Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 20:36:10 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: ./Cu2As.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per 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 27 20 6 983 665 110 Max 28 21 7 989 685 117 Sum 973 749 225 35475 24293 4027 bravais-lattice index = 14 lattice parameter (alat) = 7.1583 a.u. unit-cell volume = 575.3725 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 54.00 number of Kohn-Sham states= 64 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 237.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.158282 celldm(2)= 1.000000 celldm(3)= 1.568638 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 1.568638 ) 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 0.637496 ) 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 Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential As 5.00 74.92160 As( 1.00) Cu 11.00 63.54600 Cu( 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= 376 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026596 k( 2) = ( 0.0000000 0.0119048 -0.0000000), wk = 0.0026596 k( 3) = ( 0.0000000 0.0238095 -0.0000000), wk = 0.0026596 k( 4) = ( 0.0000000 0.0357143 -0.0000000), wk = 0.0026596 k( 5) = ( 0.0000000 0.0476191 -0.0000000), wk = 0.0026596 k( 6) = ( 0.0000000 0.0595238 -0.0000000), wk = 0.0026596 k( 7) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0026596 k( 8) = ( 0.0000000 0.0833333 -0.0000000), wk = 0.0026596 k( 9) = ( 0.0000000 0.0952381 -0.0000000), wk = 0.0026596 k( 10) = ( 0.0000000 0.1071429 -0.0000000), wk = 0.0026596 k( 11) = ( 0.0000000 0.1190476 -0.0000000), wk = 0.0026596 k( 12) = ( 0.0000000 0.1309524 -0.0000000), wk = 0.0026596 k( 13) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0026596 k( 14) = ( 0.0000000 0.1547619 -0.0000000), wk = 0.0026596 k( 15) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0026596 k( 16) = ( 0.0000000 0.1785714 -0.0000000), wk = 0.0026596 k( 17) = ( 0.0000000 0.1904762 -0.0000000), wk = 0.0026596 k( 18) = ( 0.0000000 0.2023810 -0.0000000), wk = 0.0026596 k( 19) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0026596 k( 20) = ( 0.0000000 0.2261905 -0.0000000), wk = 0.0026596 k( 21) = ( 0.0000000 0.2380952 -0.0000000), wk = 0.0026596 k( 22) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0026596 k( 23) = ( 0.0000000 0.2619048 -0.0000000), wk = 0.0026596 k( 24) = ( 0.0000000 0.2738095 -0.0000000), wk = 0.0026596 k( 25) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0026596 k( 26) = ( 0.0000000 0.2976190 -0.0000000), wk = 0.0026596 k( 27) = ( 0.0000000 0.3095238 -0.0000000), wk = 0.0026596 k( 28) = ( 0.0000000 0.3214286 -0.0000000), wk = 0.0026596 k( 29) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0026596 k( 30) = ( 0.0000000 0.3452381 -0.0000000), wk = 0.0026596 k( 31) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0026596 k( 32) = ( 0.0000000 0.3690476 -0.0000000), wk = 0.0026596 k( 33) = ( 0.0000000 0.3809524 -0.0000000), wk = 0.0026596 k( 34) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0026596 k( 35) = ( 0.0000000 0.4047619 -0.0000000), wk = 0.0026596 k( 36) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0026596 k( 37) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0026596 k( 38) = ( 0.0000000 0.4404762 -0.0000000), wk = 0.0026596 k( 39) = ( 0.0000000 0.4523810 -0.0000000), wk = 0.0026596 k( 40) = ( 0.0000000 0.4642857 -0.0000000), wk = 0.0026596 k( 41) = ( 0.0000000 0.4761905 -0.0000000), wk = 0.0026596 k( 42) = ( 0.0000000 0.4880952 -0.0000000), wk = 0.0026596 k( 43) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026596 k( 44) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026596 k( 45) = ( 0.0119048 0.5000000 -0.0000000), wk = 0.0026596 k( 46) = ( 0.0238095 0.5000000 -0.0000000), wk = 0.0026596 k( 47) = ( 0.0357143 0.5000000 -0.0000000), wk = 0.0026596 k( 48) = ( 0.0476191 0.5000000 -0.0000000), wk = 0.0026596 k( 49) = ( 0.0595238 0.5000000 -0.0000000), wk = 0.0026596 k( 50) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0026596 k( 51) = ( 0.0833333 0.5000000 -0.0000000), wk = 0.0026596 k( 52) = ( 0.0952381 0.5000000 -0.0000000), wk = 0.0026596 k( 53) = ( 0.1071429 0.5000000 -0.0000000), wk = 0.0026596 k( 54) = ( 0.1190476 0.5000000 -0.0000000), wk = 0.0026596 k( 55) = ( 0.1309524 0.5000000 -0.0000000), wk = 0.0026596 k( 56) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0026596 k( 57) = ( 0.1547619 0.5000000 -0.0000000), wk = 0.0026596 k( 58) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0026596 k( 59) = ( 0.1785714 0.5000000 -0.0000000), wk = 0.0026596 k( 60) = ( 0.1904762 0.5000000 -0.0000000), wk = 0.0026596 k( 61) = ( 0.2023810 0.5000000 -0.0000000), wk = 0.0026596 k( 62) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0026596 k( 63) = ( 0.2261905 0.5000000 -0.0000000), wk = 0.0026596 k( 64) = ( 0.2380952 0.5000000 -0.0000000), wk = 0.0026596 k( 65) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0026596 k( 66) = ( 0.2619048 0.5000000 -0.0000000), wk = 0.0026596 k( 67) = ( 0.2738095 0.5000000 -0.0000000), wk = 0.0026596 k( 68) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0026596 k( 69) = ( 0.2976190 0.5000000 -0.0000000), wk = 0.0026596 k( 70) = ( 0.3095238 0.5000000 -0.0000000), wk = 0.0026596 k( 71) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0026596 k( 72) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0026596 k( 73) = ( 0.3452381 0.5000000 -0.0000000), wk = 0.0026596 k( 74) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0026596 k( 75) = ( 0.3690476 0.5000000 -0.0000000), wk = 0.0026596 k( 76) = ( 0.3809524 0.5000000 -0.0000000), wk = 0.0026596 k( 77) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0026596 k( 78) = ( 0.4047619 0.5000000 -0.0000000), wk = 0.0026596 k( 79) = ( 0.4166667 0.5000000 -0.0000000), wk = 0.0026596 k( 80) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0026596 k( 81) = ( 0.4404762 0.5000000 -0.0000000), wk = 0.0026596 k( 82) = ( 0.4523810 0.5000000 -0.0000000), wk = 0.0026596 k( 83) = ( 0.4642857 0.5000000 -0.0000000), wk = 0.0026596 k( 84) = ( 0.4761905 0.5000000 -0.0000000), wk = 0.0026596 k( 85) = ( 0.4880952 0.5000000 -0.0000000), wk = 0.0026596 k( 86) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026596 k( 87) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026596 k( 88) = ( 0.4915254 0.4915254 -0.0000000), wk = 0.0026596 k( 89) = ( 0.4830508 0.4830508 -0.0000000), wk = 0.0026596 k( 90) = ( 0.4745763 0.4745763 -0.0000000), wk = 0.0026596 k( 91) = ( 0.4661017 0.4661017 -0.0000000), wk = 0.0026596 k( 92) = ( 0.4576271 0.4576271 -0.0000000), wk = 0.0026596 k( 93) = ( 0.4491525 0.4491525 -0.0000000), wk = 0.0026596 k( 94) = ( 0.4406780 0.4406780 -0.0000000), wk = 0.0026596 k( 95) = ( 0.4322034 0.4322034 -0.0000000), wk = 0.0026596 k( 96) = ( 0.4237288 0.4237288 -0.0000000), wk = 0.0026596 k( 97) = ( 0.4152542 0.4152542 -0.0000000), wk = 0.0026596 k( 98) = ( 0.4067797 0.4067797 -0.0000000), wk = 0.0026596 k( 99) = ( 0.3983051 0.3983051 -0.0000000), wk = 0.0026596 k( 100) = ( 0.3898305 0.3898305 -0.0000000), wk = 0.0026596 k( 101) = ( 0.3813559 0.3813559 -0.0000000), wk = 0.0026596 k( 102) = ( 0.3728814 0.3728814 -0.0000000), wk = 0.0026596 k( 103) = ( 0.3644068 0.3644068 -0.0000000), wk = 0.0026596 k( 104) = ( 0.3559322 0.3559322 -0.0000000), wk = 0.0026596 k( 105) = ( 0.3474576 0.3474576 -0.0000000), wk = 0.0026596 k( 106) = ( 0.3389831 0.3389830 -0.0000000), wk = 0.0026596 k( 107) = ( 0.3305085 0.3305085 -0.0000000), wk = 0.0026596 k( 108) = ( 0.3220339 0.3220339 -0.0000000), wk = 0.0026596 k( 109) = ( 0.3135593 0.3135593 -0.0000000), wk = 0.0026596 k( 110) = ( 0.3050848 0.3050847 -0.0000000), wk = 0.0026596 k( 111) = ( 0.2966102 0.2966102 -0.0000000), wk = 0.0026596 k( 112) = ( 0.2881356 0.2881356 -0.0000000), wk = 0.0026596 k( 113) = ( 0.2796610 0.2796610 -0.0000000), wk = 0.0026596 k( 114) = ( 0.2711864 0.2711864 -0.0000000), wk = 0.0026596 k( 115) = ( 0.2627119 0.2627119 -0.0000000), wk = 0.0026596 k( 116) = ( 0.2542373 0.2542373 -0.0000000), wk = 0.0026596 k( 117) = ( 0.2457627 0.2457627 -0.0000000), wk = 0.0026596 k( 118) = ( 0.2372881 0.2372881 -0.0000000), wk = 0.0026596 k( 119) = ( 0.2288136 0.2288136 -0.0000000), wk = 0.0026596 k( 120) = ( 0.2203390 0.2203390 -0.0000000), wk = 0.0026596 k( 121) = ( 0.2118644 0.2118644 -0.0000000), wk = 0.0026596 k( 122) = ( 0.2033898 0.2033898 -0.0000000), wk = 0.0026596 k( 123) = ( 0.1949153 0.1949152 -0.0000000), wk = 0.0026596 k( 124) = ( 0.1864407 0.1864407 -0.0000000), wk = 0.0026596 k( 125) = ( 0.1779661 0.1779661 -0.0000000), wk = 0.0026596 k( 126) = ( 0.1694915 0.1694915 -0.0000000), wk = 0.0026596 k( 127) = ( 0.1610169 0.1610169 -0.0000000), wk = 0.0026596 k( 128) = ( 0.1525424 0.1525424 -0.0000000), wk = 0.0026596 k( 129) = ( 0.1440678 0.1440678 -0.0000000), wk = 0.0026596 k( 130) = ( 0.1355932 0.1355932 -0.0000000), wk = 0.0026596 k( 131) = ( 0.1271186 0.1271186 -0.0000000), wk = 0.0026596 k( 132) = ( 0.1186441 0.1186441 -0.0000000), wk = 0.0026596 k( 133) = ( 0.1101695 0.1101695 -0.0000000), wk = 0.0026596 k( 134) = ( 0.1016949 0.1016949 -0.0000000), wk = 0.0026596 k( 135) = ( 0.0932203 0.0932203 -0.0000000), wk = 0.0026596 k( 136) = ( 0.0847458 0.0847458 -0.0000000), wk = 0.0026596 k( 137) = ( 0.0762712 0.0762712 -0.0000000), wk = 0.0026596 k( 138) = ( 0.0677966 0.0677966 -0.0000000), wk = 0.0026596 k( 139) = ( 0.0593220 0.0593220 -0.0000000), wk = 0.0026596 k( 140) = ( 0.0508475 0.0508475 -0.0000000), wk = 0.0026596 k( 141) = ( 0.0423729 0.0423729 -0.0000000), wk = 0.0026596 k( 142) = ( 0.0338983 0.0338983 -0.0000000), wk = 0.0026596 k( 143) = ( 0.0254237 0.0254237 -0.0000000), wk = 0.0026596 k( 144) = ( 0.0169491 0.0169491 -0.0000000), wk = 0.0026596 k( 145) = ( 0.0084746 0.0084746 -0.0000000), wk = 0.0026596 k( 146) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026596 k( 147) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026596 k( 148) = ( 0.0000000 0.0000000 0.0118055), wk = 0.0026596 k( 149) = ( 0.0000000 0.0000000 0.0236110), wk = 0.0026596 k( 150) = ( 0.0000000 0.0000000 0.0354164), wk = 0.0026596 k( 151) = ( 0.0000000 0.0000000 0.0472219), wk = 0.0026596 k( 152) = ( 0.0000000 0.0000000 0.0590274), wk = 0.0026596 k( 153) = ( 0.0000000 0.0000000 0.0708329), wk = 0.0026596 k( 154) = ( 0.0000000 0.0000000 0.0826383), wk = 0.0026596 k( 155) = ( 0.0000000 0.0000000 0.0944438), wk = 0.0026596 k( 156) = ( 0.0000000 0.0000000 0.1062493), wk = 0.0026596 k( 157) = ( 0.0000000 0.0000000 0.1180548), wk = 0.0026596 k( 158) = ( 0.0000000 0.0000000 0.1298603), wk = 0.0026596 k( 159) = ( 0.0000000 0.0000000 0.1416657), wk = 0.0026596 k( 160) = ( 0.0000000 0.0000000 0.1534712), wk = 0.0026596 k( 161) = ( 0.0000000 0.0000000 0.1652767), wk = 0.0026596 k( 162) = ( 0.0000000 0.0000000 0.1770822), wk = 0.0026596 k( 163) = ( 0.0000000 0.0000000 0.1888876), wk = 0.0026596 k( 164) = ( 0.0000000 0.0000000 0.2006931), wk = 0.0026596 k( 165) = ( 0.0000000 0.0000000 0.2124986), wk = 0.0026596 k( 166) = ( 0.0000000 0.0000000 0.2243041), wk = 0.0026596 k( 167) = ( 0.0000000 0.0000000 0.2361096), wk = 0.0026596 k( 168) = ( 0.0000000 0.0000000 0.2479150), wk = 0.0026596 k( 169) = ( 0.0000000 0.0000000 0.2597205), wk = 0.0026596 k( 170) = ( 0.0000000 0.0000000 0.2715260), wk = 0.0026596 k( 171) = ( 0.0000000 0.0000000 0.2833315), wk = 0.0026596 k( 172) = ( 0.0000000 0.0000000 0.2951369), wk = 0.0026596 k( 173) = ( 0.0000000 0.0000000 0.3069424), wk = 0.0026596 k( 174) = ( 0.0000000 0.0000000 0.3187479), wk = 0.0026596 k( 175) = ( 0.0000000 0.0000000 0.3187479), wk = 0.0026596 k( 176) = ( 0.0000000 0.0119048 0.3187479), wk = 0.0026596 k( 177) = ( 0.0000000 0.0238095 0.3187479), wk = 0.0026596 k( 178) = ( 0.0000000 0.0357143 0.3187479), wk = 0.0026596 k( 179) = ( 0.0000000 0.0476191 0.3187479), wk = 0.0026596 k( 180) = ( 0.0000000 0.0595238 0.3187479), wk = 0.0026596 k( 181) = ( 0.0000000 0.0714286 0.3187479), wk = 0.0026596 k( 182) = ( 0.0000000 0.0833333 0.3187479), wk = 0.0026596 k( 183) = ( 0.0000000 0.0952381 0.3187479), wk = 0.0026596 k( 184) = ( 0.0000000 0.1071429 0.3187479), wk = 0.0026596 k( 185) = ( 0.0000000 0.1190476 0.3187479), wk = 0.0026596 k( 186) = ( 0.0000000 0.1309524 0.3187479), wk = 0.0026596 k( 187) = ( 0.0000000 0.1428571 0.3187479), wk = 0.0026596 k( 188) = ( 0.0000000 0.1547619 0.3187479), wk = 0.0026596 k( 189) = ( 0.0000000 0.1666667 0.3187479), wk = 0.0026596 k( 190) = ( 0.0000000 0.1785714 0.3187479), wk = 0.0026596 k( 191) = ( 0.0000000 0.1904762 0.3187479), wk = 0.0026596 k( 192) = ( 0.0000000 0.2023810 0.3187479), wk = 0.0026596 k( 193) = ( 0.0000000 0.2142857 0.3187479), wk = 0.0026596 k( 194) = ( 0.0000000 0.2261905 0.3187479), wk = 0.0026596 k( 195) = ( 0.0000000 0.2380952 0.3187479), wk = 0.0026596 k( 196) = ( 0.0000000 0.2500000 0.3187479), wk = 0.0026596 k( 197) = ( 0.0000000 0.2619048 0.3187479), wk = 0.0026596 k( 198) = ( 0.0000000 0.2738095 0.3187479), wk = 0.0026596 k( 199) = ( 0.0000000 0.2857143 0.3187479), wk = 0.0026596 k( 200) = ( 0.0000000 0.2976190 0.3187479), wk = 0.0026596 k( 201) = ( 0.0000000 0.3095238 0.3187479), wk = 0.0026596 k( 202) = ( 0.0000000 0.3214286 0.3187479), wk = 0.0026596 k( 203) = ( 0.0000000 0.3333333 0.3187479), wk = 0.0026596 k( 204) = ( 0.0000000 0.3452381 0.3187479), wk = 0.0026596 k( 205) = ( 0.0000000 0.3571429 0.3187479), wk = 0.0026596 k( 206) = ( 0.0000000 0.3690476 0.3187479), wk = 0.0026596 k( 207) = ( 0.0000000 0.3809524 0.3187479), wk = 0.0026596 k( 208) = ( 0.0000000 0.3928571 0.3187479), wk = 0.0026596 k( 209) = ( 0.0000000 0.4047619 0.3187479), wk = 0.0026596 k( 210) = ( 0.0000000 0.4166667 0.3187479), wk = 0.0026596 k( 211) = ( 0.0000000 0.4285714 0.3187479), wk = 0.0026596 k( 212) = ( 0.0000000 0.4404762 0.3187479), wk = 0.0026596 k( 213) = ( 0.0000000 0.4523810 0.3187479), wk = 0.0026596 k( 214) = ( 0.0000000 0.4642857 0.3187479), wk = 0.0026596 k( 215) = ( 0.0000000 0.4761905 0.3187479), wk = 0.0026596 k( 216) = ( 0.0000000 0.4880952 0.3187479), wk = 0.0026596 k( 217) = ( 0.0000000 0.5000000 0.3187479), wk = 0.0026596 k( 218) = ( 0.0000000 0.5000000 0.3187479), wk = 0.0026596 k( 219) = ( 0.0119048 0.5000000 0.3187479), wk = 0.0026596 k( 220) = ( 0.0238095 0.5000000 0.3187479), wk = 0.0026596 k( 221) = ( 0.0357143 0.5000000 0.3187479), wk = 0.0026596 k( 222) = ( 0.0476191 0.5000000 0.3187479), wk = 0.0026596 k( 223) = ( 0.0595238 0.5000000 0.3187479), wk = 0.0026596 k( 224) = ( 0.0714286 0.5000000 0.3187479), wk = 0.0026596 k( 225) = ( 0.0833333 0.5000000 0.3187479), wk = 0.0026596 k( 226) = ( 0.0952381 0.5000000 0.3187479), wk = 0.0026596 k( 227) = ( 0.1071429 0.5000000 0.3187479), wk = 0.0026596 k( 228) = ( 0.1190476 0.5000000 0.3187479), wk = 0.0026596 k( 229) = ( 0.1309524 0.5000000 0.3187479), wk = 0.0026596 k( 230) = ( 0.1428571 0.5000000 0.3187479), wk = 0.0026596 k( 231) = ( 0.1547619 0.5000000 0.3187479), wk = 0.0026596 k( 232) = ( 0.1666667 0.5000000 0.3187479), wk = 0.0026596 k( 233) = ( 0.1785714 0.5000000 0.3187479), wk = 0.0026596 k( 234) = ( 0.1904762 0.5000000 0.3187479), wk = 0.0026596 k( 235) = ( 0.2023810 0.5000000 0.3187479), wk = 0.0026596 k( 236) = ( 0.2142857 0.5000000 0.3187479), wk = 0.0026596 k( 237) = ( 0.2261905 0.5000000 0.3187479), wk = 0.0026596 k( 238) = ( 0.2380952 0.5000000 0.3187479), wk = 0.0026596 k( 239) = ( 0.2500000 0.5000000 0.3187479), wk = 0.0026596 k( 240) = ( 0.2619048 0.5000000 0.3187479), wk = 0.0026596 k( 241) = ( 0.2738095 0.5000000 0.3187479), wk = 0.0026596 k( 242) = ( 0.2857143 0.5000000 0.3187479), wk = 0.0026596 k( 243) = ( 0.2976190 0.5000000 0.3187479), wk = 0.0026596 k( 244) = ( 0.3095238 0.5000000 0.3187479), wk = 0.0026596 k( 245) = ( 0.3214286 0.5000000 0.3187479), wk = 0.0026596 k( 246) = ( 0.3333333 0.5000000 0.3187479), wk = 0.0026596 k( 247) = ( 0.3452381 0.5000000 0.3187479), wk = 0.0026596 k( 248) = ( 0.3571429 0.5000000 0.3187479), wk = 0.0026596 k( 249) = ( 0.3690476 0.5000000 0.3187479), wk = 0.0026596 k( 250) = ( 0.3809524 0.5000000 0.3187479), wk = 0.0026596 k( 251) = ( 0.3928571 0.5000000 0.3187479), wk = 0.0026596 k( 252) = ( 0.4047619 0.5000000 0.3187479), wk = 0.0026596 k( 253) = ( 0.4166667 0.5000000 0.3187479), wk = 0.0026596 k( 254) = ( 0.4285714 0.5000000 0.3187479), wk = 0.0026596 k( 255) = ( 0.4404762 0.5000000 0.3187479), wk = 0.0026596 k( 256) = ( 0.4523810 0.5000000 0.3187479), wk = 0.0026596 k( 257) = ( 0.4642857 0.5000000 0.3187479), wk = 0.0026596 k( 258) = ( 0.4761905 0.5000000 0.3187479), wk = 0.0026596 k( 259) = ( 0.4880952 0.5000000 0.3187479), wk = 0.0026596 k( 260) = ( 0.5000000 0.5000000 0.3187479), wk = 0.0026596 k( 261) = ( 0.5000000 0.5000000 0.3187479), wk = 0.0026596 k( 262) = ( 0.4915254 0.4915254 0.3187479), wk = 0.0026596 k( 263) = ( 0.4830508 0.4830508 0.3187479), wk = 0.0026596 k( 264) = ( 0.4745763 0.4745763 0.3187479), wk = 0.0026596 k( 265) = ( 0.4661017 0.4661017 0.3187479), wk = 0.0026596 k( 266) = ( 0.4576271 0.4576271 0.3187479), wk = 0.0026596 k( 267) = ( 0.4491525 0.4491525 0.3187479), wk = 0.0026596 k( 268) = ( 0.4406780 0.4406780 0.3187479), wk = 0.0026596 k( 269) = ( 0.4322034 0.4322034 0.3187479), wk = 0.0026596 k( 270) = ( 0.4237288 0.4237288 0.3187479), wk = 0.0026596 k( 271) = ( 0.4152542 0.4152542 0.3187479), wk = 0.0026596 k( 272) = ( 0.4067797 0.4067797 0.3187479), wk = 0.0026596 k( 273) = ( 0.3983051 0.3983051 0.3187479), wk = 0.0026596 k( 274) = ( 0.3898305 0.3898305 0.3187479), wk = 0.0026596 k( 275) = ( 0.3813559 0.3813559 0.3187479), wk = 0.0026596 k( 276) = ( 0.3728814 0.3728814 0.3187479), wk = 0.0026596 k( 277) = ( 0.3644068 0.3644068 0.3187479), wk = 0.0026596 k( 278) = ( 0.3559322 0.3559322 0.3187479), wk = 0.0026596 k( 279) = ( 0.3474576 0.3474576 0.3187479), wk = 0.0026596 k( 280) = ( 0.3389831 0.3389830 0.3187479), wk = 0.0026596 k( 281) = ( 0.3305085 0.3305085 0.3187479), wk = 0.0026596 k( 282) = ( 0.3220339 0.3220339 0.3187479), wk = 0.0026596 k( 283) = ( 0.3135593 0.3135593 0.3187479), wk = 0.0026596 k( 284) = ( 0.3050848 0.3050847 0.3187479), wk = 0.0026596 k( 285) = ( 0.2966102 0.2966102 0.3187479), wk = 0.0026596 k( 286) = ( 0.2881356 0.2881356 0.3187479), wk = 0.0026596 k( 287) = ( 0.2796610 0.2796610 0.3187479), wk = 0.0026596 k( 288) = ( 0.2711864 0.2711864 0.3187479), wk = 0.0026596 k( 289) = ( 0.2627119 0.2627119 0.3187479), wk = 0.0026596 k( 290) = ( 0.2542373 0.2542373 0.3187479), wk = 0.0026596 k( 291) = ( 0.2457627 0.2457627 0.3187479), wk = 0.0026596 k( 292) = ( 0.2372881 0.2372881 0.3187479), wk = 0.0026596 k( 293) = ( 0.2288136 0.2288136 0.3187479), wk = 0.0026596 k( 294) = ( 0.2203390 0.2203390 0.3187479), wk = 0.0026596 k( 295) = ( 0.2118644 0.2118644 0.3187479), wk = 0.0026596 k( 296) = ( 0.2033898 0.2033898 0.3187479), wk = 0.0026596 k( 297) = ( 0.1949153 0.1949152 0.3187479), wk = 0.0026596 k( 298) = ( 0.1864407 0.1864407 0.3187479), wk = 0.0026596 k( 299) = ( 0.1779661 0.1779661 0.3187479), wk = 0.0026596 k( 300) = ( 0.1694915 0.1694915 0.3187479), wk = 0.0026596 k( 301) = ( 0.1610169 0.1610169 0.3187479), wk = 0.0026596 k( 302) = ( 0.1525424 0.1525424 0.3187479), wk = 0.0026596 k( 303) = ( 0.1440678 0.1440678 0.3187479), wk = 0.0026596 k( 304) = ( 0.1355932 0.1355932 0.3187479), wk = 0.0026596 k( 305) = ( 0.1271186 0.1271186 0.3187479), wk = 0.0026596 k( 306) = ( 0.1186441 0.1186441 0.3187479), wk = 0.0026596 k( 307) = ( 0.1101695 0.1101695 0.3187479), wk = 0.0026596 k( 308) = ( 0.1016949 0.1016949 0.3187479), wk = 0.0026596 k( 309) = ( 0.0932203 0.0932203 0.3187479), wk = 0.0026596 k( 310) = ( 0.0847458 0.0847458 0.3187479), wk = 0.0026596 k( 311) = ( 0.0762712 0.0762712 0.3187479), wk = 0.0026596 k( 312) = ( 0.0677966 0.0677966 0.3187479), wk = 0.0026596 k( 313) = ( 0.0593220 0.0593220 0.3187479), wk = 0.0026596 k( 314) = ( 0.0508475 0.0508475 0.3187479), wk = 0.0026596 k( 315) = ( 0.0423729 0.0423729 0.3187479), wk = 0.0026596 k( 316) = ( 0.0338983 0.0338983 0.3187479), wk = 0.0026596 k( 317) = ( 0.0254237 0.0254237 0.3187479), wk = 0.0026596 k( 318) = ( 0.0169491 0.0169491 0.3187479), wk = 0.0026596 k( 319) = ( 0.0084746 0.0084746 0.3187479), wk = 0.0026596 k( 320) = ( 0.0000000 0.0000000 0.3187479), wk = 0.0026596 k( 321) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026596 k( 322) = ( 0.0000000 0.5000000 0.0118055), wk = 0.0026596 k( 323) = ( 0.0000000 0.5000000 0.0236110), wk = 0.0026596 k( 324) = ( 0.0000000 0.5000000 0.0354164), wk = 0.0026596 k( 325) = ( 0.0000000 0.5000000 0.0472219), wk = 0.0026596 k( 326) = ( 0.0000000 0.5000000 0.0590274), wk = 0.0026596 k( 327) = ( 0.0000000 0.5000000 0.0708329), wk = 0.0026596 k( 328) = ( 0.0000000 0.5000000 0.0826383), wk = 0.0026596 k( 329) = ( 0.0000000 0.5000000 0.0944438), wk = 0.0026596 k( 330) = ( 0.0000000 0.5000000 0.1062493), wk = 0.0026596 k( 331) = ( 0.0000000 0.5000000 0.1180548), wk = 0.0026596 k( 332) = ( 0.0000000 0.5000000 0.1298603), wk = 0.0026596 k( 333) = ( 0.0000000 0.5000000 0.1416657), wk = 0.0026596 k( 334) = ( 0.0000000 0.5000000 0.1534712), wk = 0.0026596 k( 335) = ( 0.0000000 0.5000000 0.1652767), wk = 0.0026596 k( 336) = ( 0.0000000 0.5000000 0.1770822), wk = 0.0026596 k( 337) = ( 0.0000000 0.5000000 0.1888876), wk = 0.0026596 k( 338) = ( 0.0000000 0.5000000 0.2006931), wk = 0.0026596 k( 339) = ( 0.0000000 0.5000000 0.2124986), wk = 0.0026596 k( 340) = ( 0.0000000 0.5000000 0.2243041), wk = 0.0026596 k( 341) = ( 0.0000000 0.5000000 0.2361096), wk = 0.0026596 k( 342) = ( 0.0000000 0.5000000 0.2479150), wk = 0.0026596 k( 343) = ( 0.0000000 0.5000000 0.2597205), wk = 0.0026596 k( 344) = ( 0.0000000 0.5000000 0.2715260), wk = 0.0026596 k( 345) = ( 0.0000000 0.5000000 0.2833315), wk = 0.0026596 k( 346) = ( 0.0000000 0.5000000 0.2951369), wk = 0.0026596 k( 347) = ( 0.0000000 0.5000000 0.3069424), wk = 0.0026596 k( 348) = ( 0.0000000 0.5000000 0.3187479), wk = 0.0026596 k( 349) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026596 k( 350) = ( 0.5000000 0.5000000 0.0118055), wk = 0.0026596 k( 351) = ( 0.5000000 0.5000000 0.0236110), wk = 0.0026596 k( 352) = ( 0.5000000 0.5000000 0.0354164), wk = 0.0026596 k( 353) = ( 0.5000000 0.5000000 0.0472219), wk = 0.0026596 k( 354) = ( 0.5000000 0.5000000 0.0590274), wk = 0.0026596 k( 355) = ( 0.5000000 0.5000000 0.0708329), wk = 0.0026596 k( 356) = ( 0.5000000 0.5000000 0.0826383), wk = 0.0026596 k( 357) = ( 0.5000000 0.5000000 0.0944438), wk = 0.0026596 k( 358) = ( 0.5000000 0.5000000 0.1062493), wk = 0.0026596 k( 359) = ( 0.5000000 0.5000000 0.1180548), wk = 0.0026596 k( 360) = ( 0.5000000 0.5000000 0.1298603), wk = 0.0026596 k( 361) = ( 0.5000000 0.5000000 0.1416657), wk = 0.0026596 k( 362) = ( 0.5000000 0.5000000 0.1534712), wk = 0.0026596 k( 363) = ( 0.5000000 0.5000000 0.1652767), wk = 0.0026596 k( 364) = ( 0.5000000 0.5000000 0.1770822), wk = 0.0026596 k( 365) = ( 0.5000000 0.5000000 0.1888876), wk = 0.0026596 k( 366) = ( 0.5000000 0.5000000 0.2006931), wk = 0.0026596 k( 367) = ( 0.5000000 0.5000000 0.2124986), wk = 0.0026596 k( 368) = ( 0.5000000 0.5000000 0.2243041), wk = 0.0026596 k( 369) = ( 0.5000000 0.5000000 0.2361096), wk = 0.0026596 k( 370) = ( 0.5000000 0.5000000 0.2479150), wk = 0.0026596 k( 371) = ( 0.5000000 0.5000000 0.2597205), wk = 0.0026596 k( 372) = ( 0.5000000 0.5000000 0.2715260), wk = 0.0026596 k( 373) = ( 0.5000000 0.5000000 0.2833315), wk = 0.0026596 k( 374) = ( 0.5000000 0.5000000 0.2951369), wk = 0.0026596 k( 375) = ( 0.5000000 0.5000000 0.3069424), wk = 0.0026596 k( 376) = ( 0.5000000 0.5000000 0.3187479), wk = 0.0026596 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026596 k( 2) = ( 0.0000000 0.0119048 -0.0000000), wk = 0.0026596 k( 3) = ( 0.0000000 0.0238095 -0.0000000), wk = 0.0026596 k( 4) = ( 0.0000000 0.0357143 0.0000000), wk = 0.0026596 k( 5) = ( 0.0000000 0.0476191 0.0000000), wk = 0.0026596 k( 6) = ( 0.0000000 0.0595238 0.0000000), wk = 0.0026596 k( 7) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0026596 k( 8) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0026596 k( 9) = ( 0.0000000 0.0952381 0.0000000), wk = 0.0026596 k( 10) = ( 0.0000000 0.1071429 -0.0000000), wk = 0.0026596 k( 11) = ( 0.0000000 0.1190476 0.0000000), wk = 0.0026596 k( 12) = ( 0.0000000 0.1309524 -0.0000000), wk = 0.0026596 k( 13) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0026596 k( 14) = ( 0.0000000 0.1547619 0.0000000), wk = 0.0026596 k( 15) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0026596 k( 16) = ( 0.0000000 0.1785714 0.0000000), wk = 0.0026596 k( 17) = ( 0.0000000 0.1904762 0.0000000), wk = 0.0026596 k( 18) = ( 0.0000000 0.2023810 -0.0000000), wk = 0.0026596 k( 19) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0026596 k( 20) = ( 0.0000000 0.2261905 0.0000000), wk = 0.0026596 k( 21) = ( 0.0000000 0.2380952 0.0000000), wk = 0.0026596 k( 22) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0026596 k( 23) = ( 0.0000000 0.2619048 -0.0000000), wk = 0.0026596 k( 24) = ( 0.0000000 0.2738095 -0.0000000), wk = 0.0026596 k( 25) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0026596 k( 26) = ( 0.0000000 0.2976190 0.0000000), wk = 0.0026596 k( 27) = ( 0.0000000 0.3095238 0.0000000), wk = 0.0026596 k( 28) = ( 0.0000000 0.3214286 0.0000000), wk = 0.0026596 k( 29) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0026596 k( 30) = ( 0.0000000 0.3452381 0.0000000), wk = 0.0026596 k( 31) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0026596 k( 32) = ( 0.0000000 0.3690476 0.0000000), wk = 0.0026596 k( 33) = ( 0.0000000 0.3809524 0.0000000), wk = 0.0026596 k( 34) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0026596 k( 35) = ( 0.0000000 0.4047619 -0.0000000), wk = 0.0026596 k( 36) = ( 0.0000000 0.4166667 0.0000000), wk = 0.0026596 k( 37) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0026596 k( 38) = ( 0.0000000 0.4404762 -0.0000000), wk = 0.0026596 k( 39) = ( 0.0000000 0.4523810 -0.0000000), wk = 0.0026596 k( 40) = ( 0.0000000 0.4642857 0.0000000), wk = 0.0026596 k( 41) = ( 0.0000000 0.4761905 0.0000000), wk = 0.0026596 k( 42) = ( 0.0000000 0.4880952 0.0000000), wk = 0.0026596 k( 43) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026596 k( 44) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026596 k( 45) = ( 0.0119048 0.5000000 0.0000000), wk = 0.0026596 k( 46) = ( 0.0238095 0.5000000 0.0000000), wk = 0.0026596 k( 47) = ( 0.0357143 0.5000000 -0.0000000), wk = 0.0026596 k( 48) = ( 0.0476191 0.5000000 0.0000000), wk = 0.0026596 k( 49) = ( 0.0595238 0.5000000 0.0000000), wk = 0.0026596 k( 50) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0026596 k( 51) = ( 0.0833333 0.5000000 0.0000000), wk = 0.0026596 k( 52) = ( 0.0952381 0.5000000 0.0000000), wk = 0.0026596 k( 53) = ( 0.1071429 0.5000000 0.0000000), wk = 0.0026596 k( 54) = ( 0.1190476 0.5000000 0.0000000), wk = 0.0026596 k( 55) = ( 0.1309524 0.5000000 0.0000000), wk = 0.0026596 k( 56) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0026596 k( 57) = ( 0.1547619 0.5000000 0.0000000), wk = 0.0026596 k( 58) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0026596 k( 59) = ( 0.1785714 0.5000000 0.0000000), wk = 0.0026596 k( 60) = ( 0.1904762 0.5000000 0.0000000), wk = 0.0026596 k( 61) = ( 0.2023810 0.5000000 0.0000000), wk = 0.0026596 k( 62) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0026596 k( 63) = ( 0.2261905 0.5000000 0.0000000), wk = 0.0026596 k( 64) = ( 0.2380952 0.5000000 0.0000000), wk = 0.0026596 k( 65) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0026596 k( 66) = ( 0.2619048 0.5000000 0.0000000), wk = 0.0026596 k( 67) = ( 0.2738095 0.5000000 0.0000000), wk = 0.0026596 k( 68) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0026596 k( 69) = ( 0.2976190 0.5000000 -0.0000000), wk = 0.0026596 k( 70) = ( 0.3095238 0.5000000 0.0000000), wk = 0.0026596 k( 71) = ( 0.3214286 0.5000000 0.0000000), wk = 0.0026596 k( 72) = ( 0.3333333 0.5000000 0.0000000), wk = 0.0026596 k( 73) = ( 0.3452381 0.5000000 -0.0000000), wk = 0.0026596 k( 74) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0026596 k( 75) = ( 0.3690476 0.5000000 -0.0000000), wk = 0.0026596 k( 76) = ( 0.3809524 0.5000000 -0.0000000), wk = 0.0026596 k( 77) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0026596 k( 78) = ( 0.4047619 0.5000000 0.0000000), wk = 0.0026596 k( 79) = ( 0.4166667 0.5000000 0.0000000), wk = 0.0026596 k( 80) = ( 0.4285714 0.5000000 0.0000000), wk = 0.0026596 k( 81) = ( 0.4404762 0.5000000 -0.0000000), wk = 0.0026596 k( 82) = ( 0.4523810 0.5000000 0.0000000), wk = 0.0026596 k( 83) = ( 0.4642857 0.5000000 0.0000000), wk = 0.0026596 k( 84) = ( 0.4761905 0.5000000 0.0000000), wk = 0.0026596 k( 85) = ( 0.4880952 0.5000000 0.0000000), wk = 0.0026596 k( 86) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026596 k( 87) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026596 k( 88) = ( 0.4915254 0.4915254 0.0000000), wk = 0.0026596 k( 89) = ( 0.4830508 0.4830508 -0.0000000), wk = 0.0026596 k( 90) = ( 0.4745763 0.4745763 -0.0000000), wk = 0.0026596 k( 91) = ( 0.4661017 0.4661017 -0.0000000), wk = 0.0026596 k( 92) = ( 0.4576271 0.4576271 -0.0000000), wk = 0.0026596 k( 93) = ( 0.4491525 0.4491525 0.0000000), wk = 0.0026596 k( 94) = ( 0.4406780 0.4406780 0.0000000), wk = 0.0026596 k( 95) = ( 0.4322034 0.4322034 0.0000000), wk = 0.0026596 k( 96) = ( 0.4237288 0.4237288 0.0000000), wk = 0.0026596 k( 97) = ( 0.4152542 0.4152542 0.0000000), wk = 0.0026596 k( 98) = ( 0.4067797 0.4067797 -0.0000000), wk = 0.0026596 k( 99) = ( 0.3983051 0.3983051 -0.0000000), wk = 0.0026596 k( 100) = ( 0.3898305 0.3898305 -0.0000000), wk = 0.0026596 k( 101) = ( 0.3813559 0.3813559 -0.0000000), wk = 0.0026596 k( 102) = ( 0.3728814 0.3728814 -0.0000000), wk = 0.0026596 k( 103) = ( 0.3644068 0.3644068 -0.0000000), wk = 0.0026596 k( 104) = ( 0.3559322 0.3559322 -0.0000000), wk = 0.0026596 k( 105) = ( 0.3474576 0.3474576 -0.0000000), wk = 0.0026596 k( 106) = ( 0.3389831 0.3389831 0.0000000), wk = 0.0026596 k( 107) = ( 0.3305085 0.3305085 -0.0000000), wk = 0.0026596 k( 108) = ( 0.3220339 0.3220339 -0.0000000), wk = 0.0026596 k( 109) = ( 0.3135593 0.3135593 0.0000000), wk = 0.0026596 k( 110) = ( 0.3050848 0.3050848 0.0000000), wk = 0.0026596 k( 111) = ( 0.2966102 0.2966102 -0.0000000), wk = 0.0026596 k( 112) = ( 0.2881356 0.2881356 0.0000000), wk = 0.0026596 k( 113) = ( 0.2796610 0.2796610 -0.0000000), wk = 0.0026596 k( 114) = ( 0.2711864 0.2711864 0.0000000), wk = 0.0026596 k( 115) = ( 0.2627119 0.2627119 0.0000000), wk = 0.0026596 k( 116) = ( 0.2542373 0.2542373 0.0000000), wk = 0.0026596 k( 117) = ( 0.2457627 0.2457627 0.0000000), wk = 0.0026596 k( 118) = ( 0.2372881 0.2372881 -0.0000000), wk = 0.0026596 k( 119) = ( 0.2288136 0.2288136 -0.0000000), wk = 0.0026596 k( 120) = ( 0.2203390 0.2203390 0.0000000), wk = 0.0026596 k( 121) = ( 0.2118644 0.2118644 -0.0000000), wk = 0.0026596 k( 122) = ( 0.2033898 0.2033898 -0.0000000), wk = 0.0026596 k( 123) = ( 0.1949153 0.1949153 -0.0000000), wk = 0.0026596 k( 124) = ( 0.1864407 0.1864407 -0.0000000), wk = 0.0026596 k( 125) = ( 0.1779661 0.1779661 -0.0000000), wk = 0.0026596 k( 126) = ( 0.1694915 0.1694915 0.0000000), wk = 0.0026596 k( 127) = ( 0.1610169 0.1610169 -0.0000000), wk = 0.0026596 k( 128) = ( 0.1525424 0.1525424 0.0000000), wk = 0.0026596 k( 129) = ( 0.1440678 0.1440678 -0.0000000), wk = 0.0026596 k( 130) = ( 0.1355932 0.1355932 0.0000000), wk = 0.0026596 k( 131) = ( 0.1271186 0.1271186 0.0000000), wk = 0.0026596 k( 132) = ( 0.1186441 0.1186441 -0.0000000), wk = 0.0026596 k( 133) = ( 0.1101695 0.1101695 0.0000000), wk = 0.0026596 k( 134) = ( 0.1016949 0.1016949 -0.0000000), wk = 0.0026596 k( 135) = ( 0.0932203 0.0932203 -0.0000000), wk = 0.0026596 k( 136) = ( 0.0847458 0.0847458 -0.0000000), wk = 0.0026596 k( 137) = ( 0.0762712 0.0762712 -0.0000000), wk = 0.0026596 k( 138) = ( 0.0677966 0.0677966 0.0000000), wk = 0.0026596 k( 139) = ( 0.0593220 0.0593220 0.0000000), wk = 0.0026596 k( 140) = ( 0.0508475 0.0508475 -0.0000000), wk = 0.0026596 k( 141) = ( 0.0423729 0.0423729 -0.0000000), wk = 0.0026596 k( 142) = ( 0.0338983 0.0338983 0.0000000), wk = 0.0026596 k( 143) = ( 0.0254237 0.0254237 -0.0000000), wk = 0.0026596 k( 144) = ( 0.0169491 0.0169491 0.0000000), wk = 0.0026596 k( 145) = ( 0.0084746 0.0084746 0.0000000), wk = 0.0026596 k( 146) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026596 k( 147) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026596 k( 148) = ( 0.0000000 0.0000000 0.0185185), wk = 0.0026596 k( 149) = ( 0.0000000 0.0000000 0.0370370), wk = 0.0026596 k( 150) = ( 0.0000000 0.0000000 0.0555556), wk = 0.0026596 k( 151) = ( 0.0000000 0.0000000 0.0740741), wk = 0.0026596 k( 152) = ( 0.0000000 0.0000000 0.0925926), wk = 0.0026596 k( 153) = ( 0.0000000 0.0000000 0.1111111), wk = 0.0026596 k( 154) = ( 0.0000000 0.0000000 0.1296296), wk = 0.0026596 k( 155) = ( 0.0000000 0.0000000 0.1481482), wk = 0.0026596 k( 156) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0026596 k( 157) = ( 0.0000000 0.0000000 0.1851852), wk = 0.0026596 k( 158) = ( 0.0000000 0.0000000 0.2037037), wk = 0.0026596 k( 159) = ( 0.0000000 0.0000000 0.2222222), wk = 0.0026596 k( 160) = ( 0.0000000 0.0000000 0.2407407), wk = 0.0026596 k( 161) = ( 0.0000000 0.0000000 0.2592593), wk = 0.0026596 k( 162) = ( 0.0000000 0.0000000 0.2777778), wk = 0.0026596 k( 163) = ( 0.0000000 0.0000000 0.2962963), wk = 0.0026596 k( 164) = ( 0.0000000 0.0000000 0.3148148), wk = 0.0026596 k( 165) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0026596 k( 166) = ( 0.0000000 0.0000000 0.3518519), wk = 0.0026596 k( 167) = ( 0.0000000 0.0000000 0.3703704), wk = 0.0026596 k( 168) = ( 0.0000000 0.0000000 0.3888889), wk = 0.0026596 k( 169) = ( 0.0000000 0.0000000 0.4074074), wk = 0.0026596 k( 170) = ( 0.0000000 0.0000000 0.4259259), wk = 0.0026596 k( 171) = ( 0.0000000 0.0000000 0.4444444), wk = 0.0026596 k( 172) = ( 0.0000000 0.0000000 0.4629630), wk = 0.0026596 k( 173) = ( 0.0000000 0.0000000 0.4814815), wk = 0.0026596 k( 174) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026596 k( 175) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026596 k( 176) = ( 0.0000000 0.0119048 0.5000000), wk = 0.0026596 k( 177) = ( 0.0000000 0.0238095 0.5000000), wk = 0.0026596 k( 178) = ( 0.0000000 0.0357143 0.5000000), wk = 0.0026596 k( 179) = ( 0.0000000 0.0476191 0.5000000), wk = 0.0026596 k( 180) = ( 0.0000000 0.0595238 0.5000000), wk = 0.0026596 k( 181) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0026596 k( 182) = ( 0.0000000 0.0833333 0.5000000), wk = 0.0026596 k( 183) = ( 0.0000000 0.0952381 0.5000000), wk = 0.0026596 k( 184) = ( 0.0000000 0.1071429 0.5000000), wk = 0.0026596 k( 185) = ( 0.0000000 0.1190476 0.5000000), wk = 0.0026596 k( 186) = ( 0.0000000 0.1309524 0.5000000), wk = 0.0026596 k( 187) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0026596 k( 188) = ( 0.0000000 0.1547619 0.5000000), wk = 0.0026596 k( 189) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0026596 k( 190) = ( 0.0000000 0.1785714 0.5000000), wk = 0.0026596 k( 191) = ( 0.0000000 0.1904762 0.5000000), wk = 0.0026596 k( 192) = ( 0.0000000 0.2023810 0.5000000), wk = 0.0026596 k( 193) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0026596 k( 194) = ( 0.0000000 0.2261905 0.5000000), wk = 0.0026596 k( 195) = ( 0.0000000 0.2380952 0.5000000), wk = 0.0026596 k( 196) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0026596 k( 197) = ( 0.0000000 0.2619048 0.5000000), wk = 0.0026596 k( 198) = ( 0.0000000 0.2738095 0.5000000), wk = 0.0026596 k( 199) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0026596 k( 200) = ( 0.0000000 0.2976190 0.5000000), wk = 0.0026596 k( 201) = ( 0.0000000 0.3095238 0.5000000), wk = 0.0026596 k( 202) = ( 0.0000000 0.3214286 0.5000000), wk = 0.0026596 k( 203) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0026596 k( 204) = ( 0.0000000 0.3452381 0.5000000), wk = 0.0026596 k( 205) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0026596 k( 206) = ( 0.0000000 0.3690476 0.5000000), wk = 0.0026596 k( 207) = ( 0.0000000 0.3809524 0.5000000), wk = 0.0026596 k( 208) = ( 0.0000000 0.3928571 0.5000000), wk = 0.0026596 k( 209) = ( 0.0000000 0.4047619 0.5000000), wk = 0.0026596 k( 210) = ( 0.0000000 0.4166667 0.5000000), wk = 0.0026596 k( 211) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0026596 k( 212) = ( 0.0000000 0.4404762 0.5000000), wk = 0.0026596 k( 213) = ( 0.0000000 0.4523810 0.5000000), wk = 0.0026596 k( 214) = ( 0.0000000 0.4642857 0.5000000), wk = 0.0026596 k( 215) = ( 0.0000000 0.4761905 0.5000000), wk = 0.0026596 k( 216) = ( 0.0000000 0.4880952 0.5000000), wk = 0.0026596 k( 217) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026596 k( 218) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026596 k( 219) = ( 0.0119048 0.5000000 0.5000000), wk = 0.0026596 k( 220) = ( 0.0238095 0.5000000 0.5000000), wk = 0.0026596 k( 221) = ( 0.0357143 0.5000000 0.5000000), wk = 0.0026596 k( 222) = ( 0.0476191 0.5000000 0.5000000), wk = 0.0026596 k( 223) = ( 0.0595238 0.5000000 0.5000000), wk = 0.0026596 k( 224) = ( 0.0714286 0.5000000 0.5000000), wk = 0.0026596 k( 225) = ( 0.0833333 0.5000000 0.5000000), wk = 0.0026596 k( 226) = ( 0.0952381 0.5000000 0.5000000), wk = 0.0026596 k( 227) = ( 0.1071429 0.5000000 0.5000000), wk = 0.0026596 k( 228) = ( 0.1190476 0.5000000 0.5000000), wk = 0.0026596 k( 229) = ( 0.1309524 0.5000000 0.5000000), wk = 0.0026596 k( 230) = ( 0.1428571 0.5000000 0.5000000), wk = 0.0026596 k( 231) = ( 0.1547619 0.5000000 0.5000000), wk = 0.0026596 k( 232) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0026596 k( 233) = ( 0.1785714 0.5000000 0.5000000), wk = 0.0026596 k( 234) = ( 0.1904762 0.5000000 0.5000000), wk = 0.0026596 k( 235) = ( 0.2023810 0.5000000 0.5000000), wk = 0.0026596 k( 236) = ( 0.2142857 0.5000000 0.5000000), wk = 0.0026596 k( 237) = ( 0.2261905 0.5000000 0.5000000), wk = 0.0026596 k( 238) = ( 0.2380952 0.5000000 0.5000000), wk = 0.0026596 k( 239) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0026596 k( 240) = ( 0.2619048 0.5000000 0.5000000), wk = 0.0026596 k( 241) = ( 0.2738095 0.5000000 0.5000000), wk = 0.0026596 k( 242) = ( 0.2857143 0.5000000 0.5000000), wk = 0.0026596 k( 243) = ( 0.2976190 0.5000000 0.5000000), wk = 0.0026596 k( 244) = ( 0.3095238 0.5000000 0.5000000), wk = 0.0026596 k( 245) = ( 0.3214286 0.5000000 0.5000000), wk = 0.0026596 k( 246) = ( 0.3333333 0.5000000 0.5000000), wk = 0.0026596 k( 247) = ( 0.3452381 0.5000000 0.5000000), wk = 0.0026596 k( 248) = ( 0.3571429 0.5000000 0.5000000), wk = 0.0026596 k( 249) = ( 0.3690476 0.5000000 0.5000000), wk = 0.0026596 k( 250) = ( 0.3809524 0.5000000 0.5000000), wk = 0.0026596 k( 251) = ( 0.3928571 0.5000000 0.5000000), wk = 0.0026596 k( 252) = ( 0.4047619 0.5000000 0.5000000), wk = 0.0026596 k( 253) = ( 0.4166667 0.5000000 0.5000000), wk = 0.0026596 k( 254) = ( 0.4285714 0.5000000 0.5000000), wk = 0.0026596 k( 255) = ( 0.4404762 0.5000000 0.5000000), wk = 0.0026596 k( 256) = ( 0.4523810 0.5000000 0.5000000), wk = 0.0026596 k( 257) = ( 0.4642857 0.5000000 0.5000000), wk = 0.0026596 k( 258) = ( 0.4761905 0.5000000 0.5000000), wk = 0.0026596 k( 259) = ( 0.4880952 0.5000000 0.5000000), wk = 0.0026596 k( 260) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026596 k( 261) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026596 k( 262) = ( 0.4915254 0.4915254 0.5000000), wk = 0.0026596 k( 263) = ( 0.4830508 0.4830508 0.5000000), wk = 0.0026596 k( 264) = ( 0.4745763 0.4745763 0.5000000), wk = 0.0026596 k( 265) = ( 0.4661017 0.4661017 0.5000000), wk = 0.0026596 k( 266) = ( 0.4576271 0.4576271 0.5000000), wk = 0.0026596 k( 267) = ( 0.4491525 0.4491525 0.5000000), wk = 0.0026596 k( 268) = ( 0.4406780 0.4406780 0.5000000), wk = 0.0026596 k( 269) = ( 0.4322034 0.4322034 0.5000000), wk = 0.0026596 k( 270) = ( 0.4237288 0.4237288 0.5000000), wk = 0.0026596 k( 271) = ( 0.4152542 0.4152542 0.5000000), wk = 0.0026596 k( 272) = ( 0.4067797 0.4067797 0.5000000), wk = 0.0026596 k( 273) = ( 0.3983051 0.3983051 0.5000000), wk = 0.0026596 k( 274) = ( 0.3898305 0.3898305 0.5000000), wk = 0.0026596 k( 275) = ( 0.3813559 0.3813559 0.5000000), wk = 0.0026596 k( 276) = ( 0.3728814 0.3728814 0.5000000), wk = 0.0026596 k( 277) = ( 0.3644068 0.3644068 0.5000000), wk = 0.0026596 k( 278) = ( 0.3559322 0.3559322 0.5000000), wk = 0.0026596 k( 279) = ( 0.3474576 0.3474576 0.5000000), wk = 0.0026596 k( 280) = ( 0.3389831 0.3389831 0.5000000), wk = 0.0026596 k( 281) = ( 0.3305085 0.3305085 0.5000000), wk = 0.0026596 k( 282) = ( 0.3220339 0.3220339 0.5000000), wk = 0.0026596 k( 283) = ( 0.3135593 0.3135593 0.5000000), wk = 0.0026596 k( 284) = ( 0.3050848 0.3050848 0.5000000), wk = 0.0026596 k( 285) = ( 0.2966102 0.2966102 0.5000000), wk = 0.0026596 k( 286) = ( 0.2881356 0.2881356 0.5000000), wk = 0.0026596 k( 287) = ( 0.2796610 0.2796610 0.5000000), wk = 0.0026596 k( 288) = ( 0.2711864 0.2711864 0.5000000), wk = 0.0026596 k( 289) = ( 0.2627119 0.2627119 0.5000000), wk = 0.0026596 k( 290) = ( 0.2542373 0.2542373 0.5000000), wk = 0.0026596 k( 291) = ( 0.2457627 0.2457627 0.5000000), wk = 0.0026596 k( 292) = ( 0.2372881 0.2372881 0.5000000), wk = 0.0026596 k( 293) = ( 0.2288136 0.2288136 0.5000000), wk = 0.0026596 k( 294) = ( 0.2203390 0.2203390 0.5000000), wk = 0.0026596 k( 295) = ( 0.2118644 0.2118644 0.5000000), wk = 0.0026596 k( 296) = ( 0.2033898 0.2033898 0.5000000), wk = 0.0026596 k( 297) = ( 0.1949153 0.1949153 0.5000000), wk = 0.0026596 k( 298) = ( 0.1864407 0.1864407 0.5000000), wk = 0.0026596 k( 299) = ( 0.1779661 0.1779661 0.5000000), wk = 0.0026596 k( 300) = ( 0.1694915 0.1694915 0.5000000), wk = 0.0026596 k( 301) = ( 0.1610169 0.1610169 0.5000000), wk = 0.0026596 k( 302) = ( 0.1525424 0.1525424 0.5000000), wk = 0.0026596 k( 303) = ( 0.1440678 0.1440678 0.5000000), wk = 0.0026596 k( 304) = ( 0.1355932 0.1355932 0.5000000), wk = 0.0026596 k( 305) = ( 0.1271186 0.1271186 0.5000000), wk = 0.0026596 k( 306) = ( 0.1186441 0.1186441 0.5000000), wk = 0.0026596 k( 307) = ( 0.1101695 0.1101695 0.5000000), wk = 0.0026596 k( 308) = ( 0.1016949 0.1016949 0.5000000), wk = 0.0026596 k( 309) = ( 0.0932203 0.0932203 0.5000000), wk = 0.0026596 k( 310) = ( 0.0847458 0.0847458 0.5000000), wk = 0.0026596 k( 311) = ( 0.0762712 0.0762712 0.5000000), wk = 0.0026596 k( 312) = ( 0.0677966 0.0677966 0.5000000), wk = 0.0026596 k( 313) = ( 0.0593220 0.0593220 0.5000000), wk = 0.0026596 k( 314) = ( 0.0508475 0.0508475 0.5000000), wk = 0.0026596 k( 315) = ( 0.0423729 0.0423729 0.5000000), wk = 0.0026596 k( 316) = ( 0.0338983 0.0338983 0.5000000), wk = 0.0026596 k( 317) = ( 0.0254237 0.0254237 0.5000000), wk = 0.0026596 k( 318) = ( 0.0169491 0.0169491 0.5000000), wk = 0.0026596 k( 319) = ( 0.0084746 0.0084746 0.5000000), wk = 0.0026596 k( 320) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026596 k( 321) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026596 k( 322) = ( 0.0000000 0.5000000 0.0185185), wk = 0.0026596 k( 323) = ( 0.0000000 0.5000000 0.0370370), wk = 0.0026596 k( 324) = ( 0.0000000 0.5000000 0.0555556), wk = 0.0026596 k( 325) = ( 0.0000000 0.5000000 0.0740741), wk = 0.0026596 k( 326) = ( 0.0000000 0.5000000 0.0925926), wk = 0.0026596 k( 327) = ( 0.0000000 0.5000000 0.1111111), wk = 0.0026596 k( 328) = ( 0.0000000 0.5000000 0.1296296), wk = 0.0026596 k( 329) = ( 0.0000000 0.5000000 0.1481482), wk = 0.0026596 k( 330) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0026596 k( 331) = ( 0.0000000 0.5000000 0.1851852), wk = 0.0026596 k( 332) = ( 0.0000000 0.5000000 0.2037037), wk = 0.0026596 k( 333) = ( 0.0000000 0.5000000 0.2222222), wk = 0.0026596 k( 334) = ( 0.0000000 0.5000000 0.2407407), wk = 0.0026596 k( 335) = ( 0.0000000 0.5000000 0.2592593), wk = 0.0026596 k( 336) = ( 0.0000000 0.5000000 0.2777778), wk = 0.0026596 k( 337) = ( 0.0000000 0.5000000 0.2962963), wk = 0.0026596 k( 338) = ( 0.0000000 0.5000000 0.3148148), wk = 0.0026596 k( 339) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0026596 k( 340) = ( 0.0000000 0.5000000 0.3518519), wk = 0.0026596 k( 341) = ( 0.0000000 0.5000000 0.3703704), wk = 0.0026596 k( 342) = ( 0.0000000 0.5000000 0.3888889), wk = 0.0026596 k( 343) = ( 0.0000000 0.5000000 0.4074074), wk = 0.0026596 k( 344) = ( 0.0000000 0.5000000 0.4259259), wk = 0.0026596 k( 345) = ( 0.0000000 0.5000000 0.4444444), wk = 0.0026596 k( 346) = ( 0.0000000 0.5000000 0.4629630), wk = 0.0026596 k( 347) = ( 0.0000000 0.5000000 0.4814815), wk = 0.0026596 k( 348) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026596 k( 349) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026596 k( 350) = ( 0.5000000 0.5000000 0.0185185), wk = 0.0026596 k( 351) = ( 0.5000000 0.5000000 0.0370370), wk = 0.0026596 k( 352) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0026596 k( 353) = ( 0.5000000 0.5000000 0.0740741), wk = 0.0026596 k( 354) = ( 0.5000000 0.5000000 0.0925926), wk = 0.0026596 k( 355) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0026596 k( 356) = ( 0.5000000 0.5000000 0.1296296), wk = 0.0026596 k( 357) = ( 0.5000000 0.5000000 0.1481482), wk = 0.0026596 k( 358) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0026596 k( 359) = ( 0.5000000 0.5000000 0.1851852), wk = 0.0026596 k( 360) = ( 0.5000000 0.5000000 0.2037037), wk = 0.0026596 k( 361) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0026596 k( 362) = ( 0.5000000 0.5000000 0.2407407), wk = 0.0026596 k( 363) = ( 0.5000000 0.5000000 0.2592593), wk = 0.0026596 k( 364) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0026596 k( 365) = ( 0.5000000 0.5000000 0.2962963), wk = 0.0026596 k( 366) = ( 0.5000000 0.5000000 0.3148148), wk = 0.0026596 k( 367) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0026596 k( 368) = ( 0.5000000 0.5000000 0.3518519), wk = 0.0026596 k( 369) = ( 0.5000000 0.5000000 0.3703704), wk = 0.0026596 k( 370) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0026596 k( 371) = ( 0.5000000 0.5000000 0.4074074), wk = 0.0026596 k( 372) = ( 0.5000000 0.5000000 0.4259259), wk = 0.0026596 k( 373) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0026596 k( 374) = ( 0.5000000 0.5000000 0.4629630), wk = 0.0026596 k( 375) = ( 0.5000000 0.5000000 0.4814815), wk = 0.0026596 k( 376) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026596 Dense grid: 35475 G-vectors FFT dimensions: ( 36, 36, 60) Smooth grid: 24293 G-vectors FFT dimensions: ( 32, 32, 50) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.17 Mb ( 170, 64) NL pseudopotentials 0.21 Mb ( 85, 164) Each V/rho on FFT grid 0.04 Mb ( 2592) Each G-vector array 0.01 Mb ( 985) G-vector shells 0.00 Mb ( 489) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.66 Mb ( 170, 256) Each subspace H/S matrix 0.06 Mb ( 64, 64) Each matrix 0.32 Mb ( 164, 2, 64) The potential is recalculated from file : ./Cu2As.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.8 secs Computing kpt #: 2 total cpu time spent up to now is 2.2 secs Computing kpt #: 3 total cpu time spent up to now is 2.7 secs Computing kpt #: 4 total cpu time spent up to now is 3.1 secs Computing kpt #: 5 total cpu time spent up to now is 3.5 secs Computing kpt #: 6 total cpu time spent up to now is 4.0 secs Computing kpt #: 7 total cpu time spent up to now is 4.4 secs Computing kpt #: 8 total cpu time spent up to now is 4.8 secs Computing kpt #: 9 total cpu time spent up to now is 5.3 secs Computing kpt #: 10 total cpu time spent up to now is 5.7 secs Computing kpt #: 11 total cpu time spent up to now is 6.2 secs Computing kpt #: 12 total cpu time spent up to now is 6.6 secs Computing kpt #: 13 total cpu time spent up to now is 7.0 secs Computing kpt #: 14 total cpu time spent up to now is 7.5 secs Computing kpt #: 15 total cpu time spent up to now is 7.9 secs Computing kpt #: 16 total cpu time spent up to now is 8.3 secs Computing kpt #: 17 total cpu time spent up to now is 8.7 secs Computing kpt #: 18 total cpu time spent up to now is 9.1 secs Computing kpt #: 19 total cpu time spent up to now is 9.5 secs Computing kpt #: 20 total cpu time spent up to now is 9.9 secs Computing kpt #: 21 total cpu time spent up to now is 10.4 secs Computing kpt #: 22 total cpu time spent up to now is 10.8 secs Computing kpt #: 23 total cpu time spent up to now is 11.3 secs Computing kpt #: 24 total cpu time spent up to now is 11.7 secs Computing kpt #: 25 total cpu time spent up to now is 12.0 secs Computing kpt #: 26 total cpu time spent up to now is 12.4 secs Computing kpt #: 27 total cpu time spent up to now is 12.8 secs Computing kpt #: 28 total cpu time spent up to now is 13.1 secs Computing kpt #: 29 total cpu time spent up to now is 13.5 secs Computing kpt #: 30 total cpu time spent up to now is 13.8 secs Computing kpt #: 31 total cpu time spent up to now is 14.2 secs Computing kpt #: 32 total cpu time spent up to now is 14.6 secs Computing kpt #: 33 total cpu time spent up to now is 14.9 secs Computing kpt #: 34 total cpu time spent up to now is 15.3 secs Computing kpt #: 35 total cpu time spent up to now is 15.6 secs Computing kpt #: 36 total cpu time spent up to now is 16.0 secs Computing kpt #: 37 total cpu time spent up to now is 16.4 secs Computing kpt #: 38 total cpu time spent up to now is 16.7 secs Computing kpt #: 39 total cpu time spent up to now is 17.1 secs Computing kpt #: 40 total cpu time spent up to now is 17.4 secs Computing kpt #: 41 total cpu time spent up to now is 17.8 secs Computing kpt #: 42 total cpu time spent up to now is 18.1 secs Computing kpt #: 43 total cpu time spent up to now is 18.5 secs Computing kpt #: 44 total cpu time spent up to now is 18.9 secs Computing kpt #: 45 total cpu time spent up to now is 19.2 secs Computing kpt #: 46 total cpu time spent up to now is 19.6 secs Computing kpt #: 47 total cpu time spent up to now is 20.0 secs Computing kpt #: 48 total cpu time spent up to now is 20.3 secs Computing kpt #: 49 total cpu time spent up to now is 20.7 secs Computing kpt #: 50 total cpu time spent up to now is 21.1 secs Computing kpt #: 51 total cpu time spent up to now is 21.5 secs Computing kpt #: 52 total cpu time spent up to now is 21.8 secs Computing kpt #: 53 total cpu time spent up to now is 22.2 secs Computing kpt #: 54 total cpu time spent up to now is 22.6 secs Computing kpt #: 55 total cpu time spent up to now is 23.0 secs Computing kpt #: 56 total cpu time spent up to now is 23.4 secs Computing kpt #: 57 total cpu time spent up to now is 23.8 secs Computing kpt #: 58 total cpu time spent up to now is 24.2 secs Computing kpt #: 59 total cpu time spent up to now is 24.6 secs Computing kpt #: 60 total cpu time spent up to now is 24.9 secs Computing kpt #: 61 total cpu time spent up to now is 25.3 secs Computing kpt #: 62 total cpu time spent up to now is 25.6 secs Computing kpt #: 63 total cpu time spent up to now is 26.0 secs Computing kpt #: 64 total cpu time spent up to now is 26.3 secs Computing kpt #: 65 total cpu time spent up to now is 26.6 secs Computing kpt #: 66 total cpu time spent up to now is 27.0 secs Computing kpt #: 67 total cpu time spent up to now is 27.3 secs Computing kpt #: 68 total cpu time spent up to now is 27.6 secs Computing kpt #: 69 total cpu time spent up to now is 27.9 secs Computing kpt #: 70 total cpu time spent up to now is 28.3 secs Computing kpt #: 71 total cpu time spent up to now is 28.6 secs Computing kpt #: 72 total cpu time spent up to now is 28.9 secs Computing kpt #: 73 total cpu time spent up to now is 29.2 secs Computing kpt #: 74 total cpu time spent up to now is 29.6 secs Computing kpt #: 75 total cpu time spent up to now is 29.9 secs Computing kpt #: 76 total cpu time spent up to now is 30.2 secs Computing kpt #: 77 total cpu time spent up to now is 30.5 secs Computing kpt #: 78 total cpu time spent up to now is 30.8 secs Computing kpt #: 79 total cpu time spent up to now is 31.1 secs Computing kpt #: 80 total cpu time spent up to now is 31.4 secs Computing kpt #: 81 total cpu time spent up to now is 31.8 secs Computing kpt #: 82 total cpu time spent up to now is 32.1 secs Computing kpt #: 83 total cpu time spent up to now is 32.4 secs Computing kpt #: 84 total cpu time spent up to now is 32.7 secs Computing kpt #: 85 total cpu time spent up to now is 33.0 secs Computing kpt #: 86 total cpu time spent up to now is 33.3 secs Computing kpt #: 87 total cpu time spent up to now is 33.6 secs Computing kpt #: 88 total cpu time spent up to now is 33.9 secs Computing kpt #: 89 total cpu time spent up to now is 34.2 secs Computing kpt #: 90 total cpu time spent up to now is 34.5 secs Computing kpt #: 91 total cpu time spent up to now is 34.8 secs Computing kpt #: 92 total cpu time spent up to now is 35.1 secs Computing kpt #: 93 total cpu time spent up to now is 35.5 secs Computing kpt #: 94 total cpu time spent up to now is 35.8 secs Computing kpt #: 95 total cpu time spent up to now is 36.1 secs Computing kpt #: 96 total cpu time spent up to now is 36.4 secs Computing kpt #: 97 total cpu time spent up to now is 36.7 secs Computing kpt #: 98 total cpu time spent up to now is 37.1 secs Computing kpt #: 99 total cpu time spent up to now is 37.4 secs Computing kpt #: 100 total cpu time spent up to now is 37.7 secs Computing kpt #: 101 total cpu time spent up to now is 38.0 secs Computing kpt #: 102 total cpu time spent up to now is 38.4 secs Computing kpt #: 103 total cpu time spent up to now is 38.7 secs Computing kpt #: 104 total cpu time spent up to now is 39.0 secs Computing kpt #: 105 total cpu time spent up to now is 39.3 secs Computing kpt #: 106 total cpu time spent up to now is 39.6 secs Computing kpt #: 107 total cpu time spent up to now is 40.0 secs Computing kpt #: 108 total cpu 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secs Computing kpt #: 170 total cpu time spent up to now is 65.3 secs Computing kpt #: 171 total cpu time spent up to now is 65.7 secs Computing kpt #: 172 total cpu time spent up to now is 66.1 secs Computing kpt #: 173 total cpu time spent up to now is 66.5 secs Computing kpt #: 174 total cpu time spent up to now is 66.8 secs Computing kpt #: 175 total cpu time spent up to now is 67.2 secs Computing kpt #: 176 total cpu time spent up to now is 67.5 secs Computing kpt #: 177 total cpu time spent up to now is 67.9 secs Computing kpt #: 178 total cpu time spent up to now is 68.2 secs Computing kpt #: 179 total cpu time spent up to now is 68.6 secs Computing kpt #: 180 total cpu time spent up to now is 68.9 secs Computing kpt #: 181 total cpu time spent up to now is 69.3 secs Computing kpt #: 182 total cpu time spent up to now is 69.6 secs Computing kpt #: 183 total cpu time spent up to now is 70.0 secs Computing kpt #: 184 total cpu time spent up to now is 70.3 secs Computing kpt #: 185 total cpu time spent up to now is 70.7 secs Computing kpt #: 186 total cpu time spent up to now is 71.0 secs Computing kpt #: 187 total cpu time spent up to now is 71.4 secs Computing kpt #: 188 total cpu time spent up to now is 71.7 secs Computing kpt #: 189 total cpu time spent up to now is 72.1 secs Computing kpt #: 190 total cpu time spent up to now is 72.4 secs Computing kpt #: 191 total cpu time spent up to now is 72.8 secs Computing kpt #: 192 total cpu time spent up to now is 73.1 secs Computing kpt #: 193 total cpu time spent up to now is 73.5 secs Computing kpt #: 194 total cpu time spent up to now is 73.8 secs Computing kpt #: 195 total cpu time spent up to now is 74.1 secs Computing kpt #: 196 total cpu time spent up to now is 74.5 secs Computing kpt #: 197 total cpu time spent up to now is 74.8 secs Computing kpt #: 198 total cpu time spent up to now is 75.1 secs Computing kpt #: 199 total cpu time spent up to now is 75.5 secs Computing kpt #: 200 total cpu time spent up 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Computing kpt #: 216 total cpu time spent up to now is 81.6 secs Computing kpt #: 217 total cpu time spent up to now is 82.0 secs Computing kpt #: 218 total cpu time spent up to now is 82.4 secs Computing kpt #: 219 total cpu time spent up to now is 82.7 secs Computing kpt #: 220 total cpu time spent up to now is 83.1 secs Computing kpt #: 221 total cpu time spent up to now is 83.5 secs Computing kpt #: 222 total cpu time spent up to now is 83.9 secs Computing kpt #: 223 total cpu time spent up to now is 84.3 secs Computing kpt #: 224 total cpu time spent up to now is 84.6 secs Computing kpt #: 225 total cpu time spent up to now is 85.0 secs Computing kpt #: 226 total cpu time spent up to now is 85.4 secs Computing kpt #: 227 total cpu time spent up to now is 85.7 secs Computing kpt #: 228 total cpu time spent up to now is 86.0 secs Computing kpt #: 229 total cpu time spent up to now is 86.4 secs Computing kpt #: 230 total cpu time spent up to now is 86.7 secs Computing kpt #: 231 total cpu time spent up to now is 87.0 secs Computing kpt #: 232 total cpu time spent up to now is 87.4 secs Computing kpt #: 233 total cpu time spent up to now is 87.7 secs Computing kpt #: 234 total cpu time spent up to now is 88.0 secs Computing kpt #: 235 total cpu time spent up to now is 88.4 secs Computing kpt #: 236 total cpu time spent up to now is 88.7 secs Computing kpt #: 237 total cpu time spent up to now is 89.0 secs Computing kpt #: 238 total cpu time spent up to now is 89.3 secs Computing kpt #: 239 total cpu time spent up to now is 89.7 secs Computing kpt #: 240 total cpu time spent up to now is 90.0 secs Computing kpt #: 241 total cpu time spent up to now is 90.3 secs Computing kpt #: 242 total cpu time spent up to now is 90.7 secs Computing kpt #: 243 total cpu time spent up to now is 91.0 secs Computing kpt #: 244 total cpu time spent up to now is 91.3 secs Computing kpt #: 245 total cpu time spent up to now is 91.7 secs Computing kpt #: 246 total cpu time spent up to now is 92.0 secs Computing kpt #: 247 total cpu time spent up to now is 92.3 secs Computing kpt #: 248 total cpu time spent up to now is 92.7 secs Computing kpt #: 249 total cpu time spent up to now is 93.0 secs Computing kpt #: 250 total cpu time spent up to now is 93.4 secs Computing kpt #: 251 total cpu time spent up to now is 93.7 secs Computing kpt #: 252 total cpu time spent up to now is 94.1 secs Computing kpt #: 253 total cpu time spent up to now is 94.4 secs Computing kpt #: 254 total cpu time spent up to now is 94.8 secs Computing kpt #: 255 total cpu time spent up to now is 95.1 secs Computing kpt #: 256 total cpu time spent up to now is 95.5 secs Computing kpt #: 257 total cpu time spent up to now is 95.9 secs Computing kpt #: 258 total cpu time spent up to now is 96.2 secs Computing kpt #: 259 total cpu time spent up to now is 96.6 secs Computing kpt #: 260 total cpu time spent up to now is 96.9 secs Computing kpt #: 261 total cpu time spent up to now is 97.3 secs Computing kpt #: 262 total cpu time spent up to now is 97.7 secs Computing kpt #: 263 total cpu time spent up to now is 98.0 secs Computing kpt #: 264 total cpu time spent up to now is 98.4 secs Computing kpt #: 265 total cpu time spent up to now is 98.7 secs Computing kpt #: 266 total cpu time spent up to now is 99.1 secs Computing kpt #: 267 total cpu time spent up to now is 99.5 secs Computing kpt #: 268 total cpu time spent up to now is 99.8 secs Computing kpt #: 269 total cpu time spent up to now is 100.2 secs Computing kpt #: 270 total cpu time spent up to now is 100.5 secs Computing kpt #: 271 total cpu time spent up to now is 100.9 secs Computing kpt #: 272 total cpu time spent up to now is 101.3 secs Computing kpt #: 273 total cpu time spent up to now is 101.7 secs Computing kpt #: 274 total cpu time spent up to now is 102.1 secs Computing kpt #: 275 total cpu time spent up to now is 102.5 secs Computing kpt #: 276 total cpu time spent up to now is 102.9 secs Computing kpt #: 277 total cpu time spent up to now is 103.3 secs Computing kpt #: 278 total cpu time spent up to now is 103.7 secs Computing kpt #: 279 total cpu time spent up to now is 104.2 secs Computing kpt #: 280 total cpu time spent up to now is 104.6 secs Computing kpt #: 281 total cpu time spent up to now is 105.0 secs Computing kpt #: 282 total cpu time spent up to now is 105.5 secs Computing kpt #: 283 total cpu time spent up to now is 105.9 secs Computing kpt #: 284 total cpu time spent up to now is 106.2 secs Computing kpt #: 285 total cpu time spent up to now is 106.6 secs Computing kpt #: 286 total cpu time spent up to now is 106.9 secs Computing kpt #: 287 total cpu time spent up to now is 107.3 secs Computing kpt #: 288 total cpu time spent up to now is 107.6 secs Computing kpt #: 289 total cpu time spent up to now is 108.0 secs Computing kpt #: 290 total cpu time spent up to now is 108.3 secs Computing kpt #: 291 total cpu time spent up to now is 108.7 secs Computing kpt #: 292 total cpu time spent up to now is 109.1 secs Computing kpt #: 293 total cpu time spent up to now is 109.4 secs Computing kpt #: 294 total cpu time spent up to now is 109.8 secs Computing kpt #: 295 total cpu time spent up to now is 110.2 secs Computing kpt #: 296 total cpu time spent up to now is 110.6 secs Computing kpt #: 297 total cpu time spent up to now is 111.0 secs Computing kpt #: 298 total cpu time spent up to now is 111.4 secs Computing kpt #: 299 total cpu time spent up to now is 111.8 secs Computing kpt #: 300 total cpu time spent up to now is 112.2 secs Computing kpt #: 301 total cpu time spent up to now is 112.5 secs Computing kpt #: 302 total cpu time spent up to now is 112.9 secs Computing kpt #: 303 total cpu time spent up to now is 113.3 secs Computing kpt #: 304 total cpu time spent up to now is 113.7 secs Computing kpt #: 305 total cpu time spent up to now is 114.2 secs Computing kpt #: 306 total cpu time spent up to now is 114.6 secs Computing kpt #: 307 total cpu time spent up to now is 115.1 secs Computing kpt #: 308 total cpu time spent up to now is 115.5 secs Computing kpt #: 309 total cpu time spent up to now is 115.8 secs Computing kpt #: 310 total cpu time spent up to now is 116.2 secs Computing kpt #: 311 total cpu time spent up to now is 116.6 secs Computing kpt #: 312 total cpu time spent up to now is 116.9 secs Computing kpt #: 313 total cpu time spent up to now is 117.3 secs Computing kpt #: 314 total cpu time spent up to now is 117.7 secs Computing kpt #: 315 total cpu time spent up to now is 118.0 secs Computing kpt #: 316 total cpu time spent up to now is 118.4 secs Computing kpt #: 317 total cpu time spent up to now is 118.8 secs Computing kpt #: 318 total cpu time spent up to now is 119.1 secs Computing kpt #: 319 total cpu time spent up to now is 119.5 secs Computing kpt #: 320 total cpu time spent up to now is 119.8 secs Computing kpt #: 321 total cpu time spent up to now is 120.2 secs Computing kpt #: 322 total cpu time spent up to now is 120.5 secs Computing kpt #: 323 total cpu time spent up to now is 120.9 secs Computing kpt #: 324 total cpu time spent up to now is 121.2 secs Computing kpt #: 325 total cpu time spent up to now is 121.6 secs Computing kpt #: 326 total cpu time spent up to now is 122.0 secs Computing kpt #: 327 total cpu time spent up to now is 122.3 secs Computing kpt #: 328 total cpu time spent up to now is 122.7 secs Computing kpt #: 329 total cpu time spent up to now is 123.0 secs Computing kpt #: 330 total cpu time spent up to now is 123.4 secs Computing kpt #: 331 total cpu time spent up to now is 123.7 secs Computing kpt #: 332 total cpu time spent up to now is 124.1 secs Computing kpt #: 333 total cpu time spent up to now is 124.4 secs Computing kpt #: 334 total cpu time spent up to now is 124.8 secs Computing kpt #: 335 total cpu time spent up to now is 125.2 secs Computing kpt #: 336 total cpu time spent up to now is 125.5 secs Computing kpt #: 337 total cpu time spent up to now is 125.9 secs Computing kpt #: 338 total cpu time spent up to now is 126.2 secs Computing kpt #: 339 total cpu time spent up to now is 126.6 secs Computing kpt #: 340 total cpu time spent up to now is 127.0 secs Computing kpt #: 341 total cpu time spent up to now is 127.3 secs Computing kpt #: 342 total cpu time spent up to now is 127.7 secs Computing kpt #: 343 total cpu time spent up to now is 128.1 secs Computing kpt #: 344 total cpu time spent up to now is 128.5 secs Computing kpt #: 345 total cpu time spent up to now is 128.9 secs Computing kpt #: 346 total cpu time spent up to now is 129.3 secs Computing kpt #: 347 total cpu time spent up to now is 129.7 secs Computing kpt #: 348 total cpu time spent up to now is 130.1 secs Computing kpt #: 349 total cpu time spent up to now is 130.4 secs Computing kpt #: 350 total cpu time spent up to now is 130.7 secs Computing kpt #: 351 total cpu time spent up to now is 131.0 secs Computing kpt #: 352 total cpu time spent up to now is 131.3 secs Computing kpt #: 353 total cpu time spent up to now is 131.6 secs Computing kpt #: 354 total cpu time spent up to now is 131.9 secs Computing kpt #: 355 total cpu time spent up to now is 132.2 secs Computing kpt #: 356 total cpu time spent up to now is 132.5 secs Computing kpt #: 357 total cpu time spent up to now is 132.8 secs Computing kpt #: 358 total cpu time spent up to now is 133.2 secs Computing kpt #: 359 total cpu time spent up to now is 133.5 secs Computing kpt #: 360 total cpu time spent up to now is 133.8 secs Computing kpt #: 361 total cpu time spent up to now is 134.1 secs Computing kpt #: 362 total cpu time spent up to now is 134.6 secs Computing kpt #: 363 total cpu time spent up to now is 135.0 secs Computing kpt #: 364 total cpu time spent up to now is 135.4 secs Computing kpt #: 365 total cpu time spent up to now is 135.7 secs Computing kpt #: 366 total cpu time spent up to now is 136.1 secs Computing kpt #: 367 total cpu time spent up to now is 136.4 secs Computing kpt #: 368 total cpu time spent up to now is 136.7 secs Computing kpt #: 369 total cpu time spent up to now is 137.1 secs Computing kpt #: 370 total cpu time spent up to now is 137.4 secs Computing kpt #: 371 total cpu time spent up to now is 137.8 secs Computing kpt #: 372 total cpu time spent up to now is 138.1 secs Computing kpt #: 373 total cpu time spent up to now is 138.5 secs Computing kpt #: 374 total cpu time spent up to now is 138.9 secs Computing kpt #: 375 total cpu time spent up to now is 139.3 secs Computing kpt #: 376 total cpu time spent up to now is 139.6 secs ethr = 1.85E-08, avg # of iterations = 16.5 total cpu time spent up to now is 139.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3049 PWs) bands (ev): -2.1644 -2.1644 -0.2484 -0.2484 4.1905 4.1905 6.3583 6.3583 6.5547 6.5547 6.5838 6.5838 6.9336 6.9336 7.1287 7.1287 7.2465 7.2465 7.6288 7.6288 7.7333 7.7333 7.8215 7.8215 8.0030 8.0030 8.1502 8.1502 8.2408 8.2408 8.3082 8.3082 8.3788 8.3788 8.6089 8.6089 8.6267 8.6267 8.7348 8.7348 8.8079 8.8079 8.8167 8.8167 8.8288 8.8288 8.9581 8.9581 9.0065 9.0065 10.3425 10.3425 11.8734 11.8734 11.9879 11.9879 12.1665 12.1665 13.7433 13.7433 15.2627 15.2627 16.4632 16.4632 k = 0.0000 0.0119-0.0000 ( 3041 PWs) bands (ev): -2.1632 -2.1632 -0.2479 -0.2479 4.1918 4.1918 6.3585 6.3585 6.5541 6.5541 6.5832 6.5832 6.9340 6.9340 7.1259 7.1259 7.2467 7.2467 7.6284 7.6284 7.7329 7.7329 7.8195 7.8195 8.0029 8.0029 8.1454 8.1454 8.2352 8.2352 8.3159 8.3159 8.3788 8.3788 8.6082 8.6082 8.6258 8.6258 8.7346 8.7346 8.8057 8.8057 8.8156 8.8156 8.8294 8.8294 8.9511 8.9511 9.0136 9.0136 10.3519 10.3519 11.8075 11.8075 12.0260 12.0260 12.1958 12.1958 13.7420 13.7420 15.2661 15.2661 16.4616 16.4616 k = 0.0000 0.0238-0.0000 ( 3033 PWs) bands (ev): -2.1597 -2.1597 -0.2464 -0.2464 4.1956 4.1956 6.3591 6.3591 6.5521 6.5521 6.5815 6.5815 6.9350 6.9350 7.1175 7.1175 7.2473 7.2473 7.6268 7.6268 7.7315 7.7315 7.8137 7.8137 8.0024 8.0024 8.1315 8.1315 8.2240 8.2240 8.3327 8.3327 8.3784 8.3784 8.6062 8.6062 8.6231 8.6231 8.7337 8.7337 8.7988 8.7988 8.8145 8.8145 8.8294 8.8294 8.9359 8.9359 9.0307 9.0307 10.3791 10.3791 11.6973 11.6973 12.0587 12.0587 12.2776 12.2776 13.7383 13.7383 15.2762 15.2762 16.4543 16.4543 k = 0.0000 0.0357-0.0000 ( 3041 PWs) bands (ev): -2.1537 -2.1537 -0.2439 -0.2439 4.2019 4.2019 6.3597 6.3597 6.5481 6.5481 6.5790 6.5790 6.9365 6.9365 7.1035 7.1035 7.2480 7.2480 7.6238 7.6238 7.7291 7.7291 7.8042 7.8042 8.0012 8.0012 8.1102 8.1102 8.2124 8.2124 8.3508 8.3508 8.3780 8.3780 8.6026 8.6026 8.6186 8.6186 8.7306 8.7306 8.7886 8.7886 8.8139 8.8139 8.8274 8.8274 8.9197 8.9197 9.0547 9.0547 10.4214 10.4214 11.5798 11.5798 12.0761 12.0761 12.3850 12.3850 13.7321 13.7321 15.2927 15.2927 16.4387 16.4387 k = 0.0000 0.0476-0.0000 ( 3043 PWs) bands (ev): -2.1455 -2.1455 -0.2405 -0.2405 4.2108 4.2108 6.3605 6.3605 6.5416 6.5416 6.5765 6.5765 6.9387 6.9387 7.0837 7.0837 7.2489 7.2489 7.6193 7.6193 7.7259 7.7259 7.7912 7.7912 7.9991 7.9991 8.0850 8.0850 8.2008 8.2008 8.3654 8.3654 8.3795 8.3795 8.5976 8.5976 8.6123 8.6123 8.7223 8.7223 8.7787 8.7787 8.8126 8.8126 8.8244 8.8244 8.9065 8.9065 9.0851 9.0851 10.4749 10.4749 11.4607 11.4607 12.0901 12.0901 12.5005 12.5005 13.7235 13.7235 15.3152 15.3152 16.4165 16.4165 k = 0.0000 0.0595-0.0000 ( 3047 PWs) bands (ev): -2.1348 -2.1348 -0.2362 -0.2362 4.2222 4.2222 6.3609 6.3609 6.5322 6.5322 6.5744 6.5744 6.9414 6.9414 7.0581 7.0581 7.2497 7.2497 7.6126 7.6126 7.7214 7.7214 7.7756 7.7756 7.9952 7.9952 8.0594 8.0594 8.1876 8.1876 8.3695 8.3695 8.3890 8.3890 8.5912 8.5912 8.6040 8.6040 8.7069 8.7069 8.7728 8.7728 8.8094 8.8094 8.8228 8.8228 8.8973 8.8973 9.1219 9.1219 10.5357 10.5357 11.3422 11.3422 12.1045 12.1045 12.6179 12.6179 13.7126 13.7126 15.3430 15.3430 16.3921 16.3921 k = 0.0000 0.0714-0.0000 ( 3047 PWs) bands (ev): -2.1219 -2.1219 -0.2310 -0.2310 4.2361 4.2361 6.3606 6.3606 6.5196 6.5196 6.5727 6.5727 6.9446 6.9446 7.0265 7.0265 7.2505 7.2505 7.6036 7.6036 7.7145 7.7145 7.7590 7.7590 7.9871 7.9871 8.0375 8.0375 8.1720 8.1720 8.3682 8.3682 8.4007 8.4007 8.5836 8.5836 8.5940 8.5940 8.6880 8.6880 8.7711 8.7711 8.8048 8.8048 8.8230 8.8230 8.8914 8.8914 9.1648 9.1648 10.6000 10.6000 11.2255 11.2255 12.1206 12.1206 12.7350 12.7350 13.6996 13.6996 15.3751 15.3751 16.3698 16.3698 k = 0.0000 0.0833-0.0000 ( 3043 PWs) bands (ev): -2.1066 -2.1066 -0.2249 -0.2249 4.2525 4.2525 6.3590 6.3590 6.5041 6.5041 6.5713 6.5713 6.9476 6.9476 6.9899 6.9899 7.2510 7.2510 7.5916 7.5916 7.7022 7.7022 7.7450 7.7450 7.9719 7.9719 8.0235 8.0235 8.1536 8.1536 8.3658 8.3658 8.4105 8.4105 8.5752 8.5752 8.5826 8.5826 8.6702 8.6702 8.7715 8.7715 8.7999 8.7999 8.8243 8.8243 8.8877 8.8877 9.2134 9.2134 10.6644 10.6644 11.1116 11.1116 12.1386 12.1386 12.8507 12.8507 13.6849 13.6849 15.4099 15.4099 16.3539 16.3539 k = 0.0000 0.0952-0.0000 ( 3033 PWs) bands (ev): -2.0890 -2.0890 -0.2181 -0.2181 4.2713 4.2713 6.3550 6.3550 6.4856 6.4856 6.5702 6.5702 6.9390 6.9390 6.9605 6.9605 7.2513 7.2513 7.5763 7.5763 7.6819 7.6819 7.7368 7.7368 7.9515 7.9515 8.0165 8.0165 8.1330 8.1330 8.3628 8.3628 8.4180 8.4180 8.5667 8.5667 8.5705 8.5705 8.6557 8.6557 8.7725 8.7725 8.7954 8.7954 8.8257 8.8257 8.8858 8.8858 9.2671 9.2671 10.7253 10.7253 11.0018 11.0018 12.1588 12.1588 12.9643 12.9643 13.6688 13.6688 15.4457 15.4457 16.3486 16.3486 k = 0.0000 0.1071-0.0000 ( 3029 PWs) bands (ev): -2.0691 -2.0691 -0.2106 -0.2106 4.2927 4.2927 6.3473 6.3473 6.4642 6.4642 6.5691 6.5691 6.8963 6.8963 6.9616 6.9616 7.2511 7.2511 7.5576 7.5576 7.6556 7.6556 7.7328 7.7328 7.9298 7.9298 8.0130 8.0130 8.1113 8.1113 8.3594 8.3594 8.4233 8.4233 8.5569 8.5569 8.5600 8.5600 8.6446 8.6446 8.7732 8.7732 8.7913 8.7913 8.8268 8.8268 8.8856 8.8856 9.3254 9.3254 10.7759 10.7759 10.9012 10.9012 12.1811 12.1811 13.0754 13.0754 13.6520 13.6520 15.4801 15.4801 16.3579 16.3579 k = 0.0000 0.1190-0.0000 ( 3035 PWs) bands (ev): -2.0469 -2.0469 -0.2025 -0.2025 4.3165 4.3165 6.3339 6.3339 6.4399 6.4399 6.5681 6.5681 6.8483 6.8483 6.9669 6.9669 7.2504 7.2504 7.5356 7.5356 7.6260 7.6260 7.7309 7.7309 7.9090 7.9090 8.0109 8.0109 8.0896 8.0896 8.3557 8.3557 8.4265 8.4265 8.5448 8.5448 8.5527 8.5527 8.6361 8.6361 8.7732 8.7732 8.7880 8.7880 8.8272 8.8272 8.8871 8.8871 9.3878 9.3878 10.7634 10.7634 10.8610 10.8610 12.2053 12.2053 13.1836 13.1836 13.6351 13.6351 15.5112 15.5112 16.3849 16.3849 k = 0.0000 0.1310-0.0000 ( 3037 PWs) bands (ev): -2.0225 -2.0225 -0.1938 -0.1938 4.3427 4.3427 6.3123 6.3123 6.4122 6.4122 6.5669 6.5669 6.8015 6.8015 6.9733 6.9733 7.2493 7.2493 7.5107 7.5107 7.5947 7.5947 7.7302 7.7302 7.8900 7.8900 8.0096 8.0096 8.0690 8.0690 8.3519 8.3519 8.4276 8.4276 8.5327 8.5327 8.5467 8.5467 8.6298 8.6298 8.7719 8.7719 8.7857 8.7857 8.8269 8.8269 8.8904 8.8904 9.4539 9.4539 10.6749 10.6749 10.8929 10.8929 12.2314 12.2314 13.2885 13.2885 13.6190 13.6190 15.5376 15.5376 16.4320 16.4320 k = 0.0000 0.1429-0.0000 ( 3043 PWs) bands (ev): -1.9959 -1.9959 -0.1848 -0.1848 4.3713 4.3713 6.2796 6.2796 6.3809 6.3809 6.5658 6.5658 6.7602 6.7602 6.9802 6.9802 7.2474 7.2474 7.4834 7.4834 7.5626 7.5626 7.7302 7.7302 7.8729 7.8729 8.0086 8.0086 8.0504 8.0504 8.3479 8.3479 8.4265 8.4265 8.5210 8.5210 8.5413 8.5413 8.6251 8.6251 8.7694 8.7694 8.7844 8.7844 8.8260 8.8260 8.8954 8.8954 9.5233 9.5233 10.5814 10.5814 10.9252 10.9252 12.2591 12.2591 13.3893 13.3893 13.6053 13.6053 15.5589 15.5589 16.4996 16.4996 k = 0.0000 0.1548-0.0000 ( 3047 PWs) bands (ev): -1.9672 -1.9672 -0.1754 -0.1754 4.4023 4.4023 6.2336 6.2336 6.3457 6.3457 6.5648 6.5648 6.7276 6.7276 6.9879 6.9879 7.2450 7.2450 7.4544 7.4544 7.5303 7.5303 7.7303 7.7303 7.8575 7.8575 8.0075 8.0075 8.0343 8.0343 8.3438 8.3438 8.4231 8.4231 8.5104 8.5104 8.5361 8.5361 8.6217 8.6217 8.7660 8.7660 8.7834 8.7834 8.8250 8.8250 8.9020 8.9020 9.5958 9.5958 10.4908 10.4908 10.9492 10.9492 12.2884 12.2884 13.4828 13.4828 13.5979 13.5979 15.5760 15.5760 16.5867 16.5867 k = 0.0000 0.1667-0.0000 ( 3047 PWs) bands (ev): -1.9362 -1.9362 -0.1658 -0.1658 4.4356 4.4356 6.1736 6.1736 6.3069 6.3069 6.5641 6.5641 6.7051 6.7051 6.9961 6.9961 7.2418 7.2418 7.4240 7.4240 7.4980 7.4980 7.7303 7.7303 7.8435 7.8435 8.0050 8.0050 8.0226 8.0226 8.3398 8.3398 8.4170 8.4170 8.5008 8.5008 8.5309 8.5309 8.6193 8.6193 8.7623 8.7623 8.7822 8.7822 8.8244 8.8244 8.9098 8.9098 9.6709 9.6709 10.4045 10.4045 10.9633 10.9633 12.3189 12.3189 13.5460 13.5460 13.6205 13.6205 15.5903 15.5903 16.6907 16.6907 k = 0.0000 0.1786-0.0000 ( 3045 PWs) bands (ev): -1.9032 -1.9032 -0.1562 -0.1562 4.4712 4.4712 6.1009 6.1009 6.2650 6.2650 6.5640 6.5640 6.6920 6.6920 7.0049 7.0049 7.2380 7.2380 7.3927 7.3927 7.4661 7.4661 7.7300 7.7300 7.8308 7.8308 7.9986 7.9986 8.0176 8.0176 8.3356 8.3356 8.4085 8.4085 8.4924 8.4924 8.5255 8.5255 8.6175 8.6175 8.7585 8.7585 8.7805 8.7805 8.8249 8.8249 8.9186 8.9186 9.7484 9.7484 10.3228 10.3228 10.9670 10.9670 12.3505 12.3505 13.5560 13.5560 13.6966 13.6966 15.6033 15.6033 16.8061 16.8061 k = 0.0000 0.1905-0.0000 ( 3045 PWs) bands (ev): -1.8681 -1.8681 -0.1467 -0.1467 4.5090 4.5090 6.0183 6.0183 6.2200 6.2200 6.5645 6.5645 6.6863 6.6863 7.0141 7.0141 7.2334 7.2334 7.3610 7.3610 7.4345 7.4345 7.7292 7.7292 7.8189 7.8189 7.9900 7.9900 8.0175 8.0175 8.3315 8.3315 8.3977 8.3977 8.4847 8.4847 8.5201 8.5201 8.6157 8.6157 8.7546 8.7546 8.7781 8.7781 8.8269 8.8269 8.9284 8.9284 9.8282 9.8282 10.2459 10.2459 10.9604 10.9604 12.3828 12.3828 13.5560 13.5560 13.7838 13.7838 15.6165 15.6165 16.9121 16.9121 k = 0.0000 0.2024-0.0000 ( 3047 PWs) bands (ev): -1.8310 -1.8310 -0.1374 -0.1374 4.5491 4.5491 5.9288 5.9288 6.1721 6.1721 6.5654 6.5654 6.6860 6.6860 7.0238 7.0238 7.2278 7.2278 7.3292 7.3292 7.4032 7.4032 7.7278 7.7278 7.8078 7.8078 7.9820 7.9820 8.0195 8.0195 8.3275 8.3275 8.3853 8.3853 8.4774 8.4774 8.5147 8.5147 8.6134 8.6134 8.7507 8.7507 8.7750 8.7750 8.8305 8.8305 8.9389 8.9389 9.9101 9.9101 10.1736 10.1736 10.9439 10.9439 12.4156 12.4156 13.5576 13.5576 13.8707 13.8707 15.6307 15.6307 16.9851 16.9851 k = 0.0000 0.2143-0.0000 ( 3043 PWs) bands (ev): -1.7920 -1.7920 -0.1287 -0.1287 4.5914 4.5914 5.8350 5.8350 6.1211 6.1211 6.5668 6.5668 6.6896 6.6896 7.0340 7.0340 7.2212 7.2212 7.2979 7.2979 7.3725 7.3725 7.7256 7.7256 7.7972 7.7972 7.9753 7.9753 8.0227 8.0227 8.3233 8.3233 8.3718 8.3718 8.4700 8.4700 8.5097 8.5097 8.6104 8.6104 8.7469 8.7469 8.7717 8.7717 8.8359 8.8359 8.9501 8.9501 9.9939 9.9939 10.1061 10.1061 10.9181 10.9181 12.4485 12.4485 13.5628 13.5628 13.9556 13.9556 15.6469 15.6469 17.0485 17.0485 k = 0.0000 0.2262-0.0000 ( 3031 PWs) bands (ev): -1.7510 -1.7510 -0.1205 -0.1205 4.6357 4.6357 5.7391 5.7391 6.0673 6.0673 6.5685 6.5685 6.6957 6.6957 7.0447 7.0447 7.2129 7.2129 7.2679 7.2679 7.3425 7.3425 7.7227 7.7227 7.7869 7.7869 7.9700 7.9700 8.0271 8.0271 8.3190 8.3190 8.3580 8.3580 8.4622 8.4622 8.5049 8.5049 8.6064 8.6064 8.7429 8.7429 8.7681 8.7681 8.8430 8.8430 8.9620 8.9620 10.0430 10.0430 10.0796 10.0796 10.8838 10.8838 12.4814 12.4814 13.5719 13.5719 14.0384 14.0384 15.6653 15.6653 17.1111 17.1111 k = 0.0000 0.2381-0.0000 ( 3027 PWs) bands (ev): -1.7083 -1.7083 -0.1131 -0.1131 4.6821 4.6821 5.6427 5.6427 6.0106 6.0106 6.5705 6.5705 6.7036 6.7036 7.0556 7.0556 7.2011 7.2011 7.2408 7.2408 7.3135 7.3135 7.7189 7.7189 7.7770 7.7770 7.9658 7.9658 8.0323 8.0323 8.3140 8.3140 8.3445 8.3445 8.4541 8.4541 8.5003 8.5003 8.6012 8.6012 8.7387 8.7387 8.7647 8.7647 8.8517 8.8517 8.9744 8.9744 9.9845 9.9845 10.1667 10.1667 10.8420 10.8420 12.5137 12.5137 13.5850 13.5850 14.1188 14.1188 15.6863 15.6863 17.1273 17.1273 k = 0.0000 0.2500-0.0000 ( 3033 PWs) bands (ev): -1.6637 -1.6637 -0.1069 -0.1069 4.7305 4.7305 5.5471 5.5471 5.9512 5.9512 6.5726 6.5726 6.7121 6.7121 7.0667 7.0667 7.1830 7.1830 7.2195 7.2195 7.2862 7.2862 7.7140 7.7140 7.7673 7.7673 7.9626 7.9626 8.0384 8.0384 8.3072 8.3072 8.3326 8.3326 8.4454 8.4454 8.4957 8.4957 8.5948 8.5948 8.7344 8.7344 8.7613 8.7613 8.8619 8.8619 8.9875 8.9875 9.9301 9.9301 10.2553 10.2553 10.7937 10.7937 12.5450 12.5450 13.6021 13.6021 14.1969 14.1969 15.7101 15.7101 17.0530 17.0530 k = 0.0000 0.2619-0.0000 ( 3037 PWs) bands (ev): -1.6175 -1.6175 -0.1018 -0.1018 4.7808 4.7808 5.4534 5.4534 5.8895 5.8895 6.5750 6.5750 6.7205 6.7205 7.0776 7.0776 7.1589 7.1589 7.2033 7.2033 7.2616 7.2616 7.7081 7.7081 7.7582 7.7582 7.9601 7.9601 8.0451 8.0451 8.2976 8.2976 8.3238 8.3238 8.4366 8.4366 8.4912 8.4912 8.5873 8.5873 8.7300 8.7300 8.7582 8.7582 8.8735 8.8735 9.0012 9.0012 9.8797 9.8797 10.3452 10.3452 10.7400 10.7400 12.5750 12.5750 13.6229 13.6229 14.2726 14.2726 15.7364 15.7364 16.9710 16.9710 k = 0.0000 0.2738-0.0000 ( 3036 PWs) bands (ev): -1.5696 -1.5696 -0.0983 -0.0983 4.8328 4.8328 5.3625 5.3625 5.8255 5.8255 6.5777 6.5777 6.7282 6.7282 7.0869 7.0869 7.1340 7.1340 7.1875 7.1875 7.2415 7.2415 7.7008 7.7008 7.7501 7.7501 7.9581 7.9581 8.0526 8.0526 8.2852 8.2852 8.3181 8.3181 8.4276 8.4276 8.4866 8.4866 8.5789 8.5789 8.7256 8.7256 8.7553 8.7553 8.8862 8.8862 9.0154 9.0154 9.8330 9.8330 10.4363 10.4363 10.6820 10.6820 12.6031 12.6031 13.6472 13.6472 14.3458 14.3458 15.7654 15.7654 16.8852 16.8852 k = 0.0000 0.2857-0.0000 ( 3036 PWs) bands (ev): -1.5203 -1.5203 -0.0964 -0.0964 4.8864 4.8864 5.2753 5.2753 5.7598 5.7598 6.5807 6.5807 6.7340 6.7340 7.0861 7.0861 7.1186 7.1186 7.1696 7.1696 7.2268 7.2268 7.6921 7.6921 7.7431 7.7431 7.9565 7.9565 8.0605 8.0605 8.2716 8.2716 8.3142 8.3142 8.4187 8.4187 8.4817 8.4817 8.5696 8.5696 8.7213 8.7213 8.7525 8.7525 8.9000 8.9000 9.0302 9.0302 9.7898 9.7898 10.5279 10.5279 10.6213 10.6213 12.6289 12.6289 13.6748 13.6748 14.4163 14.4163 15.7968 15.7968 16.7975 16.7975 k = 0.0000 0.2976-0.0000 ( 3036 PWs) bands (ev): -1.4695 -1.4695 -0.0965 -0.0965 4.9412 4.9412 5.1928 5.1928 5.6927 5.6927 6.5840 6.5840 6.7371 6.7371 7.0660 7.0660 7.1219 7.1219 7.1512 7.1512 7.2168 7.2168 7.6818 7.6818 7.7372 7.7372 7.9549 7.9549 8.0688 8.0688 8.2577 8.2577 8.3112 8.3112 8.4101 8.4101 8.4766 8.4766 8.5596 8.5596 8.7172 8.7172 8.7498 8.7498 8.9146 8.9146 9.0456 9.0456 9.7499 9.7499 10.5540 10.5540 10.6246 10.6246 12.6517 12.6517 13.7055 13.7055 14.4839 14.4839 15.8303 15.8303 16.7094 16.7094 k = 0.0000 0.3095-0.0000 ( 3040 PWs) bands (ev): -1.4174 -1.4174 -0.0988 -0.0988 4.9954 4.9954 5.1171 5.1171 5.6246 5.6246 6.5875 6.5875 6.7363 6.7363 7.0402 7.0402 7.1238 7.1238 7.1408 7.1408 7.2101 7.2101 7.6702 7.6702 7.7326 7.7326 7.9532 7.9532 8.0773 8.0773 8.2440 8.2440 8.3086 8.3086 8.4019 8.4019 8.4710 8.4710 8.5491 8.5491 8.7133 8.7133 8.7472 8.7472 8.9300 8.9300 9.0616 9.0616 9.7130 9.7130 10.4897 10.4897 10.7176 10.7176 12.6711 12.6711 13.7390 13.7390 14.5483 14.5483 15.8658 15.8658 16.6221 16.6221 k = 0.0000 0.3214-0.0000 ( 3040 PWs) bands (ev): -1.3641 -1.3641 -0.1034 -0.1034 5.0204 5.0204 5.0772 5.0772 5.5560 5.5560 6.5913 6.5913 6.7304 6.7304 7.0139 7.0139 7.1116 7.1116 7.1479 7.1479 7.2061 7.2061 7.6573 7.6573 7.7290 7.7290 7.9511 7.9511 8.0856 8.0856 8.2310 8.2310 8.3064 8.3064 8.3943 8.3943 8.4652 8.4652 8.5384 8.5384 8.7098 8.7098 8.7446 8.7446 8.9460 8.9460 9.0781 9.0781 9.6791 9.6791 10.4233 10.4233 10.8125 10.8125 12.6865 12.6865 13.7752 13.7752 14.6088 14.6088 15.9028 15.9028 16.5372 16.5372 k = 0.0000 0.3333-0.0000 ( 3036 PWs) bands (ev): -1.3097 -1.3097 -0.1106 -0.1106 4.9652 4.9652 5.1241 5.1241 5.4875 5.4875 6.5955 6.5955 6.7185 6.7185 6.9880 6.9880 7.0999 7.0999 7.1573 7.1573 7.2051 7.2051 7.6436 7.6436 7.7265 7.7265 7.9484 7.9484 8.0936 8.0936 8.2190 8.2190 8.3043 8.3043 8.3874 8.3874 8.4589 8.4589 8.5274 8.5274 8.7068 8.7068 8.7420 8.7420 8.9625 8.9625 9.0951 9.0951 9.6478 9.6478 10.3567 10.3567 10.9081 10.9081 12.6972 12.6972 13.8140 13.8140 14.6648 14.6648 15.9409 15.9409 16.4560 16.4560 k = 0.0000 0.3452-0.0000 ( 3038 PWs) bands (ev): -1.2544 -1.2544 -0.1206 -0.1206 4.9051 4.9051 5.1822 5.1822 5.4202 5.4202 6.6000 6.6000 6.7002 6.7002 6.9629 6.9629 7.0920 7.0920 7.1645 7.1645 7.2081 7.2081 7.6290 7.6290 7.7250 7.7250 7.9448 7.9448 8.1011 8.1011 8.2082 8.2082 8.3022 8.3022 8.3815 8.3815 8.4521 8.4521 8.5164 8.5164 8.7041 8.7041 8.7394 8.7394 8.9793 8.9793 9.1124 9.1124 9.6192 9.6192 10.2904 10.2904 11.0042 11.0042 12.7028 12.7028 13.8551 13.8551 14.7154 14.7154 15.9796 15.9796 16.3801 16.3801 k = 0.0000 0.3571-0.0000 ( 3038 PWs) bands (ev): -1.1983 -1.1983 -0.1335 -0.1335 4.8502 4.8502 5.2382 5.2382 5.3579 5.3579 6.6046 6.6046 6.6756 6.6756 6.9385 6.9385 7.0882 7.0882 7.1683 7.1683 7.2157 7.2157 7.6138 7.6138 7.7244 7.7244 7.9403 7.9403 8.1076 8.1076 8.1990 8.1990 8.3002 8.3002 8.3766 8.3766 8.4451 8.4451 8.5057 8.5057 8.7020 8.7020 8.7368 8.7368 8.9965 8.9965 9.1299 9.1299 9.5932 9.5932 10.2249 10.2249 11.1007 11.1007 12.7026 12.7026 13.8985 13.8985 14.7595 14.7595 16.0180 16.0180 16.3113 16.3113 k = 0.0000 0.3690-0.0000 ( 3040 PWs) bands (ev): -1.1416 -1.1416 -0.1494 -0.1494 4.8014 4.8014 5.2559 5.2559 5.3365 5.3365 6.6082 6.6082 6.6462 6.6462 6.9150 6.9150 7.0880 7.0880 7.1694 7.1694 7.2270 7.2270 7.5980 7.5980 7.7248 7.7248 7.9345 7.9345 8.1130 8.1130 8.1913 8.1913 8.2982 8.2982 8.3727 8.3727 8.4377 8.4377 8.4951 8.4951 8.7003 8.7003 8.7341 8.7341 9.0139 9.0139 9.1476 9.1476 9.5698 9.5698 10.1608 10.1608 11.1972 11.1972 12.6963 12.6963 13.9440 13.9440 14.7958 14.7958 16.0552 16.0552 16.2518 16.2518 k = 0.0000 0.3810-0.0000 ( 3042 PWs) bands (ev): -1.0844 -1.0844 -0.1685 -0.1685 4.7593 4.7593 5.2044 5.2044 5.3868 5.3868 6.5980 6.5980 6.6256 6.6256 6.8924 6.8924 7.0909 7.0909 7.1692 7.1692 7.2405 7.2405 7.5817 7.5817 7.7263 7.7263 7.9275 7.9275 8.1173 8.1173 8.1854 8.1854 8.2966 8.2966 8.3701 8.3701 8.4300 8.4300 8.4849 8.4849 8.6990 8.6990 8.7314 8.7314 9.0315 9.0315 9.1648 9.1648 9.5492 9.5492 10.0982 10.0982 11.2937 11.2937 12.6835 12.6835 13.9916 13.9916 14.8227 14.8227 16.0885 16.0885 16.2047 16.2047 k = 0.0000 0.3929-0.0000 ( 3040 PWs) bands (ev): -1.0268 -1.0268 -0.1909 -0.1909 4.7240 4.7240 5.1430 5.1430 5.4496 5.4496 6.5608 6.5608 6.6277 6.6277 6.8708 6.8708 7.0958 7.0958 7.1683 7.1683 7.2553 7.2553 7.5651 7.5651 7.7289 7.7289 7.9190 7.9190 8.1203 8.1203 8.1811 8.1811 8.2956 8.2956 8.3684 8.3684 8.4223 8.4223 8.4750 8.4750 8.6982 8.6982 8.7287 8.7287 9.0492 9.0492 9.1814 9.1814 9.5319 9.5319 10.0377 10.0377 11.3899 11.3899 12.6639 12.6639 14.0412 14.0412 14.8391 14.8391 16.1100 16.1100 16.1788 16.1788 k = 0.0000 0.4048-0.0000 ( 3040 PWs) bands (ev): -0.9692 -0.9692 -0.2166 -0.2166 4.6957 4.6957 5.0820 5.0820 5.5151 5.5151 6.5157 6.5157 6.6341 6.6341 6.8500 6.8500 7.1020 7.1020 7.1672 7.1672 7.2709 7.2709 7.5482 7.5482 7.7327 7.7327 7.9093 7.9093 8.1225 8.1225 8.1778 8.1778 8.2955 8.2955 8.3674 8.3674 8.4147 8.4147 8.4656 8.4656 8.6978 8.6978 8.7260 8.7260 9.0669 9.0669 9.1966 9.1966 9.5183 9.5183 9.9793 9.9793 11.4855 11.4855 12.6373 12.6373 14.0926 14.0926 14.8440 14.8440 16.1081 16.1081 16.1853 16.1853 k = 0.0000 0.4167-0.0000 ( 3036 PWs) bands (ev): -0.9117 -0.9117 -0.2454 -0.2454 4.6744 4.6744 5.0231 5.0231 5.5817 5.5817 6.4664 6.4664 6.6417 6.6417 6.8302 6.8302 7.1090 7.1090 7.1660 7.1660 7.2869 7.2869 7.5310 7.5310 7.7377 7.7377 7.8984 7.8984 8.1244 8.1244 8.1748 8.1748 8.2965 8.2965 8.3669 8.3669 8.4075 8.4075 8.4568 8.4568 8.6978 8.6978 8.7234 8.7234 9.0845 9.0845 9.2096 9.2096 9.5090 9.5090 9.9233 9.9233 11.5803 11.5803 12.6037 12.6037 14.1458 14.1458 14.8370 14.8370 16.0999 16.0999 16.2065 16.2065 k = 0.0000 0.4286-0.0000 ( 3040 PWs) bands (ev): -0.8544 -0.8544 -0.2776 -0.2776 4.6601 4.6601 4.9669 4.9669 5.6490 5.6490 6.4139 6.4139 6.6501 6.6501 6.8112 6.8112 7.1162 7.1162 7.1647 7.1647 7.3034 7.3034 7.5134 7.5134 7.7439 7.7439 7.8864 7.8864 8.1261 8.1261 8.1719 8.1719 8.2987 8.2987 8.3660 8.3660 8.4014 8.4014 8.4483 8.4483 8.6982 8.6982 8.7207 8.7207 9.1020 9.1020 9.2196 9.2196 9.5051 9.5051 9.8698 9.8698 11.6739 11.6739 12.5631 12.5631 14.2005 14.2005 14.8185 14.8185 16.0989 16.0989 16.2269 16.2269 k = 0.0000 0.4405-0.0000 ( 3032 PWs) bands (ev): -0.7977 -0.7977 -0.3128 -0.3128 4.6527 4.6527 4.9141 4.9141 5.7166 5.7166 6.3585 6.3585 6.6592 6.6592 6.7932 6.7932 7.1232 7.1232 7.1632 7.1632 7.3202 7.3202 7.4958 7.4958 7.7515 7.7515 7.8736 7.8736 8.1284 8.1284 8.1685 8.1685 8.3024 8.3024 8.3641 8.3641 8.3972 8.3972 8.4403 8.4403 8.6989 8.6989 8.7181 8.7181 9.1194 9.1194 9.2257 9.2257 9.5073 9.5073 9.8190 9.8190 11.7662 11.7662 12.5159 12.5159 14.2566 14.2566 14.7896 14.7896 16.1069 16.1069 16.2423 16.2423 k = 0.0000 0.4524-0.0000 ( 3040 PWs) bands (ev): -0.7418 -0.7418 -0.3510 -0.3510 4.6521 4.6521 4.8649 4.8649 5.7842 5.7842 6.3006 6.3006 6.6691 6.6691 6.7760 6.7760 7.1299 7.1299 7.1615 7.1615 7.3372 7.3372 7.4781 7.4781 7.7600 7.7600 7.8601 7.8601 8.1309 8.1309 8.1645 8.1645 8.3070 8.3070 8.3603 8.3603 8.3954 8.3954 8.4327 8.4327 8.6998 8.6998 8.7155 8.7155 9.1363 9.1363 9.2273 9.2273 9.5160 9.5160 9.7709 9.7709 11.8566 11.8566 12.4622 12.4622 14.3138 14.3138 14.7519 14.7519 16.1224 16.1224 16.2510 16.2510 k = 0.0000 0.4643-0.0000 ( 3038 PWs) bands (ev): -0.6868 -0.6868 -0.3921 -0.3921 4.6582 4.6582 4.8200 4.8200 5.8517 5.8517 6.2407 6.2407 6.6797 6.6797 6.7598 6.7598 7.1361 7.1361 7.1595 7.1595 7.3545 7.3545 7.4604 7.4604 7.7700 7.7700 7.8463 7.8463 8.1340 8.1340 8.1601 8.1601 8.3126 8.3126 8.3548 8.3548 8.3962 8.3962 8.4256 8.4256 8.7011 8.7011 8.7130 8.7130 9.1528 9.1528 9.2247 9.2247 9.5312 9.5312 9.7258 9.7258 11.9449 11.9449 12.4025 12.4025 14.3719 14.3719 14.7071 14.7071 16.1434 16.1434 16.2523 16.2523 k = 0.0000 0.4762-0.0000 ( 3038 PWs) bands (ev): -0.6332 -0.6332 -0.4359 -0.4359 4.6707 4.6707 4.7796 4.7796 5.9188 5.9188 6.1789 6.1789 6.6910 6.6910 6.7444 6.7444 7.1416 7.1416 7.1570 7.1570 7.3719 7.3719 7.4426 7.4426 7.7809 7.7809 7.8325 7.8325 8.1376 8.1376 8.1555 8.1555 8.3191 8.3191 8.3481 8.3481 8.3988 8.3988 8.4190 8.4190 8.7026 8.7026 8.7107 8.7107 9.1685 9.1685 9.2183 9.2183 9.5524 9.5524 9.6838 9.6838 12.0305 12.0305 12.3373 12.3373 14.4305 14.4305 14.6571 14.6571 16.1673 16.1673 16.2461 16.2461 k = 0.0000 0.4881-0.0000 ( 3024 PWs) bands (ev): -0.5810 -0.5810 -0.4821 -0.4821 4.6894 4.6894 4.7442 4.7442 5.9853 5.9853 6.1156 6.1156 6.7032 6.7032 6.7299 6.7299 7.1464 7.1464 7.1541 7.1541 7.3895 7.3895 7.4249 7.4249 7.7929 7.7929 7.8188 7.8188 8.1417 8.1417 8.1508 8.1508 8.3262 8.3262 8.3409 8.3409 8.4028 8.4028 8.4130 8.4130 8.7045 8.7045 8.7085 8.7085 9.1834 9.1834 9.2088 9.2088 9.5789 9.5789 9.6451 9.6451 12.1130 12.1130 12.2670 12.2670 14.4890 14.4890 14.6033 14.6033 16.1918 16.1918 16.2330 16.2330 k = 0.0000 0.5000-0.0000 ( 3024 PWs) bands (ev): -0.5305 -0.5305 -0.5305 -0.5305 4.7140 4.7140 4.7140 4.7140 6.0510 6.0510 6.0510 6.0510 6.7162 6.7162 6.7162 6.7162 7.1506 7.1506 7.1506 7.1506 7.4071 7.4071 7.4071 7.4071 7.8055 7.8055 7.8055 7.8055 8.1461 8.1461 8.1461 8.1461 8.3335 8.3335 8.3335 8.3335 8.4076 8.4076 8.4076 8.4076 8.7064 8.7064 8.7064 8.7064 9.1970 9.1970 9.1970 9.1970 9.6100 9.6100 9.6100 9.6100 12.1920 12.1920 12.1920 12.1920 14.5469 14.5469 14.5469 14.5469 16.2144 16.2144 16.2144 16.2144 k = 0.0000 0.5000-0.0000 ( 3024 PWs) bands (ev): -0.5305 -0.5305 -0.5305 -0.5305 4.7140 4.7140 4.7140 4.7140 6.0510 6.0510 6.0510 6.0510 6.7162 6.7162 6.7162 6.7162 7.1506 7.1506 7.1506 7.1506 7.4071 7.4071 7.4071 7.4071 7.8055 7.8055 7.8055 7.8055 8.1461 8.1461 8.1461 8.1461 8.3335 8.3335 8.3335 8.3335 8.4076 8.4076 8.4076 8.4076 8.7064 8.7064 8.7064 8.7064 9.1970 9.1970 9.1970 9.1970 9.6100 9.6100 9.6100 9.6100 12.1920 12.1920 12.1920 12.1920 14.5469 14.5469 14.5469 14.5469 16.2144 16.2144 16.2144 16.2144 k = 0.0119 0.5000-0.0000 ( 3024 PWs) bands (ev): -0.5298 -0.5298 -0.5298 -0.5298 4.7144 4.7144 4.7147 4.7147 6.0511 6.0511 6.0520 6.0520 6.7160 6.7160 6.7167 6.7167 7.1480 7.1480 7.1527 7.1527 7.4076 7.4076 7.4076 7.4076 7.8044 7.8044 7.8066 7.8066 8.1421 8.1421 8.1490 8.1490 8.3298 8.3298 8.3365 8.3365 8.4064 8.4064 8.4100 8.4100 8.7054 8.7054 8.7076 8.7076 9.1956 9.1956 9.1979 9.1979 9.6094 9.6094 9.6103 9.6103 12.1756 12.1756 12.1774 12.1774 14.5650 14.5650 14.5676 14.5676 16.1803 16.1803 16.1978 16.1978 k = 0.0238 0.5000-0.0000 ( 3032 PWs) bands (ev): -0.5277 -0.5277 -0.5276 -0.5276 4.7160 4.7160 4.7165 4.7165 6.0521 6.0521 6.0541 6.0541 6.7161 6.7161 6.7176 6.7176 7.1449 7.1449 7.1543 7.1543 7.4088 7.4088 7.4089 7.4089 7.8032 7.8032 7.8077 7.8077 8.1369 8.1369 8.1505 8.1505 8.3258 8.3258 8.3385 8.3385 8.4069 8.4069 8.4135 8.4135 8.7044 8.7044 8.7088 8.7088 9.1936 9.1936 9.1982 9.1982 9.6085 9.6085 9.6103 9.6103 12.1296 12.1296 12.1330 12.1330 14.6206 14.6206 14.6256 14.6256 16.1019 16.1019 16.1329 16.1329 k = 0.0357 0.5000-0.0000 ( 3036 PWs) bands (ev): -0.5241 -0.5241 -0.5240 -0.5240 4.7187 4.7187 4.7195 4.7195 6.0542 6.0542 6.0571 6.0571 6.7167 6.7167 6.7189 6.7189 7.1414 7.1414 7.1553 7.1553 7.4108 7.4108 7.4111 7.4111 7.8019 7.8019 7.8085 7.8085 8.1307 8.1307 8.1505 8.1505 8.3218 8.3218 8.3392 8.3392 8.4092 8.4092 8.4179 8.4179 8.7036 8.7036 8.7101 8.7101 9.1911 9.1911 9.1980 9.1980 9.6072 9.6072 9.6099 9.6099 12.0581 12.0581 12.0629 12.0629 14.7094 14.7094 14.7167 14.7167 15.9902 15.9902 16.0294 16.0294 k = 0.0476 0.5000-0.0000 ( 3040 PWs) bands (ev): -0.5192 -0.5192 -0.5189 -0.5189 4.7224 4.7224 4.7236 4.7236 6.0573 6.0573 6.0612 6.0612 6.7177 6.7177 6.7206 6.7206 7.1376 7.1376 7.1560 7.1560 7.4136 7.4136 7.4140 7.4140 7.8005 7.8005 7.8093 7.8093 8.1238 8.1238 8.1493 8.1493 8.3178 8.3178 8.3385 8.3385 8.4132 8.4132 8.4231 8.4231 8.7030 8.7030 8.7116 8.7116 9.1880 9.1880 9.1973 9.1973 9.6057 9.6057 9.6093 9.6093 11.9664 11.9664 11.9722 11.9722 14.8262 14.8262 14.8357 14.8357 15.8555 15.8555 15.8987 15.8987 k = 0.0595 0.5000-0.0000 ( 3036 PWs) bands (ev): -0.5128 -0.5128 -0.5125 -0.5125 4.7273 4.7273 4.7287 4.7287 6.0614 6.0614 6.0663 6.0663 6.7192 6.7192 6.7227 6.7227 7.1336 7.1336 7.1563 7.1563 7.4171 7.4171 7.4178 7.4178 7.7992 7.7992 7.8099 7.8099 8.1162 8.1162 8.1469 8.1469 8.3139 8.3139 8.3365 8.3365 8.4187 8.4187 8.4288 8.4288 8.7027 8.7027 8.7132 8.7132 9.1845 9.1845 9.1960 9.1960 9.6038 9.6038 9.6084 9.6084 11.8595 11.8595 11.8661 11.8661 14.9651 14.9651 14.9770 14.9770 15.7060 15.7060 15.7504 15.7504 k = 0.0714 0.5000-0.0000 ( 3032 PWs) bands (ev): -0.5050 -0.5050 -0.5047 -0.5047 4.7331 4.7331 4.7347 4.7347 6.0663 6.0663 6.0723 6.0723 6.7212 6.7212 6.7254 6.7254 7.1293 7.1293 7.1563 7.1563 7.4212 7.4212 7.4222 7.4222 7.7979 7.7979 7.8104 7.8104 8.1082 8.1082 8.1433 8.1433 8.3099 8.3099 8.3335 8.3335 8.4254 8.4254 8.4351 8.4351 8.7027 8.7027 8.7150 8.7150 9.1803 9.1803 9.1942 9.1942 9.6016 9.6016 9.6072 9.6072 11.7420 11.7420 11.7491 11.7491 15.1188 15.1188 15.1346 15.1346 15.5500 15.5500 15.5922 15.5922 k = 0.0833 0.5000-0.0000 ( 3028 PWs) bands (ev): -0.4959 -0.4959 -0.4955 -0.4955 4.7398 4.7398 4.7417 4.7417 6.0721 6.0721 6.0791 6.0791 6.7239 6.7239 6.7287 6.7287 7.1250 7.1250 7.1560 7.1560 7.4258 7.4258 7.4273 7.4273 7.7966 7.7966 7.8108 7.8108 8.0999 8.0999 8.1388 8.1388 8.3058 8.3058 8.3295 8.3295 8.4329 8.4329 8.4416 8.4416 8.7030 8.7030 8.7169 8.7169 9.1756 9.1756 9.1917 9.1917 9.5990 9.5990 9.6057 9.6057 11.6174 11.6174 11.6249 11.6249 15.2542 15.2542 15.2894 15.2894 15.4205 15.4205 15.4442 15.4442 k = 0.0952 0.5000-0.0000 ( 3024 PWs) bands (ev): -0.4854 -0.4854 -0.4850 -0.4850 4.7473 4.7473 4.7495 4.7495 6.0786 6.0786 6.0866 6.0866 6.7272 6.7272 6.7326 6.7326 7.1207 7.1207 7.1556 7.1556 7.4307 7.4307 7.4328 7.4328 7.7954 7.7954 7.8111 7.8111 8.0913 8.0913 8.1335 8.1335 8.3015 8.3015 8.3247 8.3247 8.4409 8.4409 8.4484 8.4484 8.7036 8.7036 8.7190 8.7190 9.1703 9.1703 9.1887 9.1887 9.5961 9.5961 9.6039 9.6039 11.4887 11.4887 11.4964 11.4964 15.1737 15.1737 15.2279 15.2279 15.5146 15.5146 15.5196 15.5196 k = 0.1071 0.5000-0.0000 ( 3016 PWs) bands (ev): -0.4737 -0.4737 -0.4732 -0.4732 4.7555 4.7555 4.7581 4.7581 6.0858 6.0858 6.0949 6.0949 6.7313 6.7313 6.7373 6.7373 7.1165 7.1165 7.1552 7.1552 7.4361 7.4361 7.4388 7.4388 7.7943 7.7943 7.8112 7.8112 8.0826 8.0826 8.1276 8.1276 8.2967 8.2967 8.3193 8.3193 8.4490 8.4490 8.4554 8.4554 8.7047 8.7047 8.7214 8.7214 9.1644 9.1644 9.1850 9.1850 9.5928 9.5928 9.6018 9.6018 11.3579 11.3579 11.3656 11.3656 15.0077 15.0077 15.0589 15.0589 15.7016 15.7016 15.7091 15.7091 k = 0.1190 0.5000-0.0000 ( 3018 PWs) bands (ev): -0.4607 -0.4607 -0.4601 -0.4601 4.7644 4.7644 4.7672 4.7672 6.0935 6.0935 6.1037 6.1037 6.7362 6.7362 6.7427 6.7427 7.1124 7.1124 7.1548 7.1548 7.4416 7.4416 7.4450 7.4450 7.7933 7.7933 7.8112 7.8112 8.0739 8.0739 8.1211 8.1211 8.2915 8.2915 8.3132 8.3132 8.4572 8.4572 8.4623 8.4623 8.7062 8.7062 8.7239 8.7239 9.1579 9.1579 9.1807 9.1807 9.5890 9.5890 9.5994 9.5994 11.2267 11.2267 11.2344 11.2344 14.8335 14.8335 14.8833 14.8833 15.9035 15.9035 15.9107 15.9107 k = 0.1310 0.5000-0.0000 ( 3018 PWs) bands (ev): -0.4465 -0.4465 -0.4459 -0.4459 4.7737 4.7737 4.7768 4.7768 6.1017 6.1017 6.1130 6.1130 6.7421 6.7421 6.7491 6.7491 7.1087 7.1087 7.1545 7.1545 7.4474 7.4474 7.4515 7.4515 7.7925 7.7925 7.8111 7.8111 8.0652 8.0652 8.1143 8.1143 8.2857 8.2857 8.3067 8.3067 8.4653 8.4653 8.4691 8.4691 8.7081 8.7081 8.7266 8.7266 9.1508 9.1508 9.1758 9.1758 9.5849 9.5849 9.5966 9.5966 11.0965 11.0965 11.1040 11.1040 14.6575 14.6575 14.7063 14.7063 16.1130 16.1130 16.1134 16.1134 k = 0.1429 0.5000-0.0000 ( 3020 PWs) bands (ev): -0.4312 -0.4312 -0.4305 -0.4305 4.7834 4.7834 4.7868 4.7868 6.1104 6.1104 6.1228 6.1228 6.7491 6.7491 6.7565 6.7565 7.1053 7.1053 7.1544 7.1544 7.4532 7.4532 7.4581 7.4581 7.7919 7.7919 7.8109 7.8109 8.0566 8.0566 8.1072 8.1072 8.2792 8.2792 8.2996 8.2996 8.4730 8.4730 8.4757 8.4757 8.7106 8.7106 8.7296 8.7296 9.1430 9.1430 9.1702 9.1702 9.5804 9.5804 9.5936 9.5936 10.9682 10.9682 10.9755 10.9755 14.4814 14.4814 14.5295 14.5295 16.2327 16.2327 16.2875 16.2875 k = 0.1548 0.5000-0.0000 ( 3024 PWs) bands (ev): -0.4147 -0.4147 -0.4140 -0.4140 4.7932 4.7932 4.7970 4.7970 6.1193 6.1193 6.1328 6.1328 6.7571 6.7571 6.7650 6.7650 7.1023 7.1023 7.1545 7.1545 7.4591 7.4591 7.4647 7.4647 7.7916 7.7916 7.8107 7.8107 8.0481 8.0481 8.1000 8.1000 8.2721 8.2721 8.2921 8.2921 8.4804 8.4804 8.4820 8.4820 8.7137 8.7137 8.7330 8.7330 9.1345 9.1345 9.1640 9.1640 9.5754 9.5754 9.5901 9.5901 10.8426 10.8426 10.8496 10.8496 14.3062 14.3062 14.3537 14.3537 16.1528 16.1528 16.1892 16.1892 k = 0.1667 0.5000-0.0000 ( 3024 PWs) bands (ev): -0.3972 -0.3972 -0.3965 -0.3965 4.8031 4.8031 4.8071 4.8071 6.1285 6.1285 6.1431 6.1431 6.7664 6.7664 6.7748 6.7748 7.0999 7.0999 7.1550 7.1550 7.4650 7.4650 7.4714 7.4714 7.7915 7.7915 7.8105 7.8105 8.0399 8.0399 8.0927 8.0927 8.2644 8.2644 8.2842 8.2842 8.4872 8.4872 8.4879 8.4879 8.7172 8.7172 8.7365 8.7365 9.1254 9.1254 9.1571 9.1571 9.5699 9.5699 9.5864 9.5864 10.7205 10.7205 10.7270 10.7270 14.1323 14.1323 14.1794 14.1794 16.0453 16.0453 16.0758 16.0758 k = 0.1786 0.5000-0.0000 ( 3022 PWs) bands (ev): -0.3788 -0.3788 -0.3780 -0.3780 4.8128 4.8128 4.8171 4.8171 6.1380 6.1380 6.1535 6.1535 6.7770 6.7770 6.7858 6.7858 7.0979 7.0979 7.1559 7.1559 7.4709 7.4709 7.4780 7.4780 7.7919 7.7919 7.8103 7.8103 8.0319 8.0319 8.0855 8.0855 8.2561 8.2561 8.2760 8.2760 8.4933 8.4933 8.4935 8.4935 8.7213 8.7213 8.7403 8.7403 9.1157 9.1157 9.1496 9.1496 9.5639 9.5639 9.5822 9.5822 10.6022 10.6022 10.6082 10.6082 13.9604 13.9604 14.0072 14.0072 15.9331 15.9331 15.9604 15.9604 k = 0.1905 0.5000-0.0000 ( 3026 PWs) bands (ev): -0.3595 -0.3595 -0.3587 -0.3587 4.8221 4.8221 4.8268 4.8268 6.1476 6.1476 6.1641 6.1641 6.7890 6.7890 6.7982 6.7982 7.0965 7.0965 7.1570 7.1570 7.4768 7.4768 7.4846 7.4846 7.7926 7.7926 7.8102 7.8102 8.0241 8.0241 8.0782 8.0782 8.2472 8.2472 8.2673 8.2673 8.4982 8.4982 8.4991 8.4991 8.7257 8.7257 8.7442 8.7442 9.1052 9.1052 9.1415 9.1415 9.5574 9.5574 9.5777 9.5777 10.4883 10.4883 10.4936 10.4936 13.7908 13.7908 13.8374 13.8374 15.8192 15.8192 15.8443 15.8443 k = 0.2024 0.5000-0.0000 ( 3022 PWs) bands (ev): -0.3394 -0.3394 -0.3385 -0.3385 4.8310 4.8310 4.8359 4.8359 6.1574 6.1574 6.1747 6.1747 6.8023 6.8023 6.8121 6.8121 7.0957 7.0957 7.1585 7.1585 7.4827 7.4827 7.4911 7.4911 7.7937 7.7937 7.8102 7.8102 8.0166 8.0166 8.0711 8.0711 8.2378 8.2378 8.2584 8.2584 8.5025 8.5025 8.5041 8.5041 8.7306 8.7306 8.7483 8.7483 9.0942 9.0942 9.1328 9.1328 9.5503 9.5503 9.5727 9.5727 10.3792 10.3792 10.3837 10.3837 13.6240 13.6240 13.6705 13.6705 15.7050 15.7050 15.7283 15.7283 k = 0.2143 0.5000-0.0000 ( 3026 PWs) bands (ev): -0.3185 -0.3185 -0.3177 -0.3177 4.8391 4.8391 4.8443 4.8443 6.1675 6.1675 6.1855 6.1855 6.8169 6.8169 6.8273 6.8273 7.0955 7.0955 7.1603 7.1603 7.4886 7.4886 7.4977 7.4977 7.7953 7.7953 7.8104 7.8104 8.0094 8.0094 8.0641 8.0641 8.2279 8.2279 8.2492 8.2492 8.5063 8.5063 8.5082 8.5082 8.7358 8.7358 8.7524 8.7524 9.0825 9.0825 9.1236 9.1236 9.5425 9.5425 9.5673 9.5673 10.2750 10.2750 10.2786 10.2786 13.4601 13.4601 13.5066 13.5066 15.5913 15.5913 15.6131 15.6131 k = 0.2262 0.5000-0.0000 ( 3030 PWs) bands (ev): -0.2970 -0.2970 -0.2962 -0.2962 4.8463 4.8463 4.8518 4.8518 6.1777 6.1777 6.1964 6.1964 6.8330 6.8330 6.8440 6.8440 7.0957 7.0957 7.1623 7.1623 7.4947 7.4947 7.5044 7.5044 7.7972 7.7972 7.8107 7.8107 8.0024 8.0024 8.0573 8.0573 8.2176 8.2176 8.2397 8.2397 8.5094 8.5094 8.5116 8.5116 8.7412 8.7412 8.7564 8.7564 9.0702 9.0702 9.1139 9.1139 9.5341 9.5341 9.5613 9.5613 10.1763 10.1763 10.1787 10.1787 13.2996 13.2996 13.3460 13.3460 15.4789 15.4789 15.4992 15.4992 k = 0.2381 0.5000-0.0000 ( 3030 PWs) bands (ev): -0.2750 -0.2750 -0.2741 -0.2741 4.8525 4.8525 4.8582 4.8582 6.1882 6.1882 6.2074 6.2074 6.8502 6.8502 6.8619 6.8619 7.0964 7.0964 7.1643 7.1643 7.5011 7.5011 7.5115 7.5115 7.7996 7.7996 7.8113 7.8113 7.9958 7.9958 8.0507 8.0507 8.2071 8.2071 8.2301 8.2301 8.5118 8.5118 8.5142 8.5142 8.7468 8.7468 8.7605 8.7605 9.0574 9.0574 9.1039 9.1039 9.5248 9.5248 9.5548 9.5548 10.0830 10.0830 10.0841 10.0841 13.1427 13.1427 13.1892 13.1892 15.3682 15.3682 15.3873 15.3873 k = 0.2500 0.5000-0.0000 ( 3018 PWs) bands (ev): -0.2526 -0.2526 -0.2517 -0.2517 4.8575 4.8575 4.8634 4.8634 6.1991 6.1991 6.2187 6.2187 6.8688 6.8688 6.8812 6.8812 7.0975 7.0975 7.1663 7.1663 7.5079 7.5079 7.5190 7.5190 7.8024 7.8024 7.8121 7.8121 7.9896 7.9896 8.0444 8.0444 8.1966 8.1966 8.2204 8.2204 8.5136 8.5136 8.5159 8.5159 8.7524 8.7524 8.7643 8.7643 9.0440 9.0440 9.0935 9.0935 9.5147 9.5147 9.5477 9.5477 9.9950 9.9950 9.9956 9.9956 12.9897 12.9897 13.0362 13.0362 15.2598 15.2598 15.2777 15.2777 k = 0.2619 0.5000-0.0000 ( 3026 PWs) bands (ev): -0.2299 -0.2299 -0.2290 -0.2290 4.8611 4.8611 4.8672 4.8672 6.2104 6.2104 6.2302 6.2302 6.8884 6.8884 6.9016 6.9016 7.0987 7.0987 7.1680 7.1680 7.5153 7.5153 7.5271 7.5271 7.8054 7.8054 7.8129 7.8129 7.9837 7.9837 8.0384 8.0384 8.1859 8.1859 8.2106 8.2106 8.5145 8.5145 8.5166 8.5166 8.7578 8.7578 8.7677 8.7677 9.0303 9.0303 9.0830 9.0830 9.5035 9.5035 9.5398 9.5398 9.9113 9.9113 9.9140 9.9140 12.8408 12.8408 12.8874 12.8874 15.1541 15.1541 15.1710 15.1710 k = 0.2738 0.5000-0.0000 ( 3030 PWs) bands (ev): -0.2070 -0.2070 -0.2061 -0.2061 4.8633 4.8633 4.8695 4.8695 6.2220 6.2220 6.2420 6.2420 6.9089 6.9089 6.9228 6.9228 7.1001 7.1001 7.1693 7.1693 7.5236 7.5236 7.5361 7.5361 7.8085 7.8085 7.8139 7.8139 7.9782 7.9782 8.0328 8.0328 8.1753 8.1753 8.2008 8.2008 8.5148 8.5148 8.5165 8.5165 8.7630 8.7630 8.7706 8.7706 9.0163 9.0163 9.0725 9.0725 9.4912 9.4912 9.5312 9.5312 9.8333 9.8333 9.8386 9.8386 12.6964 12.6964 12.7431 12.7431 15.0516 15.0516 15.0674 15.0674 k = 0.2857 0.5000-0.0000 ( 3020 PWs) bands (ev): -0.1840 -0.1840 -0.1831 -0.1831 4.8640 4.8640 4.8703 4.8703 6.2342 6.2342 6.2542 6.2542 6.9303 6.9303 6.9449 6.9449 7.1015 7.1015 7.1702 7.1702 7.5330 7.5330 7.5463 7.5463 7.8119 7.8119 7.8151 7.8151 7.9733 7.9733 8.0278 8.0278 8.1650 8.1650 8.1912 8.1912 8.5142 8.5142 8.5153 8.5153 8.7680 8.7680 8.7730 8.7730 9.0023 9.0023 9.0622 9.0622 9.4776 9.4776 9.5217 9.5217 9.7610 9.7610 9.7694 9.7694 12.5568 12.5568 12.6035 12.6035 14.9525 14.9525 14.9674 14.9674 k = 0.2976 0.5000-0.0000 ( 3018 PWs) bands (ev): -0.1611 -0.1611 -0.1602 -0.1602 4.8631 4.8631 4.8695 4.8695 6.2469 6.2469 6.2667 6.2667 6.9522 6.9522 6.9676 6.9676 7.1028 7.1028 7.1702 7.1702 7.5439 7.5439 7.5579 7.5579 7.8151 7.8151 7.8162 7.8162 7.9690 7.9690 8.0234 8.0234 8.1550 8.1550 8.1816 8.1816 8.5126 8.5126 8.5130 8.5130 8.7725 8.7725 8.7747 8.7747 8.9883 8.9883 9.0522 9.0522 9.4624 9.4624 9.5113 9.5113 9.6944 9.6944 9.7066 9.7066 12.4222 12.4222 12.4689 12.4689 14.8573 14.8573 14.8712 14.8712 k = 0.3095 0.5000-0.0000 ( 3026 PWs) bands (ev): -0.1384 -0.1384 -0.1375 -0.1375 4.8608 4.8608 4.8672 4.8672 6.2601 6.2601 6.2797 6.2797 6.9745 6.9745 6.9904 6.9904 7.1038 7.1038 7.1695 7.1695 7.5563 7.5563 7.5710 7.5710 7.8171 7.8171 7.8180 7.8180 7.9652 7.9652 8.0195 8.0195 8.1452 8.1452 8.1720 8.1720 8.5094 8.5094 8.5099 8.5099 8.7756 8.7756 8.7762 8.7762 8.9746 8.9746 9.0427 9.0427 9.4456 9.4456 9.4996 9.4996 9.6334 9.6334 9.6503 9.6503 12.2931 12.2931 12.3396 12.3396 14.7662 14.7662 14.7791 14.7791 k = 0.3214 0.5000-0.0000 ( 3028 PWs) bands (ev): -0.1161 -0.1161 -0.1152 -0.1152 4.8571 4.8571 4.8634 4.8634 6.2738 6.2738 6.2930 6.2930 6.9968 6.9968 7.0130 7.0130 7.1049 7.1049 7.1682 7.1682 7.5705 7.5705 7.5857 7.5857 7.8179 7.8179 7.8207 7.8207 7.9622 7.9622 8.0165 8.0165 8.1360 8.1360 8.1628 8.1628 8.5046 8.5046 8.5060 8.5060 8.7758 8.7758 8.7795 8.7795 8.9615 8.9615 9.0340 9.0340 9.4269 9.4269 9.4867 9.4867 9.5781 9.5781 9.6005 9.6005 12.1696 12.1696 12.2159 12.2159 14.6794 14.6794 14.6915 14.6915 k = 0.3333 0.5000-0.0000 ( 3032 PWs) bands (ev): -0.0942 -0.0942 -0.0933 -0.0933 4.8520 4.8520 4.8582 4.8582 6.2878 6.2878 6.3065 6.3065 7.0187 7.0187 7.0344 7.0344 7.1066 7.1066 7.1664 7.1664 7.5865 7.5865 7.6020 7.6020 7.8185 7.8185 7.8230 7.8230 7.9600 7.9600 8.0141 8.0141 8.1274 8.1274 8.1538 8.1538 8.4983 8.4983 8.5007 8.5007 8.7752 8.7752 8.7818 8.7818 8.9495 8.9495 9.0262 9.0262 9.4064 9.4064 9.4718 9.4718 9.5289 9.5289 9.5570 9.5570 12.0522 12.0522 12.0980 12.0980 14.5973 14.5973 14.6085 14.6085 k = 0.3452 0.5000-0.0000 ( 3024 PWs) bands (ev): -0.0730 -0.0730 -0.0721 -0.0721 4.8459 4.8459 4.8519 4.8519 6.3022 6.3022 6.3203 6.3203 7.0396 7.0396 7.0530 7.0530 7.1105 7.1105 7.1647 7.1647 7.6044 7.6044 7.6198 7.6198 7.8188 7.8188 7.8249 7.8249 7.9586 7.9586 8.0126 8.0126 8.1195 8.1195 8.1451 8.1451 8.4905 8.4905 8.4939 8.4939 8.7739 8.7739 8.7835 8.7835 8.9390 8.9390 9.0196 9.0196 9.3846 9.3846 9.4537 9.4537 9.4869 9.4869 9.5194 9.5194 11.9413 11.9413 11.9864 11.9864 14.5200 14.5200 14.5303 14.5303 k = 0.3571 0.5000-0.0000 ( 3020 PWs) bands (ev): -0.0526 -0.0526 -0.0517 -0.0517 4.8388 4.8388 4.8446 4.8446 6.3167 6.3167 6.3342 6.3342 7.0584 7.0584 7.0656 7.0656 7.1195 7.1195 7.1641 7.1641 7.6241 7.6241 7.6390 7.6390 7.8190 7.8190 7.8263 7.8263 7.9579 7.9579 8.0115 8.0115 8.1122 8.1122 8.1369 8.1369 8.4812 8.4812 8.4855 8.4855 8.7722 8.7722 8.7843 8.7843 8.9302 8.9302 9.0142 9.0142 9.3621 9.3621 9.4285 9.4285 9.4556 9.4556 9.4865 9.4865 11.8371 11.8371 11.8812 11.8812 14.4477 14.4477 14.4572 14.4572 k = 0.3690 0.5000-0.0000 ( 3024 PWs) bands (ev): -0.0331 -0.0331 -0.0323 -0.0323 4.8309 4.8309 4.8364 4.8364 6.3312 6.3312 6.3479 6.3479 7.0708 7.0708 7.0733 7.0733 7.1349 7.1349 7.1662 7.1662 7.6452 7.6452 7.6591 7.6591 7.8189 7.8189 7.8274 7.8274 7.9579 7.9579 8.0108 8.0108 8.1056 8.1056 8.1289 8.1289 8.4702 8.4702 8.4754 8.4754 8.7701 8.7701 8.7842 8.7842 8.9236 8.9236 9.0100 9.0100 9.3399 9.3399 9.3980 9.3980 9.4330 9.4330 9.4573 9.4573 11.7400 11.7400 11.7829 11.7829 14.3806 14.3806 14.3892 14.3892 k = 0.3810 0.5000-0.0000 ( 3024 PWs) bands (ev): -0.0147 -0.0147 -0.0139 -0.0139 4.8226 4.8226 4.8278 4.8278 6.3456 6.3456 6.3613 6.3613 7.0710 7.0710 7.0827 7.0827 7.1542 7.1542 7.1728 7.1728 7.6674 7.6674 7.6800 7.6800 7.8189 7.8189 7.8285 7.8285 7.9584 7.9584 8.0102 8.0102 8.0998 8.0998 8.1214 8.1214 8.4578 8.4578 8.4637 8.4637 8.7679 8.7679 8.7835 8.7835 8.9196 8.9196 9.0071 9.0071 9.3188 9.3188 9.3686 9.3686 9.4126 9.4126 9.4308 9.4308 11.6505 11.6505 11.6916 11.6916 14.3189 14.3189 14.3267 14.3267 k = 0.3929 0.5000-0.0000 ( 3028 PWs) bands (ev): 0.0025 0.0025 0.0032 0.0032 4.8141 4.8141 4.8189 4.8189 6.3595 6.3595 6.3742 6.3742 7.0686 7.0686 7.0859 7.0859 7.1750 7.1750 7.1844 7.1844 7.6902 7.6902 7.7009 7.7009 7.8194 7.8194 7.8296 7.8296 7.9591 7.9591 8.0093 8.0093 8.0947 8.0947 8.1143 8.1143 8.4441 8.4441 8.4505 8.4505 8.7658 8.7658 8.7823 8.7823 8.9181 8.9181 9.0055 9.0055 9.2995 9.2995 9.3423 9.3423 9.3920 9.3920 9.4060 9.4060 11.5688 11.5688 11.6078 11.6078 14.2626 14.2626 14.2697 14.2697 k = 0.4048 0.5000-0.0000 ( 3028 PWs) bands (ev): 0.0183 0.0183 0.0189 0.0189 4.8056 4.8056 4.8100 4.8100 6.3729 6.3729 6.3864 6.3864 7.0650 7.0650 7.0845 7.0845 7.1957 7.1957 7.1996 7.1996 7.7128 7.7128 7.7212 7.7212 7.8207 7.8207 7.8313 7.8313 7.9598 7.9598 8.0077 8.0077 8.0904 8.0904 8.1078 8.1078 8.4295 8.4295 8.4362 8.4362 8.7640 8.7640 8.7807 8.7807 8.9195 8.9195 9.0050 9.0050 9.2825 9.2825 9.3196 9.3196 9.3708 9.3708 9.3825 9.3825 11.4952 11.4952 11.5316 11.5316 14.2120 14.2120 14.2183 14.2183 k = 0.4167 0.5000-0.0000 ( 3024 PWs) bands (ev): 0.0326 0.0326 0.0332 0.0332 4.7974 4.7974 4.8013 4.8013 6.3855 6.3855 6.3977 6.3977 7.0609 7.0609 7.0804 7.0804 7.2156 7.2156 7.2162 7.2162 7.7340 7.7340 7.7401 7.7401 7.8238 7.8238 7.8345 7.8345 7.9602 7.9602 8.0052 8.0052 8.0869 8.0869 8.1020 8.1020 8.4144 8.4144 8.4211 8.4211 8.7626 8.7626 8.7789 8.7789 8.9236 8.9236 9.0055 9.0055 9.2678 9.2678 9.3003 9.3003 9.3492 9.3492 9.3601 9.3601 11.4301 11.4301 11.4635 11.4635 14.1672 14.1672 14.1727 14.1727 k = 0.4286 0.5000-0.0000 ( 3028 PWs) bands (ev): 0.0453 0.0453 0.0458 0.0458 4.7898 4.7898 4.7932 4.7932 6.3971 6.3971 6.4079 6.4079 7.0569 7.0569 7.0749 7.0749 7.2329 7.2329 7.2341 7.2341 7.7524 7.7524 7.7564 7.7564 7.8299 7.8299 7.8397 7.8397 7.9598 7.9598 8.0012 8.0012 8.0840 8.0840 8.0967 8.0967 8.3993 8.3993 8.4059 8.4059 8.7617 8.7617 8.7770 8.7770 8.9302 8.9302 9.0066 9.0066 9.2554 9.2554 9.2842 9.2842 9.3275 9.3275 9.3388 9.3388 11.3737 11.3737 11.4035 11.4035 14.1282 14.1282 14.1329 14.1329 k = 0.4405 0.5000-0.0000 ( 3028 PWs) bands (ev): 0.0563 0.0563 0.0567 0.0567 4.7830 4.7830 4.7859 4.7859 6.4075 6.4075 6.4167 6.4167 7.0531 7.0531 7.0689 7.0689 7.2486 7.2486 7.2506 7.2506 7.7662 7.7662 7.7689 7.7689 7.8403 7.8403 7.8480 7.8480 7.9584 7.9584 7.9957 7.9957 8.0818 8.0818 8.0921 8.0921 8.3850 8.3850 8.3912 8.3912 8.7614 8.7614 8.7751 8.7751 8.9391 8.9391 9.0081 9.0081 9.2453 9.2453 9.2709 9.2709 9.3064 9.3064 9.3187 9.3187 11.3262 11.3262 11.3519 11.3519 14.0951 14.0951 14.0990 14.0990 k = 0.4524 0.5000-0.0000 ( 3036 PWs) bands (ev): 0.0654 0.0654 0.0657 0.0657 4.7772 4.7772 4.7795 4.7795 6.4165 6.4165 6.4240 6.4240 7.0499 7.0499 7.0630 7.0630 7.2625 7.2625 7.2648 7.2648 7.7750 7.7750 7.7773 7.7773 7.8550 7.8550 7.8594 7.8594 7.9557 7.9557 7.9883 7.9883 8.0802 8.0802 8.0882 8.0882 8.3722 8.3722 8.3776 8.3776 8.7615 8.7615 8.7732 8.7732 8.9500 8.9500 9.0093 9.0093 9.2374 9.2374 9.2600 9.2600 9.2869 9.2869 9.3005 9.3005 11.2877 11.2877 11.3088 11.3088 14.0681 14.0681 14.0711 14.0711 k = 0.4643 0.5000-0.0000 ( 3040 PWs) bands (ev): 0.0726 0.0726 0.0728 0.0728 4.7725 4.7725 4.7743 4.7743 6.4239 6.4239 6.4297 6.4297 7.0476 7.0476 7.0576 7.0576 7.2740 7.2740 7.2761 7.2761 7.7802 7.7802 7.7822 7.7822 7.8722 7.8722 7.8728 7.8728 7.9515 7.9515 7.9789 7.9789 8.0790 8.0790 8.0850 8.0850 8.3615 8.3615 8.3660 8.3660 8.7621 8.7621 8.7713 8.7713 8.9620 8.9620 9.0095 9.0095 9.2316 9.2316 9.2508 9.2508 9.2708 9.2708 9.2846 9.2846 11.2583 11.2583 11.2746 11.2746 14.0470 14.0470 14.0493 14.0493 k = 0.4762 0.5000-0.0000 ( 3036 PWs) bands (ev): 0.0778 0.0778 0.0779 0.0779 4.7692 4.7692 4.7703 4.7703 6.4296 6.4296 6.4335 6.4335 7.0464 7.0464 7.0531 7.0531 7.2828 7.2828 7.2843 7.2843 7.7832 7.7832 7.7847 7.7847 7.8867 7.8867 7.8895 7.8895 7.9463 7.9463 7.9679 7.9679 8.0785 8.0785 8.0825 8.0825 8.3537 8.3537 8.3569 8.3569 8.7632 8.7632 8.7695 8.7695 8.9745 8.9745 9.0078 9.0078 9.2281 9.2281 9.2422 9.2422 9.2603 9.2603 9.2717 9.2717 11.2381 11.2381 11.2492 11.2492 14.0321 14.0321 14.0336 14.0336 k = 0.4881 0.5000-0.0000 ( 3036 PWs) bands (ev): 0.0809 0.0809 0.0810 0.0810 4.7672 4.7672 4.7678 4.7678 6.4335 6.4335 6.4354 6.4354 7.0462 7.0462 7.0497 7.0497 7.2883 7.2883 7.2892 7.2892 7.7849 7.7849 7.7857 7.7857 7.8990 7.8990 7.9032 7.9032 7.9422 7.9422 7.9558 7.9558 8.0786 8.0786 8.0806 8.0806 8.3492 8.3492 8.3509 8.3509 8.7645 8.7645 8.7677 8.7677 8.9863 8.9863 9.0035 9.0035 9.2271 9.2271 9.2344 9.2344 9.2561 9.2561 9.2624 9.2624 11.2272 11.2272 11.2327 11.2327 14.0232 14.0232 14.0240 14.0240 k = 0.5000 0.5000-0.0000 ( 3036 PWs) bands (ev): 0.0820 0.0820 0.0820 0.0820 4.7668 4.7668 4.7668 4.7668 6.4354 6.4354 6.4354 6.4354 7.0473 7.0473 7.0473 7.0473 7.2905 7.2905 7.2905 7.2905 7.7857 7.7857 7.7857 7.7857 7.9066 7.9066 7.9066 7.9066 7.9453 7.9453 7.9453 7.9453 8.0793 8.0793 8.0793 8.0793 8.3482 8.3482 8.3482 8.3482 8.7660 8.7660 8.7660 8.7660 8.9962 8.9962 8.9962 8.9962 9.2291 9.2291 9.2291 9.2291 9.2571 9.2571 9.2571 9.2571 11.2254 11.2254 11.2254 11.2254 14.0206 14.0206 14.0206 14.0206 k = 0.5000 0.5000-0.0000 ( 3036 PWs) bands (ev): 0.0820 0.0820 0.0820 0.0820 4.7668 4.7668 4.7668 4.7668 6.4354 6.4354 6.4354 6.4354 7.0473 7.0473 7.0473 7.0473 7.2905 7.2905 7.2905 7.2905 7.7857 7.7857 7.7857 7.7857 7.9066 7.9066 7.9066 7.9066 7.9453 7.9453 7.9453 7.9453 8.0793 8.0793 8.0793 8.0793 8.3482 8.3482 8.3482 8.3482 8.7660 8.7660 8.7660 8.7660 8.9962 8.9962 8.9962 8.9962 9.2291 9.2291 9.2291 9.2291 9.2571 9.2571 9.2571 9.2571 11.2254 11.2254 11.2254 11.2254 14.0206 14.0206 14.0206 14.0206 k = 0.4915 0.4915-0.0000 ( 3036 PWs) bands (ev): 0.0798 0.0798 0.0821 0.0821 4.7670 4.7670 4.7681 4.7681 6.4334 6.4334 6.4355 6.4355 7.0462 7.0462 7.0497 7.0497 7.2879 7.2879 7.2896 7.2896 7.7846 7.7846 7.7860 7.7860 7.8958 7.8958 7.9075 7.9075 7.9400 7.9400 7.9570 7.9570 8.0786 8.0786 8.0806 8.0806 8.3480 8.3480 8.3521 8.3521 8.7644 8.7644 8.7678 8.7678 8.9860 8.9860 9.0037 9.0037 9.2272 9.2272 9.2344 9.2344 9.2557 9.2557 9.2628 9.2628 11.2259 11.2259 11.2341 11.2341 14.0212 14.0212 14.0261 14.0261 k = 0.4831 0.4831-0.0000 ( 3036 PWs) bands (ev): 0.0731 0.0731 0.0824 0.0824 4.7679 4.7679 4.7718 4.7718 6.4291 6.4291 6.4337 6.4337 7.0464 7.0464 7.0532 7.0532 7.2806 7.2806 7.2864 7.2864 7.7812 7.7812 7.7864 7.7864 7.8759 7.8759 7.9079 7.9079 7.9351 7.9351 7.9715 7.9715 8.0784 8.0784 8.0826 8.0826 8.3480 8.3480 8.3629 8.3629 8.7625 8.7625 8.7701 8.7701 8.9733 8.9733 9.0090 9.0090 9.2285 9.2285 9.2420 9.2420 9.2574 9.2574 9.2746 9.2746 11.2308 11.2308 11.2570 11.2570 14.0232 14.0232 14.0428 14.0428 k = 0.4746 0.4746-0.0000 ( 3036 PWs) bands (ev): 0.0622 0.0622 0.0829 0.0829 4.7695 4.7695 4.7779 4.7779 6.4224 6.4224 6.4303 6.4303 7.0476 7.0476 7.0580 7.0580 7.2688 7.2688 7.2812 7.2812 7.7739 7.7739 7.7869 7.7869 7.8552 7.8552 7.9078 7.9078 7.9291 7.9291 7.9843 7.9843 8.0787 8.0787 8.0854 8.0854 8.3481 8.3481 8.3804 8.3804 8.7602 8.7602 8.7732 8.7732 8.9588 8.9588 9.0130 9.0130 9.2321 9.2321 9.2509 9.2509 9.2628 9.2628 9.2925 9.2925 11.2391 11.2391 11.2946 11.2946 14.0266 14.0266 14.0704 14.0704 k = 0.4661 0.4661-0.0000 ( 3044 PWs) bands (ev): 0.0469 0.0469 0.0836 0.0836 4.7718 4.7718 4.7865 4.7865 6.4129 6.4129 6.4251 6.4251 7.0500 7.0500 7.0637 7.0637 7.2533 7.2533 7.2740 7.2740 7.7602 7.7602 7.7870 7.7870 7.8382 7.8382 7.9054 7.9054 7.9240 7.9240 7.9941 7.9941 8.0794 8.0794 8.0889 8.0889 8.3484 8.3484 8.4037 8.4037 8.7571 8.7571 8.7770 8.7770 8.9437 8.9437 9.0163 9.0163 9.2361 9.2361 9.2603 9.2603 9.2737 9.2737 9.3149 9.3149 11.2511 11.2511 11.3467 11.3467 14.0313 14.0313 14.1087 14.1087 k = 0.4576 0.4576-0.0000 ( 3047 PWs) bands (ev): 0.0274 0.0274 0.0844 0.0844 4.7751 4.7751 4.7975 4.7975 6.4005 6.4005 6.4181 6.4181 7.0535 7.0535 7.0702 7.0702 7.2348 7.2348 7.2651 7.2651 7.7388 7.7388 7.7861 7.7861 7.8272 7.8272 7.8987 7.8987 7.9229 7.9229 8.0010 8.0010 8.0807 8.0807 8.0931 8.0931 8.3490 8.3490 8.4319 8.4319 8.7535 8.7535 8.7817 8.7817 8.9290 8.9290 9.0193 9.0193 9.2394 9.2394 9.2718 9.2718 9.2898 9.2898 9.3407 9.3407 11.2669 11.2669 11.4127 11.4127 14.0373 14.0373 14.1576 14.1576 k = 0.4492 0.4492-0.0000 ( 3043 PWs) bands (ev): 0.0038 0.0038 0.0854 0.0854 4.7795 4.7795 4.8109 4.8109 6.3849 6.3849 6.4093 6.4093 7.0578 7.0578 7.0773 7.0773 7.2145 7.2145 7.2545 7.2545 7.7113 7.7113 7.7830 7.7830 7.8212 7.8212 7.8897 7.8897 7.9250 7.9250 8.0052 8.0052 8.0823 8.0823 8.0980 8.0980 8.3501 8.3501 8.4636 8.4636 8.7492 8.7492 8.7871 8.7871 8.9155 8.9155 9.0223 9.0223 9.2417 9.2417 9.2867 9.2867 9.3100 9.3100 9.3687 9.3687 11.2867 11.2867 11.4920 11.4920 14.0448 14.0448 14.2168 14.2168 k = 0.4407 0.4407-0.0000 ( 3037 PWs) bands (ev): -0.0237 -0.0237 0.0864 0.0864 4.7852 4.7852 4.8268 4.8268 6.3660 6.3660 6.3985 6.3985 7.0629 7.0629 7.0843 7.0843 7.1935 7.1935 7.2427 7.2427 7.6800 7.6800 7.7761 7.7761 7.8185 7.8185 7.8818 7.8818 7.9287 7.9287 8.0077 8.0077 8.0842 8.0842 8.1037 8.1037 8.3516 8.3516 8.4978 8.4978 8.7443 8.7443 8.7929 8.7929 8.9039 8.9039 9.0254 9.0254 9.2434 9.2434 9.3047 9.3047 9.3338 9.3338 9.3984 9.3984 11.3109 11.3109 11.5838 11.5838 14.0536 14.0536 14.2858 14.2858 k = 0.4322 0.4322-0.0000 ( 3035 PWs) bands (ev): -0.0549 -0.0549 0.0875 0.0875 4.7923 4.7923 4.8450 4.8450 6.3436 6.3436 6.3856 6.3856 7.0684 7.0684 7.0906 7.0906 7.1735 7.1735 7.2298 7.2298 7.6465 7.6465 7.7639 7.7639 7.8180 7.8180 7.8766 7.8766 7.9333 7.9333 8.0089 8.0089 8.0863 8.0863 8.1099 8.1099 8.3537 8.3537 8.5334 8.5334 8.7390 8.7390 8.7989 8.7989 8.8943 8.8943 9.0284 9.0284 9.2448 9.2448 9.3260 9.3260 9.3610 9.3610 9.4296 9.4296 11.3399 11.3399 11.6873 11.6873 14.0637 14.0637 14.3643 14.3643 k = 0.4237 0.4237-0.0000 ( 3027 PWs) bands (ev): -0.0897 -0.0897 0.0887 0.0887 4.8011 4.8011 4.8657 4.8657 6.3177 6.3177 6.3706 6.3706 7.0742 7.0742 7.0945 7.0945 7.1566 7.1566 7.2161 7.2161 7.6115 7.6115 7.7468 7.7468 7.8190 7.8190 7.8748 7.8748 7.9386 7.9386 8.0098 8.0098 8.0884 8.0884 8.1168 8.1168 8.3562 8.3562 8.5693 8.5693 8.7334 8.7334 8.8047 8.8047 8.8871 8.8871 9.0314 9.0314 9.2460 9.2460 9.3502 9.3502 9.3913 9.3913 9.4621 9.4621 11.3741 11.3741 11.8018 11.8018 14.0753 14.0753 14.4518 14.4518 k = 0.4153 0.4153-0.0000 ( 3019 PWs) bands (ev): -0.1278 -0.1278 0.0898 0.0898 4.8117 4.8117 4.8886 4.8886 6.2881 6.2881 6.3535 6.3535 7.0794 7.0794 7.0937 7.0937 7.1463 7.1463 7.2021 7.2021 7.5757 7.5757 7.7259 7.7259 7.8207 7.8207 7.8758 7.8758 7.9445 7.9445 8.0109 8.0109 8.0904 8.0904 8.1245 8.1245 8.3591 8.3591 8.6045 8.6045 8.7276 8.7276 8.8100 8.8100 8.8823 8.8823 9.0341 9.0341 9.2471 9.2471 9.3776 9.3776 9.4246 9.4246 9.4961 9.4961 11.4139 11.4139 11.9265 11.9265 14.0883 14.0883 14.5480 14.5480 k = 0.4068 0.4068-0.0000 ( 3019 PWs) bands (ev): -0.1691 -0.1691 0.0908 0.0908 4.8242 4.8242 4.9139 4.9139 6.2548 6.2548 6.3344 6.3344 7.0799 7.0799 7.0903 7.0903 7.1442 7.1442 7.1885 7.1885 7.5395 7.5395 7.7023 7.7023 7.8229 7.8229 7.8786 7.8786 7.9509 7.9509 8.0127 8.0127 8.0922 8.0922 8.1328 8.1328 8.3623 8.3623 8.6380 8.6380 8.7218 8.7218 8.8148 8.8148 8.8800 8.8800 9.0365 9.0365 9.2482 9.2482 9.4079 9.4079 9.4607 9.4607 9.5316 9.5316 11.4599 11.4599 12.0606 12.0606 14.1028 14.1028 14.6522 14.6522 k = 0.3983 0.3983-0.0000 ( 3013 PWs) bands (ev): -0.2133 -0.2133 0.0916 0.0916 4.8389 4.8389 4.9415 4.9415 6.2180 6.2180 6.3134 6.3134 7.0712 7.0712 7.0908 7.0908 7.1475 7.1475 7.1762 7.1762 7.5033 7.5033 7.6771 7.6771 7.8255 7.8255 7.8824 7.8824 7.9578 7.9578 8.0158 8.0158 8.0938 8.0938 8.1419 8.1419 8.3657 8.3657 8.6686 8.6686 8.7163 8.7163 8.8191 8.8191 8.8800 8.8800 9.0383 9.0383 9.2493 9.2493 9.4413 9.4413 9.4993 9.4993 9.5688 9.5688 11.5125 11.5125 12.2034 12.2034 14.1186 14.1186 14.7642 14.7642 k = 0.3898 0.3898-0.0000 ( 3013 PWs) bands (ev): -0.2602 -0.2602 0.0923 0.0923 4.8558 4.8558 4.9713 4.9713 6.1777 6.1777 6.2910 6.2910 7.0606 7.0606 7.0898 7.0898 7.1525 7.1525 7.1676 7.1676 7.4672 7.4672 7.6512 7.6512 7.8282 7.8282 7.8865 7.8865 7.9651 7.9651 8.0206 8.0206 8.0952 8.0952 8.1516 8.1516 8.3692 8.3692 8.6943 8.6943 8.7123 8.7123 8.8234 8.8234 8.8822 8.8822 9.0394 9.0394 9.2504 9.2504 9.4777 9.4777 9.5403 9.5403 9.6077 9.6077 11.5723 11.5723 12.3542 12.3542 14.1360 14.1360 14.8832 14.8832 k = 0.3814 0.3814-0.0000 ( 3011 PWs) bands (ev): -0.3094 -0.3094 0.0926 0.0926 4.8749 4.8749 5.0033 5.0033 6.1341 6.1341 6.2674 6.2674 7.0514 7.0514 7.0843 7.0843 7.1539 7.1539 7.1675 7.1675 7.4317 7.4317 7.6251 7.6251 7.8311 7.8311 7.8903 7.8903 7.9731 7.9731 8.0272 8.0272 8.0963 8.0963 8.1619 8.1619 8.3728 8.3728 8.7023 8.7023 8.7216 8.7216 8.8283 8.8283 8.8862 8.8862 9.0397 9.0397 9.2515 9.2515 9.5168 9.5168 9.5832 9.5832 9.6485 9.6485 11.6398 11.6398 12.5124 12.5124 14.1548 14.1548 15.0089 15.0089 k = 0.3729 0.3729-0.0000 ( 3007 PWs) bands (ev): -0.3609 -0.3609 0.0927 0.0927 4.8965 4.8965 5.0376 5.0376 6.0874 6.0874 6.2433 6.2433 7.0443 7.0443 7.0741 7.0741 7.1519 7.1519 7.1753 7.1753 7.3970 7.3970 7.5994 7.5994 7.8342 7.8342 7.8934 7.8934 7.9817 7.9817 8.0356 8.0356 8.0973 8.0973 8.1730 8.1730 8.3763 8.3763 8.6984 8.6984 8.7377 8.7377 8.8345 8.8345 8.8917 8.8917 9.0393 9.0393 9.2527 9.2527 9.5585 9.5585 9.6278 9.6278 9.6916 9.6916 11.7153 11.7153 12.6773 12.6773 14.1752 14.1752 15.1408 15.1408 k = 0.3644 0.3644-0.0000 ( 3005 PWs) bands (ev): -0.4143 -0.4143 0.0924 0.0924 4.9204 4.9204 5.0739 5.0739 6.0379 6.0379 6.2191 6.2191 7.0397 7.0397 7.0603 7.0603 7.1503 7.1503 7.1851 7.1851 7.3637 7.3637 7.5742 7.5742 7.8373 7.8373 7.8956 7.8956 7.9912 7.9912 8.0454 8.0454 8.0983 8.0983 8.1846 8.1846 8.3797 8.3797 8.6938 8.6938 8.7493 8.7493 8.8419 8.8419 8.8983 8.8983 9.0379 9.0379 9.2538 9.2538 9.6022 9.6022 9.6736 9.6736 9.7374 9.7374 11.7991 11.7991 12.8486 12.8486 14.1970 14.1970 15.2782 15.2782 k = 0.3559 0.3559-0.0000 ( 3007 PWs) bands (ev): -0.4694 -0.4694 0.0916 0.0916 4.9468 4.9468 5.1124 5.1124 5.9858 5.9858 6.1954 6.1954 7.0371 7.0371 7.0449 7.0449 7.1487 7.1487 7.1951 7.1951 7.3326 7.3326 7.5498 7.5498 7.8404 7.8404 7.8970 7.8970 8.0015 8.0015 8.0562 8.0562 8.0996 8.0996 8.1967 8.1967 8.3829 8.3829 8.6894 8.6894 8.7564 8.7564 8.8500 8.8500 8.9057 8.9057 9.0356 9.0356 9.2549 9.2549 9.6473 9.6473 9.7201 9.7201 9.7861 9.7861 11.8916 11.8916 13.0255 13.0255 14.2205 14.2205 15.4206 15.4206 k = 0.3475 0.3475-0.0000 ( 3011 PWs) bands (ev): -0.5259 -0.5259 0.0904 0.0904 4.9755 4.9755 5.1528 5.1528 5.9313 5.9313 6.1727 6.1727 7.0260 7.0260 7.0388 7.0388 7.1467 7.1467 7.2032 7.2032 7.3058 7.3058 7.5263 7.5263 7.8435 7.8435 7.8976 7.8976 8.0128 8.0128 8.0669 8.0669 8.1020 8.1020 8.2093 8.2093 8.3858 8.3858 8.6852 8.6852 8.7602 8.7602 8.8579 8.8579 8.9136 8.9136 9.0324 9.0324 9.2560 9.2560 9.6929 9.6929 9.7673 9.7673 9.8384 9.8384 11.9929 11.9929 13.2077 13.2077 14.2455 14.2455 15.5674 15.5674 k = 0.3390 0.3390-0.0000 ( 3013 PWs) bands (ev): -0.5836 -0.5836 0.0886 0.0886 5.0065 5.0065 5.1952 5.1952 5.8750 5.8750 6.1514 6.1514 7.0083 7.0083 7.0409 7.0409 7.1437 7.1437 7.2051 7.2051 7.2876 7.2876 7.5039 7.5039 7.8465 7.8465 7.8978 7.8978 8.0249 8.0249 8.0760 8.0760 8.1068 8.1068 8.2224 8.2224 8.3885 8.3885 8.6813 8.6813 8.7617 8.7617 8.8649 8.8649 8.9214 8.9214 9.0284 9.0284 9.2571 9.2571 9.7376 9.7376 9.8159 9.8159 9.8943 9.8943 12.1029 12.1029 13.3946 13.3946 14.2721 14.2721 15.7179 15.7179 k = 0.3305 0.3305-0.0000 ( 3017 PWs) bands (ev): -0.6423 -0.6423 0.0862 0.0862 5.0398 5.0398 5.2396 5.2396 5.8170 5.8170 6.1321 6.1321 6.9900 6.9900 7.0453 7.0453 7.1392 7.1392 7.1960 7.1960 7.2831 7.2831 7.4826 7.4826 7.8492 7.8492 7.8977 7.8977 8.0378 8.0378 8.0816 8.0816 8.1156 8.1156 8.2359 8.2359 8.3909 8.3909 8.6776 8.6776 8.7618 8.7618 8.8710 8.8710 8.9285 8.9285 9.0237 9.0237 9.2582 9.2582 9.7802 9.7802 9.8668 9.8668 9.9536 9.9536 12.2215 12.2215 13.5857 13.5857 14.3004 14.3004 15.8714 15.8714 k = 0.3220 0.3220-0.0000 ( 3009 PWs) bands (ev): -0.7018 -0.7018 0.0831 0.0831 5.0753 5.0753 5.2857 5.2857 5.7579 5.7579 6.1152 6.1152 6.9714 6.9714 7.0515 7.0515 7.1321 7.1321 7.1796 7.1796 7.2904 7.2904 7.4624 7.4624 7.8518 7.8518 7.8978 7.8978 8.0514 8.0514 8.0841 8.0841 8.1281 8.1281 8.2498 8.2498 8.3930 8.3930 8.6742 8.6742 8.7610 8.7610 8.8762 8.8762 8.9346 8.9346 9.0183 9.0183 9.2593 9.2593 9.8198 9.8198 9.9208 9.9208 10.0160 10.0160 12.3485 12.3485 13.7805 13.7805 14.3303 14.3303 16.0269 16.0269 k = 0.3136 0.3136-0.0000 ( 3009 PWs) bands (ev): -0.7618 -0.7618 0.0794 0.0794 5.1126 5.1126 5.3335 5.3335 5.6979 5.6979 6.1010 6.1010 6.9528 6.9528 7.0590 7.0590 7.1199 7.1199 7.1638 7.1638 7.3035 7.3035 7.4432 7.4432 7.8539 7.8539 7.8979 7.8979 8.0657 8.0657 8.0848 8.0848 8.1426 8.1426 8.2640 8.2640 8.3947 8.3947 8.6711 8.6711 8.7597 8.7597 8.8806 8.8806 8.9394 8.9394 9.0122 9.0122 9.2602 9.2602 9.8563 9.8563 9.9778 9.9778 10.0810 10.0810 12.4835 12.4835 13.9784 13.9784 14.3621 14.3621 16.1833 16.1833 k = 0.3051 0.3051-0.0000 ( 3013 PWs) bands (ev): -0.8221 -0.8221 0.0750 0.0750 5.1516 5.1516 5.3828 5.3828 5.6379 5.6379 6.0897 6.0897 6.9342 6.9342 7.0675 7.0675 7.1016 7.1016 7.1534 7.1534 7.3194 7.3194 7.4251 7.4251 7.8554 7.8554 7.8985 7.8985 8.0802 8.0802 8.0849 8.0849 8.1582 8.1582 8.2784 8.2784 8.3961 8.3961 8.6682 8.6682 8.7579 8.7579 8.8842 8.8842 8.9426 8.9426 9.0055 9.0055 9.2612 9.2612 9.8899 9.8899 10.0377 10.0377 10.1483 10.1483 12.6261 12.6261 14.1783 14.1783 14.3958 14.3958 16.3390 16.3390 k = 0.2966 0.2966-0.0000 ( 3011 PWs) bands (ev): -0.8826 -0.8826 0.0698 0.0698 5.1915 5.1915 5.4331 5.4331 5.5791 5.5791 6.0818 6.0818 6.9159 6.9159 7.0738 7.0738 7.0822 7.0822 7.1476 7.1476 7.3369 7.3369 7.4081 7.4081 7.8565 7.8565 7.8997 7.8997 8.0836 8.0836 8.0960 8.0960 8.1743 8.1743 8.2930 8.2930 8.3972 8.3972 8.6655 8.6655 8.7560 8.7560 8.8873 8.8873 8.9443 8.9443 8.9985 8.9985 9.2621 9.2621 9.9211 9.9211 10.1001 10.1001 10.2174 10.2174 12.7756 12.7756 14.3766 14.3766 14.4343 14.4343 16.4921 16.4921 k = 0.2881 0.2881-0.0000 ( 3023 PWs) bands (ev): -0.9430 -0.9430 0.0639 0.0639 5.2311 5.2311 5.4787 5.4787 5.5283 5.5283 6.0772 6.0772 6.8978 6.8978 7.0548 7.0548 7.0860 7.0860 7.1455 7.1455 7.3553 7.3553 7.3920 7.3920 7.8569 7.8569 7.9016 7.9016 8.0827 8.0827 8.1116 8.1116 8.1906 8.1906 8.3078 8.3078 8.3980 8.3980 8.6631 8.6631 8.7539 8.7539 8.8898 8.8898 8.9443 8.9443 8.9911 8.9911 9.2628 9.2628 9.9503 9.9503 10.1645 10.1645 10.2881 10.2881 12.9314 12.9314 14.4640 14.4640 14.5855 14.5855 16.6395 16.6395 k = 0.2797 0.2797-0.0000 ( 3023 PWs) bands (ev): -1.0032 -1.0032 0.0572 0.0572 5.2668 5.2668 5.4609 5.4609 5.5480 5.5480 6.0762 6.0762 6.8800 6.8800 7.0319 7.0319 7.0919 7.0919 7.1476 7.1476 7.3736 7.3736 7.3779 7.3779 7.8569 7.8569 7.9040 7.9040 8.0816 8.0816 8.1276 8.1276 8.2069 8.2069 8.3227 8.3227 8.3985 8.3985 8.6609 8.6609 8.7517 8.7517 8.8919 8.8919 8.9429 8.9429 8.9835 8.9835 9.2635 9.2635 9.9781 9.9781 10.2306 10.2306 10.3600 10.3600 13.0927 13.0927 14.5035 14.5035 14.7844 14.7844 16.7767 16.7767 k = 0.2712 0.2712-0.0000 ( 3025 PWs) bands (ev): -1.0631 -1.0631 0.0498 0.0498 5.2866 5.2866 5.4288 5.4288 5.6012 5.6012 6.0788 6.0788 6.8624 6.8624 7.0095 7.0095 7.0945 7.0945 7.1547 7.1547 7.3627 7.3627 7.3945 7.3945 7.8565 7.8565 7.9071 7.9071 8.0803 8.0803 8.1441 8.1441 8.2230 8.2230 8.3376 8.3376 8.3989 8.3989 8.6589 8.6589 8.7495 8.7495 8.8936 8.8936 8.9401 8.9401 8.9757 8.9757 9.2641 9.2641 10.0048 10.0048 10.2981 10.2981 10.4326 10.4326 13.2586 13.2586 14.5439 14.5439 14.9791 14.9791 16.8918 16.8918 k = 0.2627 0.2627-0.0000 ( 3025 PWs) bands (ev): -1.1224 -1.1224 0.0417 0.0417 5.2696 5.2696 5.4334 5.4334 5.6575 5.6575 6.0851 6.0851 6.8452 6.8452 6.9885 6.9885 7.0939 7.0939 7.1663 7.1663 7.3496 7.3496 7.4146 7.4146 7.8558 7.8558 7.9107 7.9107 8.0790 8.0790 8.1609 8.1609 8.2390 8.2390 8.3526 8.3526 8.3991 8.3991 8.6571 8.6571 8.7474 8.7474 8.8946 8.8946 8.9360 8.9360 8.9678 8.9678 9.2645 9.2645 10.0307 10.0307 10.3669 10.3669 10.5058 10.5058 13.4279 13.4279 14.5858 14.5858 15.1630 15.1630 16.8467 16.8467 k = 0.2542 0.2542-0.0000 ( 3021 PWs) bands (ev): -1.1809 -1.1809 0.0329 0.0329 5.2247 5.2247 5.4674 5.4674 5.7153 5.7153 6.0949 6.0949 6.8285 6.8285 6.9690 6.9690 7.0910 7.0910 7.1811 7.1811 7.3377 7.3377 7.4348 7.4348 7.8549 7.8549 7.9147 7.9147 8.0776 8.0776 8.1779 8.1779 8.2544 8.2544 8.3675 8.3675 8.3994 8.3994 8.6556 8.6556 8.7453 8.7453 8.8952 8.8952 8.9309 8.9309 8.9598 8.9598 9.2648 9.2648 10.0561 10.0561 10.4367 10.4367 10.5791 10.5791 13.5992 13.5992 14.6294 14.6294 15.3255 15.3255 16.7168 16.7168 k = 0.2458 0.2458-0.0000 ( 3017 PWs) bands (ev): -1.2387 -1.2387 0.0234 0.0234 5.1705 5.1705 5.5123 5.5123 5.7743 5.7743 6.1081 6.1081 6.8122 6.8122 6.9513 6.9513 7.0869 7.0869 7.1983 7.1983 7.3267 7.3267 7.4552 7.4552 7.8539 7.8539 7.9192 7.9192 8.0762 8.0762 8.1953 8.1953 8.2692 8.2692 8.3824 8.3824 8.3998 8.3998 8.6544 8.6544 8.7433 8.7433 8.8951 8.8951 8.9250 8.9250 8.9518 8.9518 9.2648 9.2648 10.0813 10.0813 10.5074 10.5074 10.6521 10.6521 13.7709 13.7709 14.6745 14.6745 15.4476 15.4476 16.6244 16.6244 k = 0.2373 0.2373-0.0000 ( 3013 PWs) bands (ev): -1.2955 -1.2955 0.0132 0.0132 5.1138 5.1138 5.5617 5.5617 5.8342 5.8342 6.1245 6.1245 6.7963 6.7963 6.9359 6.9359 7.0819 7.0819 7.2168 7.2168 7.3169 7.3169 7.4756 7.4756 7.8530 7.8530 7.9239 7.9239 8.0747 8.0747 8.2128 8.2128 8.2832 8.2832 8.3972 8.3972 8.4007 8.4007 8.6533 8.6533 8.7413 8.7413 8.8940 8.8940 8.9187 8.9187 8.9439 8.9439 9.2646 9.2646 10.1067 10.1067 10.5787 10.5787 10.7245 10.7245 13.9409 13.9409 14.7213 14.7213 15.5036 15.5036 16.5987 16.5987 k = 0.2288 0.2288-0.0000 ( 3011 PWs) bands (ev): -1.3512 -1.3512 0.0025 0.0025 5.0565 5.0565 5.6132 5.6132 5.8949 5.8949 6.1438 6.1438 6.7809 6.7809 6.9228 6.9228 7.0763 7.0763 7.2363 7.2363 7.3083 7.3083 7.4959 7.4959 7.8521 7.8521 7.9291 7.9291 8.0732 8.0732 8.2305 8.2305 8.2961 8.2961 8.4020 8.4020 8.4121 8.4121 8.6525 8.6525 8.7394 8.7394 8.8913 8.8913 8.9126 8.9126 8.9361 8.9361 9.2642 9.2642 10.1325 10.1325 10.6504 10.6504 10.7956 10.7956 14.1061 14.1061 14.7695 14.7695 15.4798 15.4798 16.6532 16.6532 k = 0.2203 0.2203-0.0000 ( 3015 PWs) bands (ev): -1.4057 -1.4057 -0.0088 -0.0088 4.9997 4.9997 5.6660 5.6660 5.9562 5.9562 6.1657 6.1657 6.7660 6.7660 6.9126 6.9126 7.0704 7.0704 7.2558 7.2558 7.3017 7.3017 7.5158 7.5158 7.8513 7.8513 7.9346 7.9346 8.0716 8.0716 8.2483 8.2483 8.3077 8.3077 8.4044 8.4044 8.4267 8.4267 8.6519 8.6519 8.7374 8.7374 8.8864 8.8864 8.9073 8.9073 8.9286 8.9286 9.2634 9.2634 10.1591 10.1591 10.7224 10.7224 10.8651 10.8651 14.2630 14.2630 14.8190 14.8190 15.3914 15.3914 16.7703 16.7703 k = 0.2119 0.2119-0.0000 ( 3015 PWs) bands (ev): -1.4588 -1.4588 -0.0205 -0.0205 4.9438 4.9438 5.7196 5.7196 6.0178 6.0178 6.1896 6.1896 6.7516 6.7516 6.9058 6.9058 7.0642 7.0642 7.2722 7.2722 7.3001 7.3001 7.5355 7.5355 7.8507 7.8507 7.9405 7.9405 8.0700 8.0700 8.2661 8.2661 8.3177 8.3177 8.4080 8.4080 8.4412 8.4412 8.6514 8.6514 8.7353 8.7353 8.8792 8.8792 8.9028 8.9028 8.9219 8.9219 9.2623 9.2623 10.1867 10.1867 10.7942 10.7942 10.9325 10.9325 14.4063 14.4063 14.8694 14.8694 15.2655 15.2655 16.9156 16.9156 k = 0.2034 0.2034-0.0000 ( 3015 PWs) bands (ev): -1.5106 -1.5106 -0.0327 -0.0327 4.8891 4.8891 5.7734 5.7734 6.0795 6.0795 6.2149 6.2149 6.7378 6.7378 6.9028 6.9028 7.0577 7.0577 7.2772 7.2772 7.3117 7.3117 7.5546 7.5546 7.8503 7.8503 7.9470 7.9470 8.0685 8.0685 8.2837 8.2837 8.3261 8.3261 8.4132 8.4132 8.4556 8.4556 8.6512 8.6512 8.7329 8.7329 8.8704 8.8704 8.8983 8.8983 8.9162 8.9162 9.2608 9.2608 10.2156 10.2156 10.8656 10.8656 10.9971 10.9971 14.5297 14.5297 14.9187 14.9187 15.1233 15.1233 16.9057 16.9057 k = 0.1949 0.1949-0.0000 ( 3021 PWs) bands (ev): -1.5609 -1.5609 -0.0451 -0.0451 4.8357 4.8357 5.8272 5.8272 6.1409 6.1409 6.2413 6.2413 6.7246 6.7246 6.9045 6.9045 7.0510 7.0510 7.2747 7.2747 7.3323 7.3323 7.5730 7.5730 7.8501 7.8501 7.9539 7.9539 8.0669 8.0669 8.3009 8.3009 8.3330 8.3330 8.4199 8.4199 8.4700 8.4700 8.6512 8.6512 8.7302 8.7302 8.8606 8.8606 8.8930 8.8930 8.9119 8.9119 9.2588 9.2588 10.2461 10.2461 10.9360 10.9360 11.0587 11.0587 14.6254 14.6254 14.9329 14.9329 15.0100 15.0100 16.8773 16.8773 k = 0.1864 0.1864-0.0000 ( 3025 PWs) bands (ev): -1.6096 -1.6096 -0.0578 -0.0578 4.7839 4.7839 5.8806 5.8806 6.2010 6.2010 6.2685 6.2685 6.7118 6.7118 6.9113 6.9113 7.0442 7.0442 7.2712 7.2712 7.3555 7.3555 7.5907 7.5907 7.8502 7.8502 7.9613 7.9613 8.0654 8.0654 8.3168 8.3168 8.3396 8.3396 8.4281 8.4281 8.4841 8.4841 8.6514 8.6514 8.7269 8.7269 8.8505 8.8505 8.8870 8.8870 8.9087 8.9087 9.2563 9.2563 10.2785 10.2785 11.0045 11.0045 11.1168 11.1168 14.6837 14.6837 14.8058 14.8058 15.0409 15.0409 16.8798 16.8798 k = 0.1780 0.1780-0.0000 ( 3025 PWs) bands (ev): -1.6566 -1.6566 -0.0707 -0.0707 4.7338 4.7338 5.9335 5.9335 6.2562 6.2562 6.2992 6.2992 6.6996 6.6996 6.9241 6.9241 7.0373 7.0373 7.2679 7.2679 7.3797 7.3797 7.6075 7.6075 7.8506 7.8506 7.9693 7.9693 8.0640 8.0640 8.3288 8.3288 8.3489 8.3489 8.4373 8.4373 8.4981 8.4981 8.6518 8.6518 8.7227 8.7227 8.8405 8.8405 8.8807 8.8807 8.9061 8.9061 9.2532 9.2532 10.3131 10.3131 11.0696 11.0696 11.1718 11.1718 14.6402 14.6402 14.7230 14.7230 15.0935 15.0935 16.9197 16.9197 k = 0.1695 0.1695-0.0000 ( 3029 PWs) bands (ev): -1.7018 -1.7018 -0.0837 -0.0837 4.6856 4.6856 5.9854 5.9854 6.2958 6.2958 6.3429 6.3429 6.6880 6.6880 6.9433 6.9433 7.0304 7.0304 7.2652 7.2652 7.4046 7.4046 7.6231 7.6231 7.8512 7.8512 7.9778 7.9778 8.0629 8.0629 8.3350 8.3350 8.3630 8.3630 8.4473 8.4473 8.5120 8.5120 8.6524 8.6524 8.7173 8.7173 8.8311 8.8311 8.8743 8.8743 8.9038 8.9038 9.2496 9.2496 10.3501 10.3501 11.1281 11.1281 11.2254 11.2254 14.5010 14.5010 14.7002 14.7002 15.1482 15.1482 16.9877 16.9877 k = 0.1610 0.1610-0.0000 ( 3029 PWs) bands (ev): -1.7453 -1.7453 -0.0967 -0.0967 4.6391 4.6391 6.0362 6.0362 6.3203 6.3203 6.3984 6.3984 6.6772 6.6772 6.9692 6.9692 7.0237 7.0237 7.2630 7.2630 7.4299 7.4299 7.6377 7.6377 7.8524 7.8524 7.9868 7.9868 8.0621 8.0621 8.3382 8.3382 8.3795 8.3795 8.4576 8.4576 8.5258 8.5258 8.6533 8.6533 8.7104 8.7104 8.8228 8.8228 8.8680 8.8680 8.9017 8.9017 9.2452 9.2452 10.3899 10.3899 11.1758 11.1758 11.2806 11.2806 14.3645 14.3645 14.6465 14.6465 15.2031 15.2031 16.9497 16.9497 k = 0.1525 0.1525-0.0000 ( 3035 PWs) bands (ev): -1.7868 -1.7868 -0.1095 -0.1095 4.5947 4.5947 6.0856 6.0856 6.3380 6.3380 6.4565 6.4565 6.6669 6.6669 6.9998 6.9998 7.0193 7.0193 7.2614 7.2614 7.4555 7.4555 7.6509 7.6509 7.8539 7.8539 7.9959 7.9959 8.0619 8.0619 8.3403 8.3403 8.3967 8.3967 8.4680 8.4680 8.5394 8.5394 8.6543 8.6543 8.7021 8.7021 8.8157 8.8157 8.8618 8.8618 8.8995 8.8995 9.2401 9.2401 10.4328 10.4328 11.2089 11.2089 11.3393 11.3393 14.2373 14.2373 14.5638 14.5638 15.2572 15.2572 16.8870 16.8870 k = 0.1441 0.1441-0.0000 ( 3035 PWs) bands (ev): -1.8265 -1.8265 -0.1223 -0.1223 4.5523 4.5523 6.1333 6.1333 6.3515 6.3515 6.5144 6.5144 6.6576 6.6576 7.0066 7.0066 7.0456 7.0456 7.2602 7.2602 7.4814 7.4814 7.6628 7.6628 7.8559 7.8559 8.0047 8.0047 8.0630 8.0630 8.3421 8.3421 8.4141 8.4141 8.4783 8.4783 8.5527 8.5527 8.6555 8.6555 8.6925 8.6925 8.8102 8.8102 8.8560 8.8560 8.8973 8.8973 9.2341 9.2341 10.4789 10.4789 11.2267 11.2267 11.4008 11.4008 14.1217 14.1217 14.4586 14.4586 15.3096 15.3096 16.7986 16.7986 k = 0.1356 0.1356-0.0000 ( 3035 PWs) bands (ev): -1.8641 -1.8641 -0.1348 -0.1348 4.5121 4.5121 6.1791 6.1791 6.3615 6.3615 6.5703 6.5703 6.6498 6.6498 7.0006 7.0006 7.0908 7.0908 7.2595 7.2595 7.5073 7.5073 7.6734 7.6734 7.8584 7.8584 8.0125 8.0125 8.0658 8.0658 8.3438 8.3438 8.4314 8.4314 8.4881 8.4881 8.5654 8.5654 8.6567 8.6567 8.6827 8.6827 8.8062 8.8062 8.8504 8.8504 8.8951 8.8951 9.2272 9.2272 10.5286 10.5286 11.2295 11.2295 11.4635 11.4635 14.0191 14.0191 14.3370 14.3370 15.3590 15.3590 16.6919 16.6919 k = 0.1271 0.1271-0.0000 ( 3031 PWs) bands (ev): -1.8997 -1.8997 -0.1469 -0.1469 4.4740 4.4740 6.2227 6.2227 6.3688 6.3688 6.6166 6.6166 6.6510 6.6510 6.9941 6.9941 7.1418 7.1418 7.2592 7.2592 7.5331 7.5331 7.6826 7.6826 7.8617 7.8617 8.0184 8.0184 8.0714 8.0714 8.3457 8.3457 8.4485 8.4485 8.4972 8.4972 8.5767 8.5767 8.6568 8.6568 8.6748 8.6748 8.8034 8.8034 8.8452 8.8452 8.8928 8.8928 9.2194 9.2194 10.5821 10.5821 11.2177 11.2177 11.5260 11.5260 13.9305 13.9305 14.2038 14.2038 15.4038 15.4038 16.5915 16.5915 k = 0.1186 0.1186-0.0000 ( 3035 PWs) bands (ev): -1.9331 -1.9331 -0.1587 -0.1587 4.4381 4.4381 6.2638 6.2638 6.3740 6.3740 6.6239 6.6239 6.6898 6.6898 6.9877 6.9877 7.1959 7.1959 7.2601 7.2601 7.5587 7.5587 7.6905 7.6905 7.8659 7.8659 8.0221 8.0221 8.0797 8.0797 8.3477 8.3477 8.4653 8.4653 8.5050 8.5050 8.5851 8.5851 8.6554 8.6554 8.6718 8.6718 8.8016 8.8016 8.8403 8.8403 8.8905 8.8905 9.2105 9.2105 10.6395 10.6395 11.1918 11.1918 11.5872 11.5872 13.8553 13.8553 14.0637 14.0637 15.4420 15.4420 16.5032 16.5032 k = 0.1102 0.1102-0.0000 ( 3035 PWs) bands (ev): -1.9645 -1.9645 -0.1700 -0.1700 4.4046 4.4046 6.3017 6.3017 6.3781 6.3781 6.6184 6.6184 6.7404 6.7404 6.9814 6.9814 7.2434 7.2434 7.2705 7.2705 7.5839 7.5839 7.6974 7.6974 7.8714 7.8714 8.0240 8.0240 8.0905 8.0905 8.3500 8.3500 8.4816 8.4816 8.5111 8.5111 8.5884 8.5884 8.6559 8.6559 8.6733 8.6733 8.8006 8.8006 8.8358 8.8358 8.8882 8.8882 9.2006 9.2006 10.7011 10.7011 11.1524 11.1524 11.6466 11.6466 13.7902 13.7902 13.9227 13.9227 15.4711 15.4711 16.4301 16.4301 k = 0.1017 0.1017-0.0000 ( 3037 PWs) bands (ev): -1.9937 -1.9937 -0.1808 -0.1808 4.3733 4.3733 6.3347 6.3347 6.3832 6.3832 6.6119 6.6119 6.7902 6.7902 6.9753 6.9753 7.2532 7.2532 7.3199 7.3199 7.6086 7.6086 7.7032 7.7032 7.8785 7.8785 8.0247 8.0247 8.1028 8.1028 8.3525 8.3525 8.4967 8.4967 8.5144 8.5144 8.5869 8.5869 8.6623 8.6623 8.6770 8.6770 8.8002 8.8002 8.8317 8.8317 8.8860 8.8860 9.1896 9.1896 10.7665 10.7665 11.1012 11.1012 11.7036 11.7036 13.7131 13.7131 13.8042 13.8042 15.4887 15.4887 16.3748 16.3748 k = 0.0932 0.0932-0.0000 ( 3037 PWs) bands (ev): -2.0206 -2.0206 -0.1909 -0.1909 4.3445 4.3445 6.3570 6.3570 6.3952 6.3952 6.6056 6.6056 6.8379 6.8379 6.9697 6.9697 7.2541 7.2541 7.3775 7.3775 7.6326 7.6326 7.7083 7.7083 7.8878 7.8878 8.0249 8.0249 8.1160 8.1160 8.3552 8.3552 8.5051 8.5051 8.5188 8.5188 8.5842 8.5842 8.6737 8.6737 8.6821 8.6821 8.8003 8.8003 8.8281 8.8281 8.8839 8.8839 9.1774 9.1774 10.8346 10.8346 11.0410 11.0410 11.7578 11.7578 13.5849 13.5849 13.7477 13.7477 15.4932 15.4932 16.3386 16.3386 k = 0.0847 0.0847-0.0000 ( 3043 PWs) bands (ev): -2.0454 -2.0454 -0.2004 -0.2004 4.3180 4.3180 6.3650 6.3650 6.4180 6.4180 6.5997 6.5997 6.8828 6.8828 6.9646 6.9646 7.2539 7.2539 7.4333 7.4333 7.6556 7.6556 7.7132 7.7132 7.8999 7.8999 8.0248 8.0248 8.1295 8.1295 8.3580 8.3580 8.4985 8.4985 8.5312 8.5312 8.5838 8.5838 8.6878 8.6878 8.6884 8.6884 8.8010 8.8010 8.8250 8.8250 8.8823 8.8823 9.1640 9.1640 10.8940 10.8940 10.9855 10.9855 11.8089 11.8089 13.4362 13.4362 13.7218 13.7218 15.4847 15.4847 16.3214 16.3214 k = 0.0763 0.0763-0.0000 ( 3033 PWs) bands (ev): -2.0678 -2.0678 -0.2092 -0.2092 4.2939 4.2939 6.3667 6.3667 6.4438 6.4438 6.5945 6.5945 6.9241 6.9241 6.9606 6.9606 7.2534 7.2534 7.4845 7.4845 7.6773 7.6773 7.7188 7.7188 7.9154 7.9154 8.0252 8.0252 8.1429 8.1429 8.3610 8.3610 8.4845 8.4845 8.5450 8.5450 8.5864 8.5864 8.6956 8.6956 8.7034 8.7034 8.8025 8.8025 8.8225 8.8225 8.8813 8.8813 9.1497 9.1497 10.8685 10.8685 11.0134 11.0134 11.8563 11.8563 13.2839 13.2839 13.7090 13.7090 15.4650 15.4650 16.3207 16.3207 k = 0.0678 0.0678-0.0000 ( 3033 PWs) bands (ev): -2.0880 -2.0880 -0.2171 -0.2171 4.2724 4.2724 6.3663 6.3663 6.4685 6.4685 6.5899 6.5899 6.9491 6.9491 6.9700 6.9700 7.2528 7.2528 7.5283 7.5283 7.6961 7.6961 7.7265 7.7265 7.9343 7.9343 8.0266 8.0266 8.1559 8.1559 8.3638 8.3638 8.4667 8.4667 8.5582 8.5582 8.5909 8.5909 8.7035 8.7035 8.7191 8.7191 8.8050 8.8050 8.8205 8.8205 8.8812 8.8812 9.1341 9.1341 10.7928 10.7928 11.0926 11.0926 11.8997 11.8997 13.1314 13.1314 13.7046 13.7046 15.4374 15.4374 16.3326 16.3326 k = 0.0593 0.0593-0.0000 ( 3045 PWs) bands (ev): -2.1058 -2.1058 -0.2243 -0.2243 4.2532 4.2532 6.3652 6.3652 6.4906 6.4906 6.5860 6.5860 6.9478 6.9478 7.0026 7.0026 7.2519 7.2519 7.5629 7.5629 7.7091 7.7091 7.7393 7.7393 7.9557 7.9557 8.0302 8.0302 8.1683 8.1683 8.3664 8.3664 8.4466 8.4466 8.5701 8.5701 8.5961 8.5961 8.7117 8.7117 8.7342 8.7342 8.8089 8.8089 8.8190 8.8190 8.8826 8.8826 9.1177 9.1177 10.7109 10.7109 11.1817 11.1817 11.9388 11.9388 12.9803 12.9803 13.7059 13.7059 15.4058 15.4058 16.3529 16.3529 k = 0.0508 0.0508-0.0000 ( 3043 PWs) bands (ev): -2.1213 -2.1213 -0.2306 -0.2306 4.2367 4.2367 6.3638 6.3638 6.5099 6.5099 6.5829 6.5829 6.9445 6.9445 7.0341 7.0341 7.2510 7.2510 7.5883 7.5883 7.7167 7.7167 7.7567 7.7567 7.9762 7.9762 8.0390 8.0390 8.1799 8.1799 8.3687 8.3687 8.4254 8.4254 8.5809 8.5809 8.6020 8.6020 8.7195 8.7195 8.7485 8.7485 8.8135 8.8135 8.8187 8.8187 8.8865 8.8865 9.1004 9.1004 10.6297 10.6297 11.2768 11.2768 11.9732 11.9732 12.8313 12.8313 13.7109 13.7109 15.3733 15.3733 16.3775 16.3775 k = 0.0424 0.0424-0.0000 ( 3043 PWs) bands (ev): -2.1344 -2.1344 -0.2359 -0.2359 4.2226 4.2226 6.3624 6.3624 6.5259 6.5259 6.5808 6.5808 6.9413 6.9413 7.0618 7.0618 7.2500 7.2500 7.6054 7.6054 7.7218 7.7218 7.7747 7.7747 7.9905 7.9905 8.0569 8.0569 8.1908 8.1908 8.3703 8.3703 8.4038 8.4038 8.5899 8.5899 8.6079 8.6079 8.7259 8.7259 8.7620 8.7620 8.8151 8.8151 8.8220 8.8220 8.8938 8.8938 9.0824 9.0824 10.5528 10.5528 11.3771 11.3771 12.0022 12.0022 12.6856 12.6856 13.7180 13.7180 15.3424 15.3424 16.4029 16.4029 k = 0.0339 0.0339-0.0000 ( 3043 PWs) bands (ev): -2.1452 -2.1452 -0.2404 -0.2404 4.2111 4.2111 6.3611 6.3611 6.5382 6.5382 6.5798 6.5798 6.9387 6.9387 7.0851 7.0851 7.2490 7.2490 7.6163 7.6163 7.7259 7.7259 7.7908 7.7908 7.9976 7.9976 8.0822 8.0822 8.2014 8.2014 8.3688 8.3688 8.3846 8.3846 8.5971 8.5971 8.6138 8.6138 8.7303 8.7303 8.7752 8.7752 8.8148 8.8148 8.8264 8.8264 8.9053 8.9053 9.0641 9.0641 10.4834 10.4834 11.4818 11.4818 12.0253 12.0253 12.5444 12.5444 13.7256 13.7256 15.3152 15.3152 16.4260 16.4260 k = 0.0254 0.0254-0.0000 ( 3035 PWs) bands (ev): -2.1536 -2.1536 -0.2439 -0.2439 4.2021 4.2021 6.3600 6.3600 6.5468 6.5468 6.5803 6.5803 6.9365 6.9365 7.1039 7.1039 7.2481 7.2481 7.6229 7.6229 7.7292 7.7292 7.8039 7.8039 8.0010 8.0010 8.1087 8.1087 8.2121 8.2121 8.3540 8.3540 8.3784 8.3784 8.6025 8.6025 8.6191 8.6191 8.7328 8.7328 8.7877 8.7877 8.8146 8.8146 8.8292 8.8292 8.9201 8.9201 9.0459 9.0459 10.4248 10.4248 11.5903 11.5903 12.0410 12.0410 12.4098 12.4098 13.7327 13.7327 15.2928 15.2928 16.4443 16.4443 k = 0.0169 0.0169-0.0000 ( 3033 PWs) bands (ev): -2.1596 -2.1596 -0.2464 -0.2464 4.1956 4.1956 6.3591 6.3591 6.5517 6.5517 6.5817 6.5817 6.9350 6.9350 7.1175 7.1175 7.2473 7.2473 7.6266 7.6266 7.7315 7.7315 7.8136 7.8136 8.0024 8.0024 8.1310 8.1310 8.2236 8.2236 8.3337 8.3337 8.3785 8.3785 8.6061 8.6061 8.6232 8.6232 8.7341 8.7341 8.7985 8.7985 8.8146 8.8146 8.8300 8.8300 8.9364 8.9364 9.0284 9.0284 10.3801 10.3801 11.7008 11.7008 12.0451 12.0451 12.2879 12.2879 13.7383 13.7383 15.2763 15.2763 16.4560 16.4560 k = 0.0085 0.0085-0.0000 ( 3041 PWs) bands (ev): -2.1632 -2.1632 -0.2479 -0.2479 4.1918 4.1918 6.3585 6.3585 6.5540 6.5540 6.5832 6.5832 6.9340 6.9340 7.1259 7.1259 7.2467 7.2467 7.6284 7.6284 7.7329 7.7329 7.8195 7.8195 8.0029 8.0029 8.1453 8.1453 8.2351 8.2351 8.3161 8.3161 8.3788 8.3788 8.6082 8.6082 8.6258 8.6258 8.7346 8.7346 8.8057 8.8057 8.8156 8.8156 8.8294 8.8294 8.9511 8.9511 9.0135 9.0135 10.3521 10.3521 11.8076 11.8076 12.0244 12.0244 12.1973 12.1973 13.7420 13.7420 15.2662 15.2662 16.4617 16.4617 k = 0.0000 0.0000 0.0000 ( 3049 PWs) bands (ev): -2.1644 -2.1644 -0.2484 -0.2484 4.1905 4.1905 6.3583 6.3583 6.5547 6.5547 6.5838 6.5838 6.9336 6.9336 7.1287 7.1287 7.2465 7.2465 7.6288 7.6288 7.7333 7.7333 7.8215 7.8215 8.0030 8.0030 8.1502 8.1502 8.2408 8.2408 8.3082 8.3082 8.3788 8.3788 8.6089 8.6089 8.6267 8.6267 8.7348 8.7348 8.8079 8.8079 8.8167 8.8167 8.8288 8.8288 8.9581 8.9581 9.0065 9.0065 10.3425 10.3425 11.8734 11.8734 11.9879 11.9879 12.1665 12.1665 13.7433 13.7433 15.2627 15.2627 16.4632 16.4632 k = 0.0000 0.0000 0.0000 ( 3049 PWs) bands (ev): -2.1644 -2.1644 -0.2484 -0.2484 4.1905 4.1905 6.3583 6.3583 6.5547 6.5547 6.5838 6.5838 6.9336 6.9336 7.1287 7.1287 7.2465 7.2465 7.6288 7.6288 7.7333 7.7333 7.8215 7.8215 8.0030 8.0030 8.1502 8.1502 8.2408 8.2408 8.3082 8.3082 8.3788 8.3788 8.6089 8.6089 8.6267 8.6267 8.7348 8.7348 8.8079 8.8079 8.8167 8.8167 8.8288 8.8288 8.9581 8.9581 9.0065 9.0065 10.3425 10.3425 11.8734 11.8734 11.9879 11.9879 12.1665 12.1665 13.7433 13.7433 15.2627 15.2627 16.4632 16.4632 k = 0.0000 0.0000 0.0118 ( 3041 PWs) bands (ev): -2.1632 -2.1632 -0.2508 -0.2508 4.1925 4.1925 6.3574 6.3574 6.5548 6.5548 6.5839 6.5839 6.9337 6.9337 7.1291 7.1291 7.2477 7.2477 7.6292 7.6292 7.7337 7.7337 7.8217 7.8217 8.0025 8.0025 8.1492 8.1492 8.2399 8.2399 8.3072 8.3072 8.3797 8.3797 8.6090 8.6090 8.6262 8.6262 8.7152 8.7152 8.8068 8.8068 8.8173 8.8173 8.8379 8.8379 8.9732 8.9732 9.0068 9.0068 10.3406 10.3406 11.8767 11.8767 11.9854 11.9854 12.1636 12.1636 13.7454 13.7454 15.2634 15.2634 16.4662 16.4662 k = 0.0000 0.0000 0.0236 ( 3045 PWs) bands (ev): -2.1598 -2.1598 -0.2582 -0.2582 4.1986 4.1986 6.3545 6.3545 6.5550 6.5550 6.5839 6.5839 6.9338 6.9338 7.1305 7.1305 7.2512 7.2512 7.6301 7.6301 7.7347 7.7347 7.8225 7.8225 8.0007 8.0007 8.1462 8.1462 8.2370 8.2370 8.3042 8.3042 8.3821 8.3821 8.6095 8.6095 8.6248 8.6248 8.6790 8.6790 8.7858 8.7858 8.8108 8.8108 8.8787 8.8787 9.0077 9.0077 9.0085 9.0085 10.3352 10.3352 11.8867 11.8867 11.9780 11.9780 12.1550 12.1550 13.7520 13.7520 15.2656 15.2656 16.4750 16.4750 k = 0.0000 0.0000 0.0354 ( 3045 PWs) bands (ev): -2.1541 -2.1541 -0.2703 -0.2703 4.2086 4.2086 6.3494 6.3494 6.5554 6.5554 6.5840 6.5840 6.9340 6.9340 7.1328 7.1328 7.2573 7.2573 7.6316 7.6316 7.7364 7.7364 7.8237 7.8237 7.9980 7.9980 8.1413 8.1413 8.2322 8.2322 8.2998 8.2998 8.3858 8.3858 8.6101 8.6101 8.6222 8.6222 8.6408 8.6408 8.7542 8.7542 8.8117 8.8117 8.9239 8.9239 9.0101 9.0101 9.0525 9.0525 10.3263 10.3263 11.9023 11.9023 11.9664 11.9664 12.1408 12.1408 13.7628 13.7628 15.2691 15.2691 16.4896 16.4896 k = 0.0000 0.0000 0.0472 ( 3029 PWs) bands (ev): -2.1461 -2.1461 -0.2871 -0.2871 4.2225 4.2225 6.3420 6.3420 6.5559 6.5559 6.5842 6.5842 6.9343 6.9343 7.1360 7.1360 7.2661 7.2661 7.6341 7.6341 7.7391 7.7391 7.8255 7.8255 7.9943 7.9943 8.1344 8.1344 8.2255 8.2255 8.2941 8.2941 8.3904 8.3904 8.6009 8.6009 8.6136 8.6136 8.6176 8.6176 8.7232 8.7232 8.8134 8.8134 8.9665 8.9665 9.0182 9.0182 9.1011 9.1011 10.3143 10.3143 11.9190 11.9190 11.9548 11.9548 12.1211 12.1211 13.7779 13.7779 15.2741 15.2741 16.5098 16.5098 k = 0.0000 0.0000 0.0590 ( 3033 PWs) bands (ev): -2.1358 -2.1358 -0.3085 -0.3085 4.2401 4.2401 6.3316 6.3316 6.5565 6.5565 6.5844 6.5844 6.9347 6.9347 7.1401 7.1401 7.2780 7.2780 7.6372 7.6372 7.7423 7.7423 7.8276 7.8276 7.9895 7.9895 8.1257 8.1257 8.2170 8.2170 8.2877 8.2877 8.3953 8.3953 8.5654 8.5654 8.6099 8.6099 8.6141 8.6141 8.6960 8.6960 8.8156 8.8156 8.9903 8.9903 9.0471 9.0471 9.1528 9.1528 10.2992 10.2992 11.9141 11.9141 11.9656 11.9656 12.0960 12.0960 13.7972 13.7972 15.2804 15.2804 16.5354 16.5354 k = 0.0000 0.0000 0.0708 ( 3025 PWs) bands (ev): -2.1232 -2.1232 -0.3341 -0.3341 4.2614 4.2614 6.3180 6.3180 6.5573 6.5573 6.5847 6.5847 6.9352 6.9352 7.1449 7.1449 7.2932 7.2932 7.6409 7.6409 7.7462 7.7462 7.8303 7.8303 7.9838 7.9838 8.1153 8.1153 8.2069 8.2069 8.2808 8.2808 8.4005 8.4005 8.5306 8.5306 8.5972 8.5972 8.6163 8.6163 8.6749 8.6749 8.8182 8.8182 8.9968 8.9968 9.0953 9.0953 9.2069 9.2069 10.2816 10.2816 11.8897 11.8897 11.9962 11.9962 12.0660 12.0660 13.8206 13.8206 15.2883 15.2883 16.5660 16.5660 k = 0.0000 0.0000 0.0826 ( 3044 PWs) bands (ev): -2.1085 -2.1085 -0.3637 -0.3637 4.2860 4.2860 6.3007 6.3007 6.5581 6.5581 6.5850 6.5850 6.9356 6.9356 7.1506 7.1506 7.3121 7.3121 7.6448 7.6448 7.7501 7.7501 7.8337 7.8337 7.9770 7.9770 8.1034 8.1034 8.1952 8.1952 8.2735 8.2735 8.4054 8.4054 8.4974 8.4974 8.5789 8.5789 8.6191 8.6191 8.6609 8.6609 8.8211 8.8211 8.9989 8.9989 9.1492 9.1492 9.2628 9.2628 10.2618 10.2618 11.8583 11.8583 12.0311 12.0311 12.0336 12.0336 13.8479 13.8479 15.2975 15.2975 16.6012 16.6012 k = 0.0000 0.0000 0.0944 ( 3036 PWs) bands (ev): -2.0915 -2.0915 -0.3972 -0.3972 4.3139 4.3139 6.2798 6.2798 6.5591 6.5591 6.5856 6.5856 6.9362 6.9362 7.1571 7.1571 7.3347 7.3347 7.6496 7.6496 7.7549 7.7549 7.8376 7.8376 7.9698 7.9698 8.0901 8.0901 8.1823 8.1823 8.2662 8.2662 8.4104 8.4104 8.4659 8.4659 8.5570 8.5570 8.6230 8.6230 8.6523 8.6523 8.8244 8.8244 8.9999 8.9999 9.2058 9.2058 9.3204 9.3204 10.2400 10.2400 11.8221 11.8221 11.9917 11.9917 12.0754 12.0754 13.8787 13.8787 15.3082 15.3082 16.6404 16.6404 k = 0.0000 0.0000 0.1062 ( 3036 PWs) bands (ev): -2.0723 -2.0723 -0.4341 -0.4341 4.3447 4.3447 6.2546 6.2546 6.5602 6.5602 6.5862 6.5862 6.9368 6.9368 7.1644 7.1644 7.3609 7.3609 7.6550 7.6550 7.7600 7.7600 7.8422 7.8422 7.9620 7.9620 8.0757 8.0757 8.1682 8.1682 8.2588 8.2588 8.4150 8.4150 8.4360 8.4360 8.5337 8.5337 8.6279 8.6279 8.6470 8.6470 8.8278 8.8278 9.0005 9.0005 9.2640 9.2640 9.3796 9.3796 10.2165 10.2165 11.7818 11.7818 11.9482 11.9482 12.1205 12.1205 13.9126 13.9126 15.3203 15.3203 16.6821 16.6821 k = 0.0000 0.0000 0.1181 ( 3032 PWs) bands (ev): -2.0509 -2.0509 -0.4741 -0.4741 4.3784 4.3784 6.2255 6.2255 6.5613 6.5613 6.5869 6.5869 6.9375 6.9375 7.1723 7.1723 7.3905 7.3905 7.6608 7.6608 7.7652 7.7652 7.8475 7.8475 7.9539 7.9539 8.0605 8.0605 8.1534 8.1534 8.2514 8.2514 8.4075 8.4075 8.4188 8.4188 8.5108 8.5108 8.6341 8.6341 8.6433 8.6433 8.8314 8.8314 9.0009 9.0009 9.3236 9.3236 9.4401 9.4401 10.1915 10.1915 11.7376 11.7376 11.9008 11.9008 12.1684 12.1684 13.9492 13.9492 15.3339 15.3339 16.5964 16.5964 k = 0.0000 0.0000 0.1299 ( 3032 PWs) bands (ev): -2.0274 -2.0274 -0.5170 -0.5170 4.4147 4.4147 6.1923 6.1923 6.5625 6.5625 6.5878 6.5878 6.9382 6.9382 7.1809 7.1809 7.4231 7.4231 7.6670 7.6670 7.7702 7.7702 7.8536 7.8536 7.9458 7.9458 8.0446 8.0446 8.1381 8.1381 8.2442 8.2442 8.3804 8.3804 8.4211 8.4211 8.4895 8.4895 8.6407 8.6407 8.6417 8.6417 8.8350 8.8350 9.0012 9.0012 9.3844 9.3844 9.5019 9.5019 10.1651 10.1651 11.6901 11.6901 11.8500 11.8500 12.2185 12.2185 13.9875 13.9875 15.3489 15.3489 16.3922 16.3922 k = 0.0000 0.0000 0.1417 ( 3040 PWs) bands (ev): -2.0018 -2.0018 -0.5624 -0.5624 4.4533 4.4533 6.1553 6.1553 6.5637 6.5637 6.5886 6.5886 6.9389 6.9389 7.1900 7.1900 7.4581 7.4581 7.6734 7.6734 7.7747 7.7747 7.8604 7.8604 7.9379 7.9379 8.0285 8.0285 8.1227 8.1227 8.2369 8.2369 8.3545 8.3545 8.4202 8.4202 8.4718 8.4718 8.6386 8.6386 8.6510 8.6510 8.8387 8.8387 9.0012 9.0012 9.4461 9.4461 9.5648 9.5648 10.1377 10.1377 11.6394 11.6394 11.7960 11.7960 12.2704 12.2704 14.0264 14.0264 15.3654 15.3654 16.1956 16.1956 k = 0.0000 0.0000 0.1535 ( 3040 PWs) bands (ev): -1.9742 -1.9742 -0.6100 -0.6100 4.4941 4.4941 6.1148 6.1148 6.5650 6.5650 6.5897 6.5897 6.9397 6.9397 7.1996 7.1996 7.4948 7.4948 7.6801 7.6801 7.7785 7.7785 7.8682 7.8682 7.9307 7.9307 8.0125 8.0125 8.1076 8.1076 8.2299 8.2299 8.3296 8.3296 8.4132 8.4132 8.4608 8.4608 8.6369 8.6369 8.6623 8.6623 8.8423 8.8423 9.0014 9.0014 9.5087 9.5087 9.6288 9.6288 10.1091 10.1091 11.5860 11.5860 11.7392 11.7392 12.3239 12.3239 14.0645 14.0645 15.3834 15.3834 16.0081 16.0081 k = 0.0000 0.0000 0.1653 ( 3016 PWs) bands (ev): -1.9445 -1.9445 -0.6594 -0.6594 4.5368 4.5368 6.0711 6.0711 6.5666 6.5666 6.5912 6.5912 6.9405 6.9405 7.2098 7.2098 7.5325 7.5325 7.6870 7.6870 7.7811 7.7811 7.8770 7.8770 7.9245 7.9245 7.9969 7.9969 8.0932 8.0932 8.2231 8.2231 8.3058 8.3058 8.3995 8.3995 8.4572 8.4572 8.6355 8.6355 8.6759 8.6759 8.8460 8.8460 9.0016 9.0016 9.5719 9.5719 9.6936 9.6936 10.0797 10.0797 11.5303 11.5303 11.6801 11.6801 12.3788 12.3788 14.0997 14.0997 15.4028 15.4028 15.8317 15.8317 k = 0.0000 0.0000 0.1771 ( 3016 PWs) bands (ev): -1.9129 -1.9129 -0.7104 -0.7104 4.5812 4.5812 6.0247 6.0247 6.5679 6.5679 6.5925 6.5925 6.9413 6.9413 7.2201 7.2201 7.5699 7.5699 7.6938 7.6938 7.7819 7.7819 7.8866 7.8866 7.9196 7.9196 7.9818 7.9818 8.0798 8.0798 8.2164 8.2164 8.2826 8.2826 8.3822 8.3822 8.4575 8.4575 8.6343 8.6343 8.6920 8.6920 8.8495 8.8495 9.0018 9.0018 9.6353 9.6353 9.7591 9.7591 10.0496 10.0496 11.4726 11.4726 11.6190 11.6190 12.4350 12.4350 14.1295 14.1295 15.4237 15.4237 15.6689 15.6689 k = 0.0000 0.0000 0.1889 ( 3024 PWs) bands (ev): -1.8795 -1.8795 -0.7626 -0.7626 4.6271 4.6271 5.9759 5.9759 6.5691 6.5691 6.5936 6.5936 6.9420 6.9420 7.2306 7.2306 7.6061 7.6061 7.7008 7.7008 7.7807 7.7807 7.8972 7.8972 7.9163 7.9163 7.9676 7.9676 8.0678 8.0678 8.2099 8.2099 8.2601 8.2601 8.3637 8.3637 8.4593 8.4593 8.6333 8.6333 8.7107 8.7107 8.8528 8.8528 9.0019 9.0019 9.6986 9.6986 9.8252 9.8252 10.0190 10.0190 11.4132 11.4132 11.5562 11.5562 12.4925 12.4925 14.1502 14.1502 15.4460 15.4460 15.5228 15.5228 k = 0.0000 0.0000 0.2007 ( 3032 PWs) bands (ev): -1.8442 -1.8442 -0.8158 -0.8158 4.6743 4.6743 5.9253 5.9253 6.5703 6.5703 6.5948 6.5948 6.9427 6.9427 7.2412 7.2412 7.6396 7.6396 7.7085 7.7085 7.7775 7.7775 7.9088 7.9088 7.9143 7.9143 7.9545 7.9545 8.0578 8.0578 8.2034 8.2034 8.2382 8.2382 8.3452 8.3452 8.4617 8.4617 8.6325 8.6325 8.7322 8.7322 8.8559 8.8559 9.0021 9.0021 9.7607 9.7607 9.8915 9.8915 9.9889 9.9889 11.3526 11.3526 11.4921 11.4921 12.5514 12.5514 14.1580 14.1580 15.3970 15.3970 15.4698 15.4698 k = 0.0000 0.0000 0.2125 ( 3032 PWs) bands (ev): -1.8073 -1.8073 -0.8695 -0.8695 4.7224 4.7224 5.8733 5.8733 6.5715 6.5715 6.5960 6.5960 6.9434 6.9434 7.2517 7.2517 7.6682 7.6682 7.7182 7.7182 7.7725 7.7725 7.9135 7.9135 7.9213 7.9213 7.9428 7.9428 8.0502 8.0502 8.1969 8.1969 8.2169 8.2169 8.3271 8.3271 8.4643 8.4643 8.6317 8.6317 8.7564 8.7564 8.8589 8.8589 9.0024 9.0024 9.8191 9.8191 9.9579 9.9579 9.9618 9.9618 11.2912 11.2912 11.4273 11.4273 12.6117 12.6117 14.1485 14.1485 15.2952 15.2952 15.4948 15.4948 k = 0.0000 0.0000 0.2243 ( 3032 PWs) bands (ev): -1.7688 -1.7688 -0.9235 -0.9235 4.7711 4.7711 5.8205 5.8205 6.5726 6.5726 6.5972 6.5972 6.9440 6.9440 7.2620 7.2620 7.6886 7.6886 7.7327 7.7327 7.7662 7.7662 7.9130 7.9130 7.9321 7.9321 7.9349 7.9349 8.0456 8.0456 8.1903 8.1903 8.1961 8.1961 8.3098 8.3098 8.4667 8.4667 8.6311 8.6311 8.7830 8.7830 8.8616 8.8616 9.0027 9.0027 9.8612 9.8612 9.9502 9.9502 10.0240 10.0240 11.2297 11.2297 11.3622 11.3622 12.6736 12.6736 14.1188 14.1188 15.2198 15.2198 15.5212 15.5212 k = 0.0000 0.0000 0.2361 ( 3024 PWs) bands (ev): -1.7289 -1.7289 -0.9775 -0.9775 4.8201 4.8201 5.7676 5.7676 6.5737 6.5737 6.5984 6.5984 6.9448 6.9448 7.2719 7.2719 7.7002 7.7002 7.7521 7.7521 7.7591 7.7591 7.9125 7.9125 7.9238 7.9238 7.9483 7.9483 8.0442 8.0442 8.1757 8.1757 8.1835 8.1835 8.2936 8.2936 8.4690 8.4690 8.6306 8.6306 8.8115 8.8115 8.8640 8.8640 9.0031 9.0031 9.8605 9.8605 9.9805 9.9805 10.0892 10.0892 11.1685 11.1685 11.2975 11.2975 12.7369 12.7369 14.0690 14.0690 15.1702 15.1702 15.5486 15.5486 k = 0.0000 0.0000 0.2479 ( 3024 PWs) bands (ev): -1.6880 -1.6880 -1.0310 -1.0310 4.8687 4.8687 5.7151 5.7151 6.5747 6.5747 6.5994 6.5994 6.9454 6.9454 7.2811 7.2811 7.7064 7.7064 7.7516 7.7516 7.7724 7.7724 7.9114 7.9114 7.9169 7.9169 7.9621 7.9621 8.0460 8.0460 8.1561 8.1561 8.1760 8.1760 8.2788 8.2788 8.4710 8.4710 8.6301 8.6301 8.8409 8.8409 8.8662 8.8662 9.0037 9.0037 9.8364 9.8364 10.0331 10.0331 10.1530 10.1530 11.1087 11.1087 11.2340 11.2340 12.8016 12.8016 14.0023 14.0023 15.1428 15.1428 15.5769 15.5769 k = 0.0000 0.0000 0.2597 ( 3032 PWs) bands (ev): -1.6463 -1.6463 -1.0835 -1.0835 4.9161 4.9161 5.6641 5.6641 6.5755 6.5755 6.6003 6.6003 6.9458 6.9458 7.2893 7.2893 7.7101 7.7101 7.7444 7.7444 7.7909 7.7909 7.9098 7.9098 7.9116 7.9116 7.9760 7.9760 8.0508 8.0508 8.1371 8.1371 8.1678 8.1678 8.2658 8.2658 8.4727 8.4727 8.6298 8.6298 8.8679 8.8679 8.8698 8.8698 9.0046 9.0046 9.8084 9.8084 10.0883 10.0883 10.2142 10.2142 11.0513 11.0513 11.1727 11.1727 12.8671 12.8671 13.9245 13.9245 15.1316 15.1316 15.6058 15.6058 k = 0.0000 0.0000 0.2715 ( 3032 PWs) bands (ev): -1.6045 -1.6045 -1.1343 -1.1343 4.9611 4.9611 5.6160 5.6160 6.5762 6.5762 6.6011 6.6011 6.9462 6.9462 7.2966 7.2966 7.7124 7.7124 7.7378 7.7378 7.8065 7.8065 7.9079 7.9079 7.9079 7.9079 7.9896 7.9896 8.0580 8.0580 8.1189 8.1189 8.1587 8.1587 8.2550 8.2550 8.4742 8.4742 8.6295 8.6295 8.8694 8.8694 8.8970 8.8970 9.0058 9.0058 9.7814 9.7814 10.1409 10.1409 10.2715 10.2715 10.9978 10.9978 11.1153 11.1153 12.9325 12.9325 13.8419 13.8419 15.1307 15.1307 15.6345 15.6345 k = 0.0000 0.0000 0.2833 ( 3032 PWs) bands (ev): -1.5638 -1.5638 -1.1821 -1.1821 5.0018 5.0018 5.5728 5.5728 6.5768 6.5768 6.6017 6.6017 6.9465 6.9465 7.3025 7.3025 7.7138 7.7138 7.7322 7.7322 7.8186 7.8186 7.9058 7.9058 7.9059 7.9059 8.0028 8.0028 8.0669 8.0669 8.1016 8.1016 8.1488 8.1488 8.2466 8.2466 8.4753 8.4753 8.6293 8.6293 8.8706 8.8706 8.9203 8.9203 9.0075 9.0075 9.7576 9.7576 10.1877 10.1877 10.3225 10.3225 10.9506 10.9506 11.0641 11.0641 12.9953 12.9953 13.7614 13.7614 15.1350 15.1350 15.6620 15.6620 k = 0.0000 0.0000 0.2951 ( 3032 PWs) bands (ev): -1.5267 -1.5267 -1.2244 -1.2244 5.0356 5.0356 5.5372 5.5372 6.5772 6.5772 6.6022 6.6022 6.9467 6.9467 7.3070 7.3070 7.7146 7.7146 7.7280 7.7280 7.8271 7.8271 7.9044 7.9044 7.9048 7.9048 8.0155 8.0155 8.0767 8.0767 8.0859 8.0859 8.1385 8.1385 8.2407 8.2407 8.4761 8.4761 8.6291 8.6291 8.8715 8.8715 8.9379 8.9379 9.0097 9.0097 9.7390 9.7390 10.2255 10.2255 10.3640 10.3640 10.9126 10.9126 11.0224 11.0224 13.0513 13.0513 13.6907 13.6907 15.1406 15.1406 15.6861 15.6861 k = 0.0000 0.0000 0.3069 ( 3024 PWs) bands (ev): -1.4981 -1.4981 -1.2561 -1.2561 5.0585 5.0585 5.5132 5.5132 6.5775 6.5775 6.6025 6.6025 6.9469 6.9469 7.3097 7.3097 7.7150 7.7150 7.7254 7.7254 7.8322 7.8322 7.9034 7.9034 7.9045 7.9045 8.0266 8.0266 8.0727 8.0727 8.0855 8.0855 8.1294 8.1294 8.2372 8.2372 8.4767 8.4767 8.6290 8.6290 8.8720 8.8720 8.9486 8.9486 9.0118 9.0118 9.7270 9.7270 10.2505 10.2505 10.3918 10.3918 10.8875 10.8875 10.9945 10.9945 13.0924 13.0924 13.6400 13.6400 15.1449 15.1449 15.7035 15.7035 k = 0.0000 0.0000 0.3187 ( 3024 PWs) bands (ev): -1.4867 -1.4867 -1.2685 -1.2685 5.0667 5.0667 5.5046 5.5046 6.5776 6.5776 6.6026 6.6026 6.9469 6.9469 7.3106 7.3106 7.7151 7.7151 7.7245 7.7245 7.8338 7.8338 7.9030 7.9030 7.9045 7.9045 8.0320 8.0320 8.0666 8.0666 8.0897 8.0897 8.1252 8.1252 8.2360 8.2360 8.4768 8.4768 8.6290 8.6290 8.8722 8.8722 8.9522 8.9522 9.0127 9.0127 9.7229 9.7229 10.2594 10.2594 10.4017 10.4017 10.8787 10.8787 10.9846 10.9846 13.1081 13.1081 13.6210 13.6210 15.1465 15.1465 15.7101 15.7101 k = 0.0000 0.0000 0.3187 ( 3024 PWs) bands (ev): -1.4867 -1.4867 -1.2685 -1.2685 5.0667 5.0667 5.5046 5.5046 6.5776 6.5776 6.6026 6.6026 6.9469 6.9469 7.3106 7.3106 7.7151 7.7151 7.7245 7.7245 7.8338 7.8338 7.9030 7.9030 7.9045 7.9045 8.0320 8.0320 8.0666 8.0666 8.0897 8.0897 8.1252 8.1252 8.2360 8.2360 8.4768 8.4768 8.6290 8.6290 8.8722 8.8722 8.9522 8.9522 9.0127 9.0127 9.7229 9.7229 10.2594 10.2594 10.4017 10.4017 10.8787 10.8787 10.9846 10.9846 13.1081 13.1081 13.6210 13.6210 15.1465 15.1465 15.7101 15.7101 k = 0.0000 0.0119 0.3187 ( 3024 PWs) bands (ev): -1.4856 -1.4856 -1.2675 -1.2675 5.0665 5.0665 5.5044 5.5044 6.5769 6.5769 6.6019 6.6019 6.9471 6.9471 7.3084 7.3084 7.7136 7.7136 7.7238 7.7238 7.8303 7.8303 7.8986 7.8986 7.9093 7.9093 8.0250 8.0250 8.0577 8.0577 8.1001 8.1001 8.1256 8.1256 8.2406 8.2406 8.4776 8.4776 8.6289 8.6289 8.8720 8.8720 8.9555 8.9555 9.0127 9.0127 9.7204 9.7204 10.2564 10.2564 10.3990 10.3990 10.8804 10.8804 10.9861 10.9861 13.1174 13.1174 13.6247 13.6247 15.1441 15.1441 15.7132 15.7132 k = 0.0000 0.0238 0.3187 ( 3028 PWs) bands (ev): -1.4826 -1.4826 -1.2645 -1.2645 5.0661 5.0661 5.5039 5.5039 6.5745 6.5745 6.5999 6.5999 6.9478 6.9478 7.3017 7.3017 7.7074 7.7074 7.7228 7.7228 7.8211 7.8211 7.8935 7.8935 7.9144 7.9144 8.0076 8.0076 8.0434 8.0434 8.1134 8.1134 8.1301 8.1301 8.2531 8.2531 8.4798 8.4798 8.6284 8.6284 8.8715 8.8715 8.9648 8.9648 9.0132 9.0132 9.7130 9.7130 10.2456 10.2456 10.3932 10.3932 10.8855 10.8855 10.9903 10.9903 13.1448 13.1448 13.6359 13.6359 15.1367 15.1367 15.7225 15.7225 k = 0.0000 0.0357 0.3187 ( 3028 PWs) bands (ev): -1.4776 -1.4776 -1.2594 -1.2594 5.0652 5.0652 5.5031 5.5031 6.5698 6.5698 6.5974 6.5974 6.9490 6.9490 7.2903 7.2903 7.6950 7.6950 7.7225 7.7225 7.8091 7.8091 7.8873 7.8873 7.9184 7.9184 7.9859 7.9859 8.0279 8.0279 8.1163 8.1163 8.1448 8.1448 8.2707 8.2707 8.4836 8.4836 8.6278 8.6278 8.8705 8.8705 8.9766 8.9766 9.0174 9.0174 9.7009 9.7009 10.2222 10.2222 10.3906 10.3906 10.8940 10.8940 10.9973 10.9973 13.1888 13.1888 13.6541 13.6541 15.1244 15.1244 15.7377 15.7377 k = 0.0000 0.0476 0.3187 ( 3032 PWs) bands (ev): -1.4706 -1.4706 -1.2524 -1.2524 5.0638 5.0638 5.5019 5.5019 6.5620 6.5620 6.5950 6.5950 6.9504 6.9504 7.2743 7.2743 7.6761 7.6761 7.7225 7.7225 7.7964 7.7964 7.8790 7.8790 7.9203 7.9203 7.9641 7.9641 8.0120 8.0120 8.1151 8.1151 8.1625 8.1625 8.2912 8.2912 8.4886 8.4886 8.6271 8.6271 8.8691 8.8691 8.9834 8.9834 9.0321 9.0321 9.6847 9.6847 10.1833 10.1833 10.3960 10.3960 10.9055 10.9055 11.0069 11.0069 13.2469 13.2469 13.6790 13.6790 15.1072 15.1072 15.7581 15.7581 k = 0.0000 0.0595 0.3187 ( 3028 PWs) bands (ev): -1.4616 -1.4616 -1.2433 -1.2433 5.0617 5.0617 5.5000 5.5000 6.5507 6.5507 6.5933 6.5933 6.9525 6.9525 7.2534 7.2534 7.6514 7.6514 7.7223 7.7223 7.7842 7.7842 7.8676 7.8676 7.9191 7.9191 7.9454 7.9454 7.9970 7.9970 8.1127 8.1127 8.1798 8.1798 8.3131 8.3131 8.4951 8.4951 8.6264 8.6264 8.8672 8.8672 8.9829 8.9829 9.0592 9.0592 9.6648 9.6648 10.1305 10.1305 10.4103 10.4103 10.9198 10.9198 11.0190 11.0190 13.3163 13.3163 13.7098 13.7098 15.0852 15.0852 15.7829 15.7829 k = 0.0000 0.0714 0.3187 ( 3034 PWs) bands (ev): -1.4506 -1.4506 -1.2324 -1.2324 5.0588 5.0588 5.4974 5.4974 6.5359 6.5359 6.5921 6.5921 6.9549 6.9549 7.2277 7.2277 7.6222 7.6222 7.7210 7.7210 7.7720 7.7720 7.8531 7.8531 7.9130 7.9130 7.9329 7.9329 7.9840 7.9840 8.1098 8.1098 8.1956 8.1956 8.3350 8.3350 8.5025 8.5025 8.6257 8.6257 8.8647 8.8647 8.9783 8.9783 9.0945 9.0945 9.6419 9.6419 10.0674 10.0674 10.4321 10.4321 10.9366 10.9366 11.0333 11.0333 13.3940 13.3940 13.7459 13.7459 15.0583 15.0583 15.8101 15.8101 k = 0.0000 0.0833 0.3187 ( 3038 PWs) bands (ev): -1.4377 -1.4377 -1.2194 -1.2194 5.0547 5.0547 5.4938 5.4938 6.5178 6.5178 6.5912 6.5912 6.9579 6.9579 7.1971 7.1971 7.5899 7.5899 7.7169 7.7169 7.7598 7.7598 7.8372 7.8372 7.9029 7.9029 7.9260 7.9260 7.9735 7.9735 8.1065 8.1065 8.2098 8.2098 8.3566 8.3566 8.5110 8.5110 8.6252 8.6252 8.8619 8.8619 8.9718 8.9718 9.1355 9.1355 9.6164 9.6164 9.9974 9.9974 10.4603 10.4603 10.9558 10.9558 11.0497 11.0497 13.4770 13.4770 13.7864 13.7864 15.0266 15.0266 15.8371 15.8371 k = 0.0000 0.0952 0.3187 ( 3038 PWs) bands (ev): -1.4228 -1.4228 -1.2046 -1.2046 5.0492 5.0492 5.4889 5.4889 6.4967 6.4967 6.5906 6.5906 6.9613 6.9613 7.1620 7.1620 7.5562 7.5562 7.7067 7.7067 7.7495 7.7495 7.8225 7.8225 7.8922 7.8922 7.9210 7.9210 7.9656 7.9656 8.1031 8.1031 8.2223 8.2223 8.3774 8.3774 8.5202 8.5202 8.6248 8.6248 8.8585 8.8585 8.9639 8.9639 9.1808 9.1808 9.5890 9.5890 9.9234 9.9234 10.4941 10.4941 10.9768 10.9768 11.0682 11.0682 13.5626 13.5626 13.8305 13.8305 14.9902 14.9902 15.8594 15.8594 k = 0.0000 0.1071 0.3187 ( 3034 PWs) bands (ev): -1.4061 -1.4061 -1.1880 -1.1880 5.0419 5.0419 5.4824 5.4824 6.4730 6.4730 6.5902 6.5902 6.9651 6.9651 7.1228 7.1228 7.5221 7.5221 7.6874 7.6874 7.7430 7.7430 7.8105 7.8105 7.8821 7.8821 7.9163 7.9163 7.9599 7.9599 8.0997 8.0997 8.2329 8.2329 8.3970 8.3970 8.5301 8.5301 8.6246 8.6246 8.8546 8.8546 8.9552 8.9552 9.2297 9.2297 9.5602 9.5602 9.8479 9.8479 10.5328 10.5328 10.9995 10.9995 11.0889 11.0889 13.6483 13.6483 13.8771 13.8771 14.9491 14.9491 15.8713 15.8713 k = 0.0000 0.1190 0.3187 ( 3040 PWs) bands (ev): -1.3875 -1.3875 -1.1695 -1.1695 5.0323 5.0323 5.4739 5.4739 6.4469 6.4469 6.5899 6.5899 6.9694 6.9694 7.0801 7.0801 7.4887 7.4887 7.6607 7.6607 7.7393 7.7393 7.8010 7.8010 7.8727 7.8727 7.9120 7.9120 7.9560 7.9560 8.0964 8.0964 8.2417 8.2417 8.4152 8.4152 8.5404 8.5404 8.6246 8.6246 8.8501 8.8501 8.9456 8.9456 9.2813 9.2813 9.5303 9.5303 9.7728 9.7728 10.5761 10.5761 11.0232 11.0232 11.1119 11.1119 13.7318 13.7318 13.9256 13.9256 14.9037 14.9037 15.8665 15.8665 k = 0.0000 0.1310 0.3187 ( 3032 PWs) bands (ev): -1.3671 -1.3671 -1.1493 -1.1493 5.0200 5.0200 5.4631 5.4631 6.4193 6.4193 6.5896 6.5896 6.9732 6.9732 7.0353 7.0353 7.4566 7.4566 7.6298 7.6298 7.7364 7.7364 7.7935 7.7935 7.8641 7.8641 7.9083 7.9083 7.9535 7.9535 8.0934 8.0934 8.2485 8.2485 8.4319 8.4319 8.5511 8.5511 8.6247 8.6247 8.8452 8.8452 8.9357 8.9357 9.3345 9.3345 9.4997 9.4997 9.7002 9.7002 10.6236 10.6236 11.0475 11.0475 11.1377 11.1377 13.8115 13.8115 13.9750 13.9750 14.8540 14.8540 15.8404 15.8404 k = 0.0000 0.1429 0.3187 ( 3038 PWs) bands (ev): -1.3449 -1.3449 -1.1274 -1.1274 5.0046 5.0046 5.4493 5.4493 6.3907 6.3907 6.5894 6.5894 6.9702 6.9702 6.9957 6.9957 7.4266 7.4266 7.5963 7.5963 7.7331 7.7331 7.7868 7.7868 7.8563 7.8563 7.9052 7.9052 7.9522 7.9522 8.0907 8.0907 8.2536 8.2536 8.4468 8.4468 8.5619 8.5619 8.6249 8.6249 8.8396 8.8396 8.9254 8.9254 9.3871 9.3871 9.4688 9.4688 9.6331 9.6331 10.6750 10.6750 11.0719 11.0719 11.1664 11.1664 13.8859 13.8859 14.0245 14.0245 14.8006 14.8006 15.7922 15.7922 k = 0.0000 0.1548 0.3187 ( 3030 PWs) bands (ev): -1.3210 -1.3210 -1.1038 -1.1038 4.9854 4.9854 5.4319 5.4319 6.3617 6.3617 6.5894 6.5894 6.9325 6.9325 6.9905 6.9905 7.3988 7.3988 7.5614 7.5614 7.7290 7.7290 7.7804 7.7804 7.8493 7.8493 7.9030 7.9030 7.9522 7.9522 8.0887 8.0887 8.2569 8.2569 8.4603 8.4603 8.5729 8.5729 8.6252 8.6252 8.8335 8.8335 8.9152 8.9152 9.4240 9.4240 9.4458 9.4458 9.5791 9.5791 10.7301 10.7301 11.0960 11.0960 11.1986 11.1986 13.9538 13.9538 14.0731 14.0731 14.7441 14.7441 15.7251 15.7251 k = 0.0000 0.1667 0.3187 ( 3030 PWs) bands (ev): -1.2954 -1.2954 -1.0787 -1.0787 4.9620 4.9620 5.4105 5.4105 6.3334 6.3334 6.5894 6.5894 6.8848 6.8848 6.9957 6.9957 7.3735 7.3735 7.5257 7.5257 7.7237 7.7237 7.7739 7.7739 7.8430 7.8430 7.9017 7.9017 7.9536 7.9536 8.0871 8.0871 8.2585 8.2585 8.4718 8.4718 8.5839 8.5839 8.6257 8.6257 8.8267 8.8267 8.9050 8.9050 9.3982 9.3982 9.4487 9.4487 9.5676 9.5676 10.7886 10.7886 11.1196 11.1196 11.2341 11.2341 14.0140 14.0140 14.1197 14.1197 14.6854 14.6854 15.6442 15.6442 k = 0.0000 0.1786 0.3187 ( 3028 PWs) bands (ev): -1.2682 -1.2682 -1.0522 -1.0522 4.9340 4.9340 5.3845 5.3845 6.3065 6.3065 6.5894 6.5894 6.8374 6.8374 7.0024 7.0024 7.3509 7.3509 7.4896 7.4896 7.7171 7.7171 7.7669 7.7669 7.8376 7.8376 7.9013 7.9013 7.9563 7.9563 8.0861 8.0861 8.2585 8.2585 8.4814 8.4814 8.5947 8.5947 8.6263 8.6263 8.8192 8.8192 8.8950 8.8950 9.3610 9.3610 9.4164 9.4164 9.6093 9.6093 10.8503 10.8503 11.1428 11.1428 11.2729 11.2729 14.0657 14.0657 14.1624 14.1624 14.6265 14.6265 15.5552 15.5552 k = 0.0000 0.1905 0.3187 ( 3032 PWs) bands (ev): -1.2395 -1.2395 -1.0243 -1.0243 4.9011 4.9011 5.3533 5.3533 6.2821 6.2821 6.5895 6.5895 6.7918 6.7918 7.0098 7.0098 7.3308 7.3308 7.4534 7.4534 7.7089 7.7089 7.7590 7.7590 7.8329 7.8329 7.9015 7.9015 7.9604 7.9604 8.0858 8.0858 8.2569 8.2569 8.4890 8.4890 8.6054 8.6054 8.6270 8.6270 8.8109 8.8109 8.8854 8.8854 9.3188 9.3188 9.3781 9.3781 9.6682 9.6682 10.9149 10.9149 11.1657 11.1657 11.3149 11.3149 14.1076 14.1076 14.1975 14.1975 14.5710 14.5710 15.4629 15.4629 k = 0.0000 0.2024 0.3187 ( 3030 PWs) bands (ev): -1.2093 -1.2093 -0.9951 -0.9951 4.8631 4.8631 5.3165 5.3165 6.2606 6.2606 6.5896 6.5896 6.7493 6.7493 7.0178 7.0178 7.3133 7.3133 7.4173 7.4173 7.6991 7.6991 7.7502 7.7502 7.8294 7.8294 7.9025 7.9025 7.9659 7.9659 8.0862 8.0862 8.2541 8.2541 8.4947 8.4947 8.6157 8.6157 8.6278 8.6278 8.8019 8.8019 8.8765 8.8765 9.2740 9.2740 9.3435 9.3435 9.7327 9.7327 10.9822 10.9822 11.1885 11.1885 11.3598 11.3598 14.1385 14.1385 14.2179 14.2179 14.5265 14.5265 15.3720 15.3720 k = 0.0000 0.2143 0.3187 ( 3034 PWs) bands (ev): -1.1778 -1.1778 -0.9649 -0.9649 4.8200 4.8200 5.2737 5.2737 6.2428 6.2428 6.5896 6.5896 6.7108 6.7108 7.0264 7.0264 7.2979 7.2979 7.3814 7.3814 7.6878 7.6878 7.7406 7.7406 7.8269 7.8269 7.9039 7.9039 7.9727 7.9727 8.0874 8.0874 8.2501 8.2501 8.4984 8.4984 8.6249 8.6249 8.6293 8.6293 8.7922 8.7922 8.8680 8.8680 9.2297 9.2297 9.3122 9.3122 9.8000 9.8000 11.0519 11.0519 11.2114 11.2114 11.4074 11.4074 14.1564 14.1564 14.2127 14.2127 14.5041 14.5041 15.2865 15.2865 k = 0.0000 0.2262 0.3187 ( 3034 PWs) bands (ev): -1.1449 -1.1449 -0.9336 -0.9336 4.7721 4.7721 5.2250 5.2250 6.2290 6.2290 6.5895 6.5895 6.6769 6.6769 7.0356 7.0356 7.2850 7.2850 7.3458 7.3458 7.6751 7.6751 7.7302 7.7302 7.8250 7.8250 7.9058 7.9058 7.9807 7.9807 8.0894 8.0894 8.2450 8.2450 8.5002 8.5002 8.6282 8.6282 8.6363 8.6363 8.7818 8.7818 8.8601 8.8601 9.1879 9.1879 9.2831 9.2831 9.8692 9.8692 11.1238 11.1238 11.2345 11.2345 11.4575 11.4575 14.1570 14.1570 14.1792 14.1792 14.5095 14.5095 15.2102 15.2102 k = 0.0000 0.2381 0.3187 ( 3034 PWs) bands (ev): -1.1109 -1.1109 -0.9014 -0.9014 4.7197 4.7197 5.1703 5.1703 6.2194 6.2194 6.5888 6.5888 6.6486 6.6486 7.0451 7.0451 7.2741 7.2741 7.3109 7.3109 7.6611 7.6611 7.7192 7.7192 7.8237 7.8237 7.9081 7.9081 7.9897 7.9897 8.0921 8.0921 8.2389 8.2389 8.5000 8.5000 8.6289 8.6289 8.6452 8.6452 8.7709 8.7709 8.8531 8.8531 9.1495 9.1495 9.2553 9.2553 9.9401 9.9401 11.1974 11.1974 11.2584 11.2584 11.5098 11.5098 14.1119 14.1119 14.1517 14.1517 14.5352 14.5352 15.1466 15.1466 k = 0.0000 0.2500 0.3187 ( 3034 PWs) bands (ev): -1.0758 -1.0758 -0.8685 -0.8685 4.6635 4.6635 5.1102 5.1102 6.2140 6.2140 6.5865 6.5865 6.6270 6.6270 7.0552 7.0552 7.2652 7.2652 7.2766 7.2766 7.6460 7.6460 7.7076 7.7076 7.8229 7.8229 7.9105 7.9105 7.9996 7.9996 8.0955 8.0955 8.2320 8.2320 8.4979 8.4979 8.6293 8.6293 8.6537 8.6537 8.7596 8.7596 8.8467 8.8467 9.1147 9.1147 9.2288 9.2288 10.0125 10.0125 11.2686 11.2686 11.2868 11.2868 11.5642 11.5642 14.0393 14.0393 14.1209 14.1209 14.5718 14.5718 15.0980 15.0980 k = 0.0000 0.2619 0.3187 ( 3034 PWs) bands (ev): -1.0398 -1.0398 -0.8351 -0.8351 4.6039 4.6039 5.0450 5.0450 6.2126 6.2126 6.5805 6.5805 6.6141 6.6141 7.0658 7.0658 7.2430 7.2430 7.2580 7.2580 7.6300 7.6300 7.6955 7.6955 7.8222 7.8222 7.9131 7.9131 8.0102 8.0102 8.0995 8.0995 8.2245 8.2245 8.4940 8.4940 8.6295 8.6295 8.6613 8.6613 8.7482 8.7482 8.8410 8.8410 9.0836 9.0836 9.2032 9.2032 10.0860 10.0860 11.3036 11.3036 11.3535 11.3535 11.6205 11.6205 13.9579 13.9579 14.0739 14.0739 14.6137 14.6137 15.0650 15.0650 k = 0.0000 0.2738 0.3187 ( 3046 PWs) bands (ev): -1.0029 -1.0029 -0.8013 -0.8013 4.5419 4.5419 4.9754 4.9754 6.2150 6.2150 6.5712 6.5712 6.6091 6.6091 7.0767 7.0767 7.2101 7.2101 7.2523 7.2523 7.6134 7.6134 7.6830 7.6830 7.8218 7.8218 7.9156 7.9156 8.0214 8.0214 8.1041 8.1041 8.2165 8.2165 8.4884 8.4884 8.6294 8.6294 8.6678 8.6678 8.7371 8.7371 8.8359 8.8359 9.0560 9.0560 9.1785 9.1785 10.1607 10.1607 11.3293 11.3293 11.4315 11.4315 11.6784 11.6784 13.8716 13.8716 14.0121 14.0121 14.6585 14.6585 15.0466 15.0466 k = 0.0000 0.2857 0.3187 ( 3044 PWs) bands (ev): -0.9654 -0.9654 -0.7674 -0.7674 4.4782 4.4782 4.9023 4.9023 6.2208 6.2208 6.5620 6.5620 6.6085 6.6085 7.0878 7.0878 7.1783 7.1783 7.2484 7.2484 7.5964 7.5964 7.6701 7.6701 7.8215 7.8215 7.9182 7.9182 8.0329 8.0329 8.1093 8.1093 8.2083 8.2083 8.4813 8.4813 8.6289 8.6289 8.6723 8.6723 8.7273 8.7273 8.8314 8.8314 9.0319 9.0319 9.1548 9.1548 10.2366 10.2366 11.3552 11.3552 11.5109 11.5109 11.7378 11.7378 13.7820 13.7820 13.9381 13.9381 14.7049 14.7049 15.0407 15.0407 k = 0.0000 0.2976 0.3187 ( 3040 PWs) bands (ev): -0.9274 -0.9274 -0.7336 -0.7336 4.4136 4.4136 4.8265 4.8265 6.2296 6.2296 6.5548 6.5548 6.6099 6.6099 7.0985 7.0985 7.1481 7.1481 7.2459 7.2459 7.5792 7.5792 7.6568 7.6568 7.8213 7.8213 7.9206 7.9206 8.0448 8.0448 8.1149 8.1149 8.2004 8.2004 8.4729 8.4729 8.6280 8.6280 8.6734 8.6734 8.7204 8.7204 8.8274 8.8274 9.0110 9.0110 9.1321 9.1321 10.3134 10.3134 11.3817 11.3817 11.5912 11.5912 11.7984 11.7984 13.6902 13.6902 13.8551 13.8551 14.7520 14.7520 15.0445 15.0445 k = 0.0000 0.3095 0.3187 ( 3040 PWs) bands (ev): -0.8891 -0.8891 -0.7000 -0.7000 4.3489 4.3489 4.7488 4.7488 6.2411 6.2411 6.5499 6.5499 6.6123 6.6123 7.1029 7.1029 7.1254 7.1254 7.2446 7.2446 7.5619 7.5619 7.6431 7.6431 7.8210 7.8210 7.9226 7.9226 8.0569 8.0569 8.1206 8.1206 8.1930 8.1930 8.4632 8.4632 8.6267 8.6267 8.6698 8.6698 8.7179 8.7179 8.8239 8.8239 8.9928 8.9928 9.1103 9.1103 10.3911 10.3911 11.4088 11.4088 11.6719 11.6719 11.8599 11.8599 13.5970 13.5970 13.7660 13.7660 14.7996 14.7996 15.0558 15.0558 k = 0.0000 0.3214 0.3187 ( 3036 PWs) bands (ev): -0.8506 -0.8506 -0.6670 -0.6670 4.2849 4.2849 4.6700 4.6700 6.2548 6.2548 6.5472 6.5472 6.6156 6.6156 7.0821 7.0821 7.1293 7.1293 7.2447 7.2447 7.5448 7.5448 7.6291 7.6291 7.8208 7.8208 7.9242 7.9242 8.0689 8.0689 8.1262 8.1262 8.1867 8.1867 8.4525 8.4525 8.6249 8.6249 8.6619 8.6619 8.7192 8.7192 8.8208 8.8208 8.9772 8.9772 9.0894 9.0894 10.4697 10.4697 11.4367 11.4367 11.7525 11.7525 11.9220 11.9220 13.5031 13.5031 13.6731 13.6731 14.8472 14.8472 15.0725 15.0725 k = 0.0000 0.3333 0.3187 ( 3034 PWs) bands (ev): -0.8122 -0.8122 -0.6348 -0.6348 4.2224 4.2224 4.5910 4.5910 6.2705 6.2705 6.5461 6.5461 6.6195 6.6195 7.0545 7.0545 7.1411 7.1411 7.2459 7.2459 7.5281 7.5281 7.6148 7.6148 7.8205 7.8205 7.9251 7.9251 8.0809 8.0809 8.1310 8.1310 8.1821 8.1821 8.4409 8.4409 8.6227 8.6227 8.6519 8.6519 8.7227 8.7227 8.8181 8.8181 8.9639 8.9639 9.0695 9.0695 10.5491 10.5491 11.4654 11.4654 11.8328 11.8328 11.9844 11.9844 13.4088 13.4088 13.5784 13.5784 14.8947 14.8947 15.0930 15.0930 k = 0.0000 0.3452 0.3187 ( 3038 PWs) bands (ev): -0.7741 -0.7741 -0.6037 -0.6037 4.1620 4.1620 4.5125 4.5125 6.2876 6.2876 6.5464 6.5464 6.6241 6.6241 7.0270 7.0270 7.1539 7.1539 7.2482 7.2482 7.5116 7.5116 7.6001 7.6001 7.8203 7.8203 7.9251 7.9251 8.0927 8.0927 8.1343 8.1343 8.1801 8.1801 8.4286 8.4286 8.6198 8.6198 8.6410 8.6410 8.7271 8.7271 8.8156 8.8156 8.9526 8.9526 9.0506 9.0506 10.6291 10.6291 11.4946 11.4946 11.9121 11.9121 12.0467 12.0467 13.3148 13.3148 13.4831 13.4831 14.9418 14.9418 15.1162 15.1162 k = 0.0000 0.3571 0.3187 ( 3042 PWs) bands (ev): -0.7365 -0.7365 -0.5740 -0.5740 4.1044 4.1044 4.4353 4.4353 6.3059 6.3059 6.5475 6.5475 6.6293 6.6293 7.0001 7.0001 7.1672 7.1672 7.2516 7.2516 7.4958 7.4958 7.5851 7.5851 7.8200 7.8200 7.9241 7.9241 8.1040 8.1040 8.1359 8.1359 8.1811 8.1811 8.4158 8.4158 8.6162 8.6162 8.6304 8.6304 8.7319 8.7319 8.8133 8.8133 8.9429 8.9429 9.0328 9.0328 10.7097 10.7097 11.5243 11.5243 11.9901 11.9901 12.1085 12.1085 13.2217 13.2217 13.3884 13.3884 14.9881 14.9881 15.1410 15.1410 k = 0.0000 0.3690 0.3187 ( 3038 PWs) bands (ev): -0.6996 -0.6996 -0.5459 -0.5459 4.0502 4.0502 4.3601 4.3601 6.3250 6.3250 6.5491 6.5491 6.6352 6.6352 6.9741 6.9741 7.1807 7.1807 7.2560 7.2560 7.4806 7.4806 7.5699 7.5699 7.8200 7.8200 7.9219 7.9219 8.1150 8.1150 8.1363 8.1363 8.1851 8.1851 8.4026 8.4026 8.6115 8.6115 8.6209 8.6209 8.7367 8.7367 8.8111 8.8111 8.9349 8.9349 9.0162 9.0162 10.7908 10.7908 11.5543 11.5543 12.0660 12.0660 12.1694 12.1694 13.1299 13.1299 13.2951 13.2951 15.0334 15.0334 15.1669 15.1669 k = 0.0000 0.3810 0.3187 ( 3038 PWs) bands (ev): -0.6638 -0.6638 -0.5198 -0.5198 4.0001 4.0001 4.2874 4.2874 6.3446 6.3446 6.5508 6.5508 6.6418 6.6418 6.9491 6.9491 7.1944 7.1944 7.2613 7.2613 7.4660 7.4660 7.5545 7.5545 7.8199 7.8199 7.9185 7.9185 8.1252 8.1252 8.1362 8.1362 8.1909 8.1909 8.3891 8.3891 8.6049 8.6049 8.6135 8.6135 8.7415 8.7415 8.8090 8.8090 8.9281 8.9281 9.0007 9.0007 10.8722 10.8722 11.5841 11.5841 12.1393 12.1393 12.2287 12.2287 13.0402 13.0402 13.2040 13.2040 15.0773 15.0773 15.1930 15.1930 k = 0.0000 0.3929 0.3187 ( 3038 PWs) bands (ev): -0.6293 -0.6293 -0.4960 -0.4960 3.9547 3.9547 4.2180 4.2180 6.3644 6.3644 6.5522 6.5522 6.6491 6.6491 6.9249 6.9249 7.2081 7.2081 7.2674 7.2674 7.4522 7.4522 7.5389 7.5389 7.8202 7.8202 7.9140 7.9140 8.1340 8.1340 8.1374 8.1374 8.1979 8.1979 8.3756 8.3756 8.5970 8.5970 8.6078 8.6078 8.7461 8.7461 8.8070 8.8070 8.9225 8.9225 8.9864 8.9864 10.9538 10.9538 11.6132 11.6132 12.2092 12.2092 12.2858 12.2858 12.9535 12.9535 13.1157 13.1157 15.1195 15.1195 15.2188 15.2188 k = 0.0000 0.4048 0.3187 ( 3040 PWs) bands (ev): -0.5964 -0.5964 -0.4748 -0.4748 3.9143 3.9143 4.1523 4.1523 6.3842 6.3842 6.5533 6.5533 6.6570 6.6570 6.9017 6.9017 7.2216 7.2216 7.2744 7.2744 7.4392 7.4392 7.5232 7.5232 7.8207 7.8207 7.9082 7.9082 8.1371 8.1371 8.1442 8.1442 8.2054 8.2054 8.3618 8.3618 8.5896 8.5896 8.6027 8.6027 8.7506 8.7506 8.8048 8.8048 8.9180 8.9180 8.9734 8.9734 11.0352 11.0352 11.6409 11.6409 12.2749 12.2749 12.3401 12.3401 12.8708 12.8708 13.0308 13.0308 15.1594 15.1594 15.2437 15.2437 k = 0.0000 0.4167 0.3187 ( 3040 PWs) bands (ev): -0.5654 -0.5654 -0.4564 -0.4564 3.8795 3.8795 4.0910 4.0910 6.4037 6.4037 6.5533 6.5533 6.6658 6.6658 6.8795 6.8795 7.2350 7.2350 7.2820 7.2820 7.4272 7.4272 7.5075 7.5075 7.8217 7.8217 7.9016 7.9016 8.1395 8.1395 8.1518 8.1518 8.2133 8.2133 8.3485 8.3485 8.5828 8.5828 8.5976 8.5976 8.7549 8.7549 8.8026 8.8026 8.9144 8.9144 8.9617 8.9617 11.1162 11.1162 11.6661 11.6661 12.3353 12.3353 12.3908 12.3908 12.7936 12.7936 12.9498 12.9498 15.1966 15.1966 15.2671 15.2671 k = 0.0000 0.4286 0.3187 ( 3040 PWs) bands (ev): -0.5366 -0.5366 -0.4411 -0.4411 3.8508 3.8508 4.0344 4.0344 6.4226 6.4226 6.5521 6.5521 6.6753 6.6753 6.8582 6.8582 7.2478 7.2478 7.2901 7.2901 7.4163 7.4163 7.4918 7.4918 7.8233 7.8233 7.8942 7.8942 8.1426 8.1426 8.1583 8.1583 8.2212 8.2212 8.3354 8.3354 8.5771 8.5771 8.5925 8.5925 8.7591 8.7591 8.8002 8.8002 8.9119 8.9119 8.9512 8.9512 11.1964 11.1964 11.6872 11.6872 12.3894 12.3894 12.4370 12.4370 12.7240 12.7240 12.8735 12.8735 15.2306 15.2306 15.2885 15.2885 k = 0.0000 0.4405 0.3187 ( 3042 PWs) bands (ev): -0.5102 -0.5102 -0.4292 -0.4292 3.8283 3.8283 3.9832 3.9832 6.4408 6.4408 6.5498 6.5498 6.6856 6.6856 6.8378 6.8378 7.2602 7.2602 7.2983 7.2983 7.4068 7.4068 7.4762 7.4762 7.8255 7.8255 7.8863 7.8863 8.1465 8.1465 8.1636 8.1636 8.2291 8.2291 8.3228 8.3228 8.5725 8.5725 8.5875 8.5875 8.7631 8.7631 8.7977 8.7977 8.9101 8.9101 8.9420 8.9420 11.2752 11.2752 11.7022 11.7022 12.4355 12.4355 12.4776 12.4776 12.6649 12.6649 12.8027 12.8027 15.2609 15.2609 15.3073 15.3073 k = 0.0000 0.4524 0.3187 ( 3032 PWs) bands (ev): -0.4866 -0.4866 -0.4207 -0.4207 3.8126 3.8126 3.9377 3.9377 6.4582 6.4582 6.5459 6.5459 6.6968 6.6968 6.8184 6.8184 7.2720 7.2720 7.3060 7.3060 7.3994 7.3994 7.4609 7.4609 7.8283 7.8283 7.8781 7.8781 8.1510 8.1510 8.1674 8.1674 8.2370 8.2370 8.3108 8.3108 8.5693 8.5693 8.5828 8.5828 8.7672 8.7672 8.7950 8.7950 8.9091 8.9091 8.9341 8.9341 11.3519 11.3519 11.7088 11.7088 12.4715 12.4715 12.5112 12.5112 12.6204 12.6204 12.7385 12.7385 15.2869 15.2869 15.3228 15.3228 k = 0.0000 0.4643 0.3187 ( 3032 PWs) bands (ev): -0.4660 -0.4660 -0.4160 -0.4160 3.8037 3.8037 3.8983 3.8983 6.4743 6.4743 6.5405 6.5405 6.7088 6.7088 6.7999 6.7999 7.2829 7.2829 7.3119 7.3119 7.3950 7.3950 7.4460 7.4460 7.8321 7.8321 7.8701 7.8701 8.1557 8.1557 8.1698 8.1698 8.2449 8.2449 8.2994 8.2994 8.5672 8.5672 8.5784 8.5784 8.7711 8.7711 8.7921 8.7921 8.9090 8.9090 8.9274 8.9274 11.4255 11.4255 11.7042 11.7042 12.4941 12.4941 12.5355 12.5355 12.5961 12.5961 12.6829 12.6829 15.3084 15.3084 15.3345 15.3345 k = 0.0000 0.4762 0.3187 ( 3032 PWs) bands (ev): -0.4486 -0.4486 -0.4150 -0.4150 3.8019 3.8019 3.8652 3.8652 6.4892 6.4892 6.5335 6.5335 6.7217 6.7217 6.7824 6.7824 7.2929 7.2929 7.3147 7.3147 7.3946 7.3946 7.4318 7.4318 7.8366 7.8366 7.8622 7.8622 8.1603 8.1603 8.1706 8.1706 8.2529 8.2529 8.2888 8.2888 8.5665 8.5665 8.5744 8.5744 8.7749 8.7749 8.7889 8.7889 8.9098 8.9098 8.9219 8.9219 11.4945 11.4945 11.6867 11.6867 12.5041 12.5041 12.5468 12.5468 12.5929 12.5929 12.6400 12.6400 15.3250 15.3250 15.3420 15.3420 k = 0.0000 0.4881 0.3187 ( 3038 PWs) bands (ev): -0.4347 -0.4347 -0.4178 -0.4178 3.8071 3.8071 3.8389 3.8389 6.5026 6.5026 6.5248 6.5248 6.7355 6.7355 6.7658 6.7658 7.3017 7.3017 7.3135 7.3135 7.3990 7.3990 7.4187 7.4187 7.8419 7.8419 7.8547 7.8547 8.1644 8.1644 8.1698 8.1698 8.2611 8.2611 8.2789 8.2789 8.5669 8.5669 8.5711 8.5711 8.7785 8.7785 8.7856 8.7856 8.9113 8.9113 8.9173 8.9173 11.5574 11.5574 11.6557 11.6557 12.5121 12.5121 12.5417 12.5417 12.5992 12.5992 12.6157 12.6157 15.3366 15.3366 15.3450 15.3450 k = 0.0000 0.5000 0.3187 ( 3036 PWs) bands (ev): -0.4243 -0.4243 -0.4243 -0.4243 3.8195 3.8195 3.8195 3.8195 6.5145 6.5145 6.5145 6.5145 6.7502 6.7502 6.7502 6.7502 7.3089 7.3089 7.3089 7.3089 7.4074 7.4074 7.4074 7.4074 7.8480 7.8480 7.8480 7.8480 8.1677 8.1677 8.1677 8.1677 8.2697 8.2697 8.2697 8.2697 8.5686 8.5686 8.5686 8.5686 8.7821 8.7821 8.7821 8.7821 8.9138 8.9138 8.9138 8.9138 11.6119 11.6119 11.6119 11.6119 12.5258 12.5258 12.5258 12.5258 12.6060 12.6060 12.6060 12.6060 15.3433 15.3433 15.3433 15.3433 k = 0.0000 0.5000 0.3187 ( 3036 PWs) bands (ev): -0.4243 -0.4243 -0.4243 -0.4243 3.8195 3.8195 3.8195 3.8195 6.5145 6.5145 6.5145 6.5145 6.7502 6.7502 6.7502 6.7502 7.3089 7.3089 7.3089 7.3089 7.4074 7.4074 7.4074 7.4074 7.8480 7.8480 7.8480 7.8480 8.1677 8.1677 8.1677 8.1677 8.2697 8.2697 8.2697 8.2697 8.5686 8.5686 8.5686 8.5686 8.7821 8.7821 8.7821 8.7821 8.9138 8.9138 8.9138 8.9138 11.6119 11.6119 11.6119 11.6119 12.5258 12.5258 12.5258 12.5258 12.6060 12.6060 12.6060 12.6060 15.3433 15.3433 15.3433 15.3433 k = 0.0119 0.5000 0.3187 ( 3036 PWs) bands (ev): -0.4237 -0.4237 -0.4237 -0.4237 3.8206 3.8206 3.8210 3.8210 6.5142 6.5142 6.5156 6.5156 6.7486 6.7486 6.7496 6.7496 7.3039 7.3039 7.3136 7.3136 7.4028 7.4028 7.4124 7.4124 7.8467 7.8467 7.8483 7.8483 8.1559 8.1559 8.1778 8.1778 8.2619 8.2619 8.2800 8.2800 8.5676 8.5676 8.5692 8.5692 8.7799 8.7799 8.7840 8.7840 8.9131 8.9131 8.9142 8.9142 11.6061 11.6061 11.6113 11.6113 12.4549 12.4549 12.4993 12.4993 12.6283 12.6283 12.6679 12.6679 15.3426 15.3426 15.3561 15.3561 k = 0.0238 0.5000 0.3187 ( 3028 PWs) bands (ev): -0.4218 -0.4218 -0.4217 -0.4217 3.8244 3.8244 3.8251 3.8251 6.5149 6.5149 6.5177 6.5177 6.7447 6.7447 6.7467 6.7467 7.2986 7.2986 7.3179 7.3179 7.3987 7.3987 7.4177 7.4177 7.8447 7.8447 7.8477 7.8477 8.1435 8.1435 8.1845 8.1845 8.2583 8.2583 8.2919 8.2919 8.5664 8.5664 8.5695 8.5695 8.7773 8.7773 8.7856 8.7856 8.9120 8.9120 8.9143 8.9143 11.5938 11.5938 11.6043 11.6043 12.3688 12.3688 12.4186 12.4186 12.6921 12.6921 12.7328 12.7328 15.3465 15.3465 15.3752 15.3752 k = 0.0357 0.5000 0.3187 ( 3028 PWs) bands (ev): -0.4186 -0.4186 -0.4184 -0.4184 3.8308 3.8308 3.8319 3.8319 6.5164 6.5164 6.5207 6.5207 6.7385 6.7385 6.7417 6.7417 7.2931 7.2931 7.3216 7.3216 7.3951 7.3951 7.4233 7.4233 7.8418 7.8418 7.8461 7.8461 8.1311 8.1311 8.1861 8.1861 8.2605 8.2605 8.3045 8.3045 8.5649 8.5649 8.5694 8.5694 8.7744 8.7744 8.7868 8.7868 8.9105 8.9105 8.9140 8.9140 11.5742 11.5742 11.5899 11.5899 12.2774 12.2774 12.3306 12.3306 12.7522 12.7522 12.7919 12.7919 15.3339 15.3339 15.3723 15.3723 k = 0.0476 0.5000 0.3187 ( 3036 PWs) bands (ev): -0.4141 -0.4141 -0.4138 -0.4138 3.8398 3.8398 3.8413 3.8413 6.5186 6.5186 6.5245 6.5245 6.7301 6.7301 6.7345 6.7345 7.2874 7.2874 7.3244 7.3244 7.3924 7.3924 7.4292 7.4292 7.8381 7.8381 7.8432 7.8432 8.1192 8.1192 8.1828 8.1828 8.2682 8.2682 8.3176 8.3176 8.5631 8.5631 8.5689 8.5689 8.7712 8.7712 8.7876 8.7876 8.9087 8.9087 8.9133 8.9133 11.5465 11.5465 11.5672 11.5672 12.1840 12.1840 12.2400 12.2400 12.8060 12.8060 12.8448 12.8448 15.2863 15.2863 15.3199 15.3199 k = 0.0595 0.5000 0.3187 ( 3040 PWs) bands (ev): -0.4083 -0.4083 -0.4079 -0.4079 3.8515 3.8515 3.8533 3.8533 6.5217 6.5217 6.5293 6.5293 6.7194 6.7194 6.7252 6.7252 7.2814 7.2814 7.3260 7.3260 7.3910 7.3910 7.4354 7.4354 7.8337 7.8337 7.8392 7.8392 8.1080 8.1080 8.1764 8.1764 8.2797 8.2797 8.3309 8.3309 8.5612 8.5612 8.5681 8.5681 8.7677 8.7677 8.7881 8.7881 8.9065 8.9065 8.9123 8.9123 11.5093 11.5093 11.5342 11.5342 12.0915 12.0915 12.1496 12.1496 12.8539 12.8539 12.8919 12.8919 15.2100 15.2100 15.2352 15.2352 k = 0.0714 0.5000 0.3187 ( 3040 PWs) bands (ev): -0.4013 -0.4013 -0.4008 -0.4008 3.8657 3.8657 3.8679 3.8679 6.5254 6.5254 6.5349 6.5349 6.7066 6.7066 6.7139 6.7139 7.2752 7.2752 7.3260 7.3260 7.3911 7.3911 7.4421 7.4421 7.8285 7.8285 7.8339 7.8339 8.0977 8.0977 8.1687 8.1687 8.2933 8.2933 8.3443 8.3443 8.5592 8.5592 8.5670 8.5670 8.7639 8.7639 8.7883 8.7883 8.9040 8.9040 8.9110 8.9110 11.4614 11.4614 11.4892 11.4892 12.0026 12.0026 12.0615 12.0615 12.8964 12.8964 12.9341 12.9341 15.1189 15.1189 15.1371 15.1371 k = 0.0833 0.5000 0.3187 ( 3036 PWs) bands (ev): -0.3931 -0.3931 -0.3925 -0.3925 3.8825 3.8825 3.8851 3.8851 6.5297 6.5297 6.5413 6.5413 6.6917 6.6917 6.7009 6.7009 7.2688 7.2688 7.3243 7.3243 7.3930 7.3930 7.4491 7.4491 7.8227 7.8227 7.8272 7.8272 8.0884 8.0884 8.1605 8.1605 8.3080 8.3080 8.3577 8.3577 8.5570 8.5570 8.5655 8.5655 8.7599 8.7599 8.7881 8.7881 8.9013 8.9013 8.9094 8.9094 11.4017 11.4017 11.4304 11.4304 11.9198 11.9198 11.9774 11.9774 12.9347 12.9347 12.9722 12.9722 15.0221 15.0221 15.0347 15.0347 k = 0.0952 0.5000 0.3187 ( 3040 PWs) bands (ev): -0.3836 -0.3836 -0.3830 -0.3830 3.9019 3.9019 3.9048 3.9048 6.5343 6.5343 6.5486 6.5486 6.6747 6.6747 6.6862 6.6862 7.2621 7.2621 7.3208 7.3208 7.3964 7.3964 7.4564 7.4564 7.8160 7.8160 7.8192 7.8192 8.0802 8.0802 8.1524 8.1524 8.3231 8.3231 8.3706 8.3706 8.5549 8.5549 8.5636 8.5636 8.7557 8.7557 8.7877 8.7877 8.8982 8.8982 8.9075 8.9075 11.3303 11.3303 11.3576 11.3576 11.8438 11.8438 11.8979 11.8979 12.9695 12.9695 13.0072 13.0072 14.9251 14.9251 14.9329 14.9329 k = 0.1071 0.5000 0.3187 ( 3036 PWs) bands (ev): -0.3730 -0.3730 -0.3723 -0.3723 3.9237 3.9237 3.9271 3.9271 6.5389 6.5389 6.5564 6.5564 6.6557 6.6557 6.6703 6.6703 7.2552 7.2552 7.3161 7.3161 7.4012 7.4012 7.4642 7.4642 7.8088 7.8088 7.8100 7.8100 8.0730 8.0730 8.1446 8.1446 8.3385 8.3385 8.3833 8.3833 8.5528 8.5528 8.5613 8.5613 8.7512 8.7512 8.7869 8.7869 8.8950 8.8950 8.9055 8.9055 11.2481 11.2481 11.2721 11.2721 11.7737 11.7737 11.8222 11.8222 13.0020 13.0020 13.0401 13.0401 14.8318 14.8318 14.8349 14.8349 k = 0.1190 0.5000 0.3187 ( 3044 PWs) bands (ev): -0.3613 -0.3613 -0.3605 -0.3605 3.9481 3.9481 3.9519 3.9519 6.5427 6.5427 6.5647 6.5647 6.6350 6.6350 6.6539 6.6539 7.2481 7.2481 7.3102 7.3102 7.4069 7.4069 7.4723 7.4723 7.7995 7.7995 7.8008 7.8008 8.0668 8.0668 8.1373 8.1373 8.3538 8.3538 8.3952 8.3952 8.5508 8.5508 8.5587 8.5587 8.7465 8.7465 8.7858 8.7858 8.8915 8.8915 8.9032 8.9032 11.1569 11.1569 11.1765 11.1765 11.7071 11.7071 11.7490 11.7490 13.0330 13.0330 13.0716 13.0716 14.7433 14.7433 14.7444 14.7444 k = 0.1310 0.5000 0.3187 ( 3048 PWs) bands (ev): -0.3484 -0.3484 -0.3476 -0.3476 3.9749 3.9749 3.9791 3.9791 6.5445 6.5445 6.5724 6.5724 6.6136 6.6136 6.6382 6.6382 7.2408 7.2408 7.3035 7.3035 7.4133 7.4133 7.4806 7.4806 7.7880 7.7880 7.7923 7.7923 8.0616 8.0616 8.1305 8.1305 8.3689 8.3689 8.4064 8.4064 8.5493 8.5493 8.5558 8.5558 8.7417 8.7417 8.7844 8.7844 8.8879 8.8879 8.9007 8.9007 11.0591 11.0591 11.0740 11.0740 11.6412 11.6412 11.6761 11.6761 13.0632 13.0632 13.1026 13.1026 14.6595 14.6595 14.6648 14.6648 k = 0.1429 0.5000 0.3187 ( 3048 PWs) bands (ev): -0.3346 -0.3346 -0.3336 -0.3336 4.0041 4.0041 4.0088 4.0088 6.5419 6.5419 6.5731 6.5731 6.5980 6.5980 6.6259 6.6259 7.2333 7.2333 7.2961 7.2961 7.4203 7.4203 7.4892 7.4892 7.7755 7.7755 7.7833 7.7833 8.0572 8.0572 8.1244 8.1244 8.3836 8.3836 8.4165 8.4165 8.5482 8.5482 8.5527 8.5527 8.7368 8.7368 8.7828 8.7828 8.8843 8.8843 8.8982 8.8982 10.9569 10.9569 10.9672 10.9672 11.5737 11.5737 11.6018 11.6018 13.0934 13.0934 13.1337 13.1337 14.5848 14.5848 14.5942 14.5942 k = 0.1548 0.5000 0.3187 ( 3048 PWs) bands (ev): -0.3198 -0.3198 -0.3187 -0.3187 4.0356 4.0356 4.0408 4.0408 6.5321 6.5321 6.5537 6.5537 6.6012 6.6012 6.6195 6.6195 7.2257 7.2257 7.2882 7.2882 7.4275 7.4275 7.4980 7.4980 7.7624 7.7624 7.7740 7.7740 8.0535 8.0535 8.1188 8.1188 8.3978 8.3978 8.4254 8.4254 8.5478 8.5478 8.5493 8.5493 8.7317 8.7317 8.7809 8.7809 8.8807 8.8807 8.8956 8.8956 10.8521 10.8521 10.8580 10.8580 11.5029 11.5029 11.5245 11.5245 13.1243 13.1243 13.1654 13.1654 14.5198 14.5198 14.5332 14.5332 k = 0.1667 0.5000 0.3187 ( 3040 PWs) bands (ev): -0.3040 -0.3040 -0.3029 -0.3029 4.0695 4.0695 4.0752 4.0752 6.5147 6.5147 6.5266 6.5266 6.6109 6.6109 6.6195 6.6195 7.2181 7.2181 7.2800 7.2800 7.4349 7.4349 7.5070 7.5070 7.7489 7.7489 7.7644 7.7644 8.0505 8.0505 8.1139 8.1139 8.4115 8.4115 8.4329 8.4329 8.5458 8.5458 8.5482 8.5482 8.7266 8.7266 8.7787 8.7787 8.8771 8.8771 8.8929 8.8929 10.7462 10.7462 10.7482 10.7482 11.4279 11.4279 11.4435 11.4435 13.1562 13.1562 13.1983 13.1983 14.4651 14.4651 14.4823 14.4823 k = 0.1786 0.5000 0.3187 ( 3048 PWs) bands (ev): -0.2874 -0.2874 -0.2863 -0.2863 4.1055 4.1055 4.1118 4.1118 6.4916 6.4916 6.4970 6.4970 6.6219 6.6219 6.6239 6.6239 7.2103 7.2103 7.2714 7.2714 7.4422 7.4422 7.5157 7.5157 7.7351 7.7351 7.7547 7.7547 8.0478 8.0478 8.1094 8.1094 8.4242 8.4242 8.4385 8.4385 8.5422 8.5422 8.5496 8.5496 8.7214 8.7214 8.7762 8.7762 8.8736 8.8736 8.8903 8.8903 10.6387 10.6387 10.6403 10.6403 11.3482 11.3482 11.3584 11.3584 13.1896 13.1896 13.2326 13.2326 14.4206 14.4206 14.4414 14.4414 k = 0.1905 0.5000 0.3187 ( 3044 PWs) bands (ev): -0.2700 -0.2700 -0.2688 -0.2688 4.1437 4.1437 4.1506 4.1506 6.4649 6.4649 6.4657 6.4657 6.6310 6.6310 6.6335 6.6335 7.2026 7.2026 7.2626 7.2626 7.4494 7.4494 7.5242 7.5242 7.7215 7.7215 7.7452 7.7452 8.0455 8.0455 8.1054 8.1054 8.4359 8.4359 8.4423 8.4423 8.5388 8.5388 8.5521 8.5521 8.7163 8.7163 8.7736 8.7736 8.8702 8.8702 8.8876 8.8876 10.5305 10.5305 10.5355 10.5355 11.2639 11.2639 11.2691 11.2691 13.2248 13.2248 13.2687 13.2687 14.3861 14.3861 14.4104 14.4104 k = 0.2024 0.5000 0.3187 ( 3044 PWs) bands (ev): -0.2519 -0.2519 -0.2507 -0.2507 4.1840 4.1840 4.1914 4.1914 6.4329 6.4329 6.4356 6.4356 6.6394 6.6394 6.6454 6.6454 7.1948 7.1948 7.2535 7.2535 7.4562 7.4562 7.5321 7.5321 7.7084 7.7084 7.7359 7.7359 8.0435 8.0435 8.1018 8.1018 8.4444 8.4444 8.4462 8.4462 8.5357 8.5357 8.5555 8.5555 8.7111 8.7111 8.7707 8.7707 8.8671 8.8671 8.8850 8.8850 10.4241 10.4241 10.4321 10.4321 11.1753 11.1753 11.1760 11.1760 13.2620 13.2620 13.3067 13.3067 14.3613 14.3613 14.3887 14.3887 k = 0.2143 0.5000 0.3187 ( 3036 PWs) bands (ev): -0.2332 -0.2332 -0.2319 -0.2319 4.2263 4.2263 4.2343 4.2343 6.3992 6.3992 6.4048 6.4048 6.6486 6.6486 6.6574 6.6574 7.1870 7.1870 7.2442 7.2442 7.4625 7.4625 7.5391 7.5391 7.6963 7.6963 7.7272 7.7272 8.0416 8.0416 8.0987 8.0987 8.4448 8.4448 8.4548 8.4548 8.5333 8.5333 8.5597 8.5597 8.7062 8.7062 8.7676 8.7676 8.8643 8.8643 8.8825 8.8825 10.3200 10.3200 10.3309 10.3309 11.0798 11.0798 11.0831 11.0831 13.3013 13.3013 13.3467 13.3467 14.3458 14.3458 14.3760 14.3760 k = 0.2262 0.5000 0.3187 ( 3036 PWs) bands (ev): -0.2139 -0.2139 -0.2126 -0.2126 4.2703 4.2703 4.2790 4.2790 6.3644 6.3644 6.3726 6.3726 6.6579 6.6579 6.6692 6.6692 7.1791 7.1791 7.2348 7.2348 7.4681 7.4681 7.5446 7.5446 7.6858 7.6858 7.7193 7.7193 8.0398 8.0398 8.0958 8.0958 8.4437 8.4437 8.4612 8.4612 8.5318 8.5318 8.5643 8.5643 8.7014 8.7014 8.7643 8.7643 8.8617 8.8617 8.8800 8.8800 10.2185 10.2185 10.2321 10.2321 10.9811 10.9811 10.9879 10.9879 13.3426 13.3426 13.3886 13.3886 14.3388 14.3388 14.3716 14.3716 k = 0.2381 0.5000 0.3187 ( 3040 PWs) bands (ev): -0.1942 -0.1942 -0.1928 -0.1928 4.3161 4.3161 4.3255 4.3255 6.3290 6.3290 6.3396 6.3396 6.6672 6.6672 6.6807 6.6807 7.1713 7.1713 7.2251 7.2251 7.4729 7.4729 7.5480 7.5480 7.6776 7.6776 7.7123 7.7123 8.0380 8.0380 8.0931 8.0931 8.4413 8.4413 8.4649 8.4649 8.5317 8.5317 8.5691 8.5691 8.6968 8.6968 8.7609 8.7609 8.8595 8.8595 8.8776 8.8776 10.1198 10.1198 10.1361 10.1361 10.8807 10.8807 10.8907 10.8907 13.3858 13.3858 13.4325 13.4325 14.3400 14.3400 14.3750 14.3750 k = 0.2500 0.5000 0.3187 ( 3032 PWs) bands (ev): -0.1741 -0.1741 -0.1727 -0.1727 4.3635 4.3635 4.3736 4.3736 6.2933 6.2933 6.3061 6.3061 6.6762 6.6762 6.6916 6.6916 7.1636 7.1636 7.2154 7.2154 7.4768 7.4768 7.5486 7.5486 7.6726 7.6726 7.7065 7.7065 8.0363 8.0363 8.0907 8.0907 8.4379 8.4379 8.4659 8.4659 8.5331 8.5331 8.5738 8.5738 8.6928 8.6928 8.7575 8.7575 8.8576 8.8576 8.8753 8.8753 10.0242 10.0242 10.0429 10.0429 10.7797 10.7797 10.7925 10.7925 13.4310 13.4310 13.4780 13.4780 14.3487 14.3487 14.3855 14.3855 k = 0.2619 0.5000 0.3187 ( 3028 PWs) bands (ev): -0.1537 -0.1537 -0.1524 -0.1524 4.4122 4.4122 4.4231 4.4231 6.2576 6.2576 6.2726 6.2726 6.6845 6.6845 6.7017 6.7017 7.1559 7.1559 7.2055 7.2055 7.4795 7.4795 7.5460 7.5460 7.6711 7.6711 7.7021 7.7021 8.0344 8.0344 8.0885 8.0885 8.4337 8.4337 8.4642 8.4642 8.5356 8.5356 8.5782 8.5782 8.6893 8.6893 8.7541 8.7541 8.8560 8.8560 8.8731 8.8731 9.9317 9.9317 9.9528 9.9528 10.6789 10.6789 10.6941 10.6941 13.4779 13.4779 13.5251 13.5251 14.3644 14.3644 14.4028 14.4028 k = 0.2738 0.5000 0.3187 ( 3016 PWs) bands (ev): -0.1333 -0.1333 -0.1319 -0.1319 4.4621 4.4621 4.4739 4.4739 6.2222 6.2222 6.2393 6.2393 6.6918 6.6918 6.7107 6.7107 7.1485 7.1485 7.1956 7.1956 7.4810 7.4810 7.5406 7.5406 7.6729 7.6729 7.6993 7.6993 8.0326 8.0326 8.0863 8.0863 8.4288 8.4288 8.4603 8.4603 8.5389 8.5389 8.5823 8.5823 8.6863 8.6863 8.7508 8.7508 8.8549 8.8549 8.8710 8.8710 9.8425 9.8425 9.8659 9.8659 10.5792 10.5792 10.5965 10.5965 13.5261 13.5261 13.5734 13.5734 14.3867 14.3867 14.4264 14.4264 k = 0.2857 0.5000 0.3187 ( 3024 PWs) bands (ev): -0.1128 -0.1128 -0.1114 -0.1114 4.5130 4.5130 4.5256 4.5256 6.1874 6.1874 6.2066 6.2066 6.6977 6.6977 6.7182 6.7182 7.1411 7.1411 7.1857 7.1857 7.4813 7.4813 7.5328 7.5328 7.6775 7.6775 7.6980 7.6980 8.0305 8.0305 8.0841 8.0841 8.4231 8.4231 8.4545 8.4545 8.5423 8.5423 8.5856 8.5856 8.6839 8.6839 8.7474 8.7474 8.8539 8.8539 8.8688 8.8688 9.7566 9.7566 9.7821 9.7821 10.4814 10.4814 10.5004 10.5004 13.5756 13.5756 13.6227 13.6227 14.4152 14.4152 14.4558 14.4558 k = 0.2976 0.5000 0.3187 ( 3028 PWs) bands (ev): -0.0924 -0.0924 -0.0910 -0.0910 4.5645 4.5645 4.5781 4.5781 6.1536 6.1536 6.1750 6.1750 6.7019 6.7019 6.7239 6.7239 7.1341 7.1341 7.1759 7.1759 7.4805 7.4805 7.5235 7.5235 7.6841 7.6841 7.6983 7.6983 8.0284 8.0284 8.0820 8.0820 8.4169 8.4169 8.4474 8.4474 8.5457 8.5457 8.5884 8.5884 8.6820 8.6820 8.7441 8.7441 8.8532 8.8532 8.8667 8.8667 9.6741 9.6741 9.7015 9.7015 10.3865 10.3865 10.4068 10.4068 13.6259 13.6259 13.6725 13.6725 14.4495 14.4495 14.4907 14.4907 k = 0.3095 0.5000 0.3187 ( 3020 PWs) bands (ev): -0.0722 -0.0722 -0.0708 -0.0708 4.6164 4.6164 4.6310 4.6310 6.1214 6.1214 6.1449 6.1449 6.7041 6.7041 6.7273 6.7273 7.1277 7.1277 7.1664 7.1664 7.4788 7.4788 7.5135 7.5135 7.6922 7.6922 7.7002 7.7002 8.0263 8.0263 8.0800 8.0800 8.4102 8.4102 8.4392 8.4392 8.5488 8.5488 8.5905 8.5905 8.6808 8.6808 8.7409 8.7409 8.8527 8.8527 8.8647 8.8647 9.5951 9.5951 9.6243 9.6243 10.2950 10.2950 10.3163 10.3163 13.6767 13.6767 13.7226 13.7226 14.4893 14.4893 14.5308 14.5308 k = 0.3214 0.5000 0.3187 ( 3020 PWs) bands (ev): -0.0523 -0.0523 -0.0510 -0.0510 4.6683 4.6683 4.6838 4.6838 6.0912 6.0912 6.1168 6.1168 6.7037 6.7037 6.7279 6.7279 7.1217 7.1217 7.1572 7.1572 7.4763 7.4763 7.5032 7.5032 7.7011 7.7011 7.7032 7.7032 8.0242 8.0242 8.0781 8.0781 8.4029 8.4029 8.4299 8.4299 8.5516 8.5516 8.5921 8.5921 8.6799 8.6799 8.7376 8.7376 8.8523 8.8523 8.8626 8.8626 9.5198 9.5198 9.5505 9.5505 10.2078 10.2078 10.2296 10.2296 13.7277 13.7277 13.7725 13.7725 14.5345 14.5345 14.5758 14.5758 k = 0.3333 0.5000 0.3187 ( 3024 PWs) bands (ev): -0.0329 -0.0329 -0.0316 -0.0316 4.7198 4.7198 4.7363 4.7363 6.0636 6.0636 6.0913 6.0913 6.7004 6.7004 6.7254 6.7254 7.1166 7.1166 7.1487 7.1487 7.4732 7.4732 7.4931 7.4931 7.7073 7.7073 7.7105 7.7105 8.0221 8.0221 8.0760 8.0760 8.3953 8.3953 8.4198 8.4198 8.5541 8.5541 8.5931 8.5931 8.6793 8.6793 8.7343 8.7343 8.8520 8.8520 8.8605 8.8605 9.4483 9.4483 9.4801 9.4801 10.1254 10.1254 10.1474 10.1474 13.7784 13.7784 13.8218 13.8218 14.5847 14.5847 14.6255 14.6255 k = 0.3452 0.5000 0.3187 ( 3020 PWs) bands (ev): -0.0141 -0.0141 -0.0129 -0.0129 4.7704 4.7704 4.7878 4.7878 6.0391 6.0391 6.0688 6.0688 6.6937 6.6937 6.7192 6.7192 7.1123 7.1123 7.1409 7.1409 7.4698 7.4698 7.4835 7.4835 7.7123 7.7123 7.7200 7.7200 8.0202 8.0202 8.0741 8.0741 8.3872 8.3872 8.4091 8.4091 8.5567 8.5567 8.5938 8.5938 8.6788 8.6788 8.7310 8.7310 8.8517 8.8517 8.8583 8.8583 9.3807 9.3807 9.4135 9.4135 10.0483 10.0483 10.0700 10.0700 13.8286 13.8286 13.8702 13.8702 14.6397 14.6397 14.6797 14.6797 k = 0.3571 0.5000 0.3187 ( 3020 PWs) bands (ev): 0.0040 0.0040 0.0052 0.0052 4.8195 4.8195 4.8378 4.8378 6.0183 6.0183 6.0500 6.0500 6.6832 6.6832 6.7091 6.7091 7.1091 7.1091 7.1341 7.1341 7.4661 7.4661 7.4745 7.4745 7.7179 7.7179 7.7295 7.7295 8.0185 8.0185 8.0722 8.0722 8.3788 8.3788 8.3978 8.3978 8.5592 8.5592 8.5940 8.5940 8.6781 8.6781 8.7274 8.7274 8.8513 8.8513 8.8560 8.8560 9.3175 9.3175 9.3507 9.3507 9.9768 9.9768 9.9980 9.9980 13.8777 13.8777 13.9172 13.9172 14.6993 14.6993 14.7381 14.7381 k = 0.3690 0.5000 0.3187 ( 3020 PWs) bands (ev): 0.0212 0.0212 0.0223 0.0223 4.8666 4.8666 4.8857 4.8857 6.0020 6.0020 6.0355 6.0355 6.6687 6.6687 6.6948 6.6948 7.1069 7.1069 7.1283 7.1283 7.4624 7.4624 7.4664 7.4664 7.7240 7.7240 7.7386 7.7386 8.0171 8.0171 8.0703 8.0703 8.3703 8.3703 8.3862 8.3862 8.5618 8.5618 8.5940 8.5940 8.6771 8.6771 8.7234 8.7234 8.8507 8.8507 8.8536 8.8536 9.2588 9.2588 9.2921 9.2921 9.9114 9.9114 9.9315 9.9315 13.9253 13.9253 13.9625 13.9625 14.7631 14.7631 14.8005 14.8005 k = 0.3810 0.5000 0.3187 ( 3020 PWs) bands (ev): 0.0375 0.0375 0.0385 0.0385 4.9111 4.9111 4.9307 4.9307 5.9907 5.9907 6.0259 6.0259 6.6501 6.6501 6.6762 6.6762 7.1057 7.1057 7.1237 7.1237 7.4588 7.4588 7.4592 7.4592 7.7303 7.7303 7.7473 7.7473 8.0160 8.0160 8.0683 8.0683 8.3616 8.3616 8.3745 8.3745 8.5645 8.5645 8.5937 8.5937 8.6757 8.6757 8.7191 8.7191 8.8497 8.8497 8.8511 8.8511 9.2051 9.2051 9.2380 9.2380 9.8520 9.8520 9.8709 9.8709 13.9711 13.9711 14.0055 14.0055 14.8309 14.8309 14.8667 14.8667 k = 0.3929 0.5000 0.3187 ( 3020 PWs) bands (ev): 0.0526 0.0526 0.0536 0.0536 4.9524 4.9524 4.9721 4.9721 5.9850 5.9850 6.0215 6.0215 6.6274 6.6274 6.6535 6.6535 7.1055 7.1055 7.1202 7.1202 7.4529 7.4529 7.4553 7.4553 7.7368 7.7368 7.7552 7.7552 8.0154 8.0154 8.0662 8.0662 8.3529 8.3529 8.3628 8.3628 8.5674 8.5674 8.5933 8.5933 8.6737 8.6737 8.7143 8.7143 8.8484 8.8484 8.8485 8.8485 9.1568 9.1568 9.1887 9.1887 9.7989 9.7989 9.8162 9.8162 14.0145 14.0145 14.0461 14.0461 14.9023 14.9023 14.9363 14.9363 k = 0.4048 0.5000 0.3187 ( 3020 PWs) bands (ev): 0.0666 0.0666 0.0674 0.0674 4.9899 4.9899 5.0094 5.0094 5.9855 5.9855 6.0229 6.0229 6.6007 6.6007 6.6267 6.6267 7.1059 7.1059 7.1178 7.1178 7.4477 7.4477 7.4520 7.4520 7.7432 7.7432 7.7624 7.7624 8.0154 8.0154 8.0640 8.0640 8.3444 8.3444 8.3515 8.3515 8.5705 8.5705 8.5929 8.5929 8.6711 8.6711 8.7089 8.7089 8.8458 8.8458 8.8466 8.8466 9.1142 9.1142 9.1445 9.1445 9.7519 9.7519 9.7675 9.7675 14.0552 14.0552 14.0836 14.0836 14.9768 14.9768 15.0088 15.0088 k = 0.4167 0.5000 0.3187 ( 3020 PWs) bands (ev): 0.0792 0.0792 0.0800 0.0800 5.0232 5.0232 5.0419 5.0419 5.9924 5.9924 6.0300 6.0300 6.5705 6.5705 6.5963 6.5963 7.1070 7.1070 7.1163 7.1163 7.4434 7.4434 7.4489 7.4489 7.7494 7.7494 7.7685 7.7685 8.0161 8.0161 8.0617 8.0617 8.3361 8.3361 8.3408 8.3408 8.5737 8.5737 8.5924 8.5924 8.6679 8.6679 8.7029 8.7029 8.8430 8.8430 8.8444 8.8444 9.0776 9.0776 9.1057 9.1057 9.7110 9.7110 9.7248 9.7248 14.0927 14.0927 14.1178 14.1178 15.0538 15.0538 15.0838 15.0838 k = 0.4286 0.5000 0.3187 ( 3020 PWs) bands (ev): 0.0903 0.0903 0.0910 0.0910 5.0520 5.0520 5.0694 5.0694 6.0056 6.0056 6.0427 6.0427 6.5374 6.5374 6.5630 6.5630 7.1083 7.1083 7.1154 7.1154 7.4400 7.4400 7.4461 7.4461 7.7553 7.7553 7.7736 7.7736 8.0174 8.0174 8.0592 8.0592 8.3283 8.3283 8.3310 8.3310 8.5770 8.5770 8.5918 8.5918 8.6644 8.6644 8.6963 8.6963 8.8401 8.8401 8.8417 8.8417 9.0472 9.0472 9.0724 9.0724 9.6762 9.6762 9.6879 9.6879 14.1265 14.1265 14.1483 14.1483 15.1326 15.1326 15.1605 15.1605 k = 0.4405 0.5000 0.3187 ( 3024 PWs) bands (ev): 0.0999 0.0999 0.1005 0.1005 5.0761 5.0761 5.0916 5.0916 6.0246 6.0246 6.0605 6.0605 6.5022 6.5022 6.5274 6.5274 7.1098 7.1098 7.1151 7.1151 7.4375 7.4375 7.4435 7.4435 7.7608 7.7608 7.7775 7.7775 8.0195 8.0195 8.0563 8.0563 8.3212 8.3212 8.3223 8.3223 8.5802 8.5802 8.5913 8.5913 8.6609 8.6609 8.6894 8.6894 8.8373 8.8373 8.8387 8.8387 9.0228 9.0228 9.0445 9.0445 9.6471 9.6471 9.6569 9.6569 14.1563 14.1563 14.1746 14.1746 15.2121 15.2121 15.2376 15.2376 k = 0.4524 0.5000 0.3187 ( 3032 PWs) bands (ev): 0.1079 0.1079 0.1084 0.1084 5.0957 5.0957 5.1088 5.1088 6.0483 6.0483 6.0819 6.0819 6.4664 6.4664 6.4907 6.4907 7.1112 7.1112 7.1150 7.1150 7.4357 7.4357 7.4412 7.4412 7.7659 7.7659 7.7802 7.7802 8.0222 8.0222 8.0532 8.0532 8.3150 8.3150 8.3150 8.3150 8.5832 8.5832 8.5908 8.5908 8.6577 8.6577 8.6821 8.6821 8.8347 8.8347 8.8357 8.8357 9.0043 9.0043 9.0220 9.0220 9.6237 9.6237 9.6315 9.6315 14.1817 14.1817 14.1963 14.1963 15.2906 15.2906 15.3135 15.3135 k = 0.4643 0.5000 0.3187 ( 3036 PWs) bands (ev): 0.1143 0.1143 0.1146 0.1146 5.1110 5.1110 5.1211 5.1211 6.0752 6.0752 6.1049 6.1049 6.4321 6.4321 6.4544 6.4544 7.1125 7.1125 7.1151 7.1151 7.4347 7.4347 7.4392 7.4392 7.7704 7.7704 7.7817 7.7817 8.0256 8.0256 8.0498 8.0498 8.3091 8.3091 8.3097 8.3097 8.5857 8.5857 8.5904 8.5904 8.6555 8.6555 8.6751 8.6751 8.8323 8.8323 8.8330 8.8330 8.9911 8.9911 9.0045 9.0045 9.6059 9.6059 9.6117 9.6117 14.2023 14.2023 14.2133 14.2133 15.3652 15.3652 15.3848 15.3848 k = 0.4762 0.5000 0.3187 ( 3048 PWs) bands (ev): 0.1188 0.1188 0.1191 0.1191 5.1221 5.1221 5.1291 5.1291 6.1025 6.1025 6.1260 6.1260 6.4028 6.4028 6.4211 6.4211 7.1136 7.1136 7.1152 7.1152 7.4342 7.4342 7.4374 7.4374 7.7743 7.7743 7.7821 7.7821 8.0293 8.0293 8.0459 8.0459 8.3050 8.3050 8.3057 8.3057 8.5876 8.5876 8.5901 8.5901 8.6547 8.6547 8.6684 8.6684 8.8305 8.8305 8.8307 8.8307 8.9828 8.9828 8.9917 8.9917 9.5936 9.5936 9.5974 9.5974 14.2177 14.2177 14.2250 14.2250 15.4311 15.4311 15.4463 15.4463 k = 0.4881 0.5000 0.3187 ( 3052 PWs) bands (ev): 0.1216 0.1216 0.1217 0.1217 5.1294 5.1294 5.1329 5.1329 6.1260 6.1260 6.1396 6.1396 6.3837 6.3837 6.3946 6.3946 7.1144 7.1144 7.1152 7.1152 7.4343 7.4343 7.4360 7.4360 7.7775 7.7775 7.7815 7.7815 8.0335 8.0335 8.0419 8.0419 8.3026 8.3026 8.3031 8.3031 8.5888 8.5888 8.5899 8.5899 8.6556 8.6556 8.6628 8.6628 8.8292 8.8292 8.8294 8.8294 8.9789 8.9789 8.9833 8.9833 9.5866 9.5866 9.5885 9.5885 14.2278 14.2278 14.2315 14.2315 15.4802 15.4802 15.4888 15.4888 k = 0.5000 0.5000 0.3187 ( 3064 PWs) bands (ev): 0.1226 0.1226 0.1226 0.1226 5.1330 5.1330 5.1330 5.1330 6.1400 6.1400 6.1400 6.1400 6.3806 6.3806 6.3806 6.3806 7.1148 7.1148 7.1148 7.1148 7.4349 7.4349 7.4349 7.4349 7.7798 7.7798 7.7798 7.7798 8.0377 8.0377 8.0377 8.0377 8.3019 8.3019 8.3019 8.3019 8.5894 8.5894 8.5894 8.5894 8.6583 8.6583 8.6583 8.6583 8.8288 8.8288 8.8288 8.8288 8.9791 8.9791 8.9791 8.9791 9.5848 9.5848 9.5848 9.5848 14.2324 14.2324 14.2324 14.2324 15.5016 15.5016 15.5016 15.5016 k = 0.5000 0.5000 0.3187 ( 3064 PWs) bands (ev): 0.1226 0.1226 0.1226 0.1226 5.1330 5.1330 5.1330 5.1330 6.1400 6.1400 6.1400 6.1400 6.3806 6.3806 6.3806 6.3806 7.1148 7.1148 7.1148 7.1148 7.4349 7.4349 7.4349 7.4349 7.7798 7.7798 7.7798 7.7798 8.0377 8.0377 8.0377 8.0377 8.3019 8.3019 8.3019 8.3019 8.5894 8.5894 8.5894 8.5894 8.6583 8.6583 8.6583 8.6583 8.8288 8.8288 8.8288 8.8288 8.9791 8.9791 8.9791 8.9791 9.5848 9.5848 9.5848 9.5848 14.2324 14.2324 14.2324 14.2324 15.5016 15.5016 15.5016 15.5016 k = 0.4915 0.4915 0.3187 ( 3052 PWs) bands (ev): 0.1214 0.1214 0.1219 0.1219 5.1276 5.1276 5.1347 5.1347 6.1224 6.1224 6.1433 6.1433 6.3819 6.3819 6.3964 6.3964 7.1140 7.1140 7.1156 7.1156 7.4343 7.4343 7.4360 7.4360 7.7774 7.7774 7.7815 7.7815 8.0334 8.0334 8.0420 8.0420 8.3026 8.3026 8.3031 8.3031 8.5885 8.5885 8.5901 8.5901 8.6555 8.6555 8.6629 8.6629 8.8290 8.8290 8.8297 8.8297 8.9784 8.9784 8.9839 8.9839 9.5850 9.5850 9.5901 9.5901 14.2254 14.2254 14.2338 14.2338 15.4664 15.4664 15.5032 15.5032 k = 0.4831 0.4831 0.3187 ( 3048 PWs) bands (ev): 0.1179 0.1179 0.1199 0.1199 5.1132 5.1132 5.1384 5.1384 6.0846 6.0846 6.1452 6.1452 6.3932 6.3932 6.4289 6.4289 7.1117 7.1117 7.1171 7.1171 7.4341 7.4341 7.4375 7.4375 7.7739 7.7739 7.7825 7.7825 8.0292 8.0292 8.0461 8.0461 8.3048 8.3048 8.3059 8.3059 8.5864 8.5864 8.5914 8.5914 8.6541 8.6541 8.6689 8.6689 8.8291 8.8291 8.8322 8.8322 8.9794 8.9794 8.9953 8.9953 9.5860 9.5860 9.6052 9.6052 14.2059 14.2059 14.2367 14.2367 15.3810 15.3810 15.5064 15.5064 k = 0.4746 0.4746 0.3187 ( 3040 PWs) bands (ev): 0.1121 0.1121 0.1165 0.1165 5.0902 5.0902 5.1445 5.1445 6.0353 6.0353 6.1480 6.1480 6.4117 6.4117 6.4693 6.4693 7.1079 7.1079 7.1197 7.1197 7.4344 7.4344 7.4393 7.4393 7.7692 7.7692 7.7830 7.7830 8.0252 8.0252 8.0501 8.0501 8.3084 8.3084 8.3106 8.3106 8.5832 8.5832 8.5936 8.5936 8.6538 8.6538 8.6764 8.6764 8.8295 8.8295 8.8365 8.8365 8.9814 8.9814 9.0143 9.0143 9.5876 9.5876 9.6303 9.6303 14.1742 14.1742 14.2414 14.2414 15.2718 15.2718 15.5119 15.5119 k = 0.4661 0.4661 0.3187 ( 3040 PWs) bands (ev): 0.1039 0.1039 0.1117 0.1117 5.0598 5.0598 5.1531 5.1531 5.9807 5.9807 6.1518 6.1518 6.4356 6.4356 6.5114 6.5114 7.1028 7.1028 7.1234 7.1234 7.4350 7.4350 7.4414 7.4414 7.7631 7.7631 7.7829 7.7829 8.0213 8.0213 8.0538 8.0538 8.3131 8.3131 8.3170 8.3170 8.5791 8.5791 8.5967 8.5967 8.6542 8.6542 8.6846 8.6846 8.8298 8.8298 8.8427 8.8427 8.9842 8.9842 9.0416 9.0416 9.5898 9.5898 9.6652 9.6652 14.1312 14.1312 14.2479 14.2479 15.1534 15.1534 15.5200 15.5200 k = 0.4576 0.4576 0.3187 ( 3030 PWs) bands (ev): 0.0934 0.0934 0.1055 0.1055 5.0236 5.0236 5.1640 5.1640 5.9239 5.9239 6.1567 6.1567 6.4635 6.4635 6.5523 6.5523 7.0967 7.0967 7.1281 7.1281 7.4360 7.4360 7.4439 7.4439 7.7558 7.7558 7.7826 7.7826 8.0177 8.0177 8.0573 8.0573 8.3188 8.3188 8.3252 8.3252 8.5745 8.5745 8.6009 8.6009 8.6551 8.6551 8.6933 8.6933 8.8300 8.8300 8.8509 8.8509 8.9880 8.9880 9.0776 9.0776 9.5927 9.5927 9.7098 9.7098 14.0782 14.0782 14.2561 14.2561 15.0326 15.0326 15.5309 15.5309 k = 0.4492 0.4492 0.3187 ( 3018 PWs) bands (ev): 0.0806 0.0806 0.0978 0.0978 4.9830 4.9830 5.1774 5.1774 5.8668 5.8668 6.1626 6.1626 6.4934 6.4934 6.5904 6.5904 7.0899 7.0899 7.1339 7.1339 7.4373 7.4373 7.4468 7.4468 7.7472 7.7472 7.7821 7.7821 8.0146 8.0146 8.0607 8.0607 8.3252 8.3252 8.3348 8.3348 8.5695 8.5695 8.6062 8.6062 8.6561 8.6561 8.7019 8.7019 8.8302 8.8302 8.8612 8.8612 8.9926 8.9926 9.1229 9.1229 9.5962 9.5962 9.7638 9.7638 14.0166 14.0166 14.2657 14.2657 14.9126 14.9126 15.5449 15.5449 k = 0.4407 0.4407 0.3187 ( 3014 PWs) bands (ev): 0.0656 0.0656 0.0887 0.0887 4.9395 4.9395 5.1930 5.1930 5.8105 5.8105 6.1696 6.1696 6.5240 6.5240 6.6249 6.6249 7.0828 7.0828 7.1406 7.1406 7.4386 7.4386 7.4500 7.4500 7.7376 7.7376 7.7813 7.7813 8.0118 8.0118 8.0638 8.0638 8.3321 8.3321 8.3455 8.3455 8.5643 8.5643 8.6126 8.6126 8.6571 8.6571 8.7100 8.7100 8.8303 8.8303 8.8737 8.8737 8.9980 8.9980 9.1773 9.1773 9.6004 9.6004 9.8270 9.8270 13.9479 13.9479 14.2760 14.2760 14.7957 14.7957 15.5622 15.5622 k = 0.4322 0.4322 0.3187 ( 3014 PWs) bands (ev): 0.0483 0.0483 0.0780 0.0780 4.8943 4.8943 5.2111 5.2111 5.7557 5.7557 6.1776 6.1776 6.5536 6.5536 6.6553 6.6553 7.0757 7.0757 7.1482 7.1482 7.4399 7.4399 7.4535 7.4535 7.7267 7.7267 7.7804 7.7804 8.0094 8.0094 8.0668 8.0668 8.3393 8.3393 8.3569 8.3569 8.5590 8.5590 8.6202 8.6202 8.6580 8.6580 8.7176 8.7176 8.8304 8.8304 8.8883 8.8883 9.0043 9.0043 9.2408 9.2408 9.6051 9.6051 9.8990 9.8990 13.8735 13.8735 14.2858 14.2858 14.6841 14.6841 15.5829 15.5829 k = 0.4237 0.4237 0.3187 ( 3018 PWs) bands (ev): 0.0288 0.0288 0.0658 0.0658 4.8485 4.8485 5.2314 5.2314 5.7030 5.7030 6.1866 6.1866 6.5810 6.5810 6.6816 6.6816 7.0692 7.0692 7.1567 7.1567 7.4412 7.4412 7.4576 7.4576 7.7150 7.7150 7.7793 7.7793 8.0074 8.0074 8.0695 8.0695 8.3466 8.3466 8.3686 8.3686 8.5536 8.5536 8.6290 8.6290 8.6588 8.6588 8.7246 8.7246 8.8304 8.8304 8.9049 8.9049 9.0116 9.0116 9.3128 9.3128 9.6106 9.6106 9.9795 9.9795 13.7950 13.7950 14.2913 14.2913 14.5822 14.5822 15.6071 15.6071 k = 0.4153 0.4153 0.3187 ( 3020 PWs) bands (ev): 0.0071 0.0071 0.0519 0.0519 4.8031 4.8031 5.2540 5.2540 5.6530 5.6530 6.1965 6.1965 6.6050 6.6050 6.7039 6.7039 7.0637 7.0637 7.1662 7.1662 7.4423 7.4423 7.4621 7.4621 7.7025 7.7025 7.7782 7.7782 8.0058 8.0058 8.0722 8.0722 8.3541 8.3541 8.3802 8.3802 8.5481 8.5481 8.6383 8.6383 8.6603 8.6603 8.7312 8.7312 8.8308 8.8308 8.9234 8.9234 9.0200 9.0200 9.3929 9.3929 9.6167 9.6167 10.0680 10.0680 13.7136 13.7136 14.2825 14.2825 14.5005 14.5005 15.6351 15.6351 k = 0.4068 0.4068 0.3187 ( 3016 PWs) bands (ev): -0.0166 -0.0166 0.0364 0.0364 4.7590 4.7590 5.2788 5.2788 5.6059 5.6059 6.2074 6.2074 6.6247 6.6247 6.7224 6.7224 7.0597 7.0597 7.1765 7.1765 7.4432 7.4432 7.4670 7.4670 7.6896 7.6896 7.7771 7.7771 8.0047 8.0047 8.0749 8.0749 8.3616 8.3616 8.3916 8.3916 8.5428 8.5428 8.6459 8.6459 8.6648 8.6648 8.7375 8.7375 8.8315 8.8315 8.9433 8.9433 9.0300 9.0300 9.4800 9.4800 9.6235 9.6235 10.1642 10.1642 13.6306 13.6306 14.2413 14.2413 14.4573 14.4573 15.6667 15.6667 k = 0.3983 0.3983 0.3187 ( 3012 PWs) bands (ev): -0.0424 -0.0424 0.0193 0.0193 4.7167 4.7167 5.3057 5.3057 5.5621 5.5621 6.2192 6.2192 6.6395 6.6395 6.7374 6.7374 7.0576 7.0576 7.1875 7.1875 7.4440 7.4440 7.4724 7.4724 7.6763 7.6763 7.7760 7.7760 8.0039 8.0039 8.0775 8.0775 8.3688 8.3688 8.4024 8.4024 8.5375 8.5375 8.6488 8.6488 8.6747 8.6747 8.7436 8.7436 8.8327 8.8327 8.9638 8.9638 9.0420 9.0420 9.5731 9.5731 9.6313 9.6313 10.2676 10.2676 13.5473 13.5473 14.1679 14.1679 14.4530 14.4530 15.7021 15.7021 k = 0.3898 0.3898 0.3187 ( 3014 PWs) bands (ev): -0.0702 -0.0702 0.0004 0.0004 4.6768 4.6768 5.3344 5.3344 5.5219 5.5219 6.2318 6.2318 6.6490 6.6490 6.7493 6.7493 7.0574 7.0574 7.1992 7.1992 7.4446 7.4446 7.4780 7.4780 7.6628 7.6628 7.7748 7.7748 8.0034 8.0034 8.0800 8.0800 8.3758 8.3758 8.4125 8.4125 8.5321 8.5321 8.6487 8.6487 8.6883 8.6883 8.7496 8.7496 8.8347 8.8347 8.9841 8.9841 9.0569 9.0569 9.6377 9.6377 9.6732 9.6732 10.3774 10.3774 13.4649 13.4649 14.0809 14.0809 14.4689 14.4689 15.7414 15.7414 k = 0.3814 0.3814 0.3187 ( 3020 PWs) bands (ev): -0.0999 -0.0999 -0.0202 -0.0202 4.6399 4.6399 5.3644 5.3644 5.4862 5.4862 6.2452 6.2452 6.6531 6.6531 6.7585 6.7585 7.0590 7.0590 7.2116 7.2116 7.4451 7.4451 7.4838 7.4838 7.6495 7.6495 7.7737 7.7737 8.0032 8.0032 8.0825 8.0825 8.3823 8.3823 8.4219 8.4219 8.5267 8.5267 8.6474 8.6474 8.7033 8.7033 8.7558 8.7558 8.8378 8.8378 9.0030 9.0030 9.0755 9.0755 9.6470 9.6470 9.7748 9.7748 10.4933 10.4933 13.3847 13.3847 13.9911 13.9911 14.4947 14.4947 15.7846 15.7846 k = 0.3729 0.3729 0.3187 ( 3024 PWs) bands (ev): -0.1314 -0.1314 -0.0425 -0.0425 4.6062 4.6062 5.3930 5.3930 5.4575 5.4575 6.2593 6.2593 6.6522 6.6522 6.7655 6.7655 7.0621 7.0621 7.2246 7.2246 7.4454 7.4454 7.4896 7.4896 7.6365 7.6365 7.7726 7.7726 8.0033 8.0033 8.0851 8.0851 8.3883 8.3883 8.4309 8.4309 8.5212 8.5212 8.6455 8.6455 8.7180 8.7180 8.7623 8.7623 8.8427 8.8427 9.0200 9.0200 9.0985 9.0985 9.6564 9.6564 9.8795 9.8795 10.6145 10.6145 13.3079 13.3079 13.9026 13.9026 14.5267 14.5267 15.8318 15.8318 k = 0.3644 0.3644 0.3187 ( 3028 PWs) bands (ev): -0.1646 -0.1646 -0.0665 -0.0665 4.5763 4.5763 5.4029 5.4029 5.4533 5.4533 6.2741 6.2741 6.6467 6.6467 6.7709 6.7709 7.0664 7.0664 7.2381 7.2381 7.4456 7.4456 7.4952 7.4952 7.6245 7.6245 7.7716 7.7716 8.0037 8.0037 8.0876 8.0876 8.3935 8.3935 8.4393 8.4393 8.5155 8.5155 8.6435 8.6435 8.7314 8.7314 8.7695 8.7695 8.8501 8.8501 9.0351 9.0351 9.1257 9.1257 9.6664 9.6664 9.9852 9.9852 10.7402 10.7402 13.2358 13.2358 13.8169 13.8169 14.5636 14.5636 15.8831 15.8831 k = 0.3559 0.3559 0.3187 ( 3032 PWs) bands (ev): -0.1995 -0.1995 -0.0923 -0.0923 4.5501 4.5501 5.3854 5.3854 5.4820 5.4820 6.2894 6.2894 6.6372 6.6372 6.7750 6.7750 7.0712 7.0712 7.2522 7.2522 7.4458 7.4458 7.5001 7.5001 7.6139 7.6139 7.7707 7.7707 8.0043 8.0043 8.0902 8.0902 8.3981 8.3981 8.4475 8.4475 8.5096 8.5096 8.6414 8.6414 8.7423 8.7423 8.7771 8.7771 8.8607 8.8607 9.0488 9.0488 9.1563 9.1563 9.6770 9.6770 10.0901 10.0901 10.8696 10.8696 13.1701 13.1701 13.7350 13.7350 14.6050 14.6050 15.9386 15.9386 k = 0.3475 0.3475 0.3187 ( 3040 PWs) bands (ev): -0.2358 -0.2358 -0.1197 -0.1197 4.5281 4.5281 5.3648 5.3648 5.5195 5.5195 6.3053 6.3053 6.6244 6.6244 6.7781 6.7781 7.0761 7.0761 7.2666 7.2666 7.4460 7.4460 7.5035 7.5035 7.6053 7.6053 7.7698 7.7698 8.0052 8.0052 8.0927 8.0927 8.4018 8.4018 8.4553 8.4553 8.5037 8.5037 8.6394 8.6394 8.7504 8.7504 8.7849 8.7849 8.8752 8.8752 9.0617 9.0617 9.1898 9.1898 9.6882 9.6882 10.1922 10.1922 11.0018 11.0018 13.1125 13.1125 13.6575 13.6575 14.6507 14.6507 15.9983 15.9983 k = 0.3390 0.3390 0.3187 ( 3050 PWs) bands (ev): -0.2734 -0.2734 -0.1487 -0.1487 4.5102 4.5102 5.3464 5.3464 5.5600 5.5600 6.3217 6.3217 6.6090 6.6090 6.7807 6.7807 7.0806 7.0806 7.2814 7.2814 7.4463 7.4463 7.5050 7.5050 7.5995 7.5995 7.7690 7.7690 8.0063 8.0063 8.0953 8.0953 8.4048 8.4048 8.4629 8.4629 8.4977 8.4977 8.6376 8.6376 8.7563 8.7563 8.7920 8.7920 8.8933 8.8933 9.0743 9.0743 9.2255 9.2255 9.7001 9.7001 10.2894 10.2894 11.1358 11.1358 13.0647 13.0647 13.5849 13.5849 14.7007 14.7007 16.0625 16.0625 k = 0.3305 0.3305 0.3187 ( 3046 PWs) bands (ev): -0.3123 -0.3123 -0.1792 -0.1792 4.4965 4.4965 5.3311 5.3311 5.6029 5.6029 6.3384 6.3384 6.5914 6.5914 6.7831 6.7831 7.0846 7.0846 7.2966 7.2966 7.4467 7.4467 7.5041 7.5041 7.5972 7.5972 7.7685 7.7685 8.0076 8.0076 8.0979 8.0979 8.4071 8.4071 8.4695 8.4695 8.4925 8.4925 8.6360 8.6360 8.7606 8.7606 8.7985 8.7985 8.9146 8.9146 9.0868 9.0868 9.2634 9.2634 9.7126 9.7126 10.3796 10.3796 11.2703 11.2703 13.0288 13.0288 13.5178 13.5178 14.7554 14.7554 16.1312 16.1312 k = 0.3220 0.3220 0.3187 ( 3050 PWs) bands (ev): -0.3523 -0.3523 -0.2112 -0.2112 4.4872 4.4872 5.3189 5.3189 5.6476 5.6476 6.3553 6.3553 6.5722 6.5722 6.7856 6.7856 7.0877 7.0877 7.3119 7.3119 7.4473 7.4473 7.5006 7.5006 7.5985 7.5985 7.7680 7.7680 8.0091 8.0091 8.1006 8.1006 8.4086 8.4086 8.4729 8.4729 8.4902 8.4902 8.6347 8.6347 8.7637 8.7637 8.8043 8.8043 8.9382 8.9382 9.0994 9.0994 9.3029 9.3029 9.7257 9.7257 10.4601 10.4601 11.4039 11.4039 13.0069 13.0069 13.4569 13.4569 14.8148 14.8148 16.2042 16.2042 k = 0.3136 0.3136 0.3187 ( 3046 PWs) bands (ev): -0.3933 -0.3933 -0.2445 -0.2445 4.4821 4.4821 5.3098 5.3098 5.6941 5.6941 6.3724 6.3724 6.5519 6.5519 6.7885 6.7885 7.0899 7.0899 7.3274 7.3274 7.4482 7.4482 7.4953 7.4953 7.6030 7.6030 7.7679 7.7679 8.0108 8.0108 8.1033 8.1033 8.4096 8.4096 8.4704 8.4704 8.4937 8.4937 8.6337 8.6337 8.7661 8.7661 8.8096 8.8096 8.9636 8.9636 9.1123 9.1123 9.3440 9.3440 9.7394 9.7394 10.5289 10.5289 11.5349 11.5349 13.0011 13.0011 13.4032 13.4032 14.8794 14.8794 16.2473 16.2473 k = 0.3051 0.3051 0.3187 ( 3046 PWs) bands (ev): -0.4351 -0.4351 -0.2791 -0.2791 4.4812 4.4812 5.3036 5.3036 5.7421 5.7421 6.3896 6.3896 6.5307 6.5307 6.7921 6.7921 7.0911 7.0911 7.3427 7.3427 7.4497 7.4497 7.4888 7.4888 7.6098 7.6098 7.7678 7.7678 8.0126 8.0126 8.1060 8.1060 8.4099 8.4099 8.4645 8.4645 8.5002 8.5002 8.6329 8.6329 8.7677 8.7677 8.8147 8.8147 8.9901 8.9901 9.1253 9.1253 9.3865 9.3865 9.7537 9.7537 10.5837 10.5837 11.6612 11.6612 13.0131 13.0131 13.3581 13.3581 14.9494 14.9494 16.2587 16.2587 k = 0.2966 0.2966 0.3187 ( 3046 PWs) bands (ev): -0.4776 -0.4776 -0.3149 -0.3149 4.4844 4.4844 5.3002 5.3002 5.7916 5.7916 6.4067 6.4067 6.5089 6.5089 6.7965 6.7965 7.0913 7.0913 7.3575 7.3575 7.4520 7.4520 7.4819 7.4819 7.6183 7.6183 7.7679 7.7679 8.0146 8.0146 8.1086 8.1086 8.4097 8.4097 8.4575 8.4575 8.5075 8.5075 8.6323 8.6323 8.7690 8.7690 8.8196 8.8196 9.0175 9.0175 9.1388 9.1388 9.4304 9.4304 9.7685 9.7685 10.6233 10.6233 11.7803 11.7803 13.0439 13.0439 13.3230 13.3230 15.0252 15.0252 16.2696 16.2696 k = 0.2881 0.2881 0.3187 ( 3044 PWs) bands (ev): -0.5206 -0.5206 -0.3516 -0.3516 4.4916 4.4916 5.2994 5.2994 5.8425 5.8425 6.4236 6.4236 6.4871 6.4871 6.8022 6.8022 7.0905 7.0905 7.3712 7.3712 7.4555 7.4555 7.4753 7.4753 7.6280 7.6280 7.7682 7.7682 8.0166 8.0166 8.1113 8.1113 8.4090 8.4090 8.4502 8.4502 8.5150 8.5150 8.6318 8.6318 8.7701 8.7701 8.8244 8.8244 9.0455 9.0455 9.1526 9.1526 9.4755 9.4755 9.7840 9.7840 10.6470 10.6470 11.8891 11.8891 13.0939 13.0939 13.3003 13.3003 15.1072 15.1072 16.2801 16.2801 k = 0.2797 0.2797 0.3187 ( 3044 PWs) bands (ev): -0.5640 -0.5640 -0.3892 -0.3892 4.5025 4.5025 5.3009 5.3009 5.8946 5.8946 6.4399 6.4399 6.4654 6.4654 6.8091 6.8091 7.0889 7.0889 7.3835 7.3835 7.4605 7.4605 7.4699 7.4699 7.6386 7.6386 7.7688 7.7688 8.0189 8.0189 8.1139 8.1139 8.4077 8.4077 8.4430 8.4430 8.5224 8.5224 8.6314 8.6314 8.7710 8.7710 8.8291 8.8291 9.0737 9.0737 9.1671 9.1671 9.5218 9.5218 9.7999 9.7999 10.6550 10.6550 11.9846 11.9846 13.1623 13.1623 13.2924 13.2924 15.1957 15.1957 16.2901 16.2901 k = 0.2712 0.2712 0.3187 ( 3042 PWs) bands (ev): -0.6077 -0.6077 -0.4275 -0.4275 4.5170 4.5170 5.3045 5.3045 5.9478 5.9478 6.4422 6.4422 6.4578 6.4578 6.8177 6.8177 7.0865 7.0865 7.3935 7.3935 7.4617 7.4617 7.4717 7.4717 7.6497 7.6497 7.7695 7.7695 8.0212 8.0212 8.1166 8.1166 8.4058 8.4058 8.4358 8.4358 8.5298 8.5298 8.6311 8.6311 8.7718 8.7718 8.8338 8.8338 9.1019 9.1019 9.1822 9.1822 9.5692 9.5692 9.8164 9.8164 10.6483 10.6483 12.0633 12.0633 13.2464 13.2464 13.3030 13.3030 15.2911 15.2911 16.2994 16.2994 k = 0.2627 0.2627 0.3187 ( 3040 PWs) bands (ev): -0.6514 -0.6514 -0.4664 -0.4664 4.5349 4.5349 5.3099 5.3099 6.0020 6.0020 6.4218 6.4218 6.4728 6.4728 6.8281 6.8281 7.0833 7.0833 7.4011 7.4011 7.4583 7.4583 7.4823 7.4823 7.6613 7.6613 7.7705 7.7705 8.0237 8.0237 8.1192 8.1192 8.4031 8.4031 8.4292 8.4292 8.5370 8.5370 8.6307 8.6307 8.7726 8.7726 8.8384 8.8384 9.1299 9.1299 9.1984 9.1984 9.6177 9.6177 9.8334 9.8334 10.6284 10.6284 12.1231 12.1231 13.3191 13.3191 13.3589 13.3589 15.3935 15.3935 16.3078 16.3078 k = 0.2542 0.2542 0.3187 ( 3036 PWs) bands (ev): -0.6951 -0.6951 -0.5056 -0.5056 4.5557 4.5557 5.3169 5.3169 6.0570 6.0570 6.4016 6.4016 6.4878 6.4878 6.8404 6.8404 7.0795 7.0795 7.4064 7.4064 7.4554 7.4554 7.4962 7.4962 7.6731 7.6731 7.7718 7.7718 8.0262 8.0262 8.1217 8.1217 8.3993 8.3993 8.4234 8.4234 8.5440 8.5440 8.6303 8.6303 8.7734 8.7734 8.8430 8.8430 9.1570 9.1570 9.2160 9.2160 9.6671 9.6671 9.8508 9.8508 10.5971 10.5971 12.1632 12.1632 13.3677 13.3677 13.4705 13.4705 15.5029 15.5029 16.3154 16.3154 k = 0.2458 0.2458 0.3187 ( 3036 PWs) bands (ev): -0.7387 -0.7387 -0.5452 -0.5452 4.5793 4.5793 5.3253 5.3253 6.1127 6.1127 6.3824 6.3824 6.5021 6.5021 6.8549 6.8549 7.0751 7.0751 7.4101 7.4101 7.4537 7.4537 7.5123 7.5123 7.6852 7.6852 7.7733 7.7733 8.0289 8.0289 8.1242 8.1242 8.3943 8.3943 8.4186 8.4186 8.5507 8.5507 8.6297 8.6297 8.7744 8.7744 8.8475 8.8475 9.1827 9.1827 9.2359 9.2359 9.7174 9.7174 9.8687 9.8687 10.5563 10.5563 12.1846 12.1846 13.4289 13.4289 13.5969 13.5969 15.6189 15.6189 16.3218 16.3218 k = 0.2373 0.2373 0.3187 ( 3040 PWs) bands (ev): -0.7819 -0.7819 -0.5848 -0.5848 4.6053 4.6053 5.3347 5.3347 6.1688 6.1688 6.3646 6.3646 6.5155 6.5155 6.8716 6.8716 7.0702 7.0702 7.4129 7.4129 7.4534 7.4534 7.5298 7.5298 7.6972 7.6972 7.7750 7.7750 8.0316 8.0316 8.1265 8.1265 8.3882 8.3882 8.4148 8.4148 8.5571 8.5571 8.6289 8.6289 8.7757 8.7757 8.8519 8.8519 9.2061 9.2061 9.2587 9.2587 9.7686 9.7686 9.8871 9.8871 10.5077 10.5077 12.1899 12.1899 13.5024 13.5024 13.7332 13.7332 15.7398 15.7398 16.3269 16.3269 k = 0.2288 0.2288 0.3187 ( 3030 PWs) bands (ev): -0.8247 -0.8247 -0.6244 -0.6244 4.6333 4.6333 5.3449 5.3449 6.2250 6.2250 6.3486 6.3486 6.5281 6.5281 6.8909 6.8909 7.0650 7.0650 7.4154 7.4154 7.4544 7.4544 7.5485 7.5485 7.7091 7.7091 7.7772 7.7772 8.0344 8.0344 8.1288 8.1288 8.3813 8.3813 8.4117 8.4117 8.5633 8.5633 8.6278 8.6278 8.7772 8.7772 8.8563 8.8563 9.2272 9.2272 9.2848 9.2848 9.8204 9.8204 9.9058 9.9058 10.4529 10.4529 12.1822 12.1822 13.5846 13.5846 13.8772 13.8772 15.8618 15.8618 16.3306 16.3306 k = 0.2203 0.2203 0.3187 ( 3030 PWs) bands (ev): -0.8669 -0.8669 -0.6638 -0.6638 4.6629 4.6629 5.3557 5.3557 6.2796 6.2796 6.3363 6.3363 6.5397 6.5397 6.9125 6.9125 7.0595 7.0595 7.4179 7.4179 7.4569 7.4569 7.5679 7.5679 7.7210 7.7210 7.7796 7.7796 8.0373 8.0373 8.1308 8.1308 8.3739 8.3739 8.4091 8.4091 8.5692 8.5692 8.6264 8.6264 8.7790 8.7790 8.8607 8.8607 9.2464 9.2464 9.3136 9.3136 9.8727 9.8727 9.9250 9.9250 10.3932 10.3932 12.1643 12.1643 13.6723 13.6723 14.0274 14.0274 15.9721 15.9721 16.3323 16.3323 k = 0.2119 0.2119 0.3187 ( 3026 PWs) bands (ev): -0.9085 -0.9085 -0.7028 -0.7028 4.6937 4.6937 5.3668 5.3668 6.3112 6.3112 6.3492 6.3492 6.5502 6.5502 6.9368 6.9368 7.0538 7.0538 7.4206 7.4206 7.4609 7.4609 7.5876 7.5876 7.7326 7.7326 7.7824 7.7824 8.0401 8.0401 8.1327 8.1327 8.3662 8.3662 8.4067 8.4067 8.5747 8.5747 8.6247 8.6247 8.7812 8.7812 8.8651 8.8651 9.2645 9.2645 9.3446 9.3446 9.9250 9.9250 9.9452 9.9452 10.3298 10.3298 12.1386 12.1386 13.7625 13.7625 14.1822 14.1822 16.0298 16.0298 16.3276 16.3276 k = 0.2034 0.2034 0.3187 ( 3026 PWs) bands (ev): -0.9492 -0.9492 -0.7414 -0.7414 4.7253 4.7253 5.3780 5.3780 6.3058 6.3058 6.4012 6.4012 6.5597 6.5597 6.9637 6.9637 7.0479 7.0479 7.4236 7.4236 7.4663 7.4663 7.6075 7.6075 7.7438 7.7438 7.7855 7.7855 8.0430 8.0430 8.1343 8.1343 8.3584 8.3584 8.4045 8.4045 8.5798 8.5798 8.6226 8.6226 8.7838 8.7838 8.8694 8.8694 9.2821 9.2821 9.3771 9.3771 9.9622 9.9622 9.9810 9.9810 10.2638 10.2638 12.1069 12.1069 13.8531 13.8531 14.3404 14.3404 15.9733 15.9733 16.3127 16.3127 k = 0.1949 0.1949 0.3187 ( 3022 PWs) bands (ev): -0.9891 -0.9891 -0.7794 -0.7794 4.7572 4.7572 5.3892 5.3892 6.2989 6.2989 6.4571 6.4571 6.5682 6.5682 6.9930 6.9930 7.0420 7.0420 7.4272 7.4272 7.4733 7.4733 7.6274 7.6274 7.7548 7.7548 7.7890 7.7890 8.0458 8.0458 8.1356 8.1356 8.3505 8.3505 8.4025 8.4025 8.5847 8.5847 8.6200 8.6200 8.7868 8.7868 8.8738 8.8738 9.2994 9.2994 9.4111 9.4111 9.9829 9.9829 10.0333 10.0333 10.1963 10.1963 12.0704 12.0704 13.9424 13.9424 14.5011 14.5011 15.8372 15.8372 16.2730 16.2730 k = 0.1864 0.1864 0.3187 ( 3026 PWs) bands (ev): -1.0279 -1.0279 -0.8166 -0.8166 4.7890 4.7890 5.4002 5.4002 6.2941 6.2941 6.5127 6.5127 6.5761 6.5761 7.0233 7.0233 7.0378 7.0378 7.4313 7.4313 7.4818 7.4818 7.6471 7.6471 7.7652 7.7652 7.7930 7.7930 8.0485 8.0485 8.1366 8.1366 8.3425 8.3425 8.4004 8.4004 8.5891 8.5891 8.6170 8.6170 8.7903 8.7903 8.8782 8.8782 9.3168 9.3168 9.4463 9.4463 10.0027 10.0027 10.0813 10.0813 10.1330 10.1330 12.0301 12.0301 14.0293 14.0293 14.6631 14.6631 15.6777 15.6777 16.1154 16.1154 k = 0.1780 0.1780 0.3187 ( 3030 PWs) bands (ev): -1.0657 -1.0657 -0.8530 -0.8530 4.8201 4.8201 5.4108 5.4108 6.2922 6.2922 6.5638 6.5638 6.5870 6.5870 7.0280 7.0280 7.0617 7.0617 7.4363 7.4363 7.4917 7.4917 7.6664 7.6664 7.7752 7.7752 7.7975 7.7975 8.0511 8.0511 8.1371 8.1371 8.3346 8.3346 8.3983 8.3983 8.5932 8.5932 8.6135 8.6135 8.7942 8.7942 8.8827 8.8827 9.3342 9.3342 9.4828 9.4828 10.0192 10.0192 10.0535 10.0535 10.1482 10.1482 11.9866 11.9866 14.1128 14.1128 14.8252 14.8252 15.5146 15.5146 15.9163 15.9163 k = 0.1695 0.1695 0.3187 ( 3034 PWs) bands (ev): -1.1023 -1.1023 -0.8884 -0.8884 4.8502 4.8502 5.4210 5.4210 6.2933 6.2933 6.5828 6.5828 6.6285 6.6285 7.0224 7.0224 7.0984 7.0984 7.4421 7.4421 7.5028 7.5028 7.6849 7.6849 7.7848 7.7848 7.8026 7.8026 8.0536 8.0536 8.1373 8.1373 8.3266 8.3266 8.3961 8.3961 8.5969 8.5969 8.6096 8.6096 8.7987 8.7987 8.8873 8.8873 9.3520 9.3520 9.5205 9.5205 9.9767 9.9767 10.0475 10.0475 10.2005 10.2005 11.9401 11.9401 14.1920 14.1920 14.9852 14.9852 15.3555 15.3555 15.7171 15.7171 k = 0.1610 0.1610 0.3187 ( 3030 PWs) bands (ev): -1.1375 -1.1375 -0.9227 -0.9227 4.8789 4.8789 5.4305 5.4305 6.2977 6.2977 6.5882 6.5882 6.6817 6.6817 7.0167 7.0167 7.1379 7.1379 7.4490 7.4490 7.5152 7.5152 7.7028 7.7028 7.7939 7.7939 7.8084 7.8084 8.0559 8.0559 8.1370 8.1370 8.3187 8.3187 8.3939 8.3939 8.5995 8.5995 8.6060 8.6060 8.8036 8.8036 8.8921 8.8921 9.3701 9.3701 9.5593 9.5593 9.9074 9.9074 10.0670 10.0670 10.2542 10.2542 11.8911 11.8911 14.2656 14.2656 15.1244 15.1244 15.2179 15.2179 15.5263 15.5263 k = 0.1525 0.1525 0.3187 ( 3030 PWs) bands (ev): -1.1715 -1.1715 -0.9558 -0.9558 4.9057 4.9057 5.4395 5.4395 6.3053 6.3053 6.5918 6.5918 6.7349 6.7349 7.0108 7.0108 7.1797 7.1797 7.4571 7.4571 7.5286 7.5286 7.7193 7.7193 7.8029 7.8029 7.8147 7.8147 8.0580 8.0580 8.1361 8.1361 8.3107 8.3107 8.3917 8.3917 8.5977 8.5977 8.6057 8.6057 8.8089 8.8089 8.8971 8.8971 9.3887 9.3887 9.5989 9.5989 9.8377 9.8377 10.0874 10.0874 10.3080 10.3080 11.8395 11.8395 14.3316 14.3316 15.0444 15.0444 15.2475 15.2475 15.4007 15.4007 k = 0.1441 0.1441 0.3187 ( 3034 PWs) bands (ev): -1.2040 -1.2040 -0.9876 -0.9876 4.9305 4.9305 5.4479 5.4479 6.3160 6.3160 6.5944 6.5944 6.7869 6.7869 7.0052 7.0052 7.2234 7.2234 7.4664 7.4664 7.5428 7.5428 7.7344 7.7344 7.8121 7.8121 7.8214 7.8214 8.0598 8.0598 8.1348 8.1348 8.3026 8.3026 8.3891 8.3891 8.5925 8.5925 8.6079 8.6079 8.8144 8.8144 8.9024 8.9024 9.4077 9.4077 9.6375 9.6375 9.7706 9.7706 10.1081 10.1081 10.3613 10.3613 11.7857 11.7857 14.3856 14.3856 14.9153 14.9153 15.1118 15.1118 15.5082 15.5082 k = 0.1356 0.1356 0.3187 ( 3018 PWs) bands (ev): -1.2350 -1.2350 -1.0181 -1.0181 4.9530 4.9530 5.4556 5.4556 6.3299 6.3299 6.5964 6.5964 6.8376 6.8376 6.9999 6.9999 7.2690 7.2690 7.4774 7.4774 7.5577 7.5577 7.7480 7.7480 7.8219 7.8219 7.8283 7.8283 8.0614 8.0614 8.1330 8.1330 8.2945 8.2945 8.3865 8.3865 8.5863 8.5863 8.6104 8.6104 8.8202 8.8202 8.9081 8.9081 9.4273 9.4273 9.6591 9.6591 9.7226 9.7226 10.1288 10.1288 10.4140 10.4140 11.7295 11.7295 14.4176 14.4176 14.8026 14.8026 14.9428 14.9428 15.6617 15.6617 k = 0.1271 0.1271 0.3187 ( 3024 PWs) bands (ev): -1.2644 -1.2644 -1.0471 -1.0471 4.9731 4.9731 5.4626 5.4626 6.3464 6.3464 6.5975 6.5975 6.8864 6.8864 6.9950 6.9950 7.3160 7.3160 7.4897 7.4897 7.5731 7.5731 7.7597 7.7597 7.8324 7.8324 7.8351 7.8351 8.0625 8.0625 8.1305 8.1305 8.2861 8.2861 8.3835 8.3835 8.5793 8.5793 8.6126 8.6126 8.8261 8.8261 8.9141 8.9141 9.4474 9.4474 9.6146 9.6146 9.7430 9.7430 10.1495 10.1495 10.4657 10.4657 11.6713 11.6713 14.4098 14.4098 14.6946 14.6946 14.8135 14.8135 15.8181 15.8181 k = 0.1186 0.1186 0.3187 ( 3028 PWs) bands (ev): -1.2922 -1.2922 -1.0745 -1.0745 4.9908 4.9908 5.4689 5.4689 6.3653 6.3653 6.5982 6.5982 6.9324 6.9324 6.9914 6.9914 7.3643 7.3643 7.5036 7.5036 7.5887 7.5887 7.7698 7.7698 7.8415 7.8415 7.8439 7.8439 8.0633 8.0633 8.1276 8.1276 8.2776 8.2776 8.3800 8.3800 8.5718 8.5718 8.6146 8.6146 8.8319 8.8319 8.9206 8.9206 9.4681 9.4681 9.5507 9.5507 9.7855 9.7855 10.1700 10.1700 10.5161 10.5161 11.6111 11.6111 14.3549 14.3549 14.5465 14.5465 14.7804 14.7804 15.9707 15.9707 k = 0.1102 0.1102 0.3187 ( 3024 PWs) bands (ev): -1.3183 -1.3183 -1.1004 -1.1004 5.0060 5.0060 5.4746 5.4746 6.3860 6.3860 6.5984 6.5984 6.9681 6.9681 6.9965 6.9965 7.4135 7.4135 7.5192 7.5192 7.6044 7.6044 7.7788 7.7788 7.8480 7.8480 7.8554 7.8554 8.0639 8.0639 8.1243 8.1243 8.2688 8.2688 8.3759 8.3759 8.5637 8.5637 8.6164 8.6164 8.8375 8.8375 8.9275 8.9275 9.4857 9.4857 9.4894 9.4894 9.8315 9.8315 10.1903 10.1903 10.5651 10.5651 11.5493 11.5493 14.2727 14.2727 14.3844 14.3844 14.7994 14.7994 16.0726 16.0726 k = 0.1017 0.1017 0.3187 ( 3018 PWs) bands (ev): -1.3427 -1.3427 -1.1246 -1.1246 5.0190 5.0190 5.4797 5.4797 6.4081 6.4081 6.5982 6.5982 6.9741 6.9741 7.0294 7.0294 7.4631 7.4631 7.5364 7.5364 7.6200 7.6200 7.7871 7.7871 7.8542 7.8542 7.8671 7.8671 8.0641 8.0641 8.1207 8.1207 8.2597 8.2597 8.3713 8.3713 8.5552 8.5552 8.6181 8.6181 8.8429 8.8429 8.9349 8.9349 9.4220 9.4220 9.5112 9.5112 9.8792 9.8792 10.2104 10.2104 10.6122 10.6122 11.4863 11.4863 14.1828 14.1828 14.2245 14.2245 14.8355 14.8355 16.0489 16.0489 k = 0.0932 0.0932 0.3187 ( 3026 PWs) bands (ev): -1.3653 -1.3653 -1.1471 -1.1471 5.0298 5.0298 5.4841 5.4841 6.4308 6.4308 6.5977 6.5977 6.9714 6.9714 7.0689 7.0689 7.5126 7.5126 7.5550 7.5550 7.6353 7.6353 7.7950 7.7950 7.8602 7.8602 7.8784 7.8784 8.0640 8.0640 8.1168 8.1168 8.2500 8.2500 8.3656 8.3656 8.5462 8.5462 8.6195 8.6195 8.8479 8.8479 8.9425 8.9425 9.3601 9.3601 9.5335 9.5335 9.9274 9.9274 10.2302 10.2302 10.6571 10.6571 11.4225 11.4225 14.0687 14.0687 14.0962 14.0962 14.8766 14.8766 16.0102 16.0102 k = 0.0847 0.0847 0.3187 ( 3026 PWs) bands (ev): -1.3860 -1.3860 -1.1678 -1.1678 5.0387 5.0387 5.4881 5.4881 6.4537 6.4537 6.5972 6.5972 6.9678 6.9678 7.1071 7.1071 7.5613 7.5613 7.5750 7.5750 7.6503 7.6503 7.8033 7.8033 7.8659 7.8659 7.8889 7.8889 8.0635 8.0635 8.1129 8.1129 8.2399 8.2399 8.3589 8.3589 8.5372 8.5372 8.6207 8.6207 8.8524 8.8524 8.9504 8.9504 9.3007 9.3007 9.5563 9.5563 9.9757 9.9757 10.2497 10.2497 10.6996 10.6996 11.3586 11.3586 13.9221 13.9221 14.0133 14.0133 14.9182 14.9182 15.9694 15.9694 k = 0.0763 0.0763 0.3187 ( 3034 PWs) bands (ev): -1.4049 -1.4049 -1.1866 -1.1866 5.0459 5.0459 5.4915 5.4915 6.4761 6.4761 6.5965 6.5965 6.9641 6.9641 7.1429 7.1429 7.5956 7.5956 7.6084 7.6084 7.6651 7.6651 7.8128 7.8128 7.8716 7.8716 7.8984 7.8984 8.0627 8.0627 8.1092 8.1092 8.2290 8.2290 8.3509 8.3509 8.5280 8.5280 8.6219 8.6219 8.8564 8.8564 8.9582 8.9582 9.2443 9.2443 9.5793 9.5793 10.0232 10.0232 10.2688 10.2688 10.7391 10.7391 11.2955 11.2955 13.7833 13.7833 13.9380 13.9380 14.9582 14.9582 15.9285 15.9285 k = 0.0678 0.0678 0.3187 ( 3040 PWs) bands (ev): -1.4219 -1.4219 -1.2036 -1.2036 5.0516 5.0516 5.4944 5.4944 6.4973 6.4973 6.5958 6.5958 6.9607 6.9607 7.1760 7.1760 7.6170 7.6170 7.6501 7.6501 7.6813 7.6813 7.8244 7.8244 7.8773 7.8773 7.9066 7.9066 8.0617 8.0617 8.1059 8.1059 8.2174 8.2174 8.3413 8.3413 8.5190 8.5190 8.6229 8.6229 8.8599 8.8599 8.9658 8.9658 9.1914 9.1914 9.6023 9.6023 10.0690 10.0690 10.2877 10.2877 10.7753 10.7753 11.2342 11.2342 13.6540 13.6540 13.8705 13.8705 14.9955 14.9955 15.8888 15.8888 k = 0.0593 0.0593 0.3187 ( 3036 PWs) bands (ev): -1.4370 -1.4370 -1.2187 -1.2187 5.0560 5.0560 5.4969 5.4969 6.5170 6.5170 6.5953 6.5953 6.9576 6.9576 7.2060 7.2060 7.6381 7.6381 7.6783 7.6783 7.7059 7.7059 7.8392 7.8392 7.8835 7.8835 7.9134 7.9134 8.0603 8.0603 8.1035 8.1035 8.2051 8.2051 8.3301 8.3301 8.5104 8.5104 8.6239 8.6239 8.8629 8.8629 8.9729 8.9729 9.1427 9.1427 9.6249 9.6249 10.1120 10.1120 10.3064 10.3064 10.8076 10.8076 11.1759 11.1759 13.5353 13.5353 13.8112 13.8112 15.0294 15.0294 15.8511 15.8511 k = 0.0508 0.0508 0.3187 ( 3036 PWs) bands (ev): -1.4501 -1.4501 -1.2318 -1.2318 5.0595 5.0595 5.4990 5.4990 6.5345 6.5345 6.5951 6.5951 6.9548 6.9548 7.2327 7.2327 7.6580 7.6580 7.6928 7.6928 7.7369 7.7369 7.8572 7.8572 7.8918 7.8918 7.9186 7.9186 8.0587 8.0587 8.1022 8.1022 8.1918 8.1918 8.3170 8.3170 8.5023 8.5023 8.6250 8.6250 8.8655 8.8655 8.9790 8.9790 9.0991 9.0991 9.6468 9.6468 10.1510 10.1510 10.3250 10.3250 10.8355 10.8355 11.1221 11.1221 13.4284 13.4284 13.7602 13.7602 15.0595 15.0595 15.8164 15.8164 k = 0.0424 0.0424 0.3187 ( 3036 PWs) bands (ev): -1.4612 -1.4612 -1.2430 -1.2430 5.0620 5.0620 5.5008 5.5008 6.5493 6.5493 6.5952 6.5952 6.9524 6.9524 7.2558 7.2558 7.6757 7.6757 7.7029 7.7029 7.7643 7.7643 7.8737 7.8737 7.9059 7.9059 7.9232 7.9232 8.0570 8.0570 8.1023 8.1023 8.1776 8.1776 8.3020 8.3020 8.4950 8.4950 8.6260 8.6260 8.8676 8.8676 8.9833 8.9833 9.0617 9.0617 9.6673 9.6673 10.1847 10.1847 10.3434 10.3434 10.8580 10.8580 11.0747 11.0747 13.3347 13.3347 13.7172 13.7172 15.0856 15.0856 15.7855 15.7855 k = 0.0339 0.0339 0.3187 ( 3036 PWs) bands (ev): -1.4704 -1.4704 -1.2521 -1.2521 5.0639 5.0639 5.5021 5.5021 6.5611 6.5611 6.5961 6.5961 6.9504 6.9504 7.2752 7.2752 7.6903 7.6903 7.7107 7.7107 7.7868 7.7868 7.8835 7.8835 7.9174 7.9174 7.9393 7.9393 8.0554 8.0554 8.1036 8.1036 8.1626 8.1626 8.2856 8.2856 8.4887 8.4887 8.6269 8.6269 8.8693 8.8693 8.9838 8.9838 9.0332 9.0332 9.6856 9.6856 10.2123 10.2123 10.3611 10.3611 10.8740 10.8740 11.0360 11.0360 13.2555 13.2555 13.6823 13.6823 15.1072 15.1072 15.7593 15.7593 k = 0.0254 0.0254 0.3187 ( 3032 PWs) bands (ev): -1.4775 -1.4775 -1.2593 -1.2593 5.0652 5.0652 5.5032 5.5032 6.5694 6.5694 6.5977 6.5977 6.9490 6.9490 7.2905 7.2905 7.7015 7.7015 7.7168 7.7168 7.8054 7.8054 7.8894 7.8894 7.9174 7.9174 7.9697 7.9697 8.0544 8.0544 8.1059 8.1059 8.1472 8.1472 8.2686 8.2686 8.4836 8.4836 8.6277 8.6277 8.8706 8.8706 8.9770 8.9770 9.0177 9.0177 9.7011 9.7011 10.2334 10.2334 10.3772 10.3772 10.8822 10.8822 11.0084 11.0084 13.1921 13.1921 13.6554 13.6554 15.1243 15.1243 15.7381 15.7381 k = 0.0169 0.0169 0.3187 ( 3032 PWs) bands (ev): -1.4826 -1.4826 -1.2644 -1.2644 5.0661 5.0661 5.5039 5.5039 6.5744 6.5744 6.5999 6.5999 6.9478 6.9478 7.3016 7.3016 7.7092 7.7092 7.7210 7.7210 7.8201 7.8201 7.8940 7.8940 7.9141 7.9141 8.0005 8.0005 8.0548 8.0548 8.1065 8.1065 8.1330 8.1330 8.2526 8.2526 8.4799 8.4799 8.6284 8.6284 8.8715 8.8715 8.9650 8.9650 9.0133 9.0133 9.7129 9.7129 10.2480 10.2480 10.3902 10.3902 10.8830 10.8830 10.9928 10.9928 13.1458 13.1458 13.6362 13.6362 15.1366 15.1366 15.7227 15.7227 k = 0.0085 0.0085 0.3187 ( 3024 PWs) bands (ev): -1.4856 -1.4856 -1.2675 -1.2675 5.0665 5.0665 5.5044 5.5044 6.5769 6.5769 6.6019 6.6019 6.9471 6.9471 7.3084 7.3084 7.7137 7.7137 7.7237 7.7237 7.8302 7.8302 7.8986 7.8986 7.9092 7.9092 8.0240 8.0240 8.0593 8.0593 8.0992 8.0992 8.1259 8.1259 8.2406 8.2406 8.4776 8.4776 8.6289 8.6289 8.8720 8.8720 8.9556 8.9556 9.0127 9.0127 9.7203 9.7203 10.2565 10.2565 10.3987 10.3987 10.8803 10.8803 10.9862 10.9862 13.1176 13.1176 13.6248 13.6248 15.1441 15.1441 15.7132 15.7132 k = 0.0000 0.0000 0.3187 ( 3024 PWs) bands (ev): -1.4867 -1.4867 -1.2685 -1.2685 5.0667 5.0667 5.5046 5.5046 6.5776 6.5776 6.6026 6.6026 6.9469 6.9469 7.3106 7.3106 7.7151 7.7151 7.7245 7.7245 7.8338 7.8338 7.9030 7.9030 7.9045 7.9045 8.0320 8.0320 8.0666 8.0666 8.0897 8.0897 8.1252 8.1252 8.2360 8.2360 8.4768 8.4768 8.6290 8.6290 8.8722 8.8722 8.9522 8.9522 9.0127 9.0127 9.7229 9.7229 10.2594 10.2594 10.4017 10.4017 10.8787 10.8787 10.9846 10.9846 13.1081 13.1081 13.6210 13.6210 15.1465 15.1465 15.7101 15.7101 k = 0.0000 0.5000-0.0000 ( 3024 PWs) bands (ev): -0.5305 -0.5305 -0.5305 -0.5305 4.7140 4.7140 4.7140 4.7140 6.0510 6.0510 6.0510 6.0510 6.7162 6.7162 6.7162 6.7162 7.1506 7.1506 7.1506 7.1506 7.4071 7.4071 7.4071 7.4071 7.8055 7.8055 7.8055 7.8055 8.1461 8.1461 8.1461 8.1461 8.3335 8.3335 8.3335 8.3335 8.4076 8.4076 8.4076 8.4076 8.7064 8.7064 8.7064 8.7064 9.1970 9.1970 9.1970 9.1970 9.6100 9.6100 9.6100 9.6100 12.1920 12.1920 12.1920 12.1920 14.5469 14.5469 14.5469 14.5469 16.2144 16.2144 16.2144 16.2144 k = 0.0000 0.5000 0.0118 ( 3028 PWs) bands (ev): -0.5302 -0.5302 -0.5302 -0.5302 4.7092 4.7092 4.7092 4.7092 6.0546 6.0546 6.0546 6.0546 6.7163 6.7163 6.7163 6.7163 7.1512 7.1512 7.1512 7.1512 7.4071 7.4071 7.4071 7.4071 7.8057 7.8057 7.8057 7.8057 8.1461 8.1461 8.1461 8.1461 8.3336 8.3336 8.3336 8.3336 8.4075 8.4075 8.4075 8.4075 8.7068 8.7068 8.7068 8.7068 9.1949 9.1949 9.1949 9.1949 9.6147 9.6147 9.6147 9.6147 12.1931 12.1931 12.1931 12.1931 14.5456 14.5456 14.5456 14.5456 16.2033 16.2033 16.2033 16.2033 k = 0.0000 0.5000 0.0236 ( 3028 PWs) bands (ev): -0.5292 -0.5292 -0.5292 -0.5292 4.6951 4.6951 4.6951 4.6951 6.0653 6.0653 6.0653 6.0653 6.7166 6.7166 6.7166 6.7166 7.1530 7.1530 7.1530 7.1530 7.4069 7.4069 7.4069 7.4069 7.8061 7.8061 7.8061 7.8061 8.1463 8.1463 8.1463 8.1463 8.3340 8.3340 8.3340 8.3340 8.4076 8.4076 8.4076 8.4076 8.7080 8.7080 8.7080 8.7080 9.1891 9.1891 9.1891 9.1891 9.6284 9.6284 9.6284 9.6284 12.1964 12.1964 12.1964 12.1964 14.5415 14.5415 14.5415 14.5415 16.1712 16.1712 16.1712 16.1712 k = 0.0000 0.5000 0.0354 ( 3028 PWs) bands (ev): -0.5275 -0.5275 -0.5275 -0.5275 4.6723 4.6723 4.6723 4.6723 6.0823 6.0823 6.0823 6.0823 6.7171 6.7171 6.7171 6.7171 7.1559 7.1559 7.1559 7.1559 7.4067 7.4067 7.4067 7.4067 7.8068 7.8068 7.8068 7.8068 8.1466 8.1466 8.1466 8.1466 8.3345 8.3345 8.3345 8.3345 8.4080 8.4080 8.4080 8.4080 8.7101 8.7101 8.7101 8.7101 9.1801 9.1801 9.1801 9.1801 9.6507 9.6507 9.6507 9.6507 12.2018 12.2018 12.2018 12.2018 14.5345 14.5345 14.5345 14.5345 16.1208 16.1208 16.1208 16.1208 k = 0.0000 0.5000 0.0472 ( 3028 PWs) bands (ev): -0.5252 -0.5252 -0.5252 -0.5252 4.6419 4.6419 4.6419 4.6419 6.1046 6.1046 6.1046 6.1046 6.7178 6.7178 6.7178 6.7178 7.1600 7.1600 7.1600 7.1600 7.4063 7.4063 7.4063 7.4063 7.8078 7.8078 7.8078 7.8078 8.1470 8.1470 8.1470 8.1470 8.3349 8.3349 8.3349 8.3349 8.4089 8.4089 8.4089 8.4089 8.7128 8.7128 8.7128 8.7128 9.1686 9.1686 9.1686 9.1686 9.6809 9.6809 9.6809 9.6809 12.2094 12.2094 12.2094 12.2094 14.5239 14.5239 14.5239 14.5239 16.0562 16.0562 16.0562 16.0562 k = 0.0000 0.5000 0.0590 ( 3042 PWs) bands (ev): -0.5223 -0.5223 -0.5223 -0.5223 4.6051 4.6051 4.6051 4.6051 6.1310 6.1310 6.1310 6.1310 6.7187 6.7187 6.7187 6.7187 7.1651 7.1651 7.1651 7.1651 7.4059 7.4059 7.4059 7.4059 7.8090 7.8090 7.8090 7.8090 8.1474 8.1474 8.1474 8.1474 8.3346 8.3346 8.3346 8.3346 8.4106 8.4106 8.4106 8.4106 8.7161 8.7161 8.7161 8.7161 9.1552 9.1552 9.1552 9.1552 9.7183 9.7183 9.7183 9.7183 12.2190 12.2190 12.2190 12.2190 14.5091 14.5091 14.5091 14.5091 15.9814 15.9814 15.9814 15.9814 k = 0.0000 0.5000 0.0708 ( 3038 PWs) bands (ev): -0.5188 -0.5188 -0.5188 -0.5188 4.5631 4.5631 4.5631 4.5631 6.1602 6.1602 6.1602 6.1602 6.7198 6.7198 6.7198 6.7198 7.1713 7.1713 7.1713 7.1713 7.4054 7.4054 7.4054 7.4054 7.8105 7.8105 7.8105 7.8105 8.1482 8.1482 8.1482 8.1482 8.3337 8.3337 8.3337 8.3337 8.4135 8.4135 8.4135 8.4135 8.7200 8.7200 8.7200 8.7200 9.1408 9.1408 9.1408 9.1408 9.7626 9.7626 9.7626 9.7626 12.2305 12.2305 12.2305 12.2305 14.4891 14.4891 14.4891 14.4891 15.9006 15.9006 15.9006 15.9006 k = 0.0000 0.5000 0.0826 ( 3038 PWs) bands (ev): -0.5147 -0.5147 -0.5147 -0.5147 4.5171 4.5171 4.5171 4.5171 6.1912 6.1912 6.1912 6.1912 6.7211 6.7211 6.7211 6.7211 7.1785 7.1785 7.1785 7.1785 7.4049 7.4049 7.4049 7.4049 7.8123 7.8123 7.8123 7.8123 8.1490 8.1490 8.1490 8.1490 8.3319 8.3319 8.3319 8.3319 8.4179 8.4179 8.4179 8.4179 8.7243 8.7243 8.7243 8.7243 9.1256 9.1256 9.1256 9.1256 9.8134 9.8134 9.8134 9.8134 12.2439 12.2439 12.2439 12.2439 14.4627 14.4627 14.4627 14.4627 15.8176 15.8176 15.8176 15.8176 k = 0.0000 0.5000 0.0944 ( 3036 PWs) bands (ev): -0.5102 -0.5102 -0.5102 -0.5102 4.4683 4.4683 4.4683 4.4683 6.2228 6.2228 6.2228 6.2228 6.7226 6.7226 6.7226 6.7226 7.1866 7.1866 7.1866 7.1866 7.4043 7.4043 7.4043 7.4043 7.8142 7.8142 7.8142 7.8142 8.1500 8.1500 8.1500 8.1500 8.3291 8.3291 8.3291 8.3291 8.4236 8.4236 8.4236 8.4236 8.7289 8.7289 8.7289 8.7289 9.1101 9.1101 9.1101 9.1101 9.8704 9.8704 9.8704 9.8704 12.2590 12.2590 12.2590 12.2590 14.4286 14.4286 14.4286 14.4286 15.7355 15.7355 15.7355 15.7355 k = 0.0000 0.5000 0.1062 ( 3036 PWs) bands (ev): -0.5052 -0.5052 -0.5052 -0.5052 4.4176 4.4176 4.4176 4.4176 6.2542 6.2542 6.2542 6.2542 6.7241 6.7241 6.7241 6.7241 7.1954 7.1954 7.1954 7.1954 7.4037 7.4037 7.4037 7.4037 7.8163 7.8163 7.8163 7.8163 8.1512 8.1512 8.1512 8.1512 8.3254 8.3254 8.3254 8.3254 8.4306 8.4306 8.4306 8.4306 8.7338 8.7338 8.7338 8.7338 9.0944 9.0944 9.0944 9.0944 9.9336 9.9336 9.9336 9.9336 12.2758 12.2758 12.2758 12.2758 14.3852 14.3852 14.3852 14.3852 15.6576 15.6576 15.6576 15.6576 k = 0.0000 0.5000 0.1181 ( 3036 PWs) bands (ev): -0.4998 -0.4998 -0.4998 -0.4998 4.3660 4.3660 4.3660 4.3660 6.2847 6.2847 6.2847 6.2847 6.7259 6.7259 6.7259 6.7259 7.2048 7.2048 7.2048 7.2048 7.4031 7.4031 7.4031 7.4031 7.8185 7.8185 7.8185 7.8185 8.1524 8.1524 8.1524 8.1524 8.3211 8.3211 8.3211 8.3211 8.4387 8.4387 8.4387 8.4387 8.7387 8.7387 8.7387 8.7387 9.0788 9.0788 9.0788 9.0788 10.0028 10.0028 10.0028 10.0028 12.2939 12.2939 12.2939 12.2939 14.3313 14.3313 14.3313 14.3313 15.5862 15.5862 15.5862 15.5862 k = 0.0000 0.5000 0.1299 ( 3042 PWs) bands (ev): -0.4941 -0.4941 -0.4941 -0.4941 4.3142 4.3142 4.3142 4.3142 6.3137 6.3137 6.3137 6.3137 6.7276 6.7276 6.7276 6.7276 7.2145 7.2145 7.2145 7.2145 7.4025 7.4025 7.4025 7.4025 7.8208 7.8208 7.8208 7.8208 8.1538 8.1538 8.1538 8.1538 8.3163 8.3163 8.3163 8.3163 8.4477 8.4477 8.4477 8.4477 8.7436 8.7436 8.7436 8.7436 9.0634 9.0634 9.0634 9.0634 10.0779 10.0779 10.0779 10.0779 12.3133 12.3133 12.3133 12.3133 14.2657 14.2657 14.2657 14.2657 15.5234 15.5234 15.5234 15.5234 k = 0.0000 0.5000 0.1417 ( 3042 PWs) bands (ev): -0.4882 -0.4882 -0.4882 -0.4882 4.2629 4.2629 4.2629 4.2629 6.3409 6.3409 6.3409 6.3409 6.7295 6.7295 6.7295 6.7295 7.2245 7.2245 7.2245 7.2245 7.4020 7.4020 7.4020 7.4020 7.8233 7.8233 7.8233 7.8233 8.1552 8.1552 8.1552 8.1552 8.3113 8.3113 8.3113 8.3113 8.4573 8.4573 8.4573 8.4573 8.7486 8.7486 8.7486 8.7486 9.0483 9.0483 9.0483 9.0483 10.1589 10.1589 10.1589 10.1589 12.3338 12.3338 12.3338 12.3338 14.1880 14.1880 14.1880 14.1880 15.4703 15.4703 15.4703 15.4703 k = 0.0000 0.5000 0.1535 ( 3042 PWs) bands (ev): -0.4821 -0.4821 -0.4821 -0.4821 4.2126 4.2126 4.2126 4.2126 6.3661 6.3661 6.3661 6.3661 6.7315 6.7315 6.7315 6.7315 7.2346 7.2346 7.2346 7.2346 7.4016 7.4016 7.4016 7.4016 7.8257 7.8257 7.8257 7.8257 8.1567 8.1567 8.1567 8.1567 8.3061 8.3061 8.3061 8.3061 8.4674 8.4674 8.4674 8.4674 8.7533 8.7533 8.7533 8.7533 9.0336 9.0336 9.0336 9.0336 10.2456 10.2456 10.2456 10.2456 12.3550 12.3550 12.3550 12.3550 14.0985 14.0985 14.0985 14.0985 15.4271 15.4271 15.4271 15.4271 k = 0.0000 0.5000 0.1653 ( 3050 PWs) bands (ev): -0.4760 -0.4760 -0.4760 -0.4760 4.1639 4.1639 4.1639 4.1639 6.3891 6.3891 6.3891 6.3891 6.7334 6.7334 6.7334 6.7334 7.2445 7.2445 7.2445 7.2445 7.4012 7.4012 7.4012 7.4012 7.8282 7.8282 7.8282 7.8282 8.1582 8.1582 8.1582 8.1582 8.3010 8.3010 8.3010 8.3010 8.4776 8.4776 8.4776 8.4776 8.7577 8.7577 8.7577 8.7577 9.0193 9.0193 9.0193 9.0193 10.3379 10.3379 10.3379 10.3379 12.3768 12.3768 12.3768 12.3768 13.9980 13.9980 13.9980 13.9980 15.3935 15.3935 15.3935 15.3935 k = 0.0000 0.5000 0.1771 ( 3054 PWs) bands (ev): -0.4698 -0.4698 -0.4698 -0.4698 4.1171 4.1171 4.1171 4.1171 6.4098 6.4098 6.4098 6.4098 6.7354 6.7354 6.7354 6.7354 7.2539 7.2539 7.2539 7.2539 7.4011 7.4011 7.4011 7.4011 7.8306 7.8306 7.8306 7.8306 8.1597 8.1597 8.1597 8.1597 8.2962 8.2962 8.2962 8.2962 8.4880 8.4880 8.4880 8.4880 8.7620 8.7620 8.7620 8.7620 9.0055 9.0055 9.0055 9.0055 10.4355 10.4355 10.4355 10.4355 12.3989 12.3989 12.3989 12.3989 13.8878 13.8878 13.8878 13.8878 15.3686 15.3686 15.3686 15.3686 k = 0.0000 0.5000 0.1889 ( 3054 PWs) bands (ev): -0.4637 -0.4637 -0.4637 -0.4637 4.0729 4.0729 4.0729 4.0729 6.4283 6.4283 6.4283 6.4283 6.7374 6.7374 6.7374 6.7374 7.2630 7.2630 7.2630 7.2630 7.4011 7.4011 7.4011 7.4011 7.8331 7.8331 7.8331 7.8331 8.1612 8.1612 8.1612 8.1612 8.2916 8.2916 8.2916 8.2916 8.4983 8.4983 8.4983 8.4983 8.7658 8.7658 8.7658 8.7658 8.9924 8.9924 8.9924 8.9924 10.5380 10.5380 10.5380 10.5380 12.4209 12.4209 12.4209 12.4209 13.7696 13.7696 13.7696 13.7696 15.3510 15.3510 15.3510 15.3510 k = 0.0000 0.5000 0.2007 ( 3046 PWs) bands (ev): -0.4578 -0.4578 -0.4578 -0.4578 4.0313 4.0313 4.0313 4.0313 6.4448 6.4448 6.4448 6.4448 6.7394 6.7394 6.7394 6.7394 7.2713 7.2713 7.2713 7.2713 7.4013 7.4013 7.4013 7.4013 7.8354 7.8354 7.8354 7.8354 8.1625 8.1625 8.1625 8.1625 8.2874 8.2874 8.2874 8.2874 8.5084 8.5084 8.5084 8.5084 8.7694 8.7694 8.7694 8.7694 8.9799 8.9799 8.9799 8.9799 10.6451 10.6451 10.6451 10.6451 12.4426 12.4426 12.4426 12.4426 13.6450 13.6450 13.6450 13.6450 15.3395 15.3395 15.3395 15.3395 k = 0.0000 0.5000 0.2125 ( 3050 PWs) bands (ev): -0.4521 -0.4521 -0.4521 -0.4521 3.9928 3.9928 3.9928 3.9928 6.4590 6.4590 6.4590 6.4590 6.7412 6.7412 6.7412 6.7412 7.2789 7.2789 7.2789 7.2789 7.4017 7.4017 7.4017 7.4017 7.8376 7.8376 7.8376 7.8376 8.1636 8.1636 8.1636 8.1636 8.2837 8.2837 8.2837 8.2837 8.5181 8.5181 8.5181 8.5181 8.7724 8.7724 8.7724 8.7724 8.9683 8.9683 8.9683 8.9683 10.7561 10.7561 10.7561 10.7561 12.4636 12.4636 12.4636 12.4636 13.5157 13.5157 13.5157 13.5157 15.3328 15.3328 15.3328 15.3328 k = 0.0000 0.5000 0.2243 ( 3042 PWs) bands (ev): -0.4468 -0.4468 -0.4468 -0.4468 3.9577 3.9577 3.9577 3.9577 6.4714 6.4714 6.4714 6.4714 6.7430 6.7430 6.7430 6.7430 7.2857 7.2857 7.2857 7.2857 7.4024 7.4024 7.4024 7.4024 7.8396 7.8396 7.8396 7.8396 8.1648 8.1648 8.1648 8.1648 8.2804 8.2804 8.2804 8.2804 8.5274 8.5274 8.5274 8.5274 8.7751 8.7751 8.7751 8.7751 8.9575 8.9575 8.9575 8.9575 10.8704 10.8704 10.8704 10.8704 12.4836 12.4836 12.4836 12.4836 13.3833 13.3833 13.3833 13.3833 15.3298 15.3298 15.3298 15.3298 k = 0.0000 0.5000 0.2361 ( 3026 PWs) bands (ev): -0.4419 -0.4419 -0.4419 -0.4419 3.9262 3.9262 3.9262 3.9262 6.4821 6.4821 6.4821 6.4821 6.7446 6.7446 6.7446 6.7446 7.2916 7.2916 7.2916 7.2916 7.4032 7.4032 7.4032 7.4032 7.8416 7.8416 7.8416 7.8416 8.1657 8.1657 8.1657 8.1657 8.2777 8.2777 8.2777 8.2777 8.5362 8.5362 8.5362 8.5362 8.7772 8.7772 8.7772 8.7772 8.9479 8.9479 8.9479 8.9479 10.9870 10.9870 10.9870 10.9870 12.5022 12.5022 12.5022 12.5022 13.2495 13.2495 13.2495 13.2495 15.3295 15.3295 15.3295 15.3295 k = 0.0000 0.5000 0.2479 ( 3026 PWs) bands (ev): -0.4375 -0.4375 -0.4375 -0.4375 3.8984 3.8984 3.8984 3.8984 6.4910 6.4910 6.4910 6.4910 6.7460 6.7460 6.7460 6.7460 7.2965 7.2965 7.2965 7.2965 7.4040 7.4040 7.4040 7.4040 7.8432 7.8432 7.8432 7.8432 8.1664 8.1664 8.1664 8.1664 8.2754 8.2754 8.2754 8.2754 8.5441 8.5441 8.5441 8.5441 8.7789 8.7789 8.7789 8.7789 8.9391 8.9391 8.9391 8.9391 11.1046 11.1046 11.1046 11.1046 12.5190 12.5190 12.5190 12.5190 13.1163 13.1163 13.1163 13.1163 15.3310 15.3310 15.3310 15.3310 k = 0.0000 0.5000 0.2597 ( 3038 PWs) bands (ev): -0.4336 -0.4336 -0.4336 -0.4336 3.8746 3.8746 3.8746 3.8746 6.4983 6.4983 6.4983 6.4983 6.7472 6.7472 6.7472 6.7472 7.3004 7.3004 7.3004 7.3004 7.4048 7.4048 7.4048 7.4048 7.8446 7.8446 7.8446 7.8446 8.1668 8.1668 8.1668 8.1668 8.2735 8.2735 8.2735 8.2735 8.5511 8.5511 8.5511 8.5511 8.7801 8.7801 8.7801 8.7801 8.9315 8.9315 8.9315 8.9315 11.2212 11.2212 11.2212 11.2212 12.5334 12.5334 12.5334 12.5334 12.9862 12.9862 12.9862 12.9862 15.3335 15.3335 15.3335 15.3335 k = 0.0000 0.5000 0.2715 ( 3038 PWs) bands (ev): -0.4303 -0.4303 -0.4303 -0.4303 3.8549 3.8549 3.8549 3.8549 6.5042 6.5042 6.5042 6.5042 6.7483 6.7483 6.7483 6.7483 7.3036 7.3036 7.3036 7.3036 7.4056 7.4056 7.4056 7.4056 7.8458 7.8458 7.8458 7.8458 8.1672 8.1672 8.1672 8.1672 8.2721 8.2721 8.2721 8.2721 8.5571 8.5571 8.5571 8.5571 8.7810 8.7810 8.7810 8.7810 8.9253 8.9253 8.9253 8.9253 11.3340 11.3340 11.3340 11.3340 12.5449 12.5449 12.5449 12.5449 12.8627 12.8627 12.8627 12.8627 15.3364 15.3364 15.3364 15.3364 k = 0.0000 0.5000 0.2833 ( 3042 PWs) bands (ev): -0.4278 -0.4278 -0.4278 -0.4278 3.8395 3.8395 3.8395 3.8395 6.5087 6.5087 6.5087 6.5087 6.7491 6.7491 6.7491 6.7491 7.3059 7.3059 7.3059 7.3059 7.4063 7.4063 7.4063 7.4063 7.8467 7.8467 7.8467 7.8467 8.1674 8.1674 8.1674 8.1674 8.2710 8.2710 8.2710 8.2710 8.5620 8.5620 8.5620 8.5620 8.7816 8.7816 8.7816 8.7816 8.9203 8.9203 8.9203 8.9203 11.4385 11.4385 11.4385 11.4385 12.5523 12.5523 12.5523 12.5523 12.7517 12.7517 12.7517 12.7517 15.3391 15.3391 15.3391 15.3391 k = 0.0000 0.5000 0.2951 ( 3040 PWs) bands (ev): -0.4259 -0.4259 -0.4259 -0.4259 3.8284 3.8284 3.8284 3.8284 6.5119 6.5119 6.5119 6.5119 6.7497 6.7497 6.7497 6.7497 7.3076 7.3076 7.3076 7.3076 7.4069 7.4069 7.4069 7.4069 7.8474 7.8474 7.8474 7.8474 8.1676 8.1676 8.1676 8.1676 8.2703 8.2703 8.2703 8.2703 8.5656 8.5656 8.5656 8.5656 8.7819 8.7819 8.7819 8.7819 8.9167 8.9167 8.9167 8.9167 11.5273 11.5273 11.5273 11.5273 12.5519 12.5519 12.5519 12.5519 12.6639 12.6639 12.6639 12.6639 15.3413 15.3413 15.3413 15.3413 k = 0.0000 0.5000 0.3069 ( 3034 PWs) bands (ev): -0.4247 -0.4247 -0.4247 -0.4247 3.8217 3.8217 3.8217 3.8217 6.5139 6.5139 6.5139 6.5139 6.7501 6.7501 6.7501 6.7501 7.3086 7.3086 7.3086 7.3086 7.4073 7.4073 7.4073 7.4073 7.8478 7.8478 7.8478 7.8478 8.1676 8.1676 8.1676 8.1676 8.2698 8.2698 8.2698 8.2698 8.5679 8.5679 8.5679 8.5679 8.7821 8.7821 8.7821 8.7821 8.9146 8.9146 8.9146 8.9146 11.5892 11.5892 11.5892 11.5892 12.5377 12.5377 12.5377 12.5377 12.6166 12.6166 12.6166 12.6166 15.3428 15.3428 15.3428 15.3428 k = 0.0000 0.5000 0.3187 ( 3036 PWs) bands (ev): -0.4243 -0.4243 -0.4243 -0.4243 3.8195 3.8195 3.8195 3.8195 6.5145 6.5145 6.5145 6.5145 6.7502 6.7502 6.7502 6.7502 7.3089 7.3089 7.3089 7.3089 7.4074 7.4074 7.4074 7.4074 7.8480 7.8480 7.8480 7.8480 8.1677 8.1677 8.1677 8.1677 8.2697 8.2697 8.2697 8.2697 8.5686 8.5686 8.5686 8.5686 8.7821 8.7821 8.7821 8.7821 8.9138 8.9138 8.9138 8.9138 11.6119 11.6119 11.6119 11.6119 12.5258 12.5258 12.5258 12.5258 12.6060 12.6060 12.6060 12.6060 15.3433 15.3433 15.3433 15.3433 k = 0.5000 0.5000-0.0000 ( 3036 PWs) bands (ev): 0.0820 0.0820 0.0820 0.0820 4.7668 4.7668 4.7668 4.7668 6.4354 6.4354 6.4354 6.4354 7.0473 7.0473 7.0473 7.0473 7.2905 7.2905 7.2905 7.2905 7.7857 7.7857 7.7857 7.7857 7.9066 7.9066 7.9066 7.9066 7.9453 7.9453 7.9453 7.9453 8.0793 8.0793 8.0793 8.0793 8.3482 8.3482 8.3482 8.3482 8.7660 8.7660 8.7660 8.7660 8.9962 8.9962 8.9962 8.9962 9.2291 9.2291 9.2291 9.2291 9.2571 9.2571 9.2571 9.2571 11.2254 11.2254 11.2254 11.2254 14.0206 14.0206 14.0206 14.0206 k = 0.5000 0.5000 0.0118 ( 3036 PWs) bands (ev): 0.0821 0.0821 0.0821 0.0821 4.7676 4.7676 4.7676 4.7676 6.4353 6.4353 6.4353 6.4353 7.0421 7.0421 7.0421 7.0421 7.2933 7.2933 7.2933 7.2933 7.7843 7.7843 7.7843 7.7843 7.9073 7.9073 7.9073 7.9073 7.9412 7.9412 7.9412 7.9412 8.0795 8.0795 8.0795 8.0795 8.3513 8.3513 8.3513 8.3513 8.7660 8.7660 8.7660 8.7660 8.9958 8.9958 8.9958 8.9958 9.2156 9.2156 9.2156 9.2156 9.2705 9.2705 9.2705 9.2705 11.2323 11.2323 11.2323 11.2323 14.0247 14.0247 14.0247 14.0247 k = 0.5000 0.5000 0.0236 ( 3036 PWs) bands (ev): 0.0825 0.0825 0.0825 0.0825 4.7703 4.7703 4.7703 4.7703 6.4349 6.4349 6.4349 6.4349 7.0270 7.0270 7.0270 7.0270 7.3011 7.3011 7.3011 7.3011 7.7804 7.7804 7.7804 7.7804 7.9049 7.9049 7.9049 7.9049 7.9340 7.9340 7.9340 7.9340 8.0804 8.0804 8.0804 8.0804 8.3599 8.3599 8.3599 8.3599 8.7659 8.7659 8.7659 8.7659 8.9944 8.9944 8.9944 8.9944 9.1937 9.1937 9.1937 9.1937 9.2919 9.2919 9.2919 9.2919 11.2529 11.2529 11.2529 11.2529 14.0372 14.0372 14.0372 14.0372 k = 0.5000 0.5000 0.0354 ( 3028 PWs) bands (ev): 0.0832 0.0832 0.0832 0.0832 4.7746 4.7746 4.7746 4.7746 6.4344 6.4344 6.4344 6.4344 7.0039 7.0039 7.0039 7.0039 7.3121 7.3121 7.3121 7.3121 7.7746 7.7746 7.7746 7.7746 7.8877 7.8877 7.8877 7.8877 7.9361 7.9361 7.9361 7.9361 8.0818 8.0818 8.0818 8.0818 8.3728 8.3728 8.3728 8.3728 8.7657 8.7657 8.7657 8.7657 8.9921 8.9921 8.9921 8.9921 9.1710 9.1710 9.1710 9.1710 9.3141 9.3141 9.3141 9.3141 11.2871 11.2871 11.2871 11.2871 14.0580 14.0580 14.0580 14.0580 k = 0.5000 0.5000 0.0472 ( 3016 PWs) bands (ev): 0.0841 0.0841 0.0841 0.0841 4.7807 4.7807 4.7807 4.7807 6.4335 6.4335 6.4335 6.4335 6.9746 6.9746 6.9746 6.9746 7.3248 7.3248 7.3248 7.3248 7.7670 7.7670 7.7670 7.7670 7.8590 7.8590 7.8590 7.8590 7.9456 7.9456 7.9456 7.9456 8.0841 8.0841 8.0841 8.0841 8.3883 8.3883 8.3883 8.3883 8.7655 8.7655 8.7655 8.7655 8.9889 8.9889 8.9889 8.9889 9.1484 9.1484 9.1484 9.1484 9.3360 9.3360 9.3360 9.3360 11.3342 11.3342 11.3342 11.3342 14.0870 14.0870 14.0870 14.0870 k = 0.5000 0.5000 0.0590 ( 3016 PWs) bands (ev): 0.0853 0.0853 0.0853 0.0853 4.7885 4.7885 4.7885 4.7885 6.4323 6.4323 6.4323 6.4323 6.9405 6.9405 6.9405 6.9405 7.3379 7.3379 7.3379 7.3379 7.7566 7.7566 7.7566 7.7566 7.8262 7.8262 7.8262 7.8262 7.9577 7.9577 7.9577 7.9577 8.0873 8.0873 8.0873 8.0873 8.4050 8.4050 8.4050 8.4050 8.7650 8.7650 8.7650 8.7650 8.9845 8.9845 8.9845 8.9845 9.1265 9.1265 9.1265 9.1265 9.3573 9.3573 9.3573 9.3573 11.3940 11.3940 11.3940 11.3940 14.1241 14.1241 14.1241 14.1241 k = 0.5000 0.5000 0.0708 ( 3016 PWs) bands (ev): 0.0867 0.0867 0.0867 0.0867 4.7979 4.7979 4.7979 4.7979 6.4308 6.4308 6.4308 6.4308 6.9028 6.9028 6.9028 6.9028 7.3506 7.3506 7.3506 7.3506 7.7392 7.7392 7.7392 7.7392 7.7965 7.7965 7.7965 7.7965 7.9705 7.9705 7.9705 7.9705 8.0917 8.0917 8.0917 8.0917 8.4221 8.4221 8.4221 8.4221 8.7644 8.7644 8.7644 8.7644 8.9789 8.9789 8.9789 8.9789 9.1057 9.1057 9.1057 9.1057 9.3779 9.3779 9.3779 9.3779 11.4656 11.4656 11.4656 11.4656 14.1691 14.1691 14.1691 14.1691 k = 0.5000 0.5000 0.0826 ( 3012 PWs) bands (ev): 0.0883 0.0883 0.0883 0.0883 4.8089 4.8089 4.8089 4.8089 6.4291 6.4291 6.4291 6.4291 6.8622 6.8622 6.8622 6.8622 7.3625 7.3625 7.3625 7.3625 7.7087 7.7087 7.7087 7.7087 7.7777 7.7777 7.7777 7.7777 7.9831 7.9831 7.9831 7.9831 8.0976 8.0976 8.0976 8.0976 8.4388 8.4388 8.4388 8.4388 8.7636 8.7636 8.7636 8.7636 8.9718 8.9718 8.9718 8.9718 9.0864 9.0864 9.0864 9.0864 9.3976 9.3976 9.3976 9.3976 11.5485 11.5485 11.5485 11.5485 14.2219 14.2219 14.2219 14.2219 k = 0.5000 0.5000 0.0944 ( 3020 PWs) bands (ev): 0.0900 0.0900 0.0900 0.0900 4.8214 4.8214 4.8214 4.8214 6.4271 6.4271 6.4271 6.4271 6.8194 6.8194 6.8194 6.8194 7.3733 7.3733 7.3733 7.3733 7.6681 7.6681 7.6681 7.6681 7.7680 7.7680 7.7680 7.7680 7.9945 7.9945 7.9945 7.9945 8.1053 8.1053 8.1053 8.1053 8.4546 8.4546 8.4546 8.4546 8.7624 8.7624 8.7624 8.7624 8.9632 8.9632 8.9632 8.9632 9.0691 9.0691 9.0691 9.0691 9.4164 9.4164 9.4164 9.4164 11.6420 11.6420 11.6420 11.6420 14.2823 14.2823 14.2823 14.2823 k = 0.5000 0.5000 0.1062 ( 3020 PWs) bands (ev): 0.0920 0.0920 0.0920 0.0920 4.8355 4.8355 4.8355 4.8355 6.4248 6.4248 6.4248 6.4248 6.7750 6.7750 6.7750 6.7750 7.3830 7.3830 7.3830 7.3830 7.6234 7.6234 7.6234 7.6234 7.7626 7.7626 7.7626 7.7626 8.0044 8.0044 8.0044 8.0044 8.1149 8.1149 8.1149 8.1149 8.4697 8.4697 8.4697 8.4697 8.7609 8.7609 8.7609 8.7609 8.9529 8.9529 8.9529 8.9529 9.0540 9.0540 9.0540 9.0540 9.4343 9.4343 9.4343 9.4343 11.7453 11.7453 11.7453 11.7453 14.3500 14.3500 14.3500 14.3500 k = 0.5000 0.5000 0.1181 ( 3012 PWs) bands (ev): 0.0941 0.0941 0.0941 0.0941 4.8510 4.8510 4.8510 4.8510 6.4222 6.4222 6.4222 6.4222 6.7293 6.7293 6.7293 6.7293 7.3913 7.3913 7.3913 7.3913 7.5774 7.5774 7.5774 7.5774 7.7594 7.7594 7.7594 7.7594 8.0125 8.0125 8.0125 8.0125 8.1264 8.1264 8.1264 8.1264 8.4836 8.4836 8.4836 8.4836 8.7589 8.7589 8.7589 8.7589 8.9412 8.9412 8.9412 8.9412 9.0414 9.0414 9.0414 9.0414 9.4512 9.4512 9.4512 9.4512 11.8577 11.8577 11.8577 11.8577 14.4247 14.4247 14.4247 14.4247 k = 0.5000 0.5000 0.1299 ( 3020 PWs) bands (ev): 0.0963 0.0963 0.0963 0.0963 4.8678 4.8678 4.8678 4.8678 6.4193 6.4193 6.4193 6.4193 6.6828 6.6828 6.6828 6.6828 7.3984 7.3984 7.3984 7.3984 7.5315 7.5315 7.5315 7.5315 7.7576 7.7576 7.7576 7.7576 8.0187 8.0187 8.0187 8.0187 8.1394 8.1394 8.1394 8.1394 8.4965 8.4965 8.4965 8.4965 8.7562 8.7562 8.7562 8.7562 8.9282 8.9282 8.9282 8.9282 9.0309 9.0309 9.0309 9.0309 9.4670 9.4670 9.4670 9.4670 11.9785 11.9785 11.9785 11.9785 14.5063 14.5063 14.5063 14.5063 k = 0.5000 0.5000 0.1417 ( 3020 PWs) bands (ev): 0.0986 0.0986 0.0986 0.0986 4.8858 4.8858 4.8858 4.8858 6.4160 6.4160 6.4160 6.4160 6.6358 6.6358 6.6358 6.6358 7.4040 7.4040 7.4040 7.4040 7.4869 7.4869 7.4869 7.4869 7.7569 7.7569 7.7569 7.7569 8.0235 8.0235 8.0235 8.0235 8.1535 8.1535 8.1535 8.1535 8.5084 8.5084 8.5084 8.5084 8.7528 8.7528 8.7528 8.7528 8.9147 8.9147 8.9147 8.9147 9.0224 9.0224 9.0224 9.0224 9.4818 9.4818 9.4818 9.4818 12.1071 12.1071 12.1071 12.1071 14.5943 14.5943 14.5943 14.5943 k = 0.5000 0.5000 0.1535 ( 3032 PWs) bands (ev): 0.1009 0.1009 0.1009 0.1009 4.9049 4.9049 4.9049 4.9049 6.4123 6.4123 6.4123 6.4123 6.5889 6.5889 6.5889 6.5889 7.4064 7.4064 7.4064 7.4064 7.4457 7.4457 7.4457 7.4457 7.7570 7.7570 7.7570 7.7570 8.0270 8.0270 8.0270 8.0270 8.1682 8.1682 8.1682 8.1682 8.5192 8.5192 8.5192 8.5192 8.7486 8.7486 8.7486 8.7486 8.9014 8.9014 8.9014 8.9014 9.0152 9.0152 9.0152 9.0152 9.4956 9.4956 9.4956 9.4956 12.2428 12.2428 12.2428 12.2428 14.6885 14.6885 14.6885 14.6885 k = 0.5000 0.5000 0.1653 ( 3024 PWs) bands (ev): 0.1033 0.1033 0.1033 0.1033 4.9249 4.9249 4.9249 4.9249 6.4081 6.4081 6.4081 6.4081 6.5427 6.5427 6.5427 6.5427 7.3912 7.3912 7.3912 7.3912 7.4234 7.4234 7.4234 7.4234 7.7579 7.7579 7.7579 7.7579 8.0298 8.0298 8.0298 8.0298 8.1833 8.1833 8.1833 8.1833 8.5292 8.5292 8.5292 8.5292 8.7434 8.7434 8.7434 8.7434 8.8888 8.8888 8.8888 8.8888 9.0093 9.0093 9.0093 9.0093 9.5083 9.5083 9.5083 9.5083 12.3851 12.3851 12.3851 12.3851 14.7884 14.7884 14.7884 14.7884 k = 0.5000 0.5000 0.1771 ( 3032 PWs) bands (ev): 0.1056 0.1056 0.1056 0.1056 4.9456 4.9456 4.9456 4.9456 6.4028 6.4028 6.4028 6.4028 6.4979 6.4979 6.4979 6.4979 7.3554 7.3554 7.3554 7.3554 7.4229 7.4229 7.4229 7.4229 7.7593 7.7593 7.7593 7.7593 8.0318 8.0318 8.0318 8.0318 8.1981 8.1981 8.1981 8.1981 8.5382 8.5382 8.5382 8.5382 8.7372 8.7372 8.7372 8.7372 8.8772 8.8772 8.8772 8.8772 9.0042 9.0042 9.0042 9.0042 9.5200 9.5200 9.5200 9.5200 12.5333 12.5333 12.5333 12.5333 14.8936 14.8936 14.8936 14.8936 k = 0.5000 0.5000 0.1889 ( 3032 PWs) bands (ev): 0.1079 0.1079 0.1079 0.1079 4.9668 4.9668 4.9668 4.9668 6.3949 6.3949 6.3949 6.3949 6.4566 6.4566 6.4566 6.4566 7.3189 7.3189 7.3189 7.3189 7.4250 7.4250 7.4250 7.4250 7.7612 7.7612 7.7612 7.7612 8.0334 8.0334 8.0334 8.0334 8.2126 8.2126 8.2126 8.2126 8.5465 8.5465 8.5465 8.5465 8.7300 8.7300 8.7300 8.7300 8.8670 8.8670 8.8670 8.8670 8.9999 8.9999 8.9999 8.9999 9.5306 9.5306 9.5306 9.5306 12.6868 12.6868 12.6868 12.6868 15.0035 15.0035 15.0035 15.0035 k = 0.5000 0.5000 0.2007 ( 3028 PWs) bands (ev): 0.1102 0.1102 0.1102 0.1102 4.9884 4.9884 4.9884 4.9884 6.3787 6.3787 6.3787 6.3787 6.4249 6.4249 6.4249 6.4249 7.2846 7.2846 7.2846 7.2846 7.4272 7.4272 7.4272 7.4272 7.7634 7.7634 7.7634 7.7634 8.0345 8.0345 8.0345 8.0345 8.2265 8.2265 8.2265 8.2265 8.5539 8.5539 8.5539 8.5539 8.7219 8.7219 8.7219 8.7219 8.8584 8.8584 8.8584 8.8584 8.9961 8.9961 8.9961 8.9961 9.5403 9.5403 9.5403 9.5403 12.8449 12.8449 12.8449 12.8449 15.1177 15.1177 15.1177 15.1177 k = 0.5000 0.5000 0.2125 ( 3028 PWs) bands (ev): 0.1123 0.1123 0.1123 0.1123 5.0099 5.0099 5.0099 5.0099 6.3486 6.3486 6.3486 6.3486 6.4089 6.4089 6.4089 6.4089 7.2529 7.2529 7.2529 7.2529 7.4290 7.4290 7.4290 7.4290 7.7657 7.7657 7.7657 7.7657 8.0355 8.0355 8.0355 8.0355 8.2396 8.2396 8.2396 8.2396 8.5606 8.5606 8.5606 8.5606 8.7132 8.7132 8.7132 8.7132 8.8513 8.8513 8.8513 8.8513 8.9928 8.9928 8.9928 8.9928 9.5489 9.5489 9.5489 9.5489 13.0070 13.0070 13.0070 13.0070 15.2352 15.2352 15.2352 15.2352 k = 0.5000 0.5000 0.2243 ( 3032 PWs) bands (ev): 0.1143 0.1143 0.1143 0.1143 5.0310 5.0310 5.0310 5.0310 6.3126 6.3126 6.3126 6.3126 6.4012 6.4012 6.4012 6.4012 7.2243 7.2243 7.2243 7.2243 7.4305 7.4305 7.4305 7.4305 7.7681 7.7681 7.7681 7.7681 8.0361 8.0361 8.0361 8.0361 8.2518 8.2518 8.2518 8.2518 8.5666 8.5666 8.5666 8.5666 8.7042 8.7042 8.7042 8.7042 8.8455 8.8455 8.8455 8.8455 8.9898 8.9898 8.9898 8.9898 9.5566 9.5566 9.5566 9.5566 13.1722 13.1722 13.1722 13.1722 15.3552 15.3552 15.3552 15.3552 k = 0.5000 0.5000 0.2361 ( 3032 PWs) bands (ev): 0.1161 0.1161 0.1161 0.1161 5.0514 5.0514 5.0514 5.0514 6.2769 6.2769 6.2769 6.2769 6.3960 6.3960 6.3960 6.3960 7.1988 7.1988 7.1988 7.1988 7.4318 7.4318 7.4318 7.4318 7.7705 7.7705 7.7705 7.7705 8.0367 8.0367 8.0367 8.0367 8.2629 8.2629 8.2629 8.2629 8.5719 8.5719 8.5719 8.5719 8.6952 8.6952 8.6952 8.6952 8.8409 8.8409 8.8409 8.8409 8.9873 8.9873 8.9873 8.9873 9.5633 9.5633 9.5633 9.5633 13.3393 13.3393 13.3393 13.3393 15.4764 15.4764 15.4764 15.4764 k = 0.5000 0.5000 0.2479 ( 3032 PWs) bands (ev): 0.1178 0.1178 0.1178 0.1178 5.0706 5.0706 5.0706 5.0706 6.2436 6.2436 6.2436 6.2436 6.3919 6.3919 6.3919 6.3919 7.1767 7.1767 7.1767 7.1767 7.4328 7.4328 7.4328 7.4328 7.7728 7.7728 7.7728 7.7728 8.0371 8.0371 8.0371 8.0371 8.2728 8.2728 8.2728 8.2728 8.5765 8.5765 8.5765 8.5765 8.6866 8.6866 8.6866 8.6866 8.8372 8.8372 8.8372 8.8372 8.9852 8.9852 8.9852 8.9852 9.5691 9.5691 9.5691 9.5691 13.5069 13.5069 13.5069 13.5069 15.5969 15.5969 15.5969 15.5969 k = 0.5000 0.5000 0.2597 ( 3032 PWs) bands (ev): 0.1192 0.1192 0.1192 0.1192 5.0881 5.0881 5.0881 5.0881 6.2139 6.2139 6.2139 6.2139 6.3885 6.3885 6.3885 6.3885 7.1579 7.1579 7.1579 7.1579 7.4335 7.4335 7.4335 7.4335 7.7749 7.7749 7.7749 7.7749 8.0374 8.0374 8.0374 8.0374 8.2814 8.2814 8.2814 8.2814 8.5804 8.5804 8.5804 8.5804 8.6787 8.6787 8.6787 8.6787 8.8344 8.8344 8.8344 8.8344 8.9833 8.9833 8.9833 8.9833 9.5740 9.5740 9.5740 9.5740 13.6727 13.6727 13.6727 13.6727 15.7140 15.7140 15.7140 15.7140 k = 0.5000 0.5000 0.2715 ( 3040 PWs) bands (ev): 0.1204 0.1204 0.1204 0.1204 5.1033 5.1033 5.1033 5.1033 6.1883 6.1883 6.1883 6.1883 6.3857 6.3857 6.3857 6.3857 7.1424 7.1424 7.1424 7.1424 7.4340 7.4340 7.4340 7.4340 7.7767 7.7767 7.7767 7.7767 8.0376 8.0376 8.0376 8.0376 8.2887 8.2887 8.2887 8.2887 8.5836 8.5836 8.5836 8.5836 8.6718 8.6718 8.6718 8.6718 8.8323 8.8323 8.8323 8.8323 8.9818 8.9818 8.9818 8.9818 9.5779 9.5779 9.5779 9.5779 13.8331 13.8331 13.8331 13.8331 15.8202 15.8202 15.8202 15.8202 k = 0.5000 0.5000 0.2833 ( 3048 PWs) bands (ev): 0.1213 0.1213 0.1213 0.1213 5.1159 5.1159 5.1159 5.1159 6.1677 6.1677 6.1677 6.1677 6.3835 6.3835 6.3835 6.3835 7.1304 7.1304 7.1304 7.1304 7.4345 7.4345 7.4345 7.4345 7.7780 7.7780 7.7780 7.7780 8.0375 8.0375 8.0375 8.0375 8.2944 8.2944 8.2944 8.2944 8.5862 8.5862 8.5862 8.5862 8.6661 8.6661 8.6661 8.6661 8.8307 8.8307 8.8307 8.8307 8.9806 8.9806 8.9806 8.9806 9.5810 9.5810 9.5810 9.5810 13.9820 13.9820 13.9820 13.9820 15.7787 15.7787 15.7787 15.7787 k = 0.5000 0.5000 0.2951 ( 3056 PWs) bands (ev): 0.1220 0.1220 0.1220 0.1220 5.1252 5.1252 5.1252 5.1252 6.1525 6.1525 6.1525 6.1525 6.3819 6.3819 6.3819 6.3819 7.1218 7.1218 7.1218 7.1218 7.4347 7.4347 7.4347 7.4347 7.7790 7.7790 7.7790 7.7790 8.0376 8.0376 8.0376 8.0376 8.2986 8.2986 8.2986 8.2986 8.5880 8.5880 8.5880 8.5880 8.6618 8.6618 8.6618 8.6618 8.8296 8.8296 8.8296 8.8296 8.9798 8.9798 8.9798 8.9798 9.5831 9.5831 9.5831 9.5831 14.1094 14.1094 14.1094 14.1094 15.6379 15.6379 15.6379 15.6379 k = 0.5000 0.5000 0.3069 ( 3048 PWs) bands (ev): 0.1224 0.1224 0.1224 0.1224 5.1310 5.1310 5.1310 5.1310 6.1432 6.1432 6.1432 6.1432 6.3809 6.3809 6.3809 6.3809 7.1167 7.1167 7.1167 7.1167 7.4349 7.4349 7.4349 7.4349 7.7797 7.7797 7.7797 7.7797 8.0377 8.0377 8.0377 8.0377 8.3012 8.3012 8.3012 8.3012 8.5891 8.5891 8.5891 8.5891 8.6593 8.6593 8.6593 8.6593 8.8291 8.8291 8.8291 8.8291 8.9793 8.9793 8.9793 8.9793 9.5845 9.5845 9.5845 9.5845 14.1993 14.1993 14.1993 14.1993 15.5382 15.5382 15.5382 15.5382 k = 0.5000 0.5000 0.3187 ( 3064 PWs) bands (ev): 0.1226 0.1226 0.1226 0.1226 5.1330 5.1330 5.1330 5.1330 6.1400 6.1400 6.1400 6.1400 6.3806 6.3806 6.3806 6.3806 7.1148 7.1148 7.1148 7.1148 7.4349 7.4349 7.4349 7.4349 7.7798 7.7798 7.7798 7.7798 8.0377 8.0377 8.0377 8.0377 8.3019 8.3019 8.3019 8.3019 8.5894 8.5894 8.5894 8.5894 8.6583 8.6583 8.6583 8.6583 8.8288 8.8288 8.8288 8.8288 8.9791 8.9791 8.9791 8.9791 9.5848 9.5848 9.5848 9.5848 14.2324 14.2324 14.2324 14.2324 15.5016 15.5016 15.5016 15.5016 Writing output data file Cu2As.save init_run : 0.17s CPU 0.27s WALL ( 1 calls) electrons : 135.58s CPU 138.20s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 135.57s CPU 138.19s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.05s CPU 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.04s WALL ( 376 calls) cegterg : 122.07s CPU 124.00s WALL ( 436 calls) Called by sum_band: Called by *egterg: h_psi : 60.92s CPU 62.53s WALL ( 7000 calls) s_psi : 5.88s CPU 6.11s WALL ( 7000 calls) g_psi : 0.23s CPU 0.19s WALL ( 6188 calls) cdiaghg : 51.21s CPU 51.71s WALL ( 6564 calls) cegterg:over : 5.90s CPU 5.86s WALL ( 6188 calls) cegterg:upda : 3.99s CPU 4.04s WALL ( 6188 calls) cegterg:last : 2.88s CPU 2.96s WALL ( 1188 calls) cdiaghg:chol : 2.65s CPU 2.87s WALL ( 6564 calls) cdiaghg:inve : 2.08s CPU 1.94s WALL ( 6564 calls) cdiaghg:para : 3.49s CPU 3.34s WALL ( 13128 calls) Called by h_psi: h_psi:vloc : 47.30s CPU 48.64s WALL ( 7000 calls) h_psi:vnl : 13.41s CPU 13.70s WALL ( 7000 calls) add_vuspsi : 7.45s CPU 7.45s WALL ( 7000 calls) General routines calbec : 5.95s CPU 6.24s WALL ( 7000 calls) fft : 0.00s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 44.20s CPU 45.55s WALL ( 931888 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.18s CPU 0.22s WALL ( 752 calls) Parallel routines fft_scatter : 22.64s CPU 23.47s WALL ( 931911 calls) PWSCF : 2m34.11s CPU 2m49.65s WALL This run was terminated on: 20:38:59 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=