37.1706 -37.1706 -25.2453 -25.2453 -25.2449 -25.2449 -9.0084 -9.0084 -9.0049 -9.0049 -8.7804 -8.7804 -8.7624 -8.7624 -8.6903 -8.6903 -8.6755 -8.6755 -4.1541 -4.1541 -4.1418 -4.1418 1.9943 1.9943 2.0198 2.0198 3.3980 3.3980 3.5231 3.5231 3.5655 3.5655 3.6624 3.6624 6.9910 6.9910 7.0738 7.0738 7.5028 7.5028 7.5514 7.5514 10.8558 10.8558 k = 0.4490 0.4490-0.0000 ( 8198 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4639 -37.4639 -37.4637 -37.4637 -37.1804 -37.1804 -37.1802 -37.1802 -37.1709 -37.1709 -37.1706 -37.1706 -25.2455 -25.2455 -25.2448 -25.2448 -9.0088 -9.0088 -9.0044 -9.0044 -8.7822 -8.7822 -8.7599 -8.7599 -8.6921 -8.6921 -8.6737 -8.6737 -4.1596 -4.1596 -4.1405 -4.1405 1.9922 1.9922 2.0304 2.0304 3.3748 3.3748 3.5343 3.5343 3.5684 3.5684 3.6854 3.6854 6.9804 6.9804 7.1034 7.1034 7.5092 7.5092 7.5797 7.5797 10.8462 10.8462 k = 0.4388 0.4388-0.0000 ( 8190 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4639 -37.4639 -37.4636 -37.4636 -37.1804 -37.1804 -37.1801 -37.1801 -37.1710 -37.1710 -37.1706 -37.1706 -25.2457 -25.2457 -25.2447 -25.2447 -9.0091 -9.0091 -9.0039 -9.0039 -8.7839 -8.7839 -8.7575 -8.7575 -8.6938 -8.6938 -8.6719 -8.6719 -4.1663 -4.1663 -4.1389 -4.1389 1.9899 1.9899 2.0435 2.0435 3.3506 3.3506 3.5456 3.5456 3.5739 3.5739 3.7096 3.7096 6.9710 6.9710 7.1386 7.1386 7.5171 7.5171 7.6114 7.6114 10.8347 10.8347 k = 0.4286 0.4286-0.0000 ( 8194 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4640 -37.4640 -37.4636 -37.4636 -37.1804 -37.1804 -37.1800 -37.1800 -37.1711 -37.1711 -37.1706 -37.1706 -25.2459 -25.2459 -25.2446 -25.2446 -9.0095 -9.0095 -9.0033 -9.0033 -8.7854 -8.7854 -8.7550 -8.7550 -8.6954 -8.6954 -8.6701 -8.6701 -4.1741 -4.1741 -4.1371 -4.1371 1.9876 1.9876 2.0588 2.0588 3.3260 3.3260 3.5572 3.5572 3.5813 3.5813 3.7348 3.7348 6.9639 6.9639 7.1789 7.1789 7.5264 7.5264 7.6457 7.6457 10.8213 10.8213 k = 0.4184 0.4184-0.0000 ( 8199 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4640 -37.4640 -37.4635 -37.4635 -37.1804 -37.1804 -37.1799 -37.1799 -37.1712 -37.1712 -37.1706 -37.1706 -25.2462 -25.2462 -25.2445 -25.2445 -9.0098 -9.0098 -9.0027 -9.0027 -8.7867 -8.7867 -8.7527 -8.7527 -8.6969 -8.6969 -8.6684 -8.6684 -4.1832 -4.1832 -4.1351 -4.1351 1.9857 1.9857 2.0765 2.0765 3.3013 3.3013 3.5688 3.5688 3.5903 3.5903 3.7611 3.7611 6.9602 6.9602 7.2236 7.2236 7.5373 7.5373 7.6820 7.6820 10.8058 10.8058 k = 0.4082 0.4082-0.0000 ( 8195 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4641 -37.4641 -37.4634 -37.4634 -37.1804 -37.1804 -37.1797 -37.1797 -37.1714 -37.1714 -37.1706 -37.1706 -25.2465 -25.2465 -25.2444 -25.2444 -9.0101 -9.0101 -9.0020 -9.0020 -8.7878 -8.7878 -8.7504 -8.7504 -8.6983 -8.6983 -8.6668 -8.6668 -4.1933 -4.1933 -4.1330 -4.1330 1.9841 1.9841 2.0965 2.0965 3.2768 3.2768 3.5798 3.5798 3.6013 3.6013 3.7883 3.7883 6.9608 6.9608 7.2721 7.2721 7.5497 7.5497 7.7198 7.7198 10.7881 10.7881 k = 0.3980 0.3980-0.0000 ( 8195 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4642 -37.4642 -37.4633 -37.4633 -37.1803 -37.1803 -37.1796 -37.1796 -37.1716 -37.1716 -37.1706 -37.1706 -25.2468 -25.2468 -25.2442 -25.2442 -9.0105 -9.0105 -9.0013 -9.0013 -8.7887 -8.7887 -8.7483 -8.7483 -8.6995 -8.6995 -8.6652 -8.6652 -4.2047 -4.2047 -4.1309 -4.1309 1.9831 1.9831 2.1188 2.1188 3.2529 3.2529 3.5894 3.5894 3.6147 3.6147 3.8165 3.8165 6.9663 6.9663 7.3236 7.3236 7.5636 7.5636 7.7587 7.7587 10.7679 10.7679 k = 0.3878 0.3878-0.0000 ( 8199 PWs) bands (ev): -70.5231 -70.5231 -70.5229 -70.5229 -37.4642 -37.4642 -37.4632 -37.4632 -37.1803 -37.1803 -37.1794 -37.1794 -37.1718 -37.1718 -37.1706 -37.1706 -25.2472 -25.2472 -25.2441 -25.2441 -9.0108 -9.0108 -9.0005 -9.0005 -8.7895 -8.7895 -8.7463 -8.7463 -8.7006 -8.7006 -8.6636 -8.6636 -4.2171 -4.2171 -4.1287 -4.1287 1.9828 1.9828 2.1434 2.1434 3.2298 3.2298 3.5969 3.5969 3.6308 3.6308 3.8456 3.8456 6.9773 6.9773 7.3774 7.3774 7.5791 7.5791 7.7985 7.7985 10.7447 10.7447 k = 0.3776 0.3776-0.0000 ( 8201 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4643 -37.4643 -37.4631 -37.4631 -37.1803 -37.1803 -37.1792 -37.1792 -37.1720 -37.1720 -37.1706 -37.1706 -25.2476 -25.2476 -25.2439 -25.2439 -9.0111 -9.0111 -8.9996 -8.9996 -8.7900 -8.7900 -8.7445 -8.7445 -8.7014 -8.7014 -8.6621 -8.6621 -4.2306 -4.2306 -4.1266 -4.1266 1.9834 1.9834 2.1703 2.1703 3.2079 3.2079 3.6023 3.6023 3.6493 3.6493 3.8758 3.8758 6.9941 6.9941 7.4326 7.4326 7.5961 7.5961 7.8389 7.8389 10.7183 10.7183 k = 0.3673 0.3673-0.0000 ( 8203 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4644 -37.4644 -37.4630 -37.4630 -37.1803 -37.1803 -37.1791 -37.1791 -37.1722 -37.1722 -37.1706 -37.1706 -25.2480 -25.2480 -25.2437 -25.2437 -9.0115 -9.0115 -8.9987 -8.9987 -8.7903 -8.7903 -8.7430 -8.7430 -8.7019 -8.7019 -8.6607 -8.6607 -4.2452 -4.2452 -4.1246 -4.1246 1.9848 1.9848 2.1994 2.1994 3.1875 3.1875 3.6059 3.6059 3.6700 3.6700 3.9068 3.9068 7.0170 7.0170 7.4885 7.4885 7.6149 7.6149 7.8799 7.8799 10.6882 10.6882 k = 0.3571 0.3571-0.0000 ( 8211 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4645 -37.4645 -37.4630 -37.4630 -37.1803 -37.1803 -37.1789 -37.1789 -37.1724 -37.1724 -37.1706 -37.1706 -25.2484 -25.2484 -25.2435 -25.2435 -9.0119 -9.0119 -8.9976 -8.9976 -8.7904 -8.7904 -8.7417 -8.7417 -8.7022 -8.7022 -8.6593 -8.6593 -4.2608 -4.2608 -4.1227 -4.1227 1.9871 1.9871 2.2308 2.2308 3.1687 3.1687 3.6078 3.6078 3.6926 3.6926 3.9387 3.9387 7.0461 7.0461 7.5443 7.5443 7.6353 7.6353 7.9213 7.9213 10.6542 10.6542 k = 0.3469 0.3469-0.0000 ( 8211 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4646 -37.4646 -37.4628 -37.4628 -37.1802 -37.1802 -37.1787 -37.1787 -37.1727 -37.1727 -37.1706 -37.1706 -25.2489 -25.2489 -25.2433 -25.2433 -9.0123 -9.0123 -8.9964 -8.9964 -8.7903 -8.7903 -8.7406 -8.7406 -8.7021 -8.7021 -8.6580 -8.6580 -4.2774 -4.2774 -4.1210 -4.1210 1.9903 1.9903 2.2644 2.2644 3.1520 3.1520 3.6083 3.6083 3.7170 3.7170 3.9715 3.9715 7.0812 7.0812 7.5990 7.5990 7.6577 7.6577 7.9632 7.9632 10.6160 10.6160 k = 0.3367 0.3367-0.0000 ( 8227 PWs) bands (ev): -70.5232 -70.5232 -70.5228 -70.5228 -37.4647 -37.4647 -37.4628 -37.4628 -37.1802 -37.1802 -37.1785 -37.1785 -37.1729 -37.1729 -37.1706 -37.1706 -25.2494 -25.2494 -25.2431 -25.2431 -9.0127 -9.0127 -8.9951 -8.9951 -8.7900 -8.7900 -8.7399 -8.7399 -8.7018 -8.7018 -8.6567 -8.6567 -4.2948 -4.2948 -4.1196 -4.1196 1.9942 1.9942 2.3001 2.3001 3.1373 3.1373 3.6075 3.6075 3.7431 3.7431 4.0050 4.0050 7.1218 7.1218 7.6514 7.6514 7.6824 7.6824 8.0055 8.0055 10.5421 10.5421 k = 0.3265 0.3265-0.0000 ( 8227 PWs) bands (ev): -70.5233 -70.5233 -70.5228 -70.5228 -37.4648 -37.4648 -37.4626 -37.4626 -37.1802 -37.1802 -37.1782 -37.1782 -37.1732 -37.1732 -37.1706 -37.1706 -25.2499 -25.2499 -25.2428 -25.2428 -9.0132 -9.0132 -8.9936 -8.9936 -8.7894 -8.7894 -8.7395 -8.7395 -8.7011 -8.7011 -8.6555 -8.6555 -4.3132 -4.3132 -4.1185 -4.1185 1.9989 1.9989 2.3380 2.3380 3.1251 3.1251 3.6060 3.6060 3.7710 3.7710 4.0391 4.0391 7.1676 7.1676 7.6972 7.6972 7.7133 7.7133 8.0485 8.0485 10.4065 10.4065 k = 0.3163 0.3163-0.0000 ( 8225 PWs) bands (ev): -70.5233 -70.5233 -70.5228 -70.5228 -37.4649 -37.4649 -37.4625 -37.4625 -37.1802 -37.1802 -37.1780 -37.1780 -37.1734 -37.1734 -37.1706 -37.1706 -25.2504 -25.2504 -25.2426 -25.2426 -9.0136 -9.0136 -8.9921 -8.9921 -8.7887 -8.7887 -8.7393 -8.7393 -8.7001 -8.7001 -8.6544 -8.6544 -4.3324 -4.3324 -4.1177 -4.1177 2.0041 2.0041 2.3780 2.3780 3.1155 3.1155 3.6040 3.6040 3.8004 3.8004 4.0738 4.0738 7.2176 7.2176 7.7297 7.7297 7.7565 7.7565 8.0923 8.0923 10.2637 10.2637 k = 0.3061 0.3061-0.0000 ( 8237 PWs) bands (ev): -70.5233 -70.5233 -70.5228 -70.5228 -37.4650 -37.4650 -37.4624 -37.4624 -37.1802 -37.1802 -37.1778 -37.1778 -37.1737 -37.1737 -37.1706 -37.1706 -25.2509 -25.2509 -25.2424 -25.2424 -9.0141 -9.0141 -8.9904 -8.9904 -8.7878 -8.7878 -8.7393 -8.7393 -8.6988 -8.6988 -8.6533 -8.6533 -4.3523 -4.3523 -4.1172 -4.1172 2.0095 2.0095 2.4201 2.4201 3.1086 3.1086 3.6022 3.6022 3.8315 3.8315 4.1088 4.1088 7.2707 7.2707 7.7595 7.7595 7.8012 7.8012 8.1373 8.1373 10.1170 10.1170 k = 0.2959 0.2959-0.0000 ( 8233 PWs) bands (ev): -70.5233 -70.5233 -70.5227 -70.5227 -37.4651 -37.4651 -37.4623 -37.4623 -37.1802 -37.1802 -37.1776 -37.1776 -37.1739 -37.1739 -37.1706 -37.1706 -25.2515 -25.2515 -25.2421 -25.2421 -9.0146 -9.0146 -8.9885 -8.9885 -8.7867 -8.7867 -8.7395 -8.7395 -8.6973 -8.6973 -8.6523 -8.6523 -4.3728 -4.3728 -4.1172 -4.1172 2.0151 2.0151 2.4642 2.4642 3.1046 3.1046 3.6011 3.6011 3.8640 3.8640 4.1441 4.1441 7.3255 7.3255 7.7903 7.7903 7.8431 7.8431 8.1840 8.1840 9.9684 9.9684 k = 0.2857 0.2857-0.0000 ( 8241 PWs) bands (ev): -70.5234 -70.5234 -70.5227 -70.5227 -37.4652 -37.4652 -37.4621 -37.4621 -37.1801 -37.1801 -37.1774 -37.1774 -37.1742 -37.1742 -37.1705 -37.1705 -25.2520 -25.2520 -25.2419 -25.2419 -9.0151 -9.0151 -8.9866 -8.9866 -8.7854 -8.7854 -8.7399 -8.7399 -8.6957 -8.6957 -8.6513 -8.6513 -4.3940 -4.3940 -4.1176 -4.1176 2.0205 2.0205 2.5103 2.5103 3.1036 3.1036 3.6013 3.6013 3.8980 3.8980 4.1794 4.1794 7.3801 7.3801 7.8225 7.8225 7.8818 7.8818 8.2334 8.2334 9.8196 9.8196 k = 0.2755 0.2755-0.0000 ( 8237 PWs) bands (ev): -70.5234 -70.5234 -70.5227 -70.5227 -37.4653 -37.4653 -37.4620 -37.4620 -37.1801 -37.1801 -37.1772 -37.1772 -37.1745 -37.1745 -37.1705 -37.1705 -25.2526 -25.2526 -25.2416 -25.2416 -9.0155 -9.0155 -8.9845 -8.9845 -8.7840 -8.7840 -8.7404 -8.7404 -8.6939 -8.6939 -8.6504 -8.6504 -4.4157 -4.4157 -4.1184 -4.1184 2.0253 2.0253 2.5583 2.5583 3.1057 3.1057 3.6035 3.6035 3.9334 3.9334 4.2146 4.2146 7.4324 7.4324 7.8563 7.8563 7.9169 7.9169 8.2864 8.2864 9.6720 9.6720 k = 0.2653 0.2653-0.0000 ( 8235 PWs) bands (ev): -70.5234 -70.5234 -70.5227 -70.5227 -37.4655 -37.4655 -37.4619 -37.4619 -37.1801 -37.1801 -37.1769 -37.1769 -37.1747 -37.1747 -37.1704 -37.1704 -25.2532 -25.2532 -25.2414 -25.2414 -9.0160 -9.0160 -8.9823 -8.9823 -8.7824 -8.7824 -8.7409 -8.7409 -8.6920 -8.6920 -8.6496 -8.6496 -4.4379 -4.4379 -4.1197 -4.1197 2.0294 2.0294 2.6081 2.6081 3.1110 3.1110 3.6083 3.6083 3.9700 3.9700 4.2494 4.2494 7.4798 7.4798 7.8915 7.8915 7.9484 7.9484 8.3443 8.3443 9.5268 9.5268 k = 0.2551 0.2551-0.0000 ( 8241 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4656 -37.4656 -37.4618 -37.4618 -37.1801 -37.1801 -37.1767 -37.1767 -37.1749 -37.1749 -37.1704 -37.1704 -25.2537 -25.2537 -25.2411 -25.2411 -9.0164 -9.0164 -8.9801 -8.9801 -8.7807 -8.7807 -8.7414 -8.7414 -8.6901 -8.6901 -8.6488 -8.6488 -4.4603 -4.4603 -4.1215 -4.1215 2.0324 2.0324 2.6596 2.6596 3.1196 3.1196 3.6164 3.6164 4.0079 4.0079 4.2838 4.2838 7.5198 7.5198 7.9279 7.9279 7.9763 7.9763 8.4085 8.4085 9.3852 9.3852 k = 0.2449 0.2449-0.0000 ( 8249 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4657 -37.4657 -37.4616 -37.4616 -37.1802 -37.1802 -37.1766 -37.1766 -37.1752 -37.1752 -37.1703 -37.1703 -25.2543 -25.2543 -25.2409 -25.2409 -9.0168 -9.0168 -8.9777 -8.9777 -8.7790 -8.7790 -8.7420 -8.7420 -8.6881 -8.6881 -8.6480 -8.6480 -4.4831 -4.4831 -4.1236 -4.1236 2.0340 2.0340 2.7129 2.7129 3.1315 3.1315 3.6282 3.6282 4.0469 4.0469 4.3174 4.3174 7.5499 7.5499 7.9648 7.9648 8.0006 8.0006 8.4804 8.4804 9.2485 9.2485 k = 0.2347 0.2347-0.0000 ( 8239 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4658 -37.4658 -37.4615 -37.4615 -37.1802 -37.1802 -37.1763 -37.1763 -37.1754 -37.1754 -37.1703 -37.1703 -25.2549 -25.2549 -25.2406 -25.2406 -9.0171 -9.0171 -8.9752 -8.9752 -8.7772 -8.7772 -8.7424 -8.7424 -8.6861 -8.6861 -8.6472 -8.6472 -4.5059 -4.5059 -4.1262 -4.1262 2.0341 2.0341 2.7677 2.7677 3.1466 3.1466 3.6443 3.6443 4.0870 4.0870 4.3500 4.3500 7.5681 7.5681 7.9993 7.9993 8.0233 8.0233 8.5607 8.5607 9.1186 9.1186 k = 0.2245 0.2245-0.0000 ( 8247 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4659 -37.4659 -37.4614 -37.4614 -37.1802 -37.1802 -37.1762 -37.1762 -37.1757 -37.1757 -37.1702 -37.1702 -25.2555 -25.2555 -25.2403 -25.2403 -9.0174 -9.0174 -8.9727 -8.9727 -8.7755 -8.7755 -8.7428 -8.7428 -8.6842 -8.6842 -8.6464 -8.6464 -4.5289 -4.5289 -4.1293 -4.1293 2.0324 2.0324 2.8240 2.8240 3.1651 3.1651 3.6652 3.6652 4.1278 4.1278 4.3815 4.3815 7.5732 7.5732 8.0211 8.0211 8.0527 8.0527 8.6498 8.6498 8.9979 8.9979 k = 0.2143 0.2143-0.0000 ( 8239 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4661 -37.4661 -37.4612 -37.4612 -37.1803 -37.1803 -37.1760 -37.1760 -37.1759 -37.1759 -37.1701 -37.1701 -25.2560 -25.2560 -25.2401 -25.2401 -9.0177 -9.0177 -8.9701 -8.9701 -8.7738 -8.7738 -8.7431 -8.7431 -8.6824 -8.6824 -8.6455 -8.6455 -4.5518 -4.5518 -4.1327 -4.1327 2.0289 2.0289 2.8815 2.8815 3.1869 3.1869 3.6910 3.6910 4.1694 4.1694 4.4117 4.4117 7.5646 7.5646 8.0268 8.0268 8.0888 8.0888 8.7464 8.7464 8.8900 8.8900 k = 0.2041 0.2041-0.0000 ( 8237 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4662 -37.4662 -37.4611 -37.4611 -37.1803 -37.1803 -37.1761 -37.1761 -37.1758 -37.1758 -37.1700 -37.1700 -25.2566 -25.2566 -25.2398 -25.2398 -9.0179 -9.0179 -8.9675 -8.9675 -8.7722 -8.7722 -8.7431 -8.7431 -8.6807 -8.6807 -8.6446 -8.6446 -4.5745 -4.5745 -4.1364 -4.1364 2.0236 2.0236 2.9402 2.9402 3.2119 3.2119 3.7220 3.7220 4.2115 4.2115 4.4404 4.4404 7.5425 7.5425 8.0187 8.0187 8.1237 8.1237 8.7948 8.7948 8.8237 8.8237 k = 0.1939 0.1939-0.0000 ( 8241 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4663 -37.4663 -37.4610 -37.4610 -37.1804 -37.1804 -37.1763 -37.1763 -37.1757 -37.1757 -37.1699 -37.1699 -25.2571 -25.2571 -25.2396 -25.2396 -9.0180 -9.0180 -8.9648 -8.9648 -8.7708 -8.7708 -8.7430 -8.7430 -8.6792 -8.6792 -8.6436 -8.6436 -4.5970 -4.5970 -4.1405 -4.1405 2.0165 2.0165 2.9999 2.9999 3.2401 3.2401 3.7582 3.7582 4.2538 4.2538 4.4674 4.4674 7.5078 7.5078 7.9942 7.9942 8.1518 8.1518 8.7107 8.7107 8.7264 8.7264 k = 0.1837 0.1837-0.0000 ( 8241 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4664 -37.4664 -37.4608 -37.4608 -37.1804 -37.1804 -37.1764 -37.1764 -37.1756 -37.1756 -37.1697 -37.1697 -25.2577 -25.2577 -25.2394 -25.2394 -9.0181 -9.0181 -8.9621 -8.9621 -8.7695 -8.7695 -8.7425 -8.7425 -8.6779 -8.6779 -8.6425 -8.6425 -4.6192 -4.6192 -4.1448 -4.1448 2.0078 2.0078 3.0603 3.0603 3.2715 3.2715 3.7996 3.7996 4.2961 4.2961 4.4928 4.4928 7.4613 7.4613 7.9512 7.9512 8.1626 8.1626 8.6083 8.6083 8.6804 8.6804 k = 0.1735 0.1735-0.0000 ( 8249 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4665 -37.4665 -37.4607 -37.4607 -37.1805 -37.1805 -37.1766 -37.1766 -37.1754 -37.1754 -37.1696 -37.1696 -25.2582 -25.2582 -25.2391 -25.2391 -9.0182 -9.0182 -8.9594 -8.9594 -8.7686 -8.7686 -8.7418 -8.7418 -8.6768 -8.6768 -8.6413 -8.6413 -4.6409 -4.6409 -4.1493 -4.1493 1.9977 1.9977 3.1211 3.1211 3.3060 3.3060 3.8460 3.8460 4.3378 4.3378 4.5166 4.5166 7.4043 7.4043 7.8902 7.8902 8.1394 8.1394 8.5446 8.5446 8.6590 8.6590 k = 0.1633 0.1633-0.0000 ( 8243 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4666 -37.4666 -37.4606 -37.4606 -37.1806 -37.1806 -37.1767 -37.1767 -37.1753 -37.1753 -37.1695 -37.1695 -25.2587 -25.2587 -25.2389 -25.2389 -9.0182 -9.0182 -8.9568 -8.9568 -8.7679 -8.7679 -8.7408 -8.7408 -8.6759 -8.6759 -8.6399 -8.6399 -4.6620 -4.6620 -4.1540 -4.1540 1.9863 1.9863 3.1820 3.1820 3.3435 3.3435 3.8973 3.8973 4.3783 4.3783 4.5391 4.5391 7.3382 7.3382 7.8152 7.8152 8.0731 8.0731 8.5294 8.5294 8.6590 8.6590 k = 0.1531 0.1531-0.0000 ( 8237 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4667 -37.4667 -37.4605 -37.4605 -37.1807 -37.1807 -37.1769 -37.1769 -37.1752 -37.1752 -37.1693 -37.1693 -25.2592 -25.2592 -25.2387 -25.2387 -9.0182 -9.0182 -8.9541 -8.9541 -8.7675 -8.7675 -8.7396 -8.7396 -8.6753 -8.6753 -8.6383 -8.6383 -4.6825 -4.6825 -4.1588 -4.1588 1.9739 1.9739 3.2426 3.2426 3.3840 3.3840 3.9530 3.9530 4.4167 4.4167 4.5610 4.5610 7.2642 7.2642 7.7311 7.7311 7.9768 7.9768 8.5501 8.5501 8.6759 8.6759 k = 0.1429 0.1429-0.0000 ( 8233 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4668 -37.4668 -37.4604 -37.4604 -37.1808 -37.1808 -37.1770 -37.1770 -37.1751 -37.1751 -37.1692 -37.1692 -25.2597 -25.2597 -25.2385 -25.2385 -9.0182 -9.0182 -8.9515 -8.9515 -8.7674 -8.7674 -8.7380 -8.7380 -8.6749 -8.6749 -8.6367 -8.6367 -4.7021 -4.7021 -4.1637 -4.1637 1.9609 1.9609 3.3025 3.3025 3.4274 3.4274 4.0126 4.0126 4.4515 4.4515 4.5833 4.5833 7.1837 7.1837 7.6422 7.6422 7.8672 7.8672 8.5903 8.5903 8.7058 8.7058 k = 0.1327 0.1327-0.0000 ( 8245 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4669 -37.4669 -37.4603 -37.4603 -37.1809 -37.1809 -37.1770 -37.1770 -37.1751 -37.1751 -37.1691 -37.1691 -25.2601 -25.2601 -25.2383 -25.2383 -9.0181 -9.0181 -8.9489 -8.9489 -8.7674 -8.7674 -8.7364 -8.7364 -8.6748 -8.6748 -8.6349 -8.6349 -4.7210 -4.7210 -4.1685 -4.1685 1.9474 1.9474 3.3612 3.3612 3.4736 3.4736 4.0757 4.0757 4.4813 4.4813 4.6074 4.6074 7.0979 7.0979 7.5521 7.5521 7.7537 7.7537 8.6409 8.6409 8.7454 8.7454 k = 0.1224 0.1224-0.0000 ( 8247 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4670 -37.4670 -37.4602 -37.4602 -37.1810 -37.1810 -37.1771 -37.1771 -37.1750 -37.1750 -37.1690 -37.1690 -25.2605 -25.2605 -25.2381 -25.2381 -9.0180 -9.0180 -8.9464 -8.9464 -8.7676 -8.7676 -8.7345 -8.7345 -8.6748 -8.6748 -8.6331 -8.6331 -4.7388 -4.7388 -4.1733 -4.1733 1.9338 1.9338 3.4183 3.4183 3.5223 3.5223 4.1415 4.1415 4.5045 4.5045 4.6346 4.6346 7.0079 7.0079 7.4631 7.4631 7.6409 7.6409 8.6976 8.6976 8.7926 8.7926 k = 0.1122 0.1122-0.0000 ( 8259 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4671 -37.4671 -37.4601 -37.4601 -37.1811 -37.1811 -37.1772 -37.1772 -37.1750 -37.1750 -37.1688 -37.1688 -25.2609 -25.2609 -25.2379 -25.2379 -9.0178 -9.0178 -8.9441 -8.9441 -8.7680 -8.7680 -8.7327 -8.7327 -8.6751 -8.6751 -8.6312 -8.6312 -4.7556 -4.7556 -4.1779 -4.1779 1.9204 1.9204 3.4735 3.4735 3.5728 3.5728 4.2088 4.2088 4.5214 4.5214 4.6649 4.6649 6.9150 6.9150 7.3770 7.3770 7.5312 7.5312 8.7583 8.7583 8.8455 8.8455 k = 0.1020 0.1020-0.0000 ( 8251 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4672 -37.4672 -37.4601 -37.4601 -37.1812 -37.1812 -37.1772 -37.1772 -37.1749 -37.1749 -37.1687 -37.1687 -25.2613 -25.2613 -25.2378 -25.2378 -9.0177 -9.0177 -8.9418 -8.9418 -8.7684 -8.7684 -8.7307 -8.7307 -8.6755 -8.6755 -8.6294 -8.6294 -4.7713 -4.7713 -4.1823 -4.1823 1.9073 1.9073 3.5267 3.5267 3.6246 3.6246 4.2760 4.2760 4.5335 4.5335 4.6975 4.6975 6.8202 6.8202 7.2951 7.2951 7.4261 7.4261 8.8218 8.8218 8.9026 8.9026 k = 0.0918 0.0918-0.0000 ( 8247 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4672 -37.4672 -37.4600 -37.4600 -37.1813 -37.1813 -37.1773 -37.1773 -37.1749 -37.1749 -37.1686 -37.1686 -25.2616 -25.2616 -25.2376 -25.2376 -9.0176 -9.0176 -8.9396 -8.9396 -8.7689 -8.7689 -8.7289 -8.7289 -8.6760 -8.6760 -8.6275 -8.6275 -4.7857 -4.7857 -4.1865 -4.1865 1.8947 1.8947 3.5778 3.5778 3.6766 3.6766 4.3399 4.3399 4.5444 4.5444 4.7310 4.7310 6.7247 6.7247 7.2185 7.2185 7.3269 7.3269 8.8813 8.8813 8.8875 8.8875 k = 0.0816 0.0816-0.0000 ( 8251 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4673 -37.4673 -37.4599 -37.4599 -37.1814 -37.1814 -37.1773 -37.1773 -37.1749 -37.1749 -37.1685 -37.1685 -25.2619 -25.2619 -25.2375 -25.2375 -9.0174 -9.0174 -8.9376 -8.9376 -8.7694 -8.7694 -8.7270 -8.7270 -8.6767 -8.6767 -8.6258 -8.6258 -4.7989 -4.7989 -4.1904 -4.1904 1.8830 1.8830 3.6267 3.6267 3.7278 3.7278 4.3942 4.3942 4.5603 4.5603 4.7644 4.7644 6.6298 6.6298 7.1479 7.1479 7.2345 7.2345 8.8075 8.8075 8.9535 8.9535 k = 0.0714 0.0714-0.0000 ( 8249 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4674 -37.4674 -37.4599 -37.4599 -37.1815 -37.1815 -37.1773 -37.1773 -37.1748 -37.1748 -37.1684 -37.1684 -25.2622 -25.2622 -25.2374 -25.2374 -9.0173 -9.0173 -8.9358 -8.9358 -8.7699 -8.7699 -8.7253 -8.7253 -8.6773 -8.6773 -8.6242 -8.6242 -4.8106 -4.8106 -4.1940 -4.1940 1.8722 1.8722 3.6731 3.6731 3.7770 3.7770 4.4295 4.4295 4.5901 4.5901 4.7968 4.7968 6.5368 6.5368 7.0841 7.0841 7.1499 7.1499 8.7406 8.7406 9.0198 9.0198 k = 0.0612 0.0612-0.0000 ( 8261 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4674 -37.4674 -37.4598 -37.4598 -37.1816 -37.1816 -37.1773 -37.1773 -37.1748 -37.1748 -37.1683 -37.1683 -25.2624 -25.2624 -25.2373 -25.2373 -9.0172 -9.0172 -8.9342 -8.9342 -8.7703 -8.7703 -8.7237 -8.7237 -8.6780 -8.6780 -8.6227 -8.6227 -4.8210 -4.8210 -4.1972 -4.1972 1.8626 1.8626 3.7164 3.7164 3.8232 3.8232 4.4430 4.4430 4.6357 4.6357 4.8281 4.8281 6.4475 6.4475 7.0277 7.0277 7.0740 7.0740 8.6815 8.6815 9.0849 9.0849 k = 0.0510 0.0510-0.0000 ( 8265 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4598 -37.4598 -37.1817 -37.1817 -37.1774 -37.1774 -37.1748 -37.1748 -37.1682 -37.1682 -25.2626 -25.2626 -25.2372 -25.2372 -9.0171 -9.0171 -8.9328 -8.9328 -8.7708 -8.7708 -8.7223 -8.7223 -8.6787 -8.6787 -8.6214 -8.6214 -4.8298 -4.8298 -4.2000 -4.2000 1.8542 1.8542 3.7558 3.7558 3.8655 3.8655 4.4424 4.4424 4.6878 4.6878 4.8583 4.8583 6.3637 6.3637 6.9791 6.9791 7.0077 7.0077 8.6306 8.6306 9.1473 9.1473 k = 0.0408 0.0408-0.0000 ( 8271 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4597 -37.4597 -37.1818 -37.1818 -37.1774 -37.1774 -37.1748 -37.1748 -37.1682 -37.1682 -25.2628 -25.2628 -25.2371 -25.2371 -9.0170 -9.0170 -8.9316 -8.9316 -8.7712 -8.7712 -8.7210 -8.7210 -8.6793 -8.6793 -8.6203 -8.6203 -4.8371 -4.8371 -4.2023 -4.2023 1.8472 1.8472 3.7903 3.7903 3.9028 3.9028 4.4350 4.4350 4.7372 4.7372 4.8875 4.8875 6.2880 6.2880 6.9388 6.9388 6.9520 6.9520 8.5883 8.5883 9.2045 9.2045 k = 0.0306 0.0306-0.0000 ( 8275 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4597 -37.4597 -37.1818 -37.1818 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2629 -25.2629 -25.2371 -25.2371 -9.0169 -9.0169 -8.9306 -8.9306 -8.7715 -8.7715 -8.7200 -8.7200 -8.6798 -8.6798 -8.6194 -8.6194 -4.8428 -4.8428 -4.2041 -4.2041 1.8417 1.8417 3.8189 3.8189 3.9339 3.9339 4.4251 4.4251 4.7777 4.7777 4.9157 4.9157 6.2233 6.2233 6.9066 6.9066 6.9082 6.9082 8.5550 8.5550 9.2537 9.2537 k = 0.0204 0.0204-0.0000 ( 8287 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2630 -25.2630 -25.2370 -25.2370 -9.0168 -9.0168 -8.9300 -8.9300 -8.7717 -8.7717 -8.7193 -8.7193 -8.6802 -8.6802 -8.6187 -8.6187 -4.8469 -4.8469 -4.2054 -4.2054 1.8376 1.8376 3.8403 3.8403 3.9576 3.9576 4.4157 4.4157 4.8065 4.8065 4.9406 4.9406 6.1731 6.1731 6.8753 6.8753 6.8845 6.8845 8.5309 8.5309 9.2915 9.2915 k = 0.0102 0.0102-0.0000 ( 8293 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2630 -25.2630 -25.2370 -25.2370 -9.0168 -9.0168 -8.9296 -8.9296 -8.7719 -8.7719 -8.7188 -8.7188 -8.6805 -8.6805 -8.6183 -8.6183 -4.8494 -4.8494 -4.2062 -4.2062 1.8352 1.8352 3.8537 3.8537 3.9726 3.9726 4.4089 4.4089 4.8231 4.8231 4.9584 4.9584 6.1411 6.1411 6.8557 6.8557 6.8707 6.8707 8.5164 8.5164 9.3152 9.3152 k = 0.0000 0.0000 0.0000 ( 8279 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2631 -25.2631 -25.2370 -25.2370 -9.0168 -9.0168 -8.9294 -8.9294 -8.7719 -8.7719 -8.7187 -8.7187 -8.6806 -8.6806 -8.6182 -8.6182 -4.8502 -4.8502 -4.2065 -4.2065 1.8344 1.8344 3.8582 3.8582 3.9777 3.9777 4.4065 4.4065 4.8285 4.8285 4.9649 4.9649 6.1301 6.1301 6.8491 6.8491 6.8661 6.8661 8.5115 8.5115 9.3232 9.3232 k = 0.0000 0.0000 0.0000 ( 8279 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2631 -25.2631 -25.2370 -25.2370 -9.0168 -9.0168 -8.9294 -8.9294 -8.7719 -8.7719 -8.7187 -8.7187 -8.6806 -8.6806 -8.6182 -8.6182 -4.8502 -4.8502 -4.2065 -4.2065 1.8344 1.8344 3.8582 3.8582 3.9777 3.9777 4.4065 4.4065 4.8285 4.8285 4.9649 4.9649 6.1301 6.1301 6.8491 6.8491 6.8661 6.8661 8.5115 8.5115 9.3232 9.3232 k = 0.0000 0.0000 0.0140 ( 8283 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2631 -25.2631 -25.2370 -25.2370 -9.0168 -9.0168 -8.9295 -8.9295 -8.7719 -8.7719 -8.7187 -8.7187 -8.6806 -8.6806 -8.6182 -8.6182 -4.8496 -4.8496 -4.2070 -4.2070 1.8345 1.8345 3.8580 3.8580 3.9775 3.9775 4.4008 4.4008 4.8279 4.8279 4.9651 4.9651 6.1392 6.1392 6.8503 6.8503 6.8683 6.8683 8.5063 8.5063 9.3255 9.3256 k = 0.0000 0.0000 0.0281 ( 8275 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2631 -25.2631 -25.2370 -25.2370 -9.0167 -9.0167 -8.9296 -8.9296 -8.7718 -8.7718 -8.7187 -8.7187 -8.6808 -8.6808 -8.6182 -8.6182 -4.8478 -4.8478 -4.2085 -4.2085 1.8346 1.8346 3.8574 3.8574 3.9768 3.9768 4.3841 4.3841 4.8265 4.8265 4.9657 4.9657 6.1659 6.1659 6.8538 6.8538 6.8751 6.8751 8.4907 8.4907 9.3325 9.3325 k = 0.0000 0.0000 0.0421 ( 8287 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2631 -25.2631 -25.2370 -25.2370 -9.0166 -9.0166 -8.9298 -8.9298 -8.7717 -8.7717 -8.7187 -8.7187 -8.6810 -8.6810 -8.6182 -8.6182 -4.8447 -4.8447 -4.2111 -4.2111 1.8349 1.8349 3.8563 3.8563 3.9757 3.9757 4.3571 4.3571 4.8246 4.8246 4.9667 4.9667 6.2088 6.2088 6.8596 6.8596 6.8864 6.8864 8.4656 8.4656 9.3440 9.3440 k = 0.0000 0.0000 0.0561 ( 8291 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2631 -25.2631 -25.2370 -25.2370 -9.0164 -9.0164 -8.9302 -8.9302 -8.7715 -8.7715 -8.7186 -8.7186 -8.6813 -8.6813 -8.6183 -8.6183 -4.8406 -4.8406 -4.2146 -4.2146 1.8354 1.8354 3.8549 3.8549 3.9742 3.9742 4.3214 4.3214 4.8227 4.8227 4.9681 4.9681 6.2660 6.2660 6.8677 6.8677 6.9019 6.9019 8.4322 8.4322 9.3602 9.3602 k = 0.0000 0.0000 0.0701 ( 8291 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1748 -37.1748 -37.1681 -37.1681 -25.2631 -25.2631 -25.2370 -25.2370 -9.0162 -9.0162 -8.9306 -8.9306 -8.7713 -8.7713 -8.7186 -8.7186 -8.6817 -8.6817 -8.6183 -8.6183 -4.8353 -4.8353 -4.2190 -4.2190 1.8360 1.8360 3.8532 3.8532 3.9724 3.9724 4.2787 4.2787 4.8211 4.8211 4.9697 4.9697 6.3354 6.3354 6.8781 6.8781 6.9215 6.9215 8.3918 8.3918 9.3809 9.3809 k = 0.0000 0.0000 0.0842 ( 8275 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1681 -37.1681 -25.2630 -25.2630 -25.2370 -25.2370 -9.0160 -9.0160 -8.9311 -8.9311 -8.7710 -8.7710 -8.7186 -8.7186 -8.6822 -8.6822 -8.6183 -8.6183 -4.8289 -4.8289 -4.2243 -4.2243 1.8368 1.8368 3.8511 3.8511 3.9702 3.9702 4.2307 4.2307 4.8200 4.8200 4.9717 4.9717 6.4146 6.4146 6.8907 6.8907 6.9451 6.9451 8.3457 8.3457 9.4061 9.4061 k = 0.0000 0.0000 0.0982 ( 8283 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1681 -37.1681 -25.2630 -25.2630 -25.2370 -25.2370 -9.0158 -9.0158 -8.9316 -8.9316 -8.7707 -8.7707 -8.7185 -8.7185 -8.6827 -8.6827 -8.6184 -8.6184 -4.8217 -4.8217 -4.2304 -4.2304 1.8377 1.8377 3.8488 3.8488 3.9678 3.9678 4.1792 4.1792 4.8196 4.8196 4.9739 4.9739 6.5015 6.5015 6.9055 6.9055 6.9723 6.9723 8.2953 8.2953 9.4358 9.4358 k = 0.0000 0.0000 0.1122 ( 8264 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1681 -37.1681 -25.2630 -25.2630 -25.2370 -25.2370 -9.0155 -9.0155 -8.9322 -8.9322 -8.7704 -8.7704 -8.7185 -8.7185 -8.6832 -8.6832 -8.6184 -8.6184 -4.8135 -4.8135 -4.2373 -4.2373 1.8389 1.8389 3.8464 3.8464 3.9652 3.9652 4.1258 4.1258 4.8196 4.8196 4.9763 4.9763 6.5941 6.5941 6.9225 6.9225 7.0030 7.0030 8.2417 8.2417 9.4698 9.4698 k = 0.0000 0.0000 0.1262 ( 8264 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4597 -37.4597 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1681 -37.1681 -25.2630 -25.2630 -25.2370 -25.2370 -9.0152 -9.0152 -8.9329 -8.9329 -8.7700 -8.7700 -8.7185 -8.7185 -8.6839 -8.6839 -8.6184 -8.6184 -4.8047 -4.8047 -4.2449 -4.2449 1.8402 1.8402 3.8438 3.8438 3.9624 3.9624 4.0718 4.0718 4.8202 4.8202 4.9789 4.9789 6.6904 6.6904 6.9414 6.9414 7.0371 7.0371 8.1861 8.1861 9.5079 9.5079 k = 0.0000 0.0000 0.1403 ( 8248 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2370 -25.2370 -9.0149 -9.0149 -8.9335 -8.9335 -8.7696 -8.7696 -8.7184 -8.7184 -8.6845 -8.6845 -8.6185 -8.6185 -4.7953 -4.7953 -4.2529 -4.2529 1.8418 1.8418 3.8411 3.8411 3.9596 3.9596 4.0186 4.0186 4.8210 4.8210 4.9815 4.9815 6.7881 6.7881 6.9623 6.9623 7.0751 7.0751 8.1294 8.1294 9.5499 9.5499 k = 0.0000 0.0000 0.1543 ( 8252 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2370 -25.2370 -9.0145 -9.0145 -8.9342 -8.9342 -8.7693 -8.7693 -8.7184 -8.7184 -8.6851 -8.6851 -8.6185 -8.6185 -4.7855 -4.7855 -4.2614 -4.2614 1.8435 1.8435 3.8383 3.8383 3.9567 3.9567 3.9671 3.9671 4.8222 4.8222 4.9841 4.9841 6.8842 6.8842 6.9850 6.9850 7.1179 7.1179 8.0723 8.0723 9.5947 9.5947 k = 0.0000 0.0000 0.1683 ( 8252 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1775 -37.1775 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2370 -25.2370 -9.0142 -9.0142 -8.9349 -8.9349 -8.7689 -8.7689 -8.7183 -8.7183 -8.6858 -8.6858 -8.6186 -8.6186 -4.7754 -4.7754 -4.2701 -4.2701 1.8453 1.8453 3.8356 3.8356 3.9182 3.9182 3.9539 3.9539 4.8235 4.8235 4.9866 4.9866 6.9739 6.9739 7.0092 7.0092 7.1683 7.1683 8.0157 8.0157 9.6325 9.6325 k = 0.0000 0.0000 0.1824 ( 8236 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2370 -25.2370 -9.0139 -9.0139 -8.9355 -8.9355 -8.7685 -8.7685 -8.7183 -8.7183 -8.6864 -8.6864 -8.6186 -8.6186 -4.7653 -4.7653 -4.2788 -4.2788 1.8472 1.8472 3.8329 3.8329 3.8726 3.8726 3.9512 3.9512 4.8250 4.8250 4.9891 4.9891 7.0348 7.0348 7.0510 7.0510 7.2304 7.2304 7.9602 7.9602 9.5711 9.5711 k = 0.0000 0.0000 0.1964 ( 8248 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1775 -37.1775 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0135 -9.0135 -8.9362 -8.9362 -8.7681 -8.7681 -8.7182 -8.7182 -8.6870 -8.6870 -8.6187 -8.6187 -4.7555 -4.7555 -4.2875 -4.2875 1.8492 1.8492 3.8272 3.8272 3.8341 3.8341 3.9487 3.9487 4.8264 4.8264 4.9913 4.9913 7.0613 7.0613 7.1116 7.1116 7.3060 7.3060 7.9066 7.9066 9.4681 9.4681 k = 0.0000 0.0000 0.2104 ( 8252 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1775 -37.1775 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0132 -9.0132 -8.9368 -8.9368 -8.7678 -8.7678 -8.7182 -8.7182 -8.6875 -8.6875 -8.6187 -8.6187 -4.7461 -4.7461 -4.2957 -4.2957 1.8511 1.8511 3.7929 3.7929 3.8290 3.8290 3.9464 3.9464 4.8277 4.8277 4.9934 4.9934 7.0882 7.0882 7.1578 7.1578 7.3904 7.3904 7.8556 7.8556 9.3668 9.3668 k = 0.0000 0.0000 0.2244 ( 8248 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1775 -37.1775 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0130 -9.0130 -8.9373 -8.9373 -8.7675 -8.7675 -8.7182 -8.7182 -8.6880 -8.6880 -8.6187 -8.6187 -4.7375 -4.7375 -4.3033 -4.3033 1.8529 1.8529 3.7607 3.7607 3.8269 3.8269 3.9443 3.9443 4.8290 4.8290 4.9953 4.9953 7.1149 7.1149 7.1939 7.1939 7.4764 7.4764 7.8083 7.8083 9.2714 9.2714 k = 0.0000 0.0000 0.2385 ( 8240 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0127 -9.0127 -8.9377 -8.9377 -8.7673 -8.7673 -8.7181 -8.7181 -8.6885 -8.6885 -8.6188 -8.6188 -4.7299 -4.7299 -4.3101 -4.3101 1.8545 1.8545 3.7338 3.7338 3.8252 3.8252 3.9426 3.9426 4.8301 4.8301 4.9968 4.9968 7.1403 7.1403 7.2224 7.2224 7.5581 7.5581 7.7658 7.7658 9.1845 9.1845 k = 0.0000 0.0000 0.2525 ( 8224 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0126 -9.0126 -8.9381 -8.9381 -8.7671 -8.7671 -8.7181 -8.7181 -8.6888 -8.6888 -8.6188 -8.6188 -4.7236 -4.7236 -4.3157 -4.3157 1.8558 1.8558 3.7124 3.7124 3.8239 3.8239 3.9412 3.9412 4.8309 4.8309 4.9981 4.9981 7.1632 7.1632 7.2443 7.2443 7.6301 7.6301 7.7295 7.7295 9.1097 9.1097 k = 0.0000 0.0000 0.2665 ( 8216 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0124 -9.0124 -8.9384 -8.9384 -8.7669 -8.7669 -8.7181 -8.7181 -8.6890 -8.6890 -8.6188 -8.6188 -4.7190 -4.7190 -4.3199 -4.3199 1.8569 1.8569 3.6970 3.6970 3.8229 3.8229 3.9402 3.9402 4.8316 4.8316 4.9990 4.9990 7.1817 7.1817 7.2601 7.2601 7.6872 7.6872 7.7013 7.7013 9.0512 9.0512 k = 0.0000 0.0000 0.2806 ( 8240 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0123 -9.0123 -8.9385 -8.9385 -8.7668 -8.7668 -8.7181 -8.7181 -8.6892 -8.6892 -8.6188 -8.6188 -4.7160 -4.7160 -4.3225 -4.3225 1.8575 1.8575 3.6877 3.6877 3.8223 3.8223 3.9396 3.9396 4.8320 4.8320 4.9995 4.9995 7.1939 7.1939 7.2695 7.2695 7.6832 7.6832 7.7243 7.7243 9.0134 9.0134 k = 0.0000 0.0000 0.2946 ( 8244 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0123 -9.0123 -8.9386 -8.9386 -8.7668 -8.7668 -8.7181 -8.7181 -8.6892 -8.6892 -8.6188 -8.6188 -4.7151 -4.7151 -4.3234 -4.3234 1.8577 1.8577 3.6845 3.6845 3.8221 3.8221 3.9394 3.9394 4.8321 4.8321 4.9997 4.9997 7.1982 7.1982 7.2727 7.2727 7.6770 7.6770 7.7372 7.7372 9.0003 9.0003 k = 0.0000 0.0000 0.2946 ( 8244 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0123 -9.0123 -8.9386 -8.9386 -8.7668 -8.7668 -8.7181 -8.7181 -8.6892 -8.6892 -8.6188 -8.6188 -4.7151 -4.7151 -4.3234 -4.3234 1.8577 1.8577 3.6845 3.6845 3.8221 3.8221 3.9394 3.9394 4.8321 4.8321 4.9997 4.9997 7.1982 7.1982 7.2727 7.2727 7.6770 7.6770 7.7372 7.7372 9.0003 9.0003 k = 0.0000 0.0143 0.2946 ( 8236 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0123 -9.0123 -8.9387 -8.9387 -8.7668 -8.7668 -8.7183 -8.7183 -8.6891 -8.6891 -8.6189 -8.6189 -4.7144 -4.7144 -4.3229 -4.3229 1.8580 1.8580 3.6663 3.6663 3.8312 3.8312 3.9440 3.9440 4.8289 4.8289 4.9962 4.9962 7.2044 7.2044 7.2765 7.2765 7.6816 7.6816 7.7423 7.7423 8.9903 8.9903 k = 0.0000 0.0286 0.2946 ( 8224 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1818 -37.1818 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2629 -25.2629 -25.2371 -25.2371 -9.0124 -9.0124 -8.9391 -8.9391 -8.7666 -8.7666 -8.7189 -8.7189 -8.6886 -8.6886 -8.6193 -8.6193 -4.7124 -4.7124 -4.3216 -4.3216 1.8587 1.8587 3.6221 3.6221 3.8481 3.8481 3.9578 3.9578 4.8187 4.8187 4.9865 4.9865 7.2200 7.2200 7.2905 7.2905 7.6922 7.6922 7.7606 7.7606 8.9612 8.9612 k = 0.0000 0.0429 0.2946 ( 8228 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4597 -37.4597 -37.1818 -37.1818 -37.1774 -37.1774 -37.1747 -37.1747 -37.1681 -37.1681 -25.2628 -25.2628 -25.2371 -25.2371 -9.0126 -9.0126 -8.9397 -8.9397 -8.7664 -8.7664 -8.7199 -8.7199 -8.6879 -8.6879 -8.6198 -8.6198 -4.7090 -4.7090 -4.3194 -4.3194 1.8600 1.8600 3.5641 3.5641 3.8627 3.8627 3.9790 3.9790 4.8004 4.8004 4.9726 4.9726 7.2372 7.2372 7.3220 7.3220 7.7032 7.7032 7.7968 7.7968 8.9152 8.9152 k = 0.0000 0.0571 0.2946 ( 8232 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4597 -37.4597 -37.1818 -37.1818 -37.1774 -37.1774 -37.1747 -37.1747 -37.1681 -37.1681 -25.2627 -25.2627 -25.2372 -25.2372 -9.0128 -9.0128 -8.9406 -8.9406 -8.7661 -8.7661 -8.7211 -8.7211 -8.6870 -8.6870 -8.6206 -8.6206 -4.7044 -4.7044 -4.3164 -4.3164 1.8616 1.8616 3.4976 3.4976 3.8738 3.8738 4.0045 4.0045 4.7725 4.7725 4.9572 4.9572 7.2509 7.2509 7.3752 7.3752 7.7126 7.7126 7.8514 7.8514 8.8555 8.8555 k = 0.0000 0.0714 0.2946 ( 8240 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4597 -37.4597 -37.1817 -37.1817 -37.1774 -37.1774 -37.1747 -37.1747 -37.1682 -37.1682 -25.2625 -25.2625 -25.2373 -25.2373 -9.0131 -9.0131 -8.9417 -8.9417 -8.7658 -8.7658 -8.7226 -8.7226 -8.6859 -8.6859 -8.6216 -8.6216 -4.6984 -4.6984 -4.3126 -4.3126 1.8636 1.8636 3.4249 3.4249 3.8830 3.8830 4.0313 4.0313 4.7346 4.7346 4.9425 4.9425 7.2625 7.2625 7.4475 7.4475 7.7214 7.7214 7.9217 7.9217 8.7852 8.7852 k = 0.0000 0.0857 0.2946 ( 8244 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4598 -37.4598 -37.1816 -37.1816 -37.1774 -37.1774 -37.1748 -37.1748 -37.1683 -37.1683 -25.2623 -25.2623 -25.2374 -25.2374 -9.0134 -9.0134 -8.9430 -8.9430 -8.7654 -8.7654 -8.7243 -8.7243 -8.6848 -8.6848 -8.6228 -8.6228 -4.6912 -4.6912 -4.3080 -4.3080 1.8659 1.8659 3.3474 3.3474 3.8915 3.8915 4.0579 4.0579 4.6876 4.6876 4.9292 4.9292 7.2739 7.2739 7.5355 7.5355 7.7306 7.7306 8.0050 8.0050 8.7074 8.7074 k = 0.0000 0.1000 0.2946 ( 8240 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4674 -37.4674 -37.4598 -37.4598 -37.1815 -37.1815 -37.1774 -37.1774 -37.1748 -37.1748 -37.1684 -37.1684 -25.2621 -25.2621 -25.2375 -25.2375 -9.0138 -9.0138 -8.9446 -8.9446 -8.7649 -8.7649 -8.7261 -8.7261 -8.6837 -8.6837 -8.6241 -8.6241 -4.6828 -4.6828 -4.3027 -4.3027 1.8683 1.8683 3.2662 3.2662 3.9000 3.9000 4.0835 4.0835 4.6332 4.6332 4.9173 4.9173 7.2859 7.2859 7.6362 7.6362 7.7408 7.7408 8.0992 8.0992 8.6247 8.6247 k = 0.0000 0.1143 0.2946 ( 8228 PWs) bands (ev): -70.5238 -70.5238 -70.5222 -70.5222 -37.4673 -37.4673 -37.4599 -37.4599 -37.1814 -37.1814 -37.1773 -37.1773 -37.1748 -37.1748 -37.1685 -37.1685 -25.2618 -25.2618 -25.2376 -25.2376 -9.0143 -9.0143 -8.9463 -8.9463 -8.7644 -8.7644 -8.7280 -8.7280 -8.6825 -8.6825 -8.6256 -8.6256 -4.6731 -4.6731 -4.2968 -4.2968 1.8706 1.8706 3.1822 3.1822 3.9090 3.9090 4.1078 4.1078 4.5738 4.5738 4.9062 4.9062 7.2989 7.2989 7.7356 7.7356 7.7634 7.7634 8.2022 8.2022 8.5402 8.5402 k = 0.0000 0.1286 0.2946 ( 8216 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4673 -37.4673 -37.4599 -37.4599 -37.1813 -37.1813 -37.1773 -37.1773 -37.1748 -37.1748 -37.1686 -37.1686 -25.2615 -25.2615 -25.2377 -25.2377 -9.0148 -9.0148 -8.9483 -8.9483 -8.7638 -8.7638 -8.7298 -8.7298 -8.6815 -8.6815 -8.6271 -8.6271 -4.6623 -4.6623 -4.2902 -4.2902 1.8728 1.8728 3.0963 3.0963 3.9185 3.9185 4.1307 4.1307 4.5114 4.5114 4.8955 4.8955 7.3129 7.3129 7.7567 7.7567 7.8722 7.8722 8.3114 8.3114 8.4584 8.4584 k = 0.0000 0.1429 0.2946 ( 8230 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4672 -37.4672 -37.4600 -37.4600 -37.1812 -37.1812 -37.1773 -37.1773 -37.1748 -37.1748 -37.1687 -37.1687 -25.2612 -25.2612 -25.2379 -25.2379 -9.0154 -9.0154 -8.9504 -8.9504 -8.7633 -8.7633 -8.7317 -8.7317 -8.6804 -8.6804 -8.6288 -8.6288 -4.6503 -4.6503 -4.2832 -4.2832 1.8746 1.8746 3.0091 3.0091 3.9288 3.9288 4.1518 4.1518 4.4481 4.4481 4.8848 4.8848 7.3278 7.3278 7.7672 7.7672 7.9914 7.9914 8.3739 8.3739 8.4386 8.4386 k = 0.0000 0.1571 0.2946 ( 8238 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4671 -37.4671 -37.4601 -37.4601 -37.1811 -37.1811 -37.1773 -37.1773 -37.1749 -37.1749 -37.1689 -37.1689 -25.2609 -25.2609 -25.2380 -25.2380 -9.0161 -9.0161 -8.9527 -8.9527 -8.7628 -8.7628 -8.7336 -8.7336 -8.6795 -8.6795 -8.6305 -8.6305 -4.6373 -4.6373 -4.2757 -4.2757 1.8758 1.8758 2.9214 2.9214 3.9398 3.9398 4.1705 4.1705 4.3861 4.3861 4.8739 4.8739 7.3433 7.3433 7.7767 7.7767 8.0835 8.0835 8.3425 8.3425 8.5548 8.5548 k = 0.0000 0.1714 0.2946 ( 8240 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4670 -37.4670 -37.4602 -37.4602 -37.1809 -37.1809 -37.1772 -37.1772 -37.1749 -37.1749 -37.1690 -37.1690 -25.2605 -25.2605 -25.2382 -25.2382 -9.0168 -9.0168 -8.9552 -8.9552 -8.7622 -8.7622 -8.7354 -8.7354 -8.6787 -8.6787 -8.6322 -8.6322 -4.6233 -4.6233 -4.2679 -4.2679 1.8763 1.8763 2.8339 2.8339 3.9515 3.9515 4.1847 4.1847 4.3288 4.3288 4.8625 4.8625 7.3591 7.3591 7.7852 7.7852 8.0886 8.0886 8.4033 8.4033 8.6796 8.6796 k = 0.0000 0.1857 0.2946 ( 8244 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4669 -37.4669 -37.4603 -37.4603 -37.1808 -37.1808 -37.1772 -37.1772 -37.1749 -37.1749 -37.1692 -37.1692 -25.2601 -25.2601 -25.2384 -25.2384 -9.0176 -9.0176 -8.9578 -8.9578 -8.7618 -8.7618 -8.7371 -8.7371 -8.6779 -8.6779 -8.6339 -8.6339 -4.6083 -4.6083 -4.2598 -4.2598 1.8758 1.8758 2.7470 2.7470 3.9640 3.9640 4.1868 4.1868 4.2850 4.2850 4.8506 4.8506 7.3745 7.3745 7.7921 7.7921 8.0327 8.0327 8.5353 8.5353 8.8075 8.8075 k = 0.0000 0.2000 0.2946 ( 8238 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4668 -37.4668 -37.4604 -37.4604 -37.1806 -37.1806 -37.1772 -37.1772 -37.1750 -37.1750 -37.1694 -37.1694 -25.2596 -25.2596 -25.2387 -25.2387 -9.0184 -9.0184 -8.9605 -8.9605 -8.7614 -8.7614 -8.7387 -8.7387 -8.6773 -8.6773 -8.6356 -8.6356 -4.5925 -4.5925 -4.2516 -4.2516 1.8741 1.8741 2.6614 2.6614 3.9769 3.9769 4.1629 4.1629 4.2694 4.2694 4.8381 4.8381 7.3883 7.3883 7.7970 7.7970 7.9640 7.9640 8.6916 8.6916 8.9375 8.9375 k = 0.0000 0.2143 0.2946 ( 8238 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4667 -37.4667 -37.4605 -37.4605 -37.1804 -37.1804 -37.1771 -37.1771 -37.1750 -37.1750 -37.1696 -37.1696 -25.2592 -25.2592 -25.2389 -25.2389 -9.0193 -9.0193 -8.9633 -8.9633 -8.7610 -8.7610 -8.7402 -8.7402 -8.6768 -8.6768 -8.6372 -8.6372 -4.5758 -4.5758 -4.2433 -4.2433 1.8710 1.8710 2.5774 2.5774 3.9898 3.9898 4.1215 4.1215 4.2747 4.2747 4.8249 4.8249 7.3990 7.3990 7.7990 7.7990 7.8977 7.8977 8.8588 8.8588 9.0687 9.0687 k = 0.0000 0.2286 0.2946 ( 8252 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4666 -37.4666 -37.4606 -37.4606 -37.1802 -37.1802 -37.1771 -37.1771 -37.1751 -37.1751 -37.1698 -37.1698 -25.2587 -25.2587 -25.2392 -25.2392 -9.0202 -9.0202 -8.9663 -8.9663 -8.7608 -8.7608 -8.7415 -8.7415 -8.6763 -8.6763 -8.6388 -8.6388 -4.5585 -4.5585 -4.2351 -4.2351 1.8663 1.8663 2.4956 2.4956 4.0011 4.0011 4.0799 4.0799 4.2859 4.2859 4.8111 4.8111 7.4040 7.4040 7.7958 7.7958 7.8420 7.8420 9.0330 9.0330 9.2001 9.2001 k = 0.0000 0.2429 0.2946 ( 8250 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4665 -37.4665 -37.4608 -37.4608 -37.1800 -37.1800 -37.1771 -37.1771 -37.1751 -37.1751 -37.1700 -37.1700 -25.2582 -25.2582 -25.2394 -25.2394 -9.0211 -9.0211 -8.9693 -8.9693 -8.7607 -8.7607 -8.7427 -8.7427 -8.6759 -8.6759 -8.6403 -8.6403 -4.5405 -4.5405 -4.2271 -4.2271 1.8600 1.8600 2.4163 2.4163 4.0019 4.0019 4.0521 4.0521 4.2980 4.2980 4.7965 4.7965 7.3999 7.3999 7.7792 7.7792 7.8096 7.8096 9.2114 9.2114 9.2378 9.2378 k = 0.0000 0.2571 0.2946 ( 8246 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4664 -37.4664 -37.4609 -37.4609 -37.1798 -37.1798 -37.1770 -37.1770 -37.1752 -37.1752 -37.1702 -37.1702 -25.2576 -25.2576 -25.2397 -25.2397 -9.0220 -9.0220 -8.9724 -8.9724 -8.7607 -8.7607 -8.7437 -8.7437 -8.6756 -8.6756 -8.6417 -8.6417 -4.5220 -4.5220 -4.2194 -4.2194 1.8519 1.8519 2.3398 2.3398 3.9793 3.9793 4.0529 4.0529 4.3093 4.3093 4.7813 4.7813 7.3840 7.3840 7.7566 7.7566 7.7965 7.7965 9.1643 9.1643 9.3888 9.3888 k = 0.0000 0.2714 0.2946 ( 8250 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4662 -37.4662 -37.4610 -37.4610 -37.1796 -37.1796 -37.1770 -37.1770 -37.1752 -37.1752 -37.1705 -37.1705 -25.2571 -25.2571 -25.2401 -25.2401 -9.0228 -9.0228 -8.9755 -8.9755 -8.7607 -8.7607 -8.7446 -8.7446 -8.6753 -8.6753 -8.6430 -8.6430 -4.5030 -4.5030 -4.2120 -4.2120 1.8420 1.8420 2.2664 2.2664 3.9502 3.9502 4.0662 4.0662 4.3191 4.3191 4.7653 4.7653 7.3563 7.3563 7.7468 7.7468 7.7842 7.7842 9.0948 9.0948 9.4211 9.4211 k = 0.0000 0.2857 0.2946 ( 8254 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4661 -37.4661 -37.4612 -37.4612 -37.1793 -37.1793 -37.1770 -37.1770 -37.1753 -37.1753 -37.1707 -37.1707 -25.2565 -25.2565 -25.2404 -25.2404 -9.0237 -9.0237 -8.9787 -8.9787 -8.7609 -8.7609 -8.7454 -8.7454 -8.6750 -8.6750 -8.6443 -8.6443 -4.4836 -4.4836 -4.2052 -4.2052 1.8303 1.8303 2.1965 2.1965 3.9243 3.9243 4.0827 4.0827 4.3269 4.3269 4.7487 4.7487 7.3201 7.3201 7.7483 7.7483 7.7710 7.7710 9.0293 9.0293 9.3960 9.3960 k = 0.0000 0.3000 0.2946 ( 8260 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4660 -37.4660 -37.4613 -37.4613 -37.1791 -37.1791 -37.1769 -37.1769 -37.1753 -37.1753 -37.1710 -37.1710 -25.2560 -25.2560 -25.2407 -25.2407 -9.0244 -9.0244 -8.9819 -8.9819 -8.7610 -8.7610 -8.7462 -8.7462 -8.6747 -8.6747 -8.6456 -8.6456 -4.4640 -4.4640 -4.1990 -4.1990 1.8170 1.8170 2.1301 2.1301 3.9036 3.9036 4.1006 4.1006 4.3324 4.3324 4.7314 4.7314 7.2799 7.2799 7.7398 7.7398 7.7743 7.7743 8.9680 8.9680 9.3724 9.3724 k = 0.0000 0.3143 0.2946 ( 8256 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4658 -37.4658 -37.4614 -37.4614 -37.1788 -37.1788 -37.1769 -37.1769 -37.1754 -37.1754 -37.1712 -37.1712 -25.2554 -25.2554 -25.2411 -25.2411 -9.0251 -9.0251 -8.9852 -8.9852 -8.7612 -8.7612 -8.7468 -8.7468 -8.6743 -8.6743 -8.6468 -8.6468 -4.4443 -4.4443 -4.1936 -4.1936 1.8023 1.8023 2.0677 2.0677 3.8885 3.8885 4.1193 4.1193 4.3353 4.3353 4.7133 4.7133 7.2395 7.2395 7.7160 7.7160 7.7958 7.7958 8.9106 8.9106 9.3517 9.3517 k = 0.0000 0.3286 0.2946 ( 8236 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4656 -37.4656 -37.4616 -37.4616 -37.1786 -37.1786 -37.1768 -37.1768 -37.1754 -37.1754 -37.1715 -37.1715 -25.2548 -25.2548 -25.2415 -25.2415 -9.0258 -9.0258 -8.9884 -8.9884 -8.7614 -8.7614 -8.7475 -8.7475 -8.6739 -8.6739 -8.6479 -8.6479 -4.4246 -4.4246 -4.1890 -4.1890 1.7865 1.7865 2.0093 2.0093 3.8792 3.8792 4.1386 4.1386 4.3354 4.3354 4.6947 4.6947 7.2016 7.2016 7.6863 7.6863 7.8242 7.8242 8.8569 8.8569 9.3340 9.3340 k = 0.0000 0.3429 0.2946 ( 8228 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4655 -37.4655 -37.4617 -37.4617 -37.1783 -37.1783 -37.1767 -37.1767 -37.1755 -37.1755 -37.1717 -37.1717 -25.2542 -25.2542 -25.2419 -25.2419 -9.0263 -9.0263 -8.9916 -8.9916 -8.7615 -8.7615 -8.7482 -8.7482 -8.6734 -8.6734 -8.6491 -8.6491 -4.4049 -4.4049 -4.1853 -4.1853 1.7698 1.7698 1.9551 1.9551 3.8754 3.8754 4.1581 4.1581 4.3328 4.3328 4.6753 4.6753 7.1678 7.1678 7.6521 7.6521 7.8568 7.8568 8.8062 8.8062 9.3195 9.3195 k = 0.0000 0.3571 0.2946 ( 8232 PWs) bands (ev): -70.5234 -70.5234 -70.5227 -70.5227 -37.4653 -37.4653 -37.4619 -37.4619 -37.1780 -37.1780 -37.1767 -37.1767 -37.1755 -37.1755 -37.1720 -37.1720 -25.2536 -25.2536 -25.2423 -25.2423 -9.0266 -9.0266 -8.9947 -8.9947 -8.7616 -8.7616 -8.7488 -8.7488 -8.6728 -8.6728 -8.6502 -8.6502 -4.3854 -4.3854 -4.1827 -4.1827 1.7528 1.7528 1.9053 1.9053 3.8770 3.8770 4.1776 4.1776 4.3275 4.3275 4.6553 4.6553 7.1393 7.1393 7.6142 7.6142 7.8925 7.8925 8.7582 8.7582 9.3081 9.3081 k = 0.0000 0.3714 0.2946 ( 8224 PWs) bands (ev): -70.5234 -70.5234 -70.5227 -70.5227 -37.4652 -37.4652 -37.4620 -37.4620 -37.1777 -37.1777 -37.1766 -37.1766 -37.1756 -37.1756 -37.1723 -37.1723 -25.2530 -25.2530 -25.2428 -25.2428 -9.0268 -9.0268 -8.9978 -8.9978 -8.7616 -8.7616 -8.7496 -8.7496 -8.6721 -8.6721 -8.6514 -8.6514 -4.3662 -4.3662 -4.1812 -4.1812 1.7357 1.7357 1.8599 1.8599 3.8836 3.8836 4.1963 4.1963 4.3202 4.3202 4.6346 4.6346 7.1168 7.1168 7.5734 7.5734 7.9304 7.9304 8.7122 8.7122 9.3000 9.3000 k = 0.0000 0.3857 0.2946 ( 8236 PWs) bands (ev): -70.5233 -70.5233 -70.5227 -70.5227 -37.4650 -37.4650 -37.4622 -37.4622 -37.1775 -37.1775 -37.1766 -37.1766 -37.1756 -37.1756 -37.1726 -37.1726 -25.2523 -25.2523 -25.2432 -25.2432 -9.0269 -9.0269 -9.0008 -9.0008 -8.7615 -8.7615 -8.7503 -8.7503 -8.6713 -8.6713 -8.6526 -8.6526 -4.3475 -4.3475 -4.1809 -4.1809 1.7190 1.7190 1.8190 1.8190 3.8947 3.8947 4.2130 4.2130 4.3122 4.3122 4.6133 4.6133 7.1007 7.1007 7.5303 7.5303 7.9702 7.9702 8.6677 8.6677 9.2950 9.2950 k = 0.0000 0.4000 0.2946 ( 8242 PWs) bands (ev): -70.5233 -70.5233 -70.5228 -70.5228 -37.4648 -37.4648 -37.4624 -37.4624 -37.1772 -37.1772 -37.1765 -37.1765 -37.1757 -37.1757 -37.1729 -37.1729 -25.2517 -25.2517 -25.2437 -25.2437 -9.0268 -9.0268 -9.0038 -9.0038 -8.7613 -8.7613 -8.7511 -8.7511 -8.6704 -8.6704 -8.6537 -8.6537 -4.3293 -4.3293 -4.1818 -4.1818 1.7033 1.7033 1.7827 1.7827 3.9100 3.9100 4.2244 4.2244 4.3068 4.3068 4.5914 4.5914 7.0911 7.0911 7.4857 7.4857 8.0114 8.0114 8.6241 8.6241 9.2933 9.2933 k = 0.0000 0.4143 0.2946 ( 8234 PWs) bands (ev): -70.5233 -70.5233 -70.5228 -70.5228 -37.4647 -37.4647 -37.4626 -37.4626 -37.1769 -37.1769 -37.1765 -37.1765 -37.1758 -37.1758 -37.1732 -37.1732 -25.2511 -25.2511 -25.2442 -25.2442 -9.0264 -9.0264 -9.0066 -9.0066 -8.7609 -8.7609 -8.7520 -8.7520 -8.6695 -8.6695 -8.6549 -8.6549 -4.3117 -4.3117 -4.1840 -4.1840 1.6889 1.6889 1.7509 1.7509 3.9289 3.9289 4.2254 4.2254 4.3092 4.3092 4.5690 4.5690 7.0881 7.0881 7.4405 7.4405 8.0538 8.0538 8.5810 8.5810 9.2948 9.2948 k = 0.0000 0.4286 0.2946 ( 8234 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4645 -37.4645 -37.4627 -37.4627 -37.1766 -37.1766 -37.1764 -37.1764 -37.1758 -37.1758 -37.1735 -37.1735 -25.2505 -25.2505 -25.2447 -25.2447 -9.0259 -9.0259 -9.0093 -9.0093 -8.7605 -8.7605 -8.7528 -8.7528 -8.6684 -8.6684 -8.6562 -8.6562 -4.2949 -4.2949 -4.1876 -4.1876 1.6763 1.6763 1.7237 1.7237 3.9509 3.9509 4.2145 4.2145 4.3212 4.3212 4.5462 4.5462 7.0916 7.0916 7.3953 7.3953 8.0971 8.0971 8.5380 8.5380 9.2995 9.2995 k = 0.0000 0.4429 0.2946 ( 8234 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4643 -37.4643 -37.4629 -37.4629 -37.1764 -37.1764 -37.1762 -37.1762 -37.1759 -37.1759 -37.1738 -37.1738 -25.2499 -25.2499 -25.2452 -25.2452 -9.0252 -9.0252 -9.0118 -9.0118 -8.7600 -8.7600 -8.7537 -8.7537 -8.6673 -8.6673 -8.6574 -8.6574 -4.2790 -4.2790 -4.1925 -4.1925 1.6658 1.6658 1.7010 1.7010 3.9755 3.9755 4.1956 4.1956 4.3390 4.3390 4.5230 4.5230 7.1013 7.1013 7.3509 7.3509 8.1410 8.1410 8.4949 8.4949 9.3072 9.3072 k = 0.0000 0.4571 0.2946 ( 8238 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4641 -37.4641 -37.4631 -37.4631 -37.1763 -37.1763 -37.1760 -37.1760 -37.1759 -37.1759 -37.1741 -37.1741 -25.2493 -25.2493 -25.2458 -25.2458 -9.0243 -9.0243 -9.0142 -9.0142 -8.7594 -8.7594 -8.7546 -8.7546 -8.6662 -8.6662 -8.6587 -8.6587 -4.2641 -4.2641 -4.1988 -4.1988 1.6580 1.6580 1.6828 1.6828 4.0021 4.0021 4.1721 4.1721 4.3598 4.3598 4.4995 4.4995 7.1169 7.1169 7.3080 7.3080 8.1854 8.1854 8.4516 8.4516 9.3181 9.3181 k = 0.0000 0.4714 0.2946 ( 8228 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4640 -37.4640 -37.4633 -37.4633 -37.1762 -37.1762 -37.1760 -37.1760 -37.1756 -37.1756 -37.1744 -37.1744 -25.2487 -25.2487 -25.2463 -25.2463 -9.0231 -9.0231 -9.0163 -9.0163 -8.7588 -8.7588 -8.7555 -8.7555 -8.6650 -8.6650 -8.6599 -8.6599 -4.2501 -4.2501 -4.2065 -4.2065 1.6531 1.6531 1.6689 1.6689 4.0303 4.0303 4.1457 4.1457 4.3820 4.3820 4.4758 4.4758 7.1380 7.1380 7.2673 7.2673 8.2300 8.2300 8.4079 8.4079 9.3319 9.3319 k = 0.0000 0.4857 0.2946 ( 8214 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4638 -37.4638 -37.4634 -37.4634 -37.1762 -37.1762 -37.1761 -37.1761 -37.1753 -37.1753 -37.1747 -37.1747 -25.2481 -25.2481 -25.2469 -25.2469 -9.0217 -9.0217 -9.0183 -9.0183 -8.7580 -8.7580 -8.7564 -8.7564 -8.6637 -8.6637 -8.6612 -8.6612 -4.2374 -4.2374 -4.2155 -4.2155 1.6515 1.6515 1.6591 1.6591 4.0593 4.0593 4.1177 4.1177 4.4050 4.4050 4.4521 4.4521 7.1641 7.1641 7.2293 7.2293 8.2747 8.2747 8.3638 8.3638 9.3486 9.3486 k = 0.0000 0.5000 0.2946 ( 8204 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0201 -9.0201 -9.0201 -9.0201 -8.7572 -8.7572 -8.7572 -8.7572 -8.6625 -8.6625 -8.6625 -8.6625 -4.2258 -4.2258 -4.2258 -4.2258 1.6534 1.6534 1.6534 1.6534 4.0886 4.0886 4.0886 4.0886 4.4284 4.4284 4.4284 4.4284 7.1947 7.1947 7.1947 7.1947 8.3194 8.3194 8.3194 8.3194 9.3681 9.3681 k = 0.0000 0.5000 0.2946 ( 8204 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0201 -9.0201 -9.0201 -9.0201 -8.7572 -8.7572 -8.7572 -8.7572 -8.6625 -8.6625 -8.6625 -8.6625 -4.2258 -4.2258 -4.2258 -4.2258 1.6534 1.6534 1.6534 1.6534 4.0886 4.0886 4.0886 4.0886 4.4284 4.4284 4.4284 4.4284 7.1947 7.1947 7.1947 7.1947 8.3194 8.3194 8.3194 8.3194 9.3681 9.3681 k = 0.0143 0.5000 0.2946 ( 8208 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1762 -37.1762 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0205 -9.0205 -9.0197 -9.0197 -8.7594 -8.7594 -8.7551 -8.7551 -8.6643 -8.6643 -8.6608 -8.6608 -4.2256 -4.2256 -4.2256 -4.2256 1.6537 1.6537 1.6547 1.6547 4.0875 4.0875 4.0884 4.0884 4.4222 4.4222 4.4249 4.4249 7.1965 7.1965 7.2004 7.2004 8.3233 8.3233 8.3241 8.3241 9.3624 9.3624 k = 0.0286 0.5000 0.2946 ( 8228 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1763 -37.1763 -37.1763 -37.1763 -37.1749 -37.1749 -37.1749 -37.1749 -25.2475 -25.2475 -25.2475 -25.2475 -9.0207 -9.0207 -9.0192 -9.0192 -8.7616 -8.7616 -8.7531 -8.7531 -8.6663 -8.6663 -8.6592 -8.6592 -4.2250 -4.2250 -4.2250 -4.2250 1.6555 1.6555 1.6575 1.6575 4.0848 4.0848 4.0868 4.0868 4.4067 4.4067 4.4118 4.4118 7.2054 7.2054 7.2131 7.2131 8.3357 8.3357 8.3375 8.3375 9.3487 9.3487 k = 0.0429 0.5000 0.2946 ( 8236 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1765 -37.1765 -37.1764 -37.1764 -37.1748 -37.1748 -37.1747 -37.1747 -25.2474 -25.2474 -25.2474 -25.2474 -9.0208 -9.0208 -9.0186 -9.0186 -8.7638 -8.7638 -8.7511 -8.7511 -8.6685 -8.6685 -8.6578 -8.6578 -4.2241 -4.2241 -4.2241 -4.2241 1.6588 1.6588 1.6618 1.6618 4.0804 4.0804 4.0839 4.0839 4.3825 4.3825 4.3894 4.3894 7.2212 7.2212 7.2324 7.2324 8.3563 8.3563 8.3590 8.3590 9.3280 9.3280 k = 0.0571 0.5000 0.2946 ( 8228 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1767 -37.1767 -37.1766 -37.1766 -37.1746 -37.1746 -37.1745 -37.1745 -25.2474 -25.2474 -25.2474 -25.2474 -9.0209 -9.0209 -9.0179 -9.0179 -8.7661 -8.7661 -8.7491 -8.7491 -8.6707 -8.6707 -8.6566 -8.6566 -4.2228 -4.2228 -4.2227 -4.2227 1.6636 1.6636 1.6676 1.6676 4.0738 4.0738 4.0798 4.0798 4.3510 4.3510 4.3585 4.3585 7.2431 7.2431 7.2574 7.2574 8.3843 8.3843 8.3879 8.3879 9.3016 9.3016 k = 0.0714 0.5000 0.2946 ( 8228 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1768 -37.1768 -37.1768 -37.1768 -37.1744 -37.1744 -37.1743 -37.1743 -25.2474 -25.2474 -25.2474 -25.2474 -9.0208 -9.0208 -9.0171 -9.0171 -8.7683 -8.7683 -8.7473 -8.7473 -8.6731 -8.6731 -8.6556 -8.6556 -4.2211 -4.2211 -4.2210 -4.2210 1.6699 1.6699 1.6749 1.6749 4.0646 4.0646 4.0743 4.0743 4.3135 4.3135 4.3201 4.3201 7.2703 7.2703 7.2873 7.2873 8.4185 8.4185 8.4230 8.4230 9.2714 9.2714 k = 0.0857 0.5000 0.2946 ( 8228 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1770 -37.1770 -37.1769 -37.1769 -37.1742 -37.1742 -37.1741 -37.1741 -25.2473 -25.2473 -25.2473 -25.2473 -9.0207 -9.0207 -9.0163 -9.0163 -8.7706 -8.7706 -8.7455 -8.7455 -8.6756 -8.6756 -8.6547 -8.6547 -4.2191 -4.2191 -4.2190 -4.2190 1.6775 1.6775 1.6836 1.6836 4.0516 4.0516 4.0673 4.0673 4.2723 4.2723 4.2753 4.2753 7.3016 7.3016 7.3209 7.3209 8.4571 8.4571 8.4624 8.4624 9.2397 9.2397 k = 0.1000 0.5000 0.2946 ( 8212 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1772 -37.1772 -37.1771 -37.1771 -37.1740 -37.1740 -37.1739 -37.1739 -25.2472 -25.2472 -25.2472 -25.2472 -9.0204 -9.0204 -9.0154 -9.0154 -8.7728 -8.7728 -8.7438 -8.7438 -8.6781 -8.6781 -8.6540 -8.6540 -4.2167 -4.2167 -4.2166 -4.2166 1.6864 1.6864 1.6937 1.6937 4.0333 4.0333 4.0586 4.0586 4.2255 4.2255 4.2299 4.2299 7.3363 7.3363 7.3575 7.3575 8.4976 8.4976 8.5030 8.5030 9.2096 9.2096 k = 0.1143 0.5000 0.2946 ( 8208 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1774 -37.1774 -37.1773 -37.1773 -37.1738 -37.1738 -37.1737 -37.1737 -25.2472 -25.2472 -25.2472 -25.2472 -9.0201 -9.0201 -9.0144 -9.0144 -8.7750 -8.7750 -8.7422 -8.7422 -8.6808 -8.6808 -8.6534 -8.6534 -4.2141 -4.2141 -4.2140 -4.2140 1.6966 1.6966 1.7050 1.7050 4.0076 4.0076 4.0475 4.0475 4.1725 4.1725 4.1896 4.1896 7.3736 7.3736 7.3962 7.3962 8.5363 8.5363 8.5411 8.5411 9.1845 9.1845 k = 0.1286 0.5000 0.2946 ( 8224 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1776 -37.1776 -37.1775 -37.1775 -37.1736 -37.1736 -37.1735 -37.1735 -25.2471 -25.2471 -25.2471 -25.2471 -9.0198 -9.0198 -9.0134 -9.0134 -8.7771 -8.7771 -8.7407 -8.7407 -8.6834 -8.6834 -8.6530 -8.6530 -4.2111 -4.2111 -4.2110 -4.2110 1.7080 1.7080 1.7176 1.7176 3.9725 3.9725 4.0322 4.0322 4.1191 4.1191 4.1543 4.1543 7.4127 7.4127 7.4365 7.4365 8.5688 8.5688 8.5716 8.5716 9.1681 9.1681 k = 0.1429 0.5000 0.2946 ( 8224 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1778 -37.1778 -37.1777 -37.1777 -37.1734 -37.1734 -37.1734 -37.1734 -25.2470 -25.2470 -25.2470 -25.2470 -9.0193 -9.0193 -9.0124 -9.0124 -8.7792 -8.7792 -8.7393 -8.7393 -8.6861 -8.6861 -8.6528 -8.6528 -4.2079 -4.2079 -4.2077 -4.2077 1.7205 1.7205 1.7313 1.7313 3.9280 3.9280 4.0070 4.0070 4.0721 4.0721 4.1252 4.1252 7.4531 7.4531 7.4778 7.4778 8.5898 8.5898 8.5907 8.5907 9.1631 9.1631 k = 0.1571 0.5000 0.2946 ( 8232 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4636 -37.4636 -37.1780 -37.1780 -37.1779 -37.1779 -37.1733 -37.1733 -37.1732 -37.1732 -25.2469 -25.2469 -25.2469 -25.2469 -9.0189 -9.0189 -9.0114 -9.0114 -8.7812 -8.7812 -8.7380 -8.7380 -8.6888 -8.6888 -8.6527 -8.6527 -4.2043 -4.2043 -4.2042 -4.2042 1.7339 1.7339 1.7460 1.7460 3.8761 3.8761 3.9637 3.9637 4.0404 4.0404 4.1010 4.1010 7.4945 7.4945 7.5198 7.5198 8.5932 8.5932 8.5991 8.5991 9.1694 9.1694 k = 0.1714 0.5000 0.2946 ( 8228 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1782 -37.1782 -37.1781 -37.1781 -37.1731 -37.1731 -37.1730 -37.1730 -25.2468 -25.2468 -25.2468 -25.2468 -9.0184 -9.0184 -9.0104 -9.0104 -8.7831 -8.7831 -8.7368 -8.7368 -8.6915 -8.6915 -8.6528 -8.6528 -4.2006 -4.2006 -4.2005 -4.2005 1.7481 1.7481 1.7616 1.7616 3.8194 3.8194 3.9083 3.9083 4.0192 4.0192 4.0799 4.0799 7.5364 7.5364 7.5623 7.5623 8.5824 8.5824 8.5938 8.5938 9.1788 9.1788 k = 0.1857 0.5000 0.2946 ( 8232 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1784 -37.1784 -37.1783 -37.1783 -37.1729 -37.1729 -37.1728 -37.1728 -25.2467 -25.2467 -25.2467 -25.2467 -9.0178 -9.0178 -9.0094 -9.0094 -8.7848 -8.7848 -8.7358 -8.7358 -8.6940 -8.6940 -8.6531 -8.6531 -4.1967 -4.1967 -4.1965 -4.1965 1.7630 1.7630 1.7779 1.7779 3.7603 3.7603 3.8490 3.8490 4.0007 4.0007 4.0602 4.0602 7.5787 7.5787 7.6049 7.6049 8.5608 8.5608 8.5773 8.5773 9.1869 9.1869 k = 0.2000 0.5000 0.2946 ( 8220 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1785 -37.1785 -37.1784 -37.1784 -37.1727 -37.1727 -37.1726 -37.1726 -25.2466 -25.2466 -25.2466 -25.2466 -9.0172 -9.0172 -9.0084 -9.0084 -8.7864 -8.7864 -8.7350 -8.7350 -8.6965 -8.6965 -8.6535 -8.6535 -4.1926 -4.1926 -4.1924 -4.1924 1.7785 1.7785 1.7948 1.7948 3.7005 3.7005 3.7894 3.7894 3.9822 3.9822 4.0409 4.0409 7.6209 7.6209 7.6475 7.6475 8.5321 8.5321 8.5532 8.5532 9.1906 9.1906 k = 0.2143 0.5000 0.2946 ( 8216 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1787 -37.1787 -37.1786 -37.1786 -37.1725 -37.1725 -37.1725 -37.1725 -25.2465 -25.2465 -25.2465 -25.2465 -9.0167 -9.0167 -9.0075 -9.0075 -8.7878 -8.7878 -8.7344 -8.7344 -8.6987 -8.6987 -8.6540 -8.6540 -4.1883 -4.1883 -4.1882 -4.1882 1.7943 1.7943 1.8121 1.8121 3.6414 3.6414 3.7309 3.7309 3.9629 3.9629 4.0214 4.0214 7.6629 7.6629 7.6898 7.6898 8.5001 8.5001 8.5250 8.5250 9.1859 9.1859 k = 0.2286 0.5000 0.2946 ( 8208 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1788 -37.1788 -37.1788 -37.1788 -37.1723 -37.1723 -37.1723 -37.1723 -25.2464 -25.2464 -25.2464 -25.2464 -9.0161 -9.0161 -9.0067 -9.0067 -8.7891 -8.7891 -8.7340 -8.7340 -8.7007 -8.7007 -8.6546 -8.6546 -4.1840 -4.1840 -4.1838 -4.1838 1.8104 1.8104 1.8296 1.8296 3.5838 3.5838 3.6743 3.6743 3.9424 3.9424 4.0011 4.0011 7.7041 7.7041 7.7311 7.7311 8.4675 8.4675 8.4956 8.4956 9.1718 9.1718 k = 0.2429 0.5000 0.2946 ( 8220 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1790 -37.1790 -37.1789 -37.1789 -37.1722 -37.1722 -37.1721 -37.1721 -25.2463 -25.2463 -25.2463 -25.2463 -9.0155 -9.0155 -9.0059 -9.0059 -8.7902 -8.7902 -8.7340 -8.7340 -8.7024 -8.7024 -8.6554 -8.6554 -4.1796 -4.1796 -4.1794 -4.1794 1.8264 1.8264 1.8471 1.8471 3.5287 3.5287 3.6203 3.6203 3.9207 3.9207 3.9799 3.9799 7.7440 7.7440 7.7711 7.7711 8.4366 8.4366 8.4674 8.4674 9.1491 9.1491 k = 0.2571 0.5000 0.2946 ( 8212 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1791 -37.1791 -37.1791 -37.1791 -37.1720 -37.1720 -37.1720 -37.1720 -25.2462 -25.2462 -25.2462 -25.2462 -9.0149 -9.0149 -9.0053 -9.0053 -8.7910 -8.7910 -8.7344 -8.7344 -8.7037 -8.7037 -8.6563 -8.6563 -4.1751 -4.1751 -4.1749 -4.1749 1.8423 1.8423 1.8643 1.8643 3.4765 3.4765 3.5695 3.5695 3.8977 3.8977 3.9577 3.9577 7.7818 7.7818 7.8087 7.8087 8.4094 8.4094 8.4422 8.4422 9.1193 9.1193 k = 0.2714 0.5000 0.2946 ( 8212 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1793 -37.1793 -37.1792 -37.1792 -37.1719 -37.1719 -37.1718 -37.1718 -25.2461 -25.2461 -25.2461 -25.2461 -9.0143 -9.0143 -9.0047 -9.0047 -8.7916 -8.7916 -8.7352 -8.7352 -8.7046 -8.7046 -8.6574 -8.6574 -4.1706 -4.1706 -4.1704 -4.1704 1.8579 1.8579 1.8812 1.8812 3.4279 3.4279 3.5223 3.5223 3.8734 3.8734 3.9344 3.9344 7.8166 7.8166 7.8428 7.8428 8.3878 8.3878 8.4218 8.4218 9.0846 9.0846 k = 0.2857 0.5000 0.2946 ( 8212 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1794 -37.1794 -37.1794 -37.1794 -37.1717 -37.1717 -37.1717 -37.1717 -25.2460 -25.2460 -25.2460 -25.2460 -9.0138 -9.0138 -9.0042 -9.0042 -8.7920 -8.7920 -8.7363 -8.7363 -8.7050 -8.7050 -8.6585 -8.6585 -4.1662 -4.1662 -4.1660 -4.1660 1.8728 1.8728 1.8973 1.8973 3.3833 3.3833 3.4791 3.4791 3.8478 3.8478 3.9099 3.9099 7.8473 7.8473 7.8722 7.8722 8.3735 8.3735 8.4079 8.4079 9.0467 9.0467 k = 0.3000 0.5000 0.2946 ( 8212 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1795 -37.1795 -37.1795 -37.1795 -37.1716 -37.1716 -37.1715 -37.1715 -25.2459 -25.2459 -25.2459 -25.2459 -9.0132 -9.0132 -9.0038 -9.0038 -8.7922 -8.7922 -8.7379 -8.7379 -8.7051 -8.7051 -8.6598 -8.6598 -4.1618 -4.1618 -4.1616 -4.1616 1.8871 1.8871 1.9125 1.9125 3.3433 3.3433 3.4403 3.4403 3.8211 3.8211 3.8842 3.8842 7.8729 7.8729 7.8956 7.8956 8.3680 8.3680 8.4016 8.4016 9.0071 9.0071 k = 0.3143 0.5000 0.2946 ( 8208 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1797 -37.1797 -37.1796 -37.1796 -37.1715 -37.1715 -37.1714 -37.1714 -25.2458 -25.2458 -25.2458 -25.2458 -9.0127 -9.0127 -9.0036 -9.0036 -8.7921 -8.7921 -8.7397 -8.7397 -8.7047 -8.7047 -8.6611 -8.6611 -4.1575 -4.1575 -4.1574 -4.1574 1.9004 1.9004 1.9265 1.9265 3.3080 3.3080 3.4060 3.4060 3.7934 3.7934 3.8576 3.8576 7.8925 7.8925 7.9121 7.9121 8.3722 8.3722 8.4038 8.4038 8.9671 8.9671 k = 0.3286 0.5000 0.2946 ( 8216 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1798 -37.1798 -37.1797 -37.1797 -37.1714 -37.1714 -37.1713 -37.1713 -25.2457 -25.2457 -25.2457 -25.2457 -9.0122 -9.0122 -9.0034 -9.0034 -8.7918 -8.7918 -8.7418 -8.7418 -8.7041 -8.7041 -8.6626 -8.6626 -4.1534 -4.1534 -4.1533 -4.1533 1.9127 1.9127 1.9392 1.9392 3.2778 3.2778 3.3764 3.3764 3.7648 3.7648 3.8300 3.8300 7.9058 7.9058 7.9216 7.9216 8.3857 8.3857 8.4146 8.4146 8.9276 8.9276 k = 0.3429 0.5000 0.2946 ( 8220 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4637 -37.4637 -37.1799 -37.1799 -37.1798 -37.1798 -37.1712 -37.1712 -37.1712 -37.1712 -25.2456 -25.2456 -25.2456 -25.2456 -9.0117 -9.0117 -9.0034 -9.0034 -8.7912 -8.7912 -8.7441 -8.7441 -8.7032 -8.7032 -8.6641 -8.6641 -4.1495 -4.1495 -4.1493 -4.1493 1.9239 1.9239 1.9504 1.9504 3.2529 3.2529 3.3516 3.3516 3.7355 3.7355 3.8015 3.8015 7.9134 7.9134 7.9252 7.9252 8.4075 8.4075 8.4331 8.4331 8.8896 8.8896 k = 0.3571 0.5000 0.2946 ( 8208 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4637 -37.4637 -37.1800 -37.1800 -37.1799 -37.1799 -37.1711 -37.1711 -37.1711 -37.1711 -25.2455 -25.2455 -25.2455 -25.2455 -9.0113 -9.0113 -9.0034 -9.0034 -8.7904 -8.7904 -8.7465 -8.7465 -8.7021 -8.7021 -8.6658 -8.6658 -4.1457 -4.1457 -4.1456 -4.1456 1.9339 1.9339 1.9599 1.9599 3.2334 3.2334 3.3316 3.3316 3.7058 3.7058 3.7725 3.7725 7.9163 7.9163 7.9243 7.9243 8.4352 8.4352 8.4576 8.4576 8.8539 8.8539 k = 0.3714 0.5000 0.2946 ( 8208 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1801 -37.1801 -37.1800 -37.1800 -37.1710 -37.1710 -37.1710 -37.1710 -25.2454 -25.2454 -25.2454 -25.2454 -9.0108 -9.0108 -9.0035 -9.0035 -8.7894 -8.7894 -8.7490 -8.7490 -8.7008 -8.7008 -8.6675 -8.6675 -4.1423 -4.1423 -4.1421 -4.1421 1.9426 1.9426 1.9678 1.9678 3.2192 3.2192 3.3161 3.3161 3.6761 3.6761 3.7430 3.7430 7.9157 7.9157 7.9205 7.9205 8.4665 8.4665 8.4861 8.4861 8.8212 8.8212 k = 0.3857 0.5000 0.2946 ( 8208 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1801 -37.1801 -37.1801 -37.1801 -37.1710 -37.1710 -37.1709 -37.1709 -25.2453 -25.2453 -25.2453 -25.2453 -9.0104 -9.0104 -9.0037 -9.0037 -8.7881 -8.7881 -8.7516 -8.7516 -8.6994 -8.6994 -8.6692 -8.6692 -4.1390 -4.1390 -4.1389 -4.1389 1.9502 1.9502 1.9740 1.9740 3.2102 3.2102 3.3049 3.3049 3.6466 3.6466 3.7134 3.7134 7.9129 7.9129 7.9151 7.9151 8.4989 8.4989 8.5161 8.5161 8.7926 8.7926 k = 0.4000 0.5000 0.2946 ( 8196 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1802 -37.1802 -37.1802 -37.1802 -37.1709 -37.1709 -37.1709 -37.1709 -25.2453 -25.2453 -25.2453 -25.2453 -9.0099 -9.0099 -9.0040 -9.0040 -8.7867 -8.7867 -8.7542 -8.7542 -8.6978 -8.6978 -8.6711 -8.6711 -4.1361 -4.1361 -4.1360 -4.1360 1.9567 1.9567 1.9787 1.9787 3.2061 3.2061 3.2975 3.2975 3.6181 3.6181 3.6839 3.6839 7.9088 7.9088 7.9092 7.9092 8.5299 8.5299 8.5449 8.5449 8.7694 8.7694 k = 0.4143 0.5000 0.2946 ( 8196 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1803 -37.1803 -37.1802 -37.1802 -37.1708 -37.1708 -37.1708 -37.1708 -25.2452 -25.2452 -25.2452 -25.2452 -9.0095 -9.0095 -9.0043 -9.0043 -8.7851 -8.7851 -8.7569 -8.7569 -8.6961 -8.6961 -8.6729 -8.6729 -4.1336 -4.1336 -4.1335 -4.1335 1.9621 1.9621 1.9819 1.9819 3.2067 3.2067 3.2931 3.2931 3.5911 3.5911 3.6549 3.6549 7.9034 7.9034 7.9043 7.9043 8.5567 8.5567 8.5695 8.5695 8.7531 8.7531 k = 0.4286 0.5000 0.2946 ( 8208 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1803 -37.1803 -37.1803 -37.1803 -37.1708 -37.1708 -37.1708 -37.1708 -25.2452 -25.2452 -25.2452 -25.2452 -9.0091 -9.0091 -9.0047 -9.0047 -8.7833 -8.7833 -8.7595 -8.7595 -8.6944 -8.6944 -8.6749 -8.6749 -4.1313 -4.1313 -4.1312 -4.1312 1.9667 1.9667 1.9839 1.9839 3.2112 3.2112 3.2909 3.2909 3.5667 3.5667 3.6269 3.6269 7.8982 7.8982 7.8998 7.8998 8.5768 8.5768 8.5869 8.5869 8.7455 8.7455 k = 0.4429 0.5000 0.2946 ( 8212 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1803 -37.1803 -37.1707 -37.1707 -37.1707 -37.1707 -25.2451 -25.2451 -25.2451 -25.2451 -9.0086 -9.0086 -9.0051 -9.0051 -8.7814 -8.7814 -8.7622 -8.7622 -8.6926 -8.6926 -8.6768 -8.6768 -4.1295 -4.1295 -4.1294 -4.1294 1.9706 1.9706 1.9847 1.9847 3.2192 3.2192 3.2896 3.2896 3.5459 3.5459 3.6003 3.6003 7.8939 7.8939 7.8957 7.8957 8.5888 8.5888 8.5958 8.5958 8.7467 8.7467 k = 0.4571 0.5000 0.2946 ( 8208 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1707 -37.1707 -37.1707 -37.1707 -25.2451 -25.2451 -25.2451 -25.2451 -9.0082 -9.0082 -9.0055 -9.0055 -8.7793 -8.7793 -8.7648 -8.7648 -8.6907 -8.6907 -8.6788 -8.6788 -4.1280 -4.1280 -4.1280 -4.1280 1.9739 1.9739 1.9847 1.9847 3.2298 3.2298 3.2877 3.2877 3.5303 3.5303 3.5759 3.5759 7.8906 7.8906 7.8923 7.8923 8.5938 8.5938 8.5979 8.5979 8.7539 8.7539 k = 0.4714 0.5000 0.2946 ( 8204 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1707 -37.1707 -37.1706 -37.1706 -25.2451 -25.2451 -25.2451 -25.2451 -9.0078 -9.0078 -9.0059 -9.0059 -8.7771 -8.7771 -8.7674 -8.7674 -8.6888 -8.6888 -8.6808 -8.6808 -4.1270 -4.1270 -4.1269 -4.1269 1.9767 1.9767 1.9840 1.9840 3.2421 3.2421 3.2837 3.2837 3.5211 3.5211 3.5545 3.5545 7.8883 7.8883 7.8896 7.8896 8.5947 8.5947 8.5968 8.5968 8.7627 8.7627 k = 0.4857 0.5000 0.2946 ( 8200 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0073 -9.0073 -9.0064 -9.0064 -8.7748 -8.7748 -8.7699 -8.7699 -8.6868 -8.6868 -8.6828 -8.6828 -4.1263 -4.1263 -4.1263 -4.1263 1.9791 1.9791 1.9828 1.9828 3.2549 3.2549 3.2768 3.2768 3.5193 3.5193 3.5371 3.5371 7.8871 7.8871 7.8878 7.8878 8.5942 8.5942 8.5950 8.5950 8.7696 8.7696 k = 0.5000 0.5000 0.2946 ( 8200 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0069 -9.0069 -9.0069 -9.0069 -8.7724 -8.7724 -8.7724 -8.7724 -8.6848 -8.6848 -8.6848 -8.6848 -4.1261 -4.1261 -4.1261 -4.1261 1.9811 1.9811 1.9811 1.9811 3.2669 3.2669 3.2669 3.2669 3.5249 3.5249 3.5249 3.5249 7.8870 7.8870 7.8870 7.8870 8.5940 8.5940 8.5940 8.5940 8.7727 8.7727 k = 0.5000 0.5000 0.2946 ( 8200 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0069 -9.0069 -9.0069 -9.0069 -8.7724 -8.7724 -8.7724 -8.7724 -8.6848 -8.6848 -8.6848 -8.6848 -4.1261 -4.1261 -4.1261 -4.1261 1.9811 1.9811 1.9811 1.9811 3.2669 3.2669 3.2669 3.2669 3.5249 3.5249 3.5249 3.5249 7.8870 7.8870 7.8870 7.8870 8.5940 8.5940 8.5940 8.5940 8.7727 8.7727 k = 0.4898 0.4898 0.2946 ( 8200 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2451 -25.2451 -25.2450 -25.2450 -9.0073 -9.0073 -9.0064 -9.0064 -8.7748 -8.7748 -8.7699 -8.7699 -8.6868 -8.6868 -8.6828 -8.6828 -4.1266 -4.1266 -4.1261 -4.1261 1.9786 1.9786 1.9833 1.9833 3.2539 3.2539 3.2779 3.2779 3.5189 3.5189 3.5376 3.5376 7.8869 7.8869 7.8881 7.8881 8.5942 8.5942 8.5950 8.5950 8.7675 8.7675 k = 0.4796 0.4796 0.2946 ( 8208 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1707 -37.1707 -37.1706 -37.1706 -25.2451 -25.2451 -25.2450 -25.2450 -9.0078 -9.0078 -9.0059 -9.0059 -8.7771 -8.7771 -8.7673 -8.7673 -8.6888 -8.6888 -8.6808 -8.6808 -4.1279 -4.1279 -4.1260 -4.1260 1.9738 1.9738 1.9871 1.9871 3.2358 3.2358 3.2907 3.2907 3.5178 3.5178 3.5573 3.5573 7.8868 7.8868 7.8911 7.8911 8.5956 8.5956 8.5975 8.5975 8.7526 8.7526 k = 0.4694 0.4694 0.2946 ( 8202 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4637 -37.4637 -37.1804 -37.1804 -37.1803 -37.1803 -37.1707 -37.1707 -37.1706 -37.1706 -25.2452 -25.2452 -25.2450 -25.2450 -9.0082 -9.0082 -9.0055 -9.0055 -8.7793 -8.7793 -8.7647 -8.7647 -8.6907 -8.6907 -8.6787 -8.6787 -4.1303 -4.1303 -4.1259 -4.1259 1.9664 1.9664 1.9931 1.9931 3.2124 3.2124 3.3079 3.3079 3.5202 3.5202 3.5831 3.5831 7.8863 7.8863 7.8961 7.8961 8.5984 8.5984 8.6015 8.6015 8.7292 8.7292 k = 0.4592 0.4592 0.2946 ( 8210 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4639 -37.4639 -37.4637 -37.4637 -37.1804 -37.1804 -37.1803 -37.1803 -37.1708 -37.1708 -37.1706 -37.1706 -25.2453 -25.2453 -25.2449 -25.2449 -9.0087 -9.0087 -9.0050 -9.0050 -8.7814 -8.7814 -8.7621 -8.7621 -8.6926 -8.6926 -8.6767 -8.6767 -4.1335 -4.1335 -4.1257 -4.1257 1.9566 1.9566 2.0015 2.0015 3.1852 3.1852 3.3298 3.3298 3.5253 3.5253 3.6134 3.6134 7.8849 7.8849 7.9033 7.9033 8.6031 8.6031 8.6072 8.6072 8.6989 8.6989 k = 0.4490 0.4490 0.2946 ( 8214 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4639 -37.4639 -37.4637 -37.4637 -37.1804 -37.1804 -37.1802 -37.1802 -37.1709 -37.1709 -37.1706 -37.1706 -25.2455 -25.2455 -25.2448 -25.2448 -9.0091 -9.0091 -9.0046 -9.0046 -8.7834 -8.7834 -8.7595 -8.7595 -8.6944 -8.6944 -8.6748 -8.6748 -4.1377 -4.1377 -4.1255 -4.1255 1.9450 1.9450 2.0122 2.0122 3.1556 3.1556 3.3563 3.3563 3.5326 3.5326 3.6469 3.6469 7.8820 7.8820 7.9125 7.9125 8.6097 8.6097 8.6151 8.6151 8.6645 8.6645 k = 0.4388 0.4388 0.2946 ( 8214 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4639 -37.4639 -37.4636 -37.4636 -37.1804 -37.1804 -37.1801 -37.1801 -37.1710 -37.1710 -37.1706 -37.1706 -25.2457 -25.2457 -25.2447 -25.2447 -9.0095 -9.0095 -9.0041 -9.0041 -8.7852 -8.7852 -8.7569 -8.7569 -8.6961 -8.6961 -8.6728 -8.6728 -4.1428 -4.1428 -4.1253 -4.1253 1.9321 1.9321 2.0253 2.0253 3.1246 3.1246 3.3867 3.3867 3.5420 3.5420 3.6827 3.6827 7.8770 7.8770 7.9240 7.9240 8.6113 8.6113 8.6240 8.6240 8.6366 8.6366 k = 0.4286 0.4286 0.2946 ( 8214 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4640 -37.4640 -37.4636 -37.4636 -37.1804 -37.1804 -37.1800 -37.1800 -37.1711 -37.1711 -37.1707 -37.1707 -25.2459 -25.2459 -25.2446 -25.2446 -9.0099 -9.0099 -9.0037 -9.0037 -8.7868 -8.7868 -8.7544 -8.7544 -8.6977 -8.6977 -8.6709 -8.6709 -4.1489 -4.1489 -4.1252 -4.1252 1.9183 1.9183 2.0408 2.0408 3.0930 3.0930 3.4202 3.4202 3.5534 3.5534 3.7200 3.7200 7.8693 7.8693 7.9377 7.9377 8.5803 8.5803 8.6319 8.6319 8.6480 8.6480 k = 0.4184 0.4184 0.2946 ( 8216 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4640 -37.4640 -37.4635 -37.4635 -37.1804 -37.1804 -37.1799 -37.1799 -37.1712 -37.1712 -37.1707 -37.1707 -25.2462 -25.2462 -25.2445 -25.2445 -9.0103 -9.0103 -9.0032 -9.0032 -8.7882 -8.7882 -8.7519 -8.7519 -8.6992 -8.6992 -8.6691 -8.6691 -4.1559 -4.1559 -4.1251 -4.1251 1.9044 1.9044 2.0586 2.0586 3.0615 3.0615 3.4560 3.4560 3.5668 3.5668 3.7585 3.7585 7.8586 7.8586 7.9539 7.9539 8.5419 8.5419 8.6429 8.6429 8.6715 8.6715 k = 0.4082 0.4082 0.2946 ( 8222 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4641 -37.4641 -37.4635 -37.4635 -37.1803 -37.1803 -37.1798 -37.1798 -37.1714 -37.1714 -37.1707 -37.1707 -25.2465 -25.2465 -25.2444 -25.2444 -9.0106 -9.0106 -9.0027 -9.0027 -8.7895 -8.7895 -8.7496 -8.7496 -8.7005 -8.7005 -8.6673 -8.6673 -4.1638 -4.1638 -4.1251 -4.1251 1.8906 1.8906 2.0788 2.0788 3.0304 3.0304 3.4931 3.4931 3.5826 3.5826 3.7978 3.7978 7.8448 7.8448 7.9727 7.9727 8.5045 8.5045 8.6557 8.6557 8.7020 8.7020 k = 0.3980 0.3980 0.2946 ( 8224 PWs) bands (ev): -70.5231 -70.5231 -70.5230 -70.5230 -37.4641 -37.4641 -37.4634 -37.4634 -37.1803 -37.1803 -37.1796 -37.1796 -37.1716 -37.1716 -37.1707 -37.1707 -25.2468 -25.2468 -25.2442 -25.2442 -9.0110 -9.0110 -9.0022 -9.0022 -8.7905 -8.7905 -8.7474 -8.7474 -8.7015 -8.7015 -8.6655 -8.6655 -4.1728 -4.1728 -4.1253 -4.1253 1.8775 1.8775 2.1012 2.1012 3.0001 3.0001 3.5304 3.5304 3.6010 3.6010 3.8378 3.8378 7.8281 7.8281 7.9943 7.9943 8.4699 8.4699 8.6700 8.6700 8.7392 8.7392 k = 0.3878 0.3878 0.2946 ( 8240 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4642 -37.4642 -37.4633 -37.4633 -37.1803 -37.1803 -37.1795 -37.1795 -37.1718 -37.1718 -37.1707 -37.1707 -25.2472 -25.2472 -25.2441 -25.2441 -9.0114 -9.0114 -9.0016 -9.0016 -8.7914 -8.7914 -8.7454 -8.7454 -8.7024 -8.7024 -8.6638 -8.6638 -4.1826 -4.1826 -4.1256 -4.1256 1.8654 1.8654 2.1260 2.1260 2.9708 2.9708 3.5663 3.5663 3.6229 3.6229 3.8782 3.8782 7.8088 7.8088 8.0189 8.0189 8.4392 8.4392 8.6857 8.6857 8.7828 8.7828 k = 0.3776 0.3776 0.2946 ( 8236 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4643 -37.4643 -37.4632 -37.4632 -37.1803 -37.1803 -37.1793 -37.1793 -37.1720 -37.1720 -37.1707 -37.1707 -25.2475 -25.2475 -25.2439 -25.2439 -9.0117 -9.0117 -9.0010 -9.0010 -8.7920 -8.7920 -8.7436 -8.7436 -8.7029 -8.7029 -8.6622 -8.6622 -4.1935 -4.1935 -4.1262 -4.1262 1.8546 1.8546 2.1531 2.1531 2.9428 2.9428 3.5994 3.5994 3.6493 3.6493 3.9188 3.9188 7.7877 7.7877 8.0467 8.0467 8.4131 8.4131 8.7028 8.7028 8.8317 8.8317 k = 0.3673 0.3673 0.2946 ( 8236 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4644 -37.4644 -37.4631 -37.4631 -37.1803 -37.1803 -37.1791 -37.1791 -37.1722 -37.1722 -37.1707 -37.1707 -25.2480 -25.2480 -25.2437 -25.2437 -9.0121 -9.0121 -9.0003 -9.0003 -8.7924 -8.7924 -8.7421 -8.7421 -8.7032 -8.7032 -8.6607 -8.6607 -4.2052 -4.2052 -4.1270 -4.1270 1.8452 1.8452 2.1824 2.1824 2.9164 2.9164 3.6289 3.6289 3.6803 3.6803 3.9596 3.9596 7.7652 7.7652 8.0779 8.0779 8.3923 8.3923 8.7212 8.7212 8.8752 8.8752 k = 0.3571 0.3571 0.2946 ( 8228 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4645 -37.4645 -37.4630 -37.4630 -37.1803 -37.1803 -37.1789 -37.1789 -37.1724 -37.1724 -37.1707 -37.1707 -25.2484 -25.2484 -25.2435 -25.2435 -9.0125 -9.0125 -8.9995 -8.9995 -8.7926 -8.7926 -8.7408 -8.7408 -8.7031 -8.7031 -8.6592 -8.6592 -4.2178 -4.2178 -4.1281 -4.1281 1.8375 1.8375 2.2140 2.2140 2.8917 2.8917 3.6560 3.6560 3.7142 3.7142 4.0003 4.0003 7.7421 7.7421 8.1127 8.1127 8.3773 8.3773 8.7408 8.7408 8.8977 8.8977 k = 0.3469 0.3469 0.2946 ( 8234 PWs) bands (ev): -70.5232 -70.5232 -70.5229 -70.5229 -37.4646 -37.4646 -37.4629 -37.4629 -37.1802 -37.1802 -37.1787 -37.1787 -37.1726 -37.1726 -37.1707 -37.1707 -25.2489 -25.2489 -25.2433 -25.2433 -9.0129 -9.0129 -8.9986 -8.9986 -8.7925 -8.7925 -8.7399 -8.7399 -8.7026 -8.7026 -8.6578 -8.6578 -4.2314 -4.2314 -4.1296 -4.1296 1.8316 1.8316 2.2477 2.2477 2.8690 2.8690 3.6824 3.6824 3.7493 3.7493 4.0409 4.0409 7.7192 7.7192 8.1507 8.1507 8.3687 8.3687 8.7616 8.7616 8.9176 8.9176 k = 0.3367 0.3367 0.2946 ( 8226 PWs) bands (ev): -70.5232 -70.5232 -70.5228 -70.5228 -37.4647 -37.4647 -37.4628 -37.4628 -37.1802 -37.1802 -37.1785 -37.1785 -37.1729 -37.1729 -37.1706 -37.1706 -25.2493 -25.2493 -25.2431 -25.2431 -9.0133 -9.0133 -8.9975 -8.9975 -8.7922 -8.7922 -8.7393 -8.7393 -8.7018 -8.7018 -8.6565 -8.6565 -4.2458 -4.2458 -4.1314 -4.1314 1.8273 1.8273 2.2837 2.2837 2.8485 2.8485 3.7090 3.7090 3.7842 3.7842 4.0810 4.0810 7.6970 7.6970 8.1915 8.1915 8.3674 8.3674 8.7834 8.7834 8.9383 8.9383 k = 0.3265 0.3265 0.2946 ( 8228 PWs) bands (ev): -70.5233 -70.5233 -70.5228 -70.5228 -37.4648 -37.4648 -37.4626 -37.4626 -37.1802 -37.1802 -37.1783 -37.1783 -37.1731 -37.1731 -37.1706 -37.1706 -25.2498 -25.2498 -25.2429 -25.2429 -9.0138 -9.0138 -8.9964 -8.9964 -8.7917 -8.7917 -8.7389 -8.7389 -8.7008 -8.7008 -8.6553 -8.6553 -4.2609 -4.2609 -4.1337 -4.1337 1.8248 1.8248 2.3217 2.3217 2.8304 2.8304 3.7363 3.7363 3.8184 3.8184 4.1205 4.1205 7.6761 7.6761 8.2329 8.2329 8.3758 8.3758 8.8060 8.8060 8.9600 8.9600 k = 0.3163 0.3163 0.2946 ( 8232 PWs) bands (ev): -70.5233 -70.5233 -70.5228 -70.5228 -37.4649 -37.4649 -37.4625 -37.4625 -37.1802 -37.1802 -37.1780 -37.1780 -37.1734 -37.1734 -37.1706 -37.1706 -25.2504 -25.2504 -25.2426 -25.2426 -9.0142 -9.0142 -8.9951 -8.9951 -8.7910 -8.7910 -8.7388 -8.7388 -8.6994 -8.6994 -8.6541 -8.6541 -4.2769 -4.2769 -4.1364 -4.1364 1.8239 1.8239 2.3619 2.3619 2.8148 2.8148 3.7644 3.7644 3.8517 3.8517 4.1592 4.1592 7.6573 7.6573 8.2708 8.2708 8.3978 8.3978 8.8291 8.8291 8.9827 8.9827 k = 0.3061 0.3061 0.2946 ( 8244 PWs) bands (ev): -70.5233 -70.5233 -70.5228 -70.5228 -37.4650 -37.4650 -37.4624 -37.4624 -37.1802 -37.1802 -37.1778 -37.1778 -37.1737 -37.1737 -37.1706 -37.1706 -25.2509 -25.2509 -25.2424 -25.2424 -9.0147 -9.0147 -8.9937 -8.9937 -8.7901 -8.7901 -8.7389 -8.7389 -8.6978 -8.6978 -8.6530 -8.6530 -4.2936 -4.2936 -4.1395 -4.1395 1.8246 1.8246 2.4040 2.4040 2.8019 2.8019 3.7934 3.7934 3.8842 3.8842 4.1968 4.1968 7.6411 7.6411 8.3007 8.3007 8.4378 8.4378 8.8526 8.8526 9.0064 9.0064 k = 0.2959 0.2959 0.2946 ( 8240 PWs) bands (ev): -70.5234 -70.5234 -70.5227 -70.5227 -37.4651 -37.4651 -37.4623 -37.4623 -37.1802 -37.1802 -37.1776 -37.1776 -37.1739 -37.1739 -37.1706 -37.1706 -25.2514 -25.2514 -25.2422 -25.2422 -9.0151 -9.0151 -8.9922 -8.9922 -8.7890 -8.7890 -8.7392 -8.7392 -8.6961 -8.6961 -8.6520 -8.6520 -4.3108 -4.3108 -4.1432 -4.1432 1.8267 1.8267 2.4481 2.4481 2.7919 2.7919 3.8231 3.8231 3.9161 3.9161 4.2331 4.2331 7.6279 7.6279 8.3233 8.3233 8.4947 8.4947 8.8758 8.8758 9.0308 9.0308 k = 0.2857 0.2857 0.2946 ( 8246 PWs) bands (ev): -70.5234 -70.5234 -70.5227 -70.5227 -37.4652 -37.4652 -37.4621 -37.4621 -37.1802 -37.1802 -37.1774 -37.1774 -37.1742 -37.1742 -37.1705 -37.1705 -25.2520 -25.2520 -25.2419 -25.2419 -9.0156 -9.0156 -8.9906 -8.9906 -8.7877 -8.7877 -8.7396 -8.7396 -8.6942 -8.6942 -8.6511 -8.6511 -4.3287 -4.3287 -4.1474 -4.1474 1.8299 1.8299 2.4941 2.4941 2.7850 2.7850 3.8535 3.8535 3.9477 3.9477 4.2678 4.2678 7.6183 7.6183 8.3424 8.3424 8.5643 8.5643 8.8984 8.8984 9.0557 9.0557 k = 0.2755 0.2755 0.2946 ( 8250 PWs) bands (ev): -70.5234 -70.5234 -70.5227 -70.5227 -37.4654 -37.4654 -37.4620 -37.4620 -37.1802 -37.1802 -37.1772 -37.1772 -37.1745 -37.1745 -37.1705 -37.1705 -25.2526 -25.2526 -25.2417 -25.2417 -9.0160 -9.0160 -8.9888 -8.9888 -8.7862 -8.7862 -8.7400 -8.7400 -8.6923 -8.6923 -8.6502 -8.6502 -4.3471 -4.3471 -4.1520 -4.1520 1.8341 1.8341 2.5417 2.5417 2.7814 2.7814 3.8844 3.8844 3.9797 3.9797 4.3005 4.3005 7.6127 7.6127 8.3603 8.3603 8.6434 8.6434 8.9195 8.9195 9.0804 9.0804 k = 0.2653 0.2653 0.2946 ( 8254 PWs) bands (ev): -70.5234 -70.5234 -70.5227 -70.5227 -37.4655 -37.4655 -37.4619 -37.4619 -37.1802 -37.1802 -37.1770 -37.1770 -37.1747 -37.1747 -37.1704 -37.1704 -25.2531 -25.2531 -25.2414 -25.2414 -9.0164 -9.0164 -8.9869 -8.9869 -8.7846 -8.7846 -8.7405 -8.7405 -8.6903 -8.6903 -8.6494 -8.6494 -4.3659 -4.3659 -4.1572 -4.1572 1.8391 1.8391 2.5908 2.5908 2.7813 2.7813 3.9156 3.9156 4.0123 4.0123 4.3311 4.3311 7.6116 7.6116 8.3780 8.3780 8.7303 8.7303 8.9381 8.9381 9.1041 9.1041 k = 0.2551 0.2551 0.2946 ( 8260 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4656 -37.4656 -37.4617 -37.4617 -37.1802 -37.1802 -37.1767 -37.1767 -37.1750 -37.1750 -37.1704 -37.1704 -25.2537 -25.2537 -25.2412 -25.2412 -9.0167 -9.0167 -8.9849 -8.9849 -8.7828 -8.7828 -8.7411 -8.7411 -8.6883 -8.6883 -8.6486 -8.6486 -4.3850 -4.3850 -4.1630 -4.1630 1.8446 1.8446 2.6409 2.6409 2.7852 2.7852 3.9470 3.9470 4.0461 4.0461 4.3591 4.3591 7.6152 7.6152 8.3953 8.3953 8.8238 8.8238 8.9527 8.9527 9.1248 9.1248 k = 0.2449 0.2449 0.2946 ( 8264 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4658 -37.4658 -37.4616 -37.4616 -37.1802 -37.1802 -37.1765 -37.1765 -37.1753 -37.1753 -37.1703 -37.1703 -25.2543 -25.2543 -25.2409 -25.2409 -9.0170 -9.0170 -8.9828 -8.9828 -8.7809 -8.7809 -8.7416 -8.7416 -8.6864 -8.6864 -8.6479 -8.6479 -4.4044 -4.4044 -4.1692 -4.1692 1.8504 1.8504 2.6909 2.6909 2.7942 2.7942 3.9788 3.9788 4.0814 4.0814 4.3843 4.3843 7.6239 7.6239 8.4119 8.4119 8.9230 8.9230 8.9617 8.9617 9.1356 9.1356 k = 0.2347 0.2347 0.2946 ( 8252 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4659 -37.4659 -37.4615 -37.4615 -37.1802 -37.1802 -37.1763 -37.1763 -37.1755 -37.1755 -37.1702 -37.1702 -25.2548 -25.2548 -25.2406 -25.2406 -9.0173 -9.0173 -8.9806 -8.9806 -8.7789 -8.7789 -8.7421 -8.7421 -8.6846 -8.6846 -8.6471 -8.6471 -4.4239 -4.4239 -4.1759 -4.1759 1.8562 1.8562 2.7380 2.7380 2.8111 2.8111 4.0109 4.0109 4.1183 4.1183 4.4064 4.4064 7.6380 7.6380 8.4270 8.4270 8.9625 8.9625 9.0269 9.0269 9.0603 9.0603 k = 0.2245 0.2245 0.2946 ( 8256 PWs) bands (ev): -70.5235 -70.5235 -70.5226 -70.5226 -37.4660 -37.4660 -37.4613 -37.4613 -37.1803 -37.1803 -37.1761 -37.1761 -37.1757 -37.1757 -37.1702 -37.1702 -25.2554 -25.2554 -25.2404 -25.2404 -9.0175 -9.0175 -8.9783 -8.9783 -8.7769 -8.7769 -8.7425 -8.7425 -8.6828 -8.6828 -8.6463 -8.6463 -4.4435 -4.4435 -4.1830 -4.1830 1.8618 1.8618 2.7761 2.7761 2.8419 2.8419 4.0436 4.0436 4.1570 4.1570 4.4252 4.4252 7.6575 7.6575 8.4398 8.4398 8.9300 8.9300 8.9548 8.9548 9.1339 9.1339 k = 0.2143 0.2143 0.2946 ( 8244 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4661 -37.4661 -37.4612 -37.4612 -37.1803 -37.1803 -37.1760 -37.1760 -37.1759 -37.1759 -37.1701 -37.1701 -25.2560 -25.2560 -25.2401 -25.2401 -9.0176 -9.0176 -8.9760 -8.9760 -8.7748 -8.7748 -8.7429 -8.7429 -8.6813 -8.6813 -8.6455 -8.6455 -4.4631 -4.4631 -4.1905 -4.1905 1.8671 1.8671 2.8035 2.8035 2.8880 2.8880 4.0773 4.0773 4.1973 4.1973 4.4405 4.4405 7.6827 7.6827 8.4491 8.4491 8.8031 8.8031 8.9316 8.9316 9.0959 9.0959 k = 0.2041 0.2041 0.2946 ( 8244 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4662 -37.4662 -37.4611 -37.4611 -37.1803 -37.1803 -37.1761 -37.1761 -37.1758 -37.1758 -37.1700 -37.1700 -25.2565 -25.2565 -25.2399 -25.2399 -9.0176 -9.0176 -8.9736 -8.9736 -8.7728 -8.7728 -8.7431 -8.7431 -8.6799 -8.6799 -8.6445 -8.6445 -4.4825 -4.4825 -4.1984 -4.1984 1.8718 1.8718 2.8274 2.8274 2.9424 2.9424 4.1120 4.1120 4.2391 4.2391 4.4521 4.4521 7.7134 7.7134 8.4538 8.4538 8.6785 8.6785 8.8953 8.8953 9.0141 9.0141 k = 0.1939 0.1939 0.2946 ( 8256 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4663 -37.4663 -37.4610 -37.4610 -37.1804 -37.1804 -37.1763 -37.1763 -37.1757 -37.1757 -37.1699 -37.1699 -25.2571 -25.2571 -25.2397 -25.2397 -9.0176 -9.0176 -8.9712 -8.9712 -8.7709 -8.7709 -8.7432 -8.7432 -8.6787 -8.6787 -8.6435 -8.6435 -4.5017 -4.5017 -4.2066 -4.2066 1.8758 1.8758 2.8522 2.8522 3.0003 3.0003 4.1480 4.1480 4.2819 4.2819 4.4601 4.4601 7.7494 7.7494 8.4521 8.4521 8.5586 8.5586 8.8449 8.8449 8.9044 8.9044 k = 0.1837 0.1837 0.2946 ( 8248 PWs) bands (ev): -70.5236 -70.5236 -70.5225 -70.5225 -37.4664 -37.4664 -37.4608 -37.4608 -37.1805 -37.1805 -37.1765 -37.1765 -37.1755 -37.1755 -37.1697 -37.1697 -25.2576 -25.2576 -25.2394 -25.2394 -9.0175 -9.0175 -8.9688 -8.9688 -8.7691 -8.7691 -8.7431 -8.7431 -8.6778 -8.6778 -8.6423 -8.6423 -4.5206 -4.5206 -4.2150 -4.2150 1.8790 1.8790 2.8791 2.8791 3.0602 3.0602 4.1853 4.1853 4.3255 4.3255 4.4650 4.4650 7.7899 7.7899 8.4309 8.4309 8.4566 8.4566 8.7794 8.7794 8.7822 8.7822 k = 0.1735 0.1735 0.2946 ( 8244 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4666 -37.4666 -37.4607 -37.4607 -37.1805 -37.1805 -37.1766 -37.1766 -37.1754 -37.1754 -37.1696 -37.1696 -25.2581 -25.2581 -25.2392 -25.2392 -9.0173 -9.0173 -8.9663 -8.9663 -8.7675 -8.7675 -8.7428 -8.7428 -8.6772 -8.6772 -8.6410 -8.6410 -4.5391 -4.5391 -4.2237 -4.2237 1.8815 1.8815 2.9089 2.9089 3.1213 3.1213 4.2236 4.2236 4.3684 4.3684 4.4677 4.4677 7.8336 7.8336 8.3317 8.3317 8.4314 8.4314 8.6492 8.6492 8.7090 8.7090 k = 0.1633 0.1633 0.2946 ( 8244 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4667 -37.4667 -37.4606 -37.4606 -37.1806 -37.1806 -37.1768 -37.1768 -37.1753 -37.1753 -37.1695 -37.1695 -25.2586 -25.2586 -25.2390 -25.2390 -9.0171 -9.0171 -8.9638 -8.9638 -8.7662 -8.7662 -8.7421 -8.7421 -8.6769 -8.6769 -8.6396 -8.6396 -4.5570 -4.5570 -4.2324 -4.2324 1.8830 1.8830 2.9415 2.9415 3.1832 3.1832 4.2622 4.2622 4.4070 4.4070 4.4726 4.4726 7.8766 7.8766 8.2352 8.2352 8.4046 8.4046 8.5189 8.5189 8.6290 8.6290 k = 0.1531 0.1531 0.2946 ( 8240 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4668 -37.4668 -37.4605 -37.4605 -37.1807 -37.1807 -37.1769 -37.1769 -37.1752 -37.1752 -37.1693 -37.1693 -25.2591 -25.2591 -25.2388 -25.2388 -9.0168 -9.0168 -8.9614 -8.9614 -8.7651 -8.7651 -8.7412 -8.7412 -8.6768 -8.6768 -8.6380 -8.6380 -4.5744 -4.5744 -4.2411 -4.2411 1.8837 1.8837 2.9771 2.9771 3.2454 3.2454 4.2993 4.2993 4.4301 4.4301 4.4923 4.4923 7.9075 7.9075 8.1607 8.1607 8.3547 8.3547 8.4050 8.4050 8.5445 8.5445 k = 0.1429 0.1429 0.2946 ( 8238 PWs) bands (ev): -70.5237 -70.5237 -70.5224 -70.5224 -37.4669 -37.4669 -37.4604 -37.4604 -37.1808 -37.1808 -37.1770 -37.1770 -37.1751 -37.1751 -37.1692 -37.1692 -25.2596 -25.2596 -25.2386 -25.2386 -9.0165 -9.0165 -8.9590 -8.9590 -8.7644 -8.7644 -8.7399 -8.7399 -8.6770 -8.6770 -8.6363 -8.6363 -4.5911 -4.5911 -4.2498 -4.2498 1.8836 1.8836 3.0156 3.0156 3.3075 3.3075 4.3300 4.3300 4.4385 4.4385 4.5303 4.5303 7.8997 7.8997 8.1350 8.1350 8.2452 8.2452 8.3461 8.3461 8.4580 8.4580 k = 0.1327 0.1327 0.2946 ( 8234 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4670 -37.4670 -37.4603 -37.4603 -37.1809 -37.1809 -37.1771 -37.1771 -37.1750 -37.1750 -37.1691 -37.1691 -25.2600 -25.2600 -25.2384 -25.2384 -9.0161 -9.0161 -8.9567 -8.9567 -8.7640 -8.7640 -8.7384 -8.7384 -8.6775 -8.6775 -8.6346 -8.6346 -4.6070 -4.6070 -4.2584 -4.2584 1.8828 1.8828 3.0568 3.0568 3.3691 3.3691 4.3444 4.3444 4.4534 4.4534 4.5749 4.5749 7.8462 7.8462 8.1211 8.1211 8.1661 8.1661 8.2977 8.2977 8.3712 8.3712 k = 0.1224 0.1224 0.2946 ( 8242 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4670 -37.4670 -37.4602 -37.4602 -37.1811 -37.1811 -37.1771 -37.1771 -37.1750 -37.1750 -37.1689 -37.1689 -25.2604 -25.2604 -25.2382 -25.2382 -9.0157 -9.0157 -8.9544 -8.9544 -8.7638 -8.7638 -8.7366 -8.7366 -8.6781 -8.6781 -8.6328 -8.6328 -4.6220 -4.6220 -4.2667 -4.2667 1.8813 1.8813 3.1007 3.1007 3.4299 3.4299 4.3381 4.3381 4.4833 4.4833 4.6213 4.6213 7.7747 7.7747 8.0024 8.0024 8.2111 8.2111 8.2569 8.2569 8.2863 8.2863 k = 0.1122 0.1122 0.2946 ( 8234 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4671 -37.4671 -37.4601 -37.4601 -37.1811 -37.1811 -37.1772 -37.1772 -37.1749 -37.1749 -37.1688 -37.1688 -25.2608 -25.2608 -25.2380 -25.2380 -9.0153 -9.0153 -8.9522 -8.9522 -8.7639 -8.7639 -8.7347 -8.7347 -8.6790 -8.6790 -8.6310 -8.6310 -4.6362 -4.6362 -4.2747 -4.2747 1.8794 1.8794 3.1471 3.1471 3.4894 3.4894 4.3180 4.3180 4.5222 4.5222 4.6679 4.6679 7.7008 7.7008 7.8879 7.8879 8.1766 8.1766 8.2048 8.2048 8.3038 8.3038 k = 0.1020 0.1020 0.2946 ( 8250 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4672 -37.4672 -37.4600 -37.4600 -37.1813 -37.1813 -37.1772 -37.1772 -37.1749 -37.1749 -37.1687 -37.1687 -25.2612 -25.2612 -25.2379 -25.2379 -9.0149 -9.0149 -8.9501 -8.9501 -8.7640 -8.7640 -8.7327 -8.7327 -8.6799 -8.6799 -8.6292 -8.6292 -4.6493 -4.6493 -4.2824 -4.2824 1.8770 1.8770 3.1958 3.1958 3.5469 3.5469 4.2899 4.2899 4.5642 4.5642 4.7141 4.7141 7.6299 7.6299 7.7794 7.7794 8.1114 8.1114 8.1329 8.1329 8.3793 8.3793 k = 0.0918 0.0918 0.2946 ( 8242 PWs) bands (ev): -70.5238 -70.5238 -70.5223 -70.5223 -37.4673 -37.4673 -37.4600 -37.4600 -37.1814 -37.1814 -37.1773 -37.1773 -37.1749 -37.1749 -37.1686 -37.1686 -25.2615 -25.2615 -25.2377 -25.2377 -9.0145 -9.0145 -8.9481 -8.9481 -8.7643 -8.7643 -8.7306 -8.7306 -8.6810 -8.6810 -8.6275 -8.6275 -4.6614 -4.6614 -4.2896 -4.2896 1.8744 1.8744 3.2465 3.2465 3.6019 3.6019 4.2562 4.2562 4.6066 4.6066 4.7591 4.7591 7.5640 7.5640 7.6777 7.6777 8.0396 8.0396 8.0699 8.0699 8.4600 8.4600 k = 0.0816 0.0816 0.2946 ( 8244 PWs) bands (ev): -70.5239 -70.5239 -70.5223 -70.5223 -37.4673 -37.4673 -37.4599 -37.4599 -37.1815 -37.1815 -37.1773 -37.1773 -37.1748 -37.1748 -37.1685 -37.1685 -25.2618 -25.2618 -25.2376 -25.2376 -9.0141 -9.0141 -8.9462 -8.9462 -8.7647 -8.7647 -8.7285 -8.7285 -8.6822 -8.6822 -8.6258 -8.6258 -4.6724 -4.6724 -4.2963 -4.2963 1.8717 1.8717 3.2990 3.2990 3.6537 3.6537 4.2183 4.2183 4.6479 4.6479 4.8023 4.8023 7.5040 7.5040 7.5837 7.5837 7.9700 7.9700 8.0103 8.0103 8.5429 8.5429 k = 0.0714 0.0714 0.2946 ( 8252 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4674 -37.4674 -37.4598 -37.4598 -37.1816 -37.1816 -37.1773 -37.1773 -37.1748 -37.1748 -37.1684 -37.1684 -25.2621 -25.2621 -25.2375 -25.2375 -9.0137 -9.0137 -8.9445 -8.9445 -8.7651 -8.7651 -8.7265 -8.7265 -8.6834 -8.6834 -8.6243 -8.6243 -4.6822 -4.6822 -4.3023 -4.3023 1.8689 1.8689 3.3530 3.3530 3.7016 3.7016 4.1769 4.1769 4.6869 4.6869 4.8432 4.8432 7.4504 7.4504 7.4982 7.4982 7.9057 7.9057 7.9537 7.9537 8.6258 8.6258 k = 0.0612 0.0612 0.2946 ( 8254 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4674 -37.4674 -37.4598 -37.4598 -37.1816 -37.1816 -37.1774 -37.1774 -37.1748 -37.1748 -37.1683 -37.1683 -25.2623 -25.2623 -25.2374 -25.2374 -9.0134 -9.0134 -8.9430 -8.9430 -8.7654 -8.7654 -8.7246 -8.7246 -8.6846 -8.6846 -8.6229 -8.6229 -4.6908 -4.6908 -4.3077 -4.3077 1.8663 1.8663 3.4081 3.4081 3.7447 3.7447 4.1329 4.1329 4.7227 4.7227 4.8810 4.8810 7.4035 7.4035 7.4221 7.4221 7.8479 7.8479 7.9013 7.9013 8.7069 8.7069 k = 0.0510 0.0510 0.2946 ( 8242 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4597 -37.4597 -37.1817 -37.1817 -37.1774 -37.1774 -37.1748 -37.1748 -37.1682 -37.1682 -25.2625 -25.2625 -25.2373 -25.2373 -9.0131 -9.0131 -8.9417 -8.9417 -8.7658 -8.7658 -8.7228 -8.7228 -8.6858 -8.6858 -8.6217 -8.6217 -4.6981 -4.6981 -4.3124 -4.3124 1.8639 1.8639 3.4638 3.4638 3.7819 3.7819 4.0873 4.0873 4.7545 4.7545 4.9149 4.9149 7.3551 7.3551 7.3643 7.3643 7.7974 7.7974 7.8542 7.8542 8.7838 8.7838 k = 0.0408 0.0408 0.2946 ( 8230 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4597 -37.4597 -37.1818 -37.1818 -37.1774 -37.1774 -37.1747 -37.1747 -37.1681 -37.1681 -25.2627 -25.2627 -25.2372 -25.2372 -9.0128 -9.0128 -8.9406 -8.9406 -8.7661 -8.7661 -8.7212 -8.7212 -8.6869 -8.6869 -8.6207 -8.6207 -4.7042 -4.7042 -4.3163 -4.3163 1.8618 1.8618 3.5194 3.5194 3.8118 3.8118 4.0415 4.0415 4.7815 4.7815 4.9441 4.9441 7.2999 7.2999 7.3313 7.3313 7.7550 7.7550 7.8138 7.8138 8.8539 8.8539 k = 0.0306 0.0306 0.2946 ( 8230 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4675 -37.4675 -37.4597 -37.4597 -37.1818 -37.1818 -37.1774 -37.1774 -37.1747 -37.1747 -37.1681 -37.1681 -25.2628 -25.2628 -25.2371 -25.2371 -9.0126 -9.0126 -8.9397 -8.9397 -8.7664 -8.7664 -8.7199 -8.7199 -8.6879 -8.6879 -8.6199 -8.6199 -4.7089 -4.7089 -4.3194 -4.3194 1.8600 1.8600 3.5737 3.5737 3.8322 3.8322 3.9985 3.9985 4.8033 4.8033 4.9678 4.9678 7.2560 7.2560 7.3057 7.3057 7.7213 7.7213 7.7810 7.7810 8.9139 8.9139 k = 0.0204 0.0204 0.2946 ( 8230 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1818 -37.1818 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2629 -25.2629 -25.2371 -25.2371 -9.0124 -9.0124 -8.9391 -8.9391 -8.7666 -8.7666 -8.7189 -8.7189 -8.6886 -8.6886 -8.6193 -8.6193 -4.7123 -4.7123 -4.3216 -4.3216 1.8587 1.8587 3.6246 3.6246 3.8389 3.8389 3.9639 3.9639 4.8192 4.8192 4.9853 4.9853 7.2240 7.2240 7.2874 7.2874 7.6968 7.6968 7.7569 7.7569 8.9605 8.9605 k = 0.0102 0.0102 0.2946 ( 8234 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0123 -9.0123 -8.9387 -8.9387 -8.7668 -8.7668 -8.7183 -8.7183 -8.6891 -8.6891 -8.6189 -8.6189 -4.7144 -4.7144 -4.3229 -4.3229 1.8580 1.8580 3.6663 3.6663 3.8305 3.8305 3.9446 3.9446 4.8289 4.8289 4.9961 4.9961 7.2047 7.2047 7.2764 7.2764 7.6819 7.6819 7.7422 7.7422 8.9901 8.9901 k = 0.0000 0.0000 0.2946 ( 8244 PWs) bands (ev): -70.5239 -70.5239 -70.5222 -70.5222 -37.4676 -37.4676 -37.4596 -37.4596 -37.1819 -37.1819 -37.1774 -37.1774 -37.1747 -37.1747 -37.1680 -37.1680 -25.2630 -25.2630 -25.2371 -25.2371 -9.0123 -9.0123 -8.9386 -8.9386 -8.7668 -8.7668 -8.7181 -8.7181 -8.6892 -8.6892 -8.6188 -8.6188 -4.7151 -4.7151 -4.3234 -4.3234 1.8577 1.8577 3.6845 3.6845 3.8221 3.8221 3.9394 3.9394 4.8321 4.8321 4.9997 4.9997 7.1982 7.1982 7.2727 7.2727 7.6770 7.6770 7.7372 7.7372 9.0003 9.0003 k = 0.0000 0.5000-0.0000 ( 8262 PWs) bands (ev): -70.5231 -70.5231 -70.5231 -70.5231 -37.4636 -37.4636 -37.4636 -37.4636 -37.1762 -37.1762 -37.1762 -37.1762 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0158 -9.0158 -9.0158 -9.0158 -8.7567 -8.7567 -8.7567 -8.7567 -8.6654 -8.6654 -8.6654 -8.6654 -4.2468 -4.2468 -4.2468 -4.2468 1.8888 1.8888 1.8888 1.8888 3.7142 3.7142 3.7142 3.7142 4.4357 4.4357 4.4357 4.4357 7.8108 7.8108 7.8108 7.8108 8.4095 8.4095 8.4095 8.4095 9.0138 9.0138 k = 0.0000 0.5000 0.0140 ( 8244 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0158 -9.0158 -9.0158 -9.0158 -8.7567 -8.7567 -8.7567 -8.7567 -8.6654 -8.6654 -8.6654 -8.6654 -4.2467 -4.2467 -4.2467 -4.2467 1.8873 1.8873 1.8873 1.8873 3.7165 3.7165 3.7165 3.7165 4.4356 4.4356 4.4356 4.4356 7.8064 7.8064 7.8064 7.8064 8.4066 8.4066 8.4066 8.4066 9.0154 9.0154 k = 0.0000 0.5000 0.0281 ( 8240 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0159 -9.0159 -9.0159 -9.0159 -8.7567 -8.7567 -8.7567 -8.7567 -8.6653 -8.6653 -8.6653 -8.6653 -4.2463 -4.2463 -4.2463 -4.2463 1.8827 1.8827 1.8827 1.8827 3.7231 3.7231 3.7231 3.7231 4.4354 4.4354 4.4354 4.4354 7.7935 7.7935 7.7935 7.7935 8.3986 8.3986 8.3986 8.3986 9.0201 9.0201 k = 0.0000 0.5000 0.0421 ( 8236 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0160 -9.0160 -9.0160 -9.0160 -8.7568 -8.7568 -8.7568 -8.7568 -8.6653 -8.6653 -8.6653 -8.6653 -4.2458 -4.2458 -4.2458 -4.2458 1.8754 1.8754 1.8754 1.8754 3.7340 3.7340 3.7340 3.7340 4.4350 4.4350 4.4350 4.4350 7.7724 7.7724 7.7724 7.7724 8.3872 8.3872 8.3872 8.3872 9.0279 9.0279 k = 0.0000 0.5000 0.0561 ( 8232 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0162 -9.0162 -9.0162 -9.0162 -8.7568 -8.7568 -8.7568 -8.7568 -8.6651 -8.6651 -8.6651 -8.6651 -4.2450 -4.2450 -4.2450 -4.2450 1.8654 1.8654 1.8654 1.8654 3.7489 3.7489 3.7489 3.7489 4.4346 4.4346 4.4346 4.4346 7.7440 7.7440 7.7440 7.7440 8.3745 8.3745 8.3745 8.3745 9.0386 9.0386 k = 0.0000 0.5000 0.0701 ( 8246 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0164 -9.0164 -9.0164 -9.0164 -8.7568 -8.7568 -8.7568 -8.7568 -8.6650 -8.6650 -8.6650 -8.6650 -4.2440 -4.2440 -4.2440 -4.2440 1.8531 1.8531 1.8531 1.8531 3.7672 3.7672 3.7672 3.7672 4.4340 4.4340 4.4340 4.4340 7.7093 7.7093 7.7093 7.7093 8.3621 8.3621 8.3621 8.3621 9.0522 9.0522 k = 0.0000 0.5000 0.0842 ( 8242 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0166 -9.0166 -9.0166 -9.0166 -8.7568 -8.7568 -8.7568 -8.7568 -8.6648 -8.6648 -8.6648 -8.6648 -4.2429 -4.2429 -4.2429 -4.2429 1.8390 1.8390 1.8390 1.8390 3.7887 3.7887 3.7887 3.7887 4.4334 4.4334 4.4334 4.4334 7.6698 7.6698 7.6698 7.6698 8.3511 8.3511 8.3511 8.3511 9.0685 9.0685 k = 0.0000 0.5000 0.0982 ( 8226 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0169 -9.0169 -9.0169 -9.0169 -8.7569 -8.7569 -8.7569 -8.7569 -8.6647 -8.6647 -8.6647 -8.6647 -4.2416 -4.2416 -4.2416 -4.2416 1.8233 1.8233 1.8233 1.8233 3.8126 3.8126 3.8126 3.8126 4.4327 4.4327 4.4327 4.4327 7.6267 7.6267 7.6267 7.6267 8.3419 8.3419 8.3419 8.3419 9.0873 9.0873 k = 0.0000 0.5000 0.1122 ( 8236 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0172 -9.0172 -9.0172 -9.0172 -8.7569 -8.7569 -8.7569 -8.7569 -8.6645 -8.6645 -8.6645 -8.6645 -4.2402 -4.2402 -4.2402 -4.2402 1.8066 1.8066 1.8066 1.8066 3.8384 3.8384 3.8384 3.8384 4.4320 4.4320 4.4320 4.4320 7.5815 7.5815 7.5815 7.5815 8.3345 8.3345 8.3345 8.3345 9.1083 9.1083 k = 0.0000 0.5000 0.1262 ( 8248 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0175 -9.0175 -9.0175 -9.0175 -8.7569 -8.7569 -8.7569 -8.7569 -8.6643 -8.6643 -8.6643 -8.6643 -4.2387 -4.2387 -4.2387 -4.2387 1.7892 1.7892 1.7892 1.7892 3.8655 3.8655 3.8655 3.8655 4.4312 4.4312 4.4312 4.4312 7.5354 7.5354 7.5354 7.5354 8.3289 8.3289 8.3289 8.3289 9.1313 9.1313 k = 0.0000 0.5000 0.1403 ( 8244 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0178 -9.0178 -9.0178 -9.0178 -8.7570 -8.7570 -8.7570 -8.7570 -8.6640 -8.6640 -8.6640 -8.6640 -4.2371 -4.2371 -4.2371 -4.2371 1.7716 1.7716 1.7716 1.7716 3.8933 3.8933 3.8933 3.8933 4.4305 4.4305 4.4305 4.4305 7.4894 7.4894 7.4894 7.4894 8.3248 8.3248 8.3248 8.3248 9.1559 9.1559 k = 0.0000 0.5000 0.1543 ( 8244 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0181 -9.0181 -9.0181 -9.0181 -8.7570 -8.7570 -8.7570 -8.7570 -8.6638 -8.6638 -8.6638 -8.6638 -4.2355 -4.2355 -4.2355 -4.2355 1.7542 1.7542 1.7542 1.7542 3.9211 3.9211 3.9211 3.9211 4.4299 4.4299 4.4299 4.4299 7.4446 7.4446 7.4446 7.4446 8.3219 8.3219 8.3219 8.3219 9.1816 9.1816 k = 0.0000 0.5000 0.1683 ( 8236 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0185 -9.0185 -9.0185 -9.0185 -8.7570 -8.7570 -8.7570 -8.7570 -8.6636 -8.6636 -8.6636 -8.6636 -4.2340 -4.2340 -4.2340 -4.2340 1.7373 1.7373 1.7373 1.7373 3.9484 3.9484 3.9484 3.9484 4.4293 4.4293 4.4293 4.4293 7.4018 7.4018 7.4018 7.4018 8.3200 8.3200 8.3200 8.3200 9.2080 9.2080 k = 0.0000 0.5000 0.1824 ( 8232 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0188 -9.0188 -9.0188 -9.0188 -8.7571 -8.7571 -8.7571 -8.7571 -8.6634 -8.6634 -8.6634 -8.6634 -4.2325 -4.2325 -4.2325 -4.2325 1.7213 1.7213 1.7213 1.7213 3.9746 3.9746 3.9746 3.9746 4.4289 4.4289 4.4289 4.4289 7.3616 7.3616 7.3616 7.3616 8.3189 8.3189 8.3189 8.3189 9.2346 9.2346 k = 0.0000 0.5000 0.1964 ( 8226 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0190 -9.0190 -9.0190 -9.0190 -8.7571 -8.7571 -8.7571 -8.7571 -8.6632 -8.6632 -8.6632 -8.6632 -4.2311 -4.2311 -4.2311 -4.2311 1.7065 1.7065 1.7065 1.7065 3.9992 3.9992 3.9992 3.9992 4.4286 4.4286 4.4286 4.4286 7.3247 7.3247 7.3247 7.3247 8.3184 8.3184 8.3184 8.3184 9.2606 9.2606 k = 0.0000 0.5000 0.2104 ( 8232 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0193 -9.0193 -9.0193 -9.0193 -8.7571 -8.7571 -8.7571 -8.7571 -8.6630 -8.6630 -8.6630 -8.6630 -4.2298 -4.2298 -4.2298 -4.2298 1.6931 1.6931 1.6931 1.6931 4.0215 4.0215 4.0215 4.0215 4.4283 4.4283 4.4283 4.4283 7.2917 7.2917 7.2917 7.2917 8.3182 8.3182 8.3182 8.3182 9.2854 9.2854 k = 0.0000 0.5000 0.2244 ( 8222 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0196 -9.0196 -9.0196 -9.0196 -8.7572 -8.7572 -8.7572 -8.7572 -8.6629 -8.6629 -8.6629 -8.6629 -4.2286 -4.2286 -4.2286 -4.2286 1.6814 1.6814 1.6814 1.6814 4.0412 4.0412 4.0412 4.0412 4.4282 4.4282 4.4282 4.4282 7.2629 7.2629 7.2629 7.2629 8.3183 8.3183 8.3183 8.3183 9.3083 9.3083 k = 0.0000 0.5000 0.2385 ( 8232 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0198 -9.0198 -9.0198 -9.0198 -8.7572 -8.7572 -8.7572 -8.7572 -8.6627 -8.6627 -8.6627 -8.6627 -4.2276 -4.2276 -4.2276 -4.2276 1.6715 1.6715 1.6715 1.6715 4.0578 4.0578 4.0578 4.0578 4.4282 4.4282 4.4282 4.4282 7.2388 7.2388 7.2388 7.2388 8.3186 8.3186 8.3186 8.3186 9.3285 9.3285 k = 0.0000 0.5000 0.2525 ( 8220 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0199 -9.0199 -9.0199 -9.0199 -8.7572 -8.7572 -8.7572 -8.7572 -8.6626 -8.6626 -8.6626 -8.6626 -4.2268 -4.2268 -4.2268 -4.2268 1.6637 1.6637 1.6637 1.6637 4.0711 4.0711 4.0711 4.0711 4.4283 4.4283 4.4283 4.4283 7.2197 7.2197 7.2197 7.2197 8.3189 8.3189 8.3189 8.3189 9.3452 9.3452 k = 0.0000 0.5000 0.2665 ( 8224 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0200 -9.0200 -9.0200 -9.0200 -8.7572 -8.7572 -8.7572 -8.7572 -8.6625 -8.6625 -8.6625 -8.6625 -4.2263 -4.2263 -4.2263 -4.2263 1.6580 1.6580 1.6580 1.6580 4.0808 4.0808 4.0808 4.0808 4.4283 4.4283 4.4283 4.4283 7.2059 7.2059 7.2059 7.2059 8.3191 8.3191 8.3191 8.3191 9.3577 9.3577 k = 0.0000 0.5000 0.2806 ( 8206 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0201 -9.0201 -9.0201 -9.0201 -8.7572 -8.7572 -8.7572 -8.7572 -8.6625 -8.6625 -8.6625 -8.6625 -4.2259 -4.2259 -4.2259 -4.2259 1.6546 1.6546 1.6546 1.6546 4.0867 4.0867 4.0867 4.0867 4.4284 4.4284 4.4284 4.4284 7.1975 7.1975 7.1975 7.1975 8.3193 8.3193 8.3193 8.3193 9.3655 9.3655 k = 0.0000 0.5000 0.2946 ( 8204 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4636 -37.4636 -37.4636 -37.4636 -37.1761 -37.1761 -37.1761 -37.1761 -37.1750 -37.1750 -37.1750 -37.1750 -25.2475 -25.2475 -25.2475 -25.2475 -9.0201 -9.0201 -9.0201 -9.0201 -8.7572 -8.7572 -8.7572 -8.7572 -8.6625 -8.6625 -8.6625 -8.6625 -4.2258 -4.2258 -4.2258 -4.2258 1.6534 1.6534 1.6534 1.6534 4.0886 4.0886 4.0886 4.0886 4.4284 4.4284 4.4284 4.4284 7.1947 7.1947 7.1947 7.1947 8.3194 8.3194 8.3194 8.3194 9.3681 9.3681 k = 0.5000 0.5000-0.0000 ( 8140 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7720 -8.7720 -8.7720 -8.7720 -8.6829 -8.6829 -8.6829 -8.6829 -4.1444 -4.1444 -4.1444 -4.1444 1.9999 1.9999 1.9999 1.9999 3.4739 3.4739 3.4739 3.4739 3.5879 3.5879 3.5879 3.5879 7.0189 7.0189 7.0189 7.0189 7.4927 7.4927 7.4927 7.4927 10.8736 10.8736 k = 0.5000 0.5000 0.0140 ( 8144 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7720 -8.7720 -8.7720 -8.7720 -8.6829 -8.6829 -8.6829 -8.6829 -4.1443 -4.1443 -4.1443 -4.1443 1.9998 1.9998 1.9998 1.9998 3.4732 3.4732 3.4732 3.4732 3.5870 3.5870 3.5870 3.5870 7.0231 7.0231 7.0231 7.0231 7.4956 7.4956 7.4956 7.4956 10.8604 10.8604 k = 0.5000 0.5000 0.0281 ( 8184 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7720 -8.7720 -8.7720 -8.7720 -8.6830 -8.6830 -8.6830 -8.6830 -4.1440 -4.1440 -4.1440 -4.1440 1.9995 1.9995 1.9995 1.9995 3.4710 3.4710 3.4710 3.4710 3.5841 3.5841 3.5841 3.5841 7.0359 7.0359 7.0359 7.0359 7.5043 7.5043 7.5043 7.5043 10.8220 10.8220 k = 0.5000 0.5000 0.0421 ( 8184 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7720 -8.7720 -8.7720 -8.7720 -8.6830 -8.6830 -8.6830 -8.6830 -4.1435 -4.1435 -4.1435 -4.1435 1.9989 1.9989 1.9989 1.9989 3.4672 3.4672 3.4672 3.4672 3.5797 3.5797 3.5797 3.5797 7.0569 7.0569 7.0569 7.0569 7.5187 7.5187 7.5187 7.5187 10.7611 10.7611 k = 0.5000 0.5000 0.0561 ( 8176 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7720 -8.7720 -8.7720 -8.7720 -8.6831 -8.6831 -8.6831 -8.6831 -4.1428 -4.1428 -4.1428 -4.1428 1.9982 1.9982 1.9982 1.9982 3.4617 3.4617 3.4617 3.4617 3.5741 3.5741 3.5741 3.5741 7.0858 7.0858 7.0858 7.0858 7.5389 7.5389 7.5389 7.5389 10.6816 10.6816 k = 0.5000 0.5000 0.0701 ( 8184 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7721 -8.7721 -8.7721 -8.7721 -8.6832 -8.6832 -8.6832 -8.6832 -4.1420 -4.1420 -4.1420 -4.1420 1.9974 1.9974 1.9974 1.9974 3.4541 3.4541 3.4541 3.4541 3.5679 3.5679 3.5679 3.5679 7.1220 7.1220 7.1220 7.1220 7.5648 7.5648 7.5648 7.5648 10.5876 10.5876 k = 0.5000 0.5000 0.0842 ( 8176 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7721 -8.7721 -8.7721 -8.7721 -8.6833 -8.6833 -8.6833 -8.6833 -4.1410 -4.1410 -4.1410 -4.1410 1.9963 1.9963 1.9963 1.9963 3.4445 3.4445 3.4445 3.4445 3.5615 3.5615 3.5615 3.5615 7.1650 7.1650 7.1650 7.1650 7.5962 7.5962 7.5962 7.5962 10.4825 10.4825 k = 0.5000 0.5000 0.0982 ( 8144 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7721 -8.7721 -8.7721 -8.7721 -8.6834 -8.6834 -8.6834 -8.6834 -4.1398 -4.1398 -4.1398 -4.1398 1.9952 1.9952 1.9952 1.9952 3.4329 3.4329 3.4329 3.4329 3.5555 3.5555 3.5555 3.5555 7.2140 7.2140 7.2140 7.2140 7.6333 7.6333 7.6333 7.6333 10.3693 10.3693 k = 0.5000 0.5000 0.1122 ( 8148 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7721 -8.7721 -8.7721 -8.7721 -8.6835 -8.6835 -8.6835 -8.6835 -4.1386 -4.1386 -4.1386 -4.1386 1.9939 1.9939 1.9939 1.9939 3.4193 3.4193 3.4193 3.4193 3.5501 3.5501 3.5501 3.5501 7.2680 7.2680 7.2680 7.2680 7.6758 7.6758 7.6758 7.6758 10.2505 10.2505 k = 0.5000 0.5000 0.1262 ( 8148 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4637 -37.4637 -37.4637 -37.4637 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7722 -8.7722 -8.7722 -8.7722 -8.6836 -8.6836 -8.6836 -8.6836 -4.1373 -4.1373 -4.1373 -4.1373 1.9926 1.9926 1.9926 1.9926 3.4042 3.4042 3.4042 3.4042 3.5454 3.5454 3.5454 3.5454 7.3263 7.3263 7.3263 7.3263 7.7237 7.7237 7.7237 7.7237 10.1279 10.1279 k = 0.5000 0.5000 0.1403 ( 8164 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7722 -8.7722 -8.7722 -8.7722 -8.6838 -8.6838 -8.6838 -8.6838 -4.1359 -4.1359 -4.1359 -4.1359 1.9912 1.9912 1.9912 1.9912 3.3880 3.3880 3.3880 3.3880 3.5413 3.5413 3.5413 3.5413 7.3877 7.3877 7.3877 7.3877 7.7769 7.7769 7.7769 7.7769 10.0030 10.0030 k = 0.5000 0.5000 0.1543 ( 8172 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7722 -8.7722 -8.7722 -8.7722 -8.6839 -8.6839 -8.6839 -8.6839 -4.1346 -4.1346 -4.1346 -4.1346 1.9898 1.9898 1.9898 1.9898 3.3713 3.3713 3.3713 3.3713 3.5380 3.5380 3.5380 3.5380 7.4511 7.4511 7.4511 7.4511 7.8352 7.8352 7.8352 7.8352 9.8769 9.8769 k = 0.5000 0.5000 0.1683 ( 8184 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7722 -8.7722 -8.7722 -8.7722 -8.6841 -8.6841 -8.6841 -8.6841 -4.1332 -4.1332 -4.1332 -4.1332 1.9884 1.9884 1.9884 1.9884 3.3547 3.3547 3.3547 3.3547 3.5351 3.5351 3.5351 3.5351 7.5152 7.5152 7.5152 7.5152 7.8985 7.8985 7.8985 7.8985 9.7507 9.7507 k = 0.5000 0.5000 0.1824 ( 8168 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7723 -8.7723 -8.7723 -8.7723 -8.6842 -8.6842 -8.6842 -8.6842 -4.1319 -4.1319 -4.1319 -4.1319 1.9871 1.9871 1.9871 1.9871 3.3385 3.3385 3.3385 3.3385 3.5328 3.5328 3.5328 3.5328 7.5788 7.5788 7.5788 7.5788 7.9667 7.9667 7.9667 7.9667 9.6250 9.6250 k = 0.5000 0.5000 0.1964 ( 8176 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7723 -8.7723 -8.7723 -8.7723 -8.6843 -8.6843 -8.6843 -8.6843 -4.1307 -4.1307 -4.1307 -4.1307 1.9858 1.9858 1.9858 1.9858 3.3232 3.3232 3.3232 3.3232 3.5308 3.5308 3.5308 3.5308 7.6403 7.6403 7.6403 7.6403 8.0396 8.0396 8.0396 8.0396 9.5005 9.5005 k = 0.5000 0.5000 0.2104 ( 8168 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7723 -8.7723 -8.7723 -8.7723 -8.6845 -8.6845 -8.6845 -8.6845 -4.1296 -4.1296 -4.1296 -4.1296 1.9847 1.9847 1.9847 1.9847 3.3092 3.3092 3.3092 3.3092 3.5292 3.5292 3.5292 3.5292 7.6984 7.6984 7.6984 7.6984 8.1169 8.1169 8.1169 8.1169 9.3779 9.3779 k = 0.5000 0.5000 0.2244 ( 8188 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7723 -8.7723 -8.7723 -8.7723 -8.6846 -8.6846 -8.6846 -8.6846 -4.1286 -4.1286 -4.1286 -4.1286 1.9836 1.9836 1.9836 1.9836 3.2968 3.2968 3.2968 3.2968 3.5278 3.5278 3.5278 3.5278 7.7513 7.7513 7.7513 7.7513 8.1985 8.1985 8.1985 8.1985 9.2576 9.2576 k = 0.5000 0.5000 0.2385 ( 8196 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0068 -9.0068 -9.0068 -9.0068 -8.7724 -8.7724 -8.7724 -8.7724 -8.6846 -8.6846 -8.6846 -8.6846 -4.1277 -4.1277 -4.1277 -4.1277 1.9828 1.9828 1.9828 1.9828 3.2864 3.2864 3.2864 3.2864 3.5268 3.5268 3.5268 3.5268 7.7975 7.7975 7.7975 7.7975 8.2839 8.2839 8.2839 8.2839 9.1402 9.1402 k = 0.5000 0.5000 0.2525 ( 8204 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0069 -9.0069 -9.0069 -9.0069 -8.7724 -8.7724 -8.7724 -8.7724 -8.6847 -8.6847 -8.6847 -8.6847 -4.1270 -4.1270 -4.1270 -4.1270 1.9821 1.9821 1.9821 1.9821 3.2780 3.2780 3.2780 3.2780 3.5260 3.5260 3.5260 3.5260 7.8354 7.8354 7.8354 7.8354 8.3724 8.3724 8.3724 8.3724 9.0267 9.0267 k = 0.5000 0.5000 0.2665 ( 8196 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0069 -9.0069 -9.0069 -9.0069 -8.7724 -8.7724 -8.7724 -8.7724 -8.6848 -8.6848 -8.6848 -8.6848 -4.1265 -4.1265 -4.1265 -4.1265 1.9816 1.9816 1.9816 1.9816 3.2719 3.2719 3.2719 3.2719 3.5254 3.5254 3.5254 3.5254 7.8636 7.8636 7.8636 7.8636 8.4622 8.4622 8.4622 8.4622 8.9189 8.9189 k = 0.5000 0.5000 0.2806 ( 8200 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0069 -9.0069 -9.0069 -9.0069 -8.7724 -8.7724 -8.7724 -8.7724 -8.6848 -8.6848 -8.6848 -8.6848 -4.1262 -4.1262 -4.1262 -4.1262 1.9812 1.9812 1.9812 1.9812 3.2682 3.2682 3.2682 3.2682 3.5251 3.5251 3.5251 3.5251 7.8811 7.8811 7.8811 7.8811 8.5472 8.5472 8.5472 8.5472 8.8232 8.8232 k = 0.5000 0.5000 0.2946 ( 8200 PWs) bands (ev): -70.5230 -70.5230 -70.5230 -70.5230 -37.4638 -37.4638 -37.4638 -37.4638 -37.1804 -37.1804 -37.1804 -37.1804 -37.1706 -37.1706 -37.1706 -37.1706 -25.2450 -25.2450 -25.2450 -25.2450 -9.0069 -9.0069 -9.0069 -9.0069 -8.7724 -8.7724 -8.7724 -8.7724 -8.6848 -8.6848 -8.6848 -8.6848 -4.1261 -4.1261 -4.1261 -4.1261 1.9811 1.9811 1.9811 1.9811 3.2669 3.2669 3.2669 3.2669 3.5249 3.5249 3.5249 3.5249 7.8870 7.8870 7.8870 7.8870 8.5940 8.5940 8.5940 8.5940 8.7727 8.7727 Writing output data file KMgAs.save init_run : 0.35s CPU 0.52s WALL ( 1 calls) electrons : 214.23s CPU 217.44s 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 : 214.22s CPU 217.43s 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 : 0.07s CPU 0.11s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.12s WALL ( 310 calls) cegterg : 198.02s CPU 200.35s WALL ( 494 calls) Called by sum_band: Called by *egterg: h_psi : 109.84s CPU 111.48s WALL ( 7962 calls) s_psi : 5.35s CPU 5.64s WALL ( 7962 calls) g_psi : 0.43s CPU 0.47s WALL ( 7158 calls) cdiaghg : 62.86s CPU 63.60s WALL ( 7468 calls) cegterg:over : 11.38s CPU 11.22s WALL ( 7158 calls) cegterg:upda : 11.29s CPU 11.24s WALL ( 7158 calls) cegterg:last : 5.02s CPU 5.11s WALL ( 1114 calls) cdiaghg:chol : 3.62s CPU 3.67s WALL ( 7468 calls) cdiaghg:inve : 2.42s CPU 2.51s WALL ( 7468 calls) cdiaghg:para : 3.94s CPU 4.06s WALL ( 14936 calls) Called by h_psi: h_psi:vloc : 96.19s CPU 97.62s WALL ( 7962 calls) h_psi:vnl : 13.19s CPU 13.36s WALL ( 7962 calls) add_vuspsi : 6.40s CPU 6.35s WALL ( 7962 calls) General routines calbec : 6.76s CPU 7.00s WALL ( 7962 calls) fft : 0.02s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 89.74s CPU 91.00s WALL ( 815852 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.30s CPU 0.43s WALL ( 620 calls) Parallel routines fft_scatter : 31.57s CPU 31.82s WALL ( 815875 calls) PWSCF : 3m59.75s CPU 4m13.43s WALL This run was terminated on: 13:12:47 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=