Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:56:44 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: ./PbO2.save/ file Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 62 36 11 1538 672 111 Max 63 37 12 1543 685 115 Sum 2249 1313 401 55429 24419 4071 bravais-lattice index = 14 lattice parameter (alat) = 9.3689 a.u. unit-cell volume = 561.9430 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.368884 celldm(2)= 1.000000 celldm(3)= 0.683327 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 0.683327 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 1.463428 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 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 Pb read from file: /users/gautes/Pseudo/Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 75f9fe62f948a5acf869e43db2c29526 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 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 O 6.00 15.99940 O( 1.00) Pb 14.00 207.20000 Pb( 1.00) 16 Sym. Ops., with inversion, found ( 8 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 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3416636 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3416636 ) 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 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) f =( -0.5000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) f =( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.3416636 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.3416636 ) 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 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(10) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.3416636 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.3416636 ) 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 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(14) = ( 0.0000000 1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3416636 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) f =( -0.5000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) f =( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3416636 ) 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= 368 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027174 k( 2) = ( 0.0000000 0.0156250 -0.0000000), wk = 0.0027174 k( 3) = ( 0.0000000 0.0312500 -0.0000000), wk = 0.0027174 k( 4) = ( 0.0000000 0.0468750 -0.0000000), wk = 0.0027174 k( 5) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0027174 k( 6) = ( 0.0000000 0.0781250 -0.0000000), wk = 0.0027174 k( 7) = ( 0.0000000 0.0937500 -0.0000000), wk = 0.0027174 k( 8) = ( 0.0000000 0.1093750 -0.0000000), wk = 0.0027174 k( 9) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0027174 k( 10) = ( 0.0000000 0.1406250 -0.0000000), wk = 0.0027174 k( 11) = ( 0.0000000 0.1562500 -0.0000000), wk = 0.0027174 k( 12) = ( 0.0000000 0.1718750 -0.0000000), wk = 0.0027174 k( 13) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0027174 k( 14) = ( 0.0000000 0.2031250 -0.0000000), wk = 0.0027174 k( 15) = ( 0.0000000 0.2187500 -0.0000000), wk = 0.0027174 k( 16) = ( 0.0000000 0.2343750 -0.0000000), wk = 0.0027174 k( 17) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0027174 k( 18) = ( 0.0000000 0.2656250 -0.0000000), wk = 0.0027174 k( 19) = ( 0.0000000 0.2812500 -0.0000000), wk = 0.0027174 k( 20) = ( 0.0000000 0.2968750 -0.0000000), wk = 0.0027174 k( 21) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0027174 k( 22) = ( 0.0000000 0.3281250 -0.0000000), wk = 0.0027174 k( 23) = ( 0.0000000 0.3437500 -0.0000000), wk = 0.0027174 k( 24) = ( 0.0000000 0.3593750 -0.0000000), wk = 0.0027174 k( 25) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0027174 k( 26) = ( 0.0000000 0.3906250 -0.0000000), wk = 0.0027174 k( 27) = ( 0.0000000 0.4062500 -0.0000000), wk = 0.0027174 k( 28) = ( 0.0000000 0.4218750 -0.0000000), wk = 0.0027174 k( 29) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0027174 k( 30) = ( 0.0000000 0.4531250 -0.0000000), wk = 0.0027174 k( 31) = ( 0.0000000 0.4687500 -0.0000000), wk = 0.0027174 k( 32) = ( 0.0000000 0.4843750 -0.0000000), wk = 0.0027174 k( 33) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027174 k( 34) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027174 k( 35) = ( 0.0156250 0.5000000 -0.0000000), wk = 0.0027174 k( 36) = ( 0.0312500 0.5000000 -0.0000000), wk = 0.0027174 k( 37) = ( 0.0468750 0.5000000 -0.0000000), wk = 0.0027174 k( 38) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0027174 k( 39) = ( 0.0781250 0.5000000 -0.0000000), wk = 0.0027174 k( 40) = ( 0.0937500 0.5000000 -0.0000000), wk = 0.0027174 k( 41) = ( 0.1093750 0.5000000 -0.0000000), wk = 0.0027174 k( 42) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0027174 k( 43) = ( 0.1406250 0.5000000 -0.0000000), wk = 0.0027174 k( 44) = ( 0.1562500 0.5000000 -0.0000000), wk = 0.0027174 k( 45) = ( 0.1718750 0.5000000 -0.0000000), wk = 0.0027174 k( 46) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0027174 k( 47) = ( 0.2031250 0.5000000 -0.0000000), wk = 0.0027174 k( 48) = ( 0.2187500 0.5000000 -0.0000000), wk = 0.0027174 k( 49) = ( 0.2343750 0.5000000 -0.0000000), wk = 0.0027174 k( 50) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0027174 k( 51) = ( 0.2656250 0.5000000 -0.0000000), wk = 0.0027174 k( 52) = ( 0.2812500 0.5000000 -0.0000000), wk = 0.0027174 k( 53) = ( 0.2968750 0.5000000 -0.0000000), wk = 0.0027174 k( 54) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0027174 k( 55) = ( 0.3281250 0.5000000 -0.0000000), wk = 0.0027174 k( 56) = ( 0.3437500 0.5000000 -0.0000000), wk = 0.0027174 k( 57) = ( 0.3593750 0.5000000 -0.0000000), wk = 0.0027174 k( 58) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0027174 k( 59) = ( 0.3906250 0.5000000 -0.0000000), wk = 0.0027174 k( 60) = ( 0.4062500 0.5000000 -0.0000000), wk = 0.0027174 k( 61) = ( 0.4218750 0.5000000 -0.0000000), wk = 0.0027174 k( 62) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0027174 k( 63) = ( 0.4531250 0.5000000 -0.0000000), wk = 0.0027174 k( 64) = ( 0.4687500 0.5000000 -0.0000000), wk = 0.0027174 k( 65) = ( 0.4843750 0.5000000 -0.0000000), wk = 0.0027174 k( 66) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027174 k( 67) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027174 k( 68) = ( 0.4888889 0.4888889 -0.0000000), wk = 0.0027174 k( 69) = ( 0.4777778 0.4777778 -0.0000000), wk = 0.0027174 k( 70) = ( 0.4666667 0.4666667 -0.0000000), wk = 0.0027174 k( 71) = ( 0.4555556 0.4555556 -0.0000000), wk = 0.0027174 k( 72) = ( 0.4444444 0.4444444 -0.0000000), wk = 0.0027174 k( 73) = ( 0.4333333 0.4333333 -0.0000000), wk = 0.0027174 k( 74) = ( 0.4222222 0.4222222 -0.0000000), wk = 0.0027174 k( 75) = ( 0.4111111 0.4111111 -0.0000000), wk = 0.0027174 k( 76) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0027174 k( 77) = ( 0.3888889 0.3888889 -0.0000000), wk = 0.0027174 k( 78) = ( 0.3777778 0.3777778 -0.0000000), wk = 0.0027174 k( 79) = ( 0.3666667 0.3666667 -0.0000000), wk = 0.0027174 k( 80) = ( 0.3555556 0.3555556 -0.0000000), wk = 0.0027174 k( 81) = ( 0.3444444 0.3444444 -0.0000000), wk = 0.0027174 k( 82) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0027174 k( 83) = ( 0.3222222 0.3222222 -0.0000000), wk = 0.0027174 k( 84) = ( 0.3111111 0.3111111 -0.0000000), wk = 0.0027174 k( 85) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0027174 k( 86) = ( 0.2888889 0.2888889 -0.0000000), wk = 0.0027174 k( 87) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0027174 k( 88) = ( 0.2666667 0.2666667 -0.0000000), wk = 0.0027174 k( 89) = ( 0.2555556 0.2555556 -0.0000000), wk = 0.0027174 k( 90) = ( 0.2444444 0.2444444 -0.0000000), wk = 0.0027174 k( 91) = ( 0.2333333 0.2333333 -0.0000000), wk = 0.0027174 k( 92) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0027174 k( 93) = ( 0.2111111 0.2111111 -0.0000000), wk = 0.0027174 k( 94) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0027174 k( 95) = ( 0.1888889 0.1888889 -0.0000000), wk = 0.0027174 k( 96) = ( 0.1777778 0.1777778 -0.0000000), wk = 0.0027174 k( 97) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0027174 k( 98) = ( 0.1555556 0.1555556 -0.0000000), wk = 0.0027174 k( 99) = ( 0.1444444 0.1444444 -0.0000000), wk = 0.0027174 k( 100) = ( 0.1333333 0.1333333 -0.0000000), wk = 0.0027174 k( 101) = ( 0.1222222 0.1222222 -0.0000000), wk = 0.0027174 k( 102) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0027174 k( 103) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0027174 k( 104) = ( 0.0888889 0.0888889 -0.0000000), wk = 0.0027174 k( 105) = ( 0.0777778 0.0777778 -0.0000000), wk = 0.0027174 k( 106) = ( 0.0666667 0.0666667 -0.0000000), wk = 0.0027174 k( 107) = ( 0.0555556 0.0555556 -0.0000000), wk = 0.0027174 k( 108) = ( 0.0444444 0.0444444 -0.0000000), wk = 0.0027174 k( 109) = ( 0.0333333 0.0333333 -0.0000000), wk = 0.0027174 k( 110) = ( 0.0222222 0.0222222 -0.0000000), wk = 0.0027174 k( 111) = ( 0.0111111 0.0111111 -0.0000000), wk = 0.0027174 k( 112) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027174 k( 113) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027174 k( 114) = ( 0.0000000 0.0000000 0.0155684), wk = 0.0027174 k( 115) = ( 0.0000000 0.0000000 0.0311368), wk = 0.0027174 k( 116) = ( 0.0000000 0.0000000 0.0467051), wk = 0.0027174 k( 117) = ( 0.0000000 0.0000000 0.0622735), wk = 0.0027174 k( 118) = ( 0.0000000 0.0000000 0.0778419), wk = 0.0027174 k( 119) = ( 0.0000000 0.0000000 0.0934103), wk = 0.0027174 k( 120) = ( 0.0000000 0.0000000 0.1089787), wk = 0.0027174 k( 121) = ( 0.0000000 0.0000000 0.1245470), wk = 0.0027174 k( 122) = ( 0.0000000 0.0000000 0.1401154), wk = 0.0027174 k( 123) = ( 0.0000000 0.0000000 0.1556838), wk = 0.0027174 k( 124) = ( 0.0000000 0.0000000 0.1712522), wk = 0.0027174 k( 125) = ( 0.0000000 0.0000000 0.1868205), wk = 0.0027174 k( 126) = ( 0.0000000 0.0000000 0.2023889), wk = 0.0027174 k( 127) = ( 0.0000000 0.0000000 0.2179573), wk = 0.0027174 k( 128) = ( 0.0000000 0.0000000 0.2335257), wk = 0.0027174 k( 129) = ( 0.0000000 0.0000000 0.2490941), wk = 0.0027174 k( 130) = ( 0.0000000 0.0000000 0.2646624), wk = 0.0027174 k( 131) = ( 0.0000000 0.0000000 0.2802308), wk = 0.0027174 k( 132) = ( 0.0000000 0.0000000 0.2957992), wk = 0.0027174 k( 133) = ( 0.0000000 0.0000000 0.3113676), wk = 0.0027174 k( 134) = ( 0.0000000 0.0000000 0.3269360), wk = 0.0027174 k( 135) = ( 0.0000000 0.0000000 0.3425043), wk = 0.0027174 k( 136) = ( 0.0000000 0.0000000 0.3580727), wk = 0.0027174 k( 137) = ( 0.0000000 0.0000000 0.3736411), wk = 0.0027174 k( 138) = ( 0.0000000 0.0000000 0.3892095), wk = 0.0027174 k( 139) = ( 0.0000000 0.0000000 0.4047778), wk = 0.0027174 k( 140) = ( 0.0000000 0.0000000 0.4203462), wk = 0.0027174 k( 141) = ( 0.0000000 0.0000000 0.4359146), wk = 0.0027174 k( 142) = ( 0.0000000 0.0000000 0.4514830), wk = 0.0027174 k( 143) = ( 0.0000000 0.0000000 0.4670514), wk = 0.0027174 k( 144) = ( 0.0000000 0.0000000 0.4826197), wk = 0.0027174 k( 145) = ( 0.0000000 0.0000000 0.4981881), wk = 0.0027174 k( 146) = ( 0.0000000 0.0000000 0.5137565), wk = 0.0027174 k( 147) = ( 0.0000000 0.0000000 0.5293249), wk = 0.0027174 k( 148) = ( 0.0000000 0.0000000 0.5448933), wk = 0.0027174 k( 149) = ( 0.0000000 0.0000000 0.5604616), wk = 0.0027174 k( 150) = ( 0.0000000 0.0000000 0.5760300), wk = 0.0027174 k( 151) = ( 0.0000000 0.0000000 0.5915984), wk = 0.0027174 k( 152) = ( 0.0000000 0.0000000 0.6071668), wk = 0.0027174 k( 153) = ( 0.0000000 0.0000000 0.6227351), wk = 0.0027174 k( 154) = ( 0.0000000 0.0000000 0.6383035), wk = 0.0027174 k( 155) = ( 0.0000000 0.0000000 0.6538719), wk = 0.0027174 k( 156) = ( 0.0000000 0.0000000 0.6694403), wk = 0.0027174 k( 157) = ( 0.0000000 0.0000000 0.6850087), wk = 0.0027174 k( 158) = ( 0.0000000 0.0000000 0.7005770), wk = 0.0027174 k( 159) = ( 0.0000000 0.0000000 0.7161454), wk = 0.0027174 k( 160) = ( 0.0000000 0.0000000 0.7317138), wk = 0.0027174 k( 161) = ( 0.0000000 0.0000000 0.7317138), wk = 0.0027174 k( 162) = ( 0.0000000 0.0156250 0.7317138), wk = 0.0027174 k( 163) = ( 0.0000000 0.0312500 0.7317138), wk = 0.0027174 k( 164) = ( 0.0000000 0.0468750 0.7317138), wk = 0.0027174 k( 165) = ( 0.0000000 0.0625000 0.7317138), wk = 0.0027174 k( 166) = ( 0.0000000 0.0781250 0.7317138), wk = 0.0027174 k( 167) = ( 0.0000000 0.0937500 0.7317138), wk = 0.0027174 k( 168) = ( 0.0000000 0.1093750 0.7317138), wk = 0.0027174 k( 169) = ( 0.0000000 0.1250000 0.7317138), wk = 0.0027174 k( 170) = ( 0.0000000 0.1406250 0.7317138), wk = 0.0027174 k( 171) = ( 0.0000000 0.1562500 0.7317138), wk = 0.0027174 k( 172) = ( 0.0000000 0.1718750 0.7317138), wk = 0.0027174 k( 173) = ( 0.0000000 0.1875000 0.7317138), wk = 0.0027174 k( 174) = ( 0.0000000 0.2031250 0.7317138), wk = 0.0027174 k( 175) = ( 0.0000000 0.2187500 0.7317138), wk = 0.0027174 k( 176) = ( 0.0000000 0.2343750 0.7317138), wk = 0.0027174 k( 177) = ( 0.0000000 0.2500000 0.7317138), wk = 0.0027174 k( 178) = ( 0.0000000 0.2656250 0.7317138), wk = 0.0027174 k( 179) = ( 0.0000000 0.2812500 0.7317138), wk = 0.0027174 k( 180) = ( 0.0000000 0.2968750 0.7317138), wk = 0.0027174 k( 181) = ( 0.0000000 0.3125000 0.7317138), wk = 0.0027174 k( 182) = ( 0.0000000 0.3281250 0.7317138), wk = 0.0027174 k( 183) = ( 0.0000000 0.3437500 0.7317138), wk = 0.0027174 k( 184) = ( 0.0000000 0.3593750 0.7317138), wk = 0.0027174 k( 185) = ( 0.0000000 0.3750000 0.7317138), wk = 0.0027174 k( 186) = ( 0.0000000 0.3906250 0.7317138), wk = 0.0027174 k( 187) = ( 0.0000000 0.4062500 0.7317138), wk = 0.0027174 k( 188) = ( 0.0000000 0.4218750 0.7317138), wk = 0.0027174 k( 189) = ( 0.0000000 0.4375000 0.7317138), wk = 0.0027174 k( 190) = ( 0.0000000 0.4531250 0.7317138), wk = 0.0027174 k( 191) = ( 0.0000000 0.4687500 0.7317138), wk = 0.0027174 k( 192) = ( 0.0000000 0.4843750 0.7317138), wk = 0.0027174 k( 193) = ( 0.0000000 0.5000000 0.7317138), wk = 0.0027174 k( 194) = ( 0.0000000 0.5000000 0.7317138), wk = 0.0027174 k( 195) = ( 0.0156250 0.5000000 0.7317138), wk = 0.0027174 k( 196) = ( 0.0312500 0.5000000 0.7317138), wk = 0.0027174 k( 197) = ( 0.0468750 0.5000000 0.7317138), wk = 0.0027174 k( 198) = ( 0.0625000 0.5000000 0.7317138), wk = 0.0027174 k( 199) = ( 0.0781250 0.5000000 0.7317138), wk = 0.0027174 k( 200) = ( 0.0937500 0.5000000 0.7317138), wk = 0.0027174 k( 201) = ( 0.1093750 0.5000000 0.7317138), wk = 0.0027174 k( 202) = ( 0.1250000 0.5000000 0.7317138), wk = 0.0027174 k( 203) = ( 0.1406250 0.5000000 0.7317138), wk = 0.0027174 k( 204) = ( 0.1562500 0.5000000 0.7317138), wk = 0.0027174 k( 205) = ( 0.1718750 0.5000000 0.7317138), wk = 0.0027174 k( 206) = ( 0.1875000 0.5000000 0.7317138), wk = 0.0027174 k( 207) = ( 0.2031250 0.5000000 0.7317138), wk = 0.0027174 k( 208) = ( 0.2187500 0.5000000 0.7317138), wk = 0.0027174 k( 209) = ( 0.2343750 0.5000000 0.7317138), wk = 0.0027174 k( 210) = ( 0.2500000 0.5000000 0.7317138), wk = 0.0027174 k( 211) = ( 0.2656250 0.5000000 0.7317138), wk = 0.0027174 k( 212) = ( 0.2812500 0.5000000 0.7317138), wk = 0.0027174 k( 213) = ( 0.2968750 0.5000000 0.7317138), wk = 0.0027174 k( 214) = ( 0.3125000 0.5000000 0.7317138), wk = 0.0027174 k( 215) = ( 0.3281250 0.5000000 0.7317138), wk = 0.0027174 k( 216) = ( 0.3437500 0.5000000 0.7317138), wk = 0.0027174 k( 217) = ( 0.3593750 0.5000000 0.7317138), wk = 0.0027174 k( 218) = ( 0.3750000 0.5000000 0.7317138), wk = 0.0027174 k( 219) = ( 0.3906250 0.5000000 0.7317138), wk = 0.0027174 k( 220) = ( 0.4062500 0.5000000 0.7317138), wk = 0.0027174 k( 221) = ( 0.4218750 0.5000000 0.7317138), wk = 0.0027174 k( 222) = ( 0.4375000 0.5000000 0.7317138), wk = 0.0027174 k( 223) = ( 0.4531250 0.5000000 0.7317138), wk = 0.0027174 k( 224) = ( 0.4687500 0.5000000 0.7317138), wk = 0.0027174 k( 225) = ( 0.4843750 0.5000000 0.7317138), wk = 0.0027174 k( 226) = ( 0.5000000 0.5000000 0.7317138), wk = 0.0027174 k( 227) = ( 0.5000000 0.5000000 0.7317138), wk = 0.0027174 k( 228) = ( 0.4888889 0.4888889 0.7317138), wk = 0.0027174 k( 229) = ( 0.4777778 0.4777778 0.7317138), wk = 0.0027174 k( 230) = ( 0.4666667 0.4666667 0.7317138), wk = 0.0027174 k( 231) = ( 0.4555556 0.4555556 0.7317138), wk = 0.0027174 k( 232) = ( 0.4444444 0.4444444 0.7317138), wk = 0.0027174 k( 233) = ( 0.4333333 0.4333333 0.7317138), wk = 0.0027174 k( 234) = ( 0.4222222 0.4222222 0.7317138), wk = 0.0027174 k( 235) = ( 0.4111111 0.4111111 0.7317138), wk = 0.0027174 k( 236) = ( 0.4000000 0.4000000 0.7317138), wk = 0.0027174 k( 237) = ( 0.3888889 0.3888889 0.7317138), wk = 0.0027174 k( 238) = ( 0.3777778 0.3777778 0.7317138), wk = 0.0027174 k( 239) = ( 0.3666667 0.3666667 0.7317138), wk = 0.0027174 k( 240) = ( 0.3555556 0.3555556 0.7317138), wk = 0.0027174 k( 241) = ( 0.3444444 0.3444444 0.7317138), wk = 0.0027174 k( 242) = ( 0.3333333 0.3333333 0.7317138), wk = 0.0027174 k( 243) = ( 0.3222222 0.3222222 0.7317138), wk = 0.0027174 k( 244) = ( 0.3111111 0.3111111 0.7317138), wk = 0.0027174 k( 245) = ( 0.3000000 0.3000000 0.7317138), wk = 0.0027174 k( 246) = ( 0.2888889 0.2888889 0.7317138), wk = 0.0027174 k( 247) = ( 0.2777778 0.2777778 0.7317138), wk = 0.0027174 k( 248) = ( 0.2666667 0.2666667 0.7317138), wk = 0.0027174 k( 249) = ( 0.2555556 0.2555556 0.7317138), wk = 0.0027174 k( 250) = ( 0.2444444 0.2444444 0.7317138), wk = 0.0027174 k( 251) = ( 0.2333333 0.2333333 0.7317138), wk = 0.0027174 k( 252) = ( 0.2222222 0.2222222 0.7317138), wk = 0.0027174 k( 253) = ( 0.2111111 0.2111111 0.7317138), wk = 0.0027174 k( 254) = ( 0.2000000 0.2000000 0.7317138), wk = 0.0027174 k( 255) = ( 0.1888889 0.1888889 0.7317138), wk = 0.0027174 k( 256) = ( 0.1777778 0.1777778 0.7317138), wk = 0.0027174 k( 257) = ( 0.1666667 0.1666667 0.7317138), wk = 0.0027174 k( 258) = ( 0.1555556 0.1555556 0.7317138), wk = 0.0027174 k( 259) = ( 0.1444444 0.1444444 0.7317138), wk = 0.0027174 k( 260) = ( 0.1333333 0.1333333 0.7317138), wk = 0.0027174 k( 261) = ( 0.1222222 0.1222222 0.7317138), wk = 0.0027174 k( 262) = ( 0.1111111 0.1111111 0.7317138), wk = 0.0027174 k( 263) = ( 0.1000000 0.1000000 0.7317138), wk = 0.0027174 k( 264) = ( 0.0888889 0.0888889 0.7317138), wk = 0.0027174 k( 265) = ( 0.0777778 0.0777778 0.7317138), wk = 0.0027174 k( 266) = ( 0.0666667 0.0666667 0.7317138), wk = 0.0027174 k( 267) = ( 0.0555556 0.0555556 0.7317138), wk = 0.0027174 k( 268) = ( 0.0444444 0.0444444 0.7317138), wk = 0.0027174 k( 269) = ( 0.0333333 0.0333333 0.7317138), wk = 0.0027174 k( 270) = ( 0.0222222 0.0222222 0.7317138), wk = 0.0027174 k( 271) = ( 0.0111111 0.0111111 0.7317138), wk = 0.0027174 k( 272) = ( 0.0000000 0.0000000 0.7317138), wk = 0.0027174 k( 273) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027174 k( 274) = ( 0.0000000 0.5000000 0.0155684), wk = 0.0027174 k( 275) = ( 0.0000000 0.5000000 0.0311368), wk = 0.0027174 k( 276) = ( 0.0000000 0.5000000 0.0467051), wk = 0.0027174 k( 277) = ( 0.0000000 0.5000000 0.0622735), wk = 0.0027174 k( 278) = ( 0.0000000 0.5000000 0.0778419), wk = 0.0027174 k( 279) = ( 0.0000000 0.5000000 0.0934103), wk = 0.0027174 k( 280) = ( 0.0000000 0.5000000 0.1089787), wk = 0.0027174 k( 281) = ( 0.0000000 0.5000000 0.1245470), wk = 0.0027174 k( 282) = ( 0.0000000 0.5000000 0.1401154), wk = 0.0027174 k( 283) = ( 0.0000000 0.5000000 0.1556838), wk = 0.0027174 k( 284) = ( 0.0000000 0.5000000 0.1712522), wk = 0.0027174 k( 285) = ( 0.0000000 0.5000000 0.1868205), wk = 0.0027174 k( 286) = ( 0.0000000 0.5000000 0.2023889), wk = 0.0027174 k( 287) = ( 0.0000000 0.5000000 0.2179573), wk = 0.0027174 k( 288) = ( 0.0000000 0.5000000 0.2335257), wk = 0.0027174 k( 289) = ( 0.0000000 0.5000000 0.2490941), wk = 0.0027174 k( 290) = ( 0.0000000 0.5000000 0.2646624), wk = 0.0027174 k( 291) = ( 0.0000000 0.5000000 0.2802308), wk = 0.0027174 k( 292) = ( 0.0000000 0.5000000 0.2957992), wk = 0.0027174 k( 293) = ( 0.0000000 0.5000000 0.3113676), wk = 0.0027174 k( 294) = ( 0.0000000 0.5000000 0.3269360), wk = 0.0027174 k( 295) = ( 0.0000000 0.5000000 0.3425043), wk = 0.0027174 k( 296) = ( 0.0000000 0.5000000 0.3580727), wk = 0.0027174 k( 297) = ( 0.0000000 0.5000000 0.3736411), wk = 0.0027174 k( 298) = ( 0.0000000 0.5000000 0.3892095), wk = 0.0027174 k( 299) = ( 0.0000000 0.5000000 0.4047778), wk = 0.0027174 k( 300) = ( 0.0000000 0.5000000 0.4203462), wk = 0.0027174 k( 301) = ( 0.0000000 0.5000000 0.4359146), wk = 0.0027174 k( 302) = ( 0.0000000 0.5000000 0.4514830), wk = 0.0027174 k( 303) = ( 0.0000000 0.5000000 0.4670514), wk = 0.0027174 k( 304) = ( 0.0000000 0.5000000 0.4826197), wk = 0.0027174 k( 305) = ( 0.0000000 0.5000000 0.4981881), wk = 0.0027174 k( 306) = ( 0.0000000 0.5000000 0.5137565), wk = 0.0027174 k( 307) = ( 0.0000000 0.5000000 0.5293249), wk = 0.0027174 k( 308) = ( 0.0000000 0.5000000 0.5448933), wk = 0.0027174 k( 309) = ( 0.0000000 0.5000000 0.5604616), wk = 0.0027174 k( 310) = ( 0.0000000 0.5000000 0.5760300), wk = 0.0027174 k( 311) = ( 0.0000000 0.5000000 0.5915984), wk = 0.0027174 k( 312) = ( 0.0000000 0.5000000 0.6071668), wk = 0.0027174 k( 313) = ( 0.0000000 0.5000000 0.6227351), wk = 0.0027174 k( 314) = ( 0.0000000 0.5000000 0.6383035), wk = 0.0027174 k( 315) = ( 0.0000000 0.5000000 0.6538719), wk = 0.0027174 k( 316) = ( 0.0000000 0.5000000 0.6694403), wk = 0.0027174 k( 317) = ( 0.0000000 0.5000000 0.6850087), wk = 0.0027174 k( 318) = ( 0.0000000 0.5000000 0.7005770), wk = 0.0027174 k( 319) = ( 0.0000000 0.5000000 0.7161454), wk = 0.0027174 k( 320) = ( 0.0000000 0.5000000 0.7317138), wk = 0.0027174 k( 321) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027174 k( 322) = ( 0.5000000 0.5000000 0.0155684), wk = 0.0027174 k( 323) = ( 0.5000000 0.5000000 0.0311368), wk = 0.0027174 k( 324) = ( 0.5000000 0.5000000 0.0467051), wk = 0.0027174 k( 325) = ( 0.5000000 0.5000000 0.0622735), wk = 0.0027174 k( 326) = ( 0.5000000 0.5000000 0.0778419), wk = 0.0027174 k( 327) = ( 0.5000000 0.5000000 0.0934103), wk = 0.0027174 k( 328) = ( 0.5000000 0.5000000 0.1089787), wk = 0.0027174 k( 329) = ( 0.5000000 0.5000000 0.1245470), wk = 0.0027174 k( 330) = ( 0.5000000 0.5000000 0.1401154), wk = 0.0027174 k( 331) = ( 0.5000000 0.5000000 0.1556838), wk = 0.0027174 k( 332) = ( 0.5000000 0.5000000 0.1712522), wk = 0.0027174 k( 333) = ( 0.5000000 0.5000000 0.1868205), wk = 0.0027174 k( 334) = ( 0.5000000 0.5000000 0.2023889), wk = 0.0027174 k( 335) = ( 0.5000000 0.5000000 0.2179573), wk = 0.0027174 k( 336) = ( 0.5000000 0.5000000 0.2335257), wk = 0.0027174 k( 337) = ( 0.5000000 0.5000000 0.2490941), wk = 0.0027174 k( 338) = ( 0.5000000 0.5000000 0.2646624), wk = 0.0027174 k( 339) = ( 0.5000000 0.5000000 0.2802308), wk = 0.0027174 k( 340) = ( 0.5000000 0.5000000 0.2957992), wk = 0.0027174 k( 341) = ( 0.5000000 0.5000000 0.3113676), wk = 0.0027174 k( 342) = ( 0.5000000 0.5000000 0.3269360), wk = 0.0027174 k( 343) = ( 0.5000000 0.5000000 0.3425043), wk = 0.0027174 k( 344) = ( 0.5000000 0.5000000 0.3580727), wk = 0.0027174 k( 345) = ( 0.5000000 0.5000000 0.3736411), wk = 0.0027174 k( 346) = ( 0.5000000 0.5000000 0.3892095), wk = 0.0027174 k( 347) = ( 0.5000000 0.5000000 0.4047778), wk = 0.0027174 k( 348) = ( 0.5000000 0.5000000 0.4203462), wk = 0.0027174 k( 349) = ( 0.5000000 0.5000000 0.4359146), wk = 0.0027174 k( 350) = ( 0.5000000 0.5000000 0.4514830), wk = 0.0027174 k( 351) = ( 0.5000000 0.5000000 0.4670514), wk = 0.0027174 k( 352) = ( 0.5000000 0.5000000 0.4826197), wk = 0.0027174 k( 353) = ( 0.5000000 0.5000000 0.4981881), wk = 0.0027174 k( 354) = ( 0.5000000 0.5000000 0.5137565), wk = 0.0027174 k( 355) = ( 0.5000000 0.5000000 0.5293249), wk = 0.0027174 k( 356) = ( 0.5000000 0.5000000 0.5448933), wk = 0.0027174 k( 357) = ( 0.5000000 0.5000000 0.5604616), wk = 0.0027174 k( 358) = ( 0.5000000 0.5000000 0.5760300), wk = 0.0027174 k( 359) = ( 0.5000000 0.5000000 0.5915984), wk = 0.0027174 k( 360) = ( 0.5000000 0.5000000 0.6071668), wk = 0.0027174 k( 361) = ( 0.5000000 0.5000000 0.6227351), wk = 0.0027174 k( 362) = ( 0.5000000 0.5000000 0.6383035), wk = 0.0027174 k( 363) = ( 0.5000000 0.5000000 0.6538719), wk = 0.0027174 k( 364) = ( 0.5000000 0.5000000 0.6694403), wk = 0.0027174 k( 365) = ( 0.5000000 0.5000000 0.6850087), wk = 0.0027174 k( 366) = ( 0.5000000 0.5000000 0.7005770), wk = 0.0027174 k( 367) = ( 0.5000000 0.5000000 0.7161454), wk = 0.0027174 k( 368) = ( 0.5000000 0.5000000 0.7317138), wk = 0.0027174 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027174 k( 2) = ( 0.0000000 0.0156250 -0.0000000), wk = 0.0027174 k( 3) = ( 0.0000000 0.0312500 -0.0000000), wk = 0.0027174 k( 4) = ( 0.0000000 0.0468750 0.0000000), wk = 0.0027174 k( 5) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0027174 k( 6) = ( 0.0000000 0.0781250 -0.0000000), wk = 0.0027174 k( 7) = ( 0.0000000 0.0937500 0.0000000), wk = 0.0027174 k( 8) = ( 0.0000000 0.1093750 -0.0000000), wk = 0.0027174 k( 9) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0027174 k( 10) = ( 0.0000000 0.1406250 -0.0000000), wk = 0.0027174 k( 11) = ( 0.0000000 0.1562500 -0.0000000), wk = 0.0027174 k( 12) = ( 0.0000000 0.1718750 -0.0000000), wk = 0.0027174 k( 13) = ( 0.0000000 0.1875000 0.0000000), wk = 0.0027174 k( 14) = ( 0.0000000 0.2031250 -0.0000000), wk = 0.0027174 k( 15) = ( 0.0000000 0.2187500 -0.0000000), wk = 0.0027174 k( 16) = ( 0.0000000 0.2343750 -0.0000000), wk = 0.0027174 k( 17) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0027174 k( 18) = ( 0.0000000 0.2656250 -0.0000000), wk = 0.0027174 k( 19) = ( 0.0000000 0.2812500 -0.0000000), wk = 0.0027174 k( 20) = ( 0.0000000 0.2968750 -0.0000000), wk = 0.0027174 k( 21) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0027174 k( 22) = ( 0.0000000 0.3281250 -0.0000000), wk = 0.0027174 k( 23) = ( 0.0000000 0.3437500 -0.0000000), wk = 0.0027174 k( 24) = ( 0.0000000 0.3593750 0.0000000), wk = 0.0027174 k( 25) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0027174 k( 26) = ( 0.0000000 0.3906250 -0.0000000), wk = 0.0027174 k( 27) = ( 0.0000000 0.4062500 -0.0000000), wk = 0.0027174 k( 28) = ( 0.0000000 0.4218750 -0.0000000), wk = 0.0027174 k( 29) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0027174 k( 30) = ( 0.0000000 0.4531250 -0.0000000), wk = 0.0027174 k( 31) = ( 0.0000000 0.4687500 -0.0000000), wk = 0.0027174 k( 32) = ( 0.0000000 0.4843750 0.0000000), wk = 0.0027174 k( 33) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027174 k( 34) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027174 k( 35) = ( 0.0156250 0.5000000 -0.0000000), wk = 0.0027174 k( 36) = ( 0.0312500 0.5000000 -0.0000000), wk = 0.0027174 k( 37) = ( 0.0468750 0.5000000 -0.0000000), wk = 0.0027174 k( 38) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0027174 k( 39) = ( 0.0781250 0.5000000 0.0000000), wk = 0.0027174 k( 40) = ( 0.0937500 0.5000000 -0.0000000), wk = 0.0027174 k( 41) = ( 0.1093750 0.5000000 -0.0000000), wk = 0.0027174 k( 42) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0027174 k( 43) = ( 0.1406250 0.5000000 -0.0000000), wk = 0.0027174 k( 44) = ( 0.1562500 0.5000000 -0.0000000), wk = 0.0027174 k( 45) = ( 0.1718750 0.5000000 -0.0000000), wk = 0.0027174 k( 46) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0027174 k( 47) = ( 0.2031250 0.5000000 0.0000000), wk = 0.0027174 k( 48) = ( 0.2187500 0.5000000 0.0000000), wk = 0.0027174 k( 49) = ( 0.2343750 0.5000000 0.0000000), wk = 0.0027174 k( 50) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0027174 k( 51) = ( 0.2656250 0.5000000 -0.0000000), wk = 0.0027174 k( 52) = ( 0.2812500 0.5000000 -0.0000000), wk = 0.0027174 k( 53) = ( 0.2968750 0.5000000 -0.0000000), wk = 0.0027174 k( 54) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0027174 k( 55) = ( 0.3281250 0.5000000 -0.0000000), wk = 0.0027174 k( 56) = ( 0.3437500 0.5000000 -0.0000000), wk = 0.0027174 k( 57) = ( 0.3593750 0.5000000 -0.0000000), wk = 0.0027174 k( 58) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0027174 k( 59) = ( 0.3906250 0.5000000 -0.0000000), wk = 0.0027174 k( 60) = ( 0.4062500 0.5000000 -0.0000000), wk = 0.0027174 k( 61) = ( 0.4218750 0.5000000 -0.0000000), wk = 0.0027174 k( 62) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0027174 k( 63) = ( 0.4531250 0.5000000 0.0000000), wk = 0.0027174 k( 64) = ( 0.4687500 0.5000000 0.0000000), wk = 0.0027174 k( 65) = ( 0.4843750 0.5000000 -0.0000000), wk = 0.0027174 k( 66) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027174 k( 67) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027174 k( 68) = ( 0.4888889 0.4888889 0.0000000), wk = 0.0027174 k( 69) = ( 0.4777778 0.4777778 0.0000000), wk = 0.0027174 k( 70) = ( 0.4666667 0.4666667 -0.0000000), wk = 0.0027174 k( 71) = ( 0.4555556 0.4555556 0.0000000), wk = 0.0027174 k( 72) = ( 0.4444444 0.4444444 0.0000000), wk = 0.0027174 k( 73) = ( 0.4333333 0.4333333 -0.0000000), wk = 0.0027174 k( 74) = ( 0.4222222 0.4222222 0.0000000), wk = 0.0027174 k( 75) = ( 0.4111111 0.4111111 0.0000000), wk = 0.0027174 k( 76) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0027174 k( 77) = ( 0.3888889 0.3888889 -0.0000000), wk = 0.0027174 k( 78) = ( 0.3777778 0.3777778 -0.0000000), wk = 0.0027174 k( 79) = ( 0.3666667 0.3666667 -0.0000000), wk = 0.0027174 k( 80) = ( 0.3555556 0.3555556 -0.0000000), wk = 0.0027174 k( 81) = ( 0.3444444 0.3444444 -0.0000000), wk = 0.0027174 k( 82) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0027174 k( 83) = ( 0.3222222 0.3222222 -0.0000000), wk = 0.0027174 k( 84) = ( 0.3111111 0.3111111 -0.0000000), wk = 0.0027174 k( 85) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0027174 k( 86) = ( 0.2888889 0.2888889 -0.0000000), wk = 0.0027174 k( 87) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0027174 k( 88) = ( 0.2666667 0.2666667 -0.0000000), wk = 0.0027174 k( 89) = ( 0.2555556 0.2555556 0.0000000), wk = 0.0027174 k( 90) = ( 0.2444444 0.2444444 -0.0000000), wk = 0.0027174 k( 91) = ( 0.2333333 0.2333333 0.0000000), wk = 0.0027174 k( 92) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0027174 k( 93) = ( 0.2111111 0.2111111 0.0000000), wk = 0.0027174 k( 94) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0027174 k( 95) = ( 0.1888889 0.1888889 -0.0000000), wk = 0.0027174 k( 96) = ( 0.1777778 0.1777778 -0.0000000), wk = 0.0027174 k( 97) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0027174 k( 98) = ( 0.1555556 0.1555556 -0.0000000), wk = 0.0027174 k( 99) = ( 0.1444444 0.1444444 -0.0000000), wk = 0.0027174 k( 100) = ( 0.1333333 0.1333333 0.0000000), wk = 0.0027174 k( 101) = ( 0.1222222 0.1222222 -0.0000000), wk = 0.0027174 k( 102) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0027174 k( 103) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0027174 k( 104) = ( 0.0888889 0.0888889 -0.0000000), wk = 0.0027174 k( 105) = ( 0.0777778 0.0777778 -0.0000000), wk = 0.0027174 k( 106) = ( 0.0666667 0.0666667 0.0000000), wk = 0.0027174 k( 107) = ( 0.0555556 0.0555556 -0.0000000), wk = 0.0027174 k( 108) = ( 0.0444444 0.0444444 -0.0000000), wk = 0.0027174 k( 109) = ( 0.0333333 0.0333333 0.0000000), wk = 0.0027174 k( 110) = ( 0.0222222 0.0222222 -0.0000000), wk = 0.0027174 k( 111) = ( 0.0111111 0.0111111 -0.0000000), wk = 0.0027174 k( 112) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027174 k( 113) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027174 k( 114) = ( 0.0000000 0.0000000 0.0106383), wk = 0.0027174 k( 115) = ( 0.0000000 0.0000000 0.0212766), wk = 0.0027174 k( 116) = ( 0.0000000 0.0000000 0.0319149), wk = 0.0027174 k( 117) = ( 0.0000000 0.0000000 0.0425532), wk = 0.0027174 k( 118) = ( 0.0000000 0.0000000 0.0531915), wk = 0.0027174 k( 119) = ( 0.0000000 0.0000000 0.0638298), wk = 0.0027174 k( 120) = ( 0.0000000 0.0000000 0.0744681), wk = 0.0027174 k( 121) = ( 0.0000000 0.0000000 0.0851064), wk = 0.0027174 k( 122) = ( 0.0000000 0.0000000 0.0957447), wk = 0.0027174 k( 123) = ( 0.0000000 0.0000000 0.1063830), wk = 0.0027174 k( 124) = ( 0.0000000 0.0000000 0.1170213), wk = 0.0027174 k( 125) = ( 0.0000000 0.0000000 0.1276596), wk = 0.0027174 k( 126) = ( 0.0000000 0.0000000 0.1382979), wk = 0.0027174 k( 127) = ( 0.0000000 0.0000000 0.1489362), wk = 0.0027174 k( 128) = ( 0.0000000 0.0000000 0.1595745), wk = 0.0027174 k( 129) = ( 0.0000000 0.0000000 0.1702128), wk = 0.0027174 k( 130) = ( 0.0000000 0.0000000 0.1808511), wk = 0.0027174 k( 131) = ( 0.0000000 0.0000000 0.1914894), wk = 0.0027174 k( 132) = ( 0.0000000 0.0000000 0.2021277), wk = 0.0027174 k( 133) = ( 0.0000000 0.0000000 0.2127660), wk = 0.0027174 k( 134) = ( 0.0000000 0.0000000 0.2234043), wk = 0.0027174 k( 135) = ( 0.0000000 0.0000000 0.2340425), wk = 0.0027174 k( 136) = ( 0.0000000 0.0000000 0.2446809), wk = 0.0027174 k( 137) = ( 0.0000000 0.0000000 0.2553191), wk = 0.0027174 k( 138) = ( 0.0000000 0.0000000 0.2659574), wk = 0.0027174 k( 139) = ( 0.0000000 0.0000000 0.2765957), wk = 0.0027174 k( 140) = ( 0.0000000 0.0000000 0.2872340), wk = 0.0027174 k( 141) = ( 0.0000000 0.0000000 0.2978723), wk = 0.0027174 k( 142) = ( 0.0000000 0.0000000 0.3085106), wk = 0.0027174 k( 143) = ( 0.0000000 0.0000000 0.3191489), wk = 0.0027174 k( 144) = ( 0.0000000 0.0000000 0.3297872), wk = 0.0027174 k( 145) = ( 0.0000000 0.0000000 0.3404255), wk = 0.0027174 k( 146) = ( 0.0000000 0.0000000 0.3510638), wk = 0.0027174 k( 147) = ( 0.0000000 0.0000000 0.3617021), wk = 0.0027174 k( 148) = ( 0.0000000 0.0000000 0.3723404), wk = 0.0027174 k( 149) = ( 0.0000000 0.0000000 0.3829787), wk = 0.0027174 k( 150) = ( 0.0000000 0.0000000 0.3936170), wk = 0.0027174 k( 151) = ( 0.0000000 0.0000000 0.4042553), wk = 0.0027174 k( 152) = ( 0.0000000 0.0000000 0.4148936), wk = 0.0027174 k( 153) = ( 0.0000000 0.0000000 0.4255319), wk = 0.0027174 k( 154) = ( 0.0000000 0.0000000 0.4361702), wk = 0.0027174 k( 155) = ( 0.0000000 0.0000000 0.4468085), wk = 0.0027174 k( 156) = ( 0.0000000 0.0000000 0.4574468), wk = 0.0027174 k( 157) = ( 0.0000000 0.0000000 0.4680851), wk = 0.0027174 k( 158) = ( 0.0000000 0.0000000 0.4787234), wk = 0.0027174 k( 159) = ( 0.0000000 0.0000000 0.4893617), wk = 0.0027174 k( 160) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027174 k( 161) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027174 k( 162) = ( 0.0000000 0.0156250 0.5000000), wk = 0.0027174 k( 163) = ( 0.0000000 0.0312500 0.5000000), wk = 0.0027174 k( 164) = ( 0.0000000 0.0468750 0.5000000), wk = 0.0027174 k( 165) = ( 0.0000000 0.0625000 0.5000000), wk = 0.0027174 k( 166) = ( 0.0000000 0.0781250 0.5000000), wk = 0.0027174 k( 167) = ( 0.0000000 0.0937500 0.5000000), wk = 0.0027174 k( 168) = ( 0.0000000 0.1093750 0.5000000), wk = 0.0027174 k( 169) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0027174 k( 170) = ( 0.0000000 0.1406250 0.5000000), wk = 0.0027174 k( 171) = ( 0.0000000 0.1562500 0.5000000), wk = 0.0027174 k( 172) = ( 0.0000000 0.1718750 0.5000000), wk = 0.0027174 k( 173) = ( 0.0000000 0.1875000 0.5000000), wk = 0.0027174 k( 174) = ( 0.0000000 0.2031250 0.5000000), wk = 0.0027174 k( 175) = ( 0.0000000 0.2187500 0.5000000), wk = 0.0027174 k( 176) = ( 0.0000000 0.2343750 0.5000000), wk = 0.0027174 k( 177) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0027174 k( 178) = ( 0.0000000 0.2656250 0.5000000), wk = 0.0027174 k( 179) = ( 0.0000000 0.2812500 0.5000000), wk = 0.0027174 k( 180) = ( 0.0000000 0.2968750 0.5000000), wk = 0.0027174 k( 181) = ( 0.0000000 0.3125000 0.5000000), wk = 0.0027174 k( 182) = ( 0.0000000 0.3281250 0.5000000), wk = 0.0027174 k( 183) = ( 0.0000000 0.3437500 0.5000000), wk = 0.0027174 k( 184) = ( 0.0000000 0.3593750 0.5000000), wk = 0.0027174 k( 185) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0027174 k( 186) = ( 0.0000000 0.3906250 0.5000000), wk = 0.0027174 k( 187) = ( 0.0000000 0.4062500 0.5000000), wk = 0.0027174 k( 188) = ( 0.0000000 0.4218750 0.5000000), wk = 0.0027174 k( 189) = ( 0.0000000 0.4375000 0.5000000), wk = 0.0027174 k( 190) = ( 0.0000000 0.4531250 0.5000000), wk = 0.0027174 k( 191) = ( 0.0000000 0.4687500 0.5000000), wk = 0.0027174 k( 192) = ( 0.0000000 0.4843750 0.5000000), wk = 0.0027174 k( 193) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027174 k( 194) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027174 k( 195) = ( 0.0156250 0.5000000 0.5000000), wk = 0.0027174 k( 196) = ( 0.0312500 0.5000000 0.5000000), wk = 0.0027174 k( 197) = ( 0.0468750 0.5000000 0.5000000), wk = 0.0027174 k( 198) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0027174 k( 199) = ( 0.0781250 0.5000000 0.5000000), wk = 0.0027174 k( 200) = ( 0.0937500 0.5000000 0.5000000), wk = 0.0027174 k( 201) = ( 0.1093750 0.5000000 0.5000000), wk = 0.0027174 k( 202) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0027174 k( 203) = ( 0.1406250 0.5000000 0.5000000), wk = 0.0027174 k( 204) = ( 0.1562500 0.5000000 0.5000000), wk = 0.0027174 k( 205) = ( 0.1718750 0.5000000 0.5000000), wk = 0.0027174 k( 206) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0027174 k( 207) = ( 0.2031250 0.5000000 0.5000000), wk = 0.0027174 k( 208) = ( 0.2187500 0.5000000 0.5000000), wk = 0.0027174 k( 209) = ( 0.2343750 0.5000000 0.5000000), wk = 0.0027174 k( 210) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0027174 k( 211) = ( 0.2656250 0.5000000 0.5000000), wk = 0.0027174 k( 212) = ( 0.2812500 0.5000000 0.5000000), wk = 0.0027174 k( 213) = ( 0.2968750 0.5000000 0.5000000), wk = 0.0027174 k( 214) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0027174 k( 215) = ( 0.3281250 0.5000000 0.5000000), wk = 0.0027174 k( 216) = ( 0.3437500 0.5000000 0.5000000), wk = 0.0027174 k( 217) = ( 0.3593750 0.5000000 0.5000000), wk = 0.0027174 k( 218) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0027174 k( 219) = ( 0.3906250 0.5000000 0.5000000), wk = 0.0027174 k( 220) = ( 0.4062500 0.5000000 0.5000000), wk = 0.0027174 k( 221) = ( 0.4218750 0.5000000 0.5000000), wk = 0.0027174 k( 222) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0027174 k( 223) = ( 0.4531250 0.5000000 0.5000000), wk = 0.0027174 k( 224) = ( 0.4687500 0.5000000 0.5000000), wk = 0.0027174 k( 225) = ( 0.4843750 0.5000000 0.5000000), wk = 0.0027174 k( 226) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027174 k( 227) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027174 k( 228) = ( 0.4888889 0.4888889 0.5000000), wk = 0.0027174 k( 229) = ( 0.4777778 0.4777778 0.5000000), wk = 0.0027174 k( 230) = ( 0.4666667 0.4666667 0.5000000), wk = 0.0027174 k( 231) = ( 0.4555556 0.4555556 0.5000000), wk = 0.0027174 k( 232) = ( 0.4444444 0.4444444 0.5000000), wk = 0.0027174 k( 233) = ( 0.4333333 0.4333333 0.5000000), wk = 0.0027174 k( 234) = ( 0.4222222 0.4222222 0.5000000), wk = 0.0027174 k( 235) = ( 0.4111111 0.4111111 0.5000000), wk = 0.0027174 k( 236) = ( 0.4000000 0.4000000 0.5000000), wk = 0.0027174 k( 237) = ( 0.3888889 0.3888889 0.5000000), wk = 0.0027174 k( 238) = ( 0.3777778 0.3777778 0.5000000), wk = 0.0027174 k( 239) = ( 0.3666667 0.3666667 0.5000000), wk = 0.0027174 k( 240) = ( 0.3555556 0.3555556 0.5000000), wk = 0.0027174 k( 241) = ( 0.3444444 0.3444444 0.5000000), wk = 0.0027174 k( 242) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0027174 k( 243) = ( 0.3222222 0.3222222 0.5000000), wk = 0.0027174 k( 244) = ( 0.3111111 0.3111111 0.5000000), wk = 0.0027174 k( 245) = ( 0.3000000 0.3000000 0.5000000), wk = 0.0027174 k( 246) = ( 0.2888889 0.2888889 0.5000000), wk = 0.0027174 k( 247) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0027174 k( 248) = ( 0.2666667 0.2666667 0.5000000), wk = 0.0027174 k( 249) = ( 0.2555556 0.2555556 0.5000000), wk = 0.0027174 k( 250) = ( 0.2444444 0.2444444 0.5000000), wk = 0.0027174 k( 251) = ( 0.2333333 0.2333333 0.5000000), wk = 0.0027174 k( 252) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0027174 k( 253) = ( 0.2111111 0.2111111 0.5000000), wk = 0.0027174 k( 254) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0027174 k( 255) = ( 0.1888889 0.1888889 0.5000000), wk = 0.0027174 k( 256) = ( 0.1777778 0.1777778 0.5000000), wk = 0.0027174 k( 257) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0027174 k( 258) = ( 0.1555556 0.1555556 0.5000000), wk = 0.0027174 k( 259) = ( 0.1444444 0.1444444 0.5000000), wk = 0.0027174 k( 260) = ( 0.1333333 0.1333333 0.5000000), wk = 0.0027174 k( 261) = ( 0.1222222 0.1222222 0.5000000), wk = 0.0027174 k( 262) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0027174 k( 263) = ( 0.1000000 0.1000000 0.5000000), wk = 0.0027174 k( 264) = ( 0.0888889 0.0888889 0.5000000), wk = 0.0027174 k( 265) = ( 0.0777778 0.0777778 0.5000000), wk = 0.0027174 k( 266) = ( 0.0666667 0.0666667 0.5000000), wk = 0.0027174 k( 267) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0027174 k( 268) = ( 0.0444444 0.0444444 0.5000000), wk = 0.0027174 k( 269) = ( 0.0333333 0.0333333 0.5000000), wk = 0.0027174 k( 270) = ( 0.0222222 0.0222222 0.5000000), wk = 0.0027174 k( 271) = ( 0.0111111 0.0111111 0.5000000), wk = 0.0027174 k( 272) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027174 k( 273) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027174 k( 274) = ( 0.0000000 0.5000000 0.0106383), wk = 0.0027174 k( 275) = ( 0.0000000 0.5000000 0.0212766), wk = 0.0027174 k( 276) = ( 0.0000000 0.5000000 0.0319149), wk = 0.0027174 k( 277) = ( 0.0000000 0.5000000 0.0425532), wk = 0.0027174 k( 278) = ( 0.0000000 0.5000000 0.0531915), wk = 0.0027174 k( 279) = ( 0.0000000 0.5000000 0.0638298), wk = 0.0027174 k( 280) = ( 0.0000000 0.5000000 0.0744681), wk = 0.0027174 k( 281) = ( 0.0000000 0.5000000 0.0851064), wk = 0.0027174 k( 282) = ( 0.0000000 0.5000000 0.0957447), wk = 0.0027174 k( 283) = ( 0.0000000 0.5000000 0.1063830), wk = 0.0027174 k( 284) = ( 0.0000000 0.5000000 0.1170213), wk = 0.0027174 k( 285) = ( 0.0000000 0.5000000 0.1276596), wk = 0.0027174 k( 286) = ( 0.0000000 0.5000000 0.1382979), wk = 0.0027174 k( 287) = ( 0.0000000 0.5000000 0.1489362), wk = 0.0027174 k( 288) = ( 0.0000000 0.5000000 0.1595745), wk = 0.0027174 k( 289) = ( 0.0000000 0.5000000 0.1702128), wk = 0.0027174 k( 290) = ( 0.0000000 0.5000000 0.1808511), wk = 0.0027174 k( 291) = ( 0.0000000 0.5000000 0.1914894), wk = 0.0027174 k( 292) = ( 0.0000000 0.5000000 0.2021277), wk = 0.0027174 k( 293) = ( 0.0000000 0.5000000 0.2127660), wk = 0.0027174 k( 294) = ( 0.0000000 0.5000000 0.2234043), wk = 0.0027174 k( 295) = ( 0.0000000 0.5000000 0.2340425), wk = 0.0027174 k( 296) = ( 0.0000000 0.5000000 0.2446809), wk = 0.0027174 k( 297) = ( 0.0000000 0.5000000 0.2553191), wk = 0.0027174 k( 298) = ( 0.0000000 0.5000000 0.2659574), wk = 0.0027174 k( 299) = ( 0.0000000 0.5000000 0.2765957), wk = 0.0027174 k( 300) = ( 0.0000000 0.5000000 0.2872340), wk = 0.0027174 k( 301) = ( 0.0000000 0.5000000 0.2978723), wk = 0.0027174 k( 302) = ( 0.0000000 0.5000000 0.3085106), wk = 0.0027174 k( 303) = ( 0.0000000 0.5000000 0.3191489), wk = 0.0027174 k( 304) = ( 0.0000000 0.5000000 0.3297872), wk = 0.0027174 k( 305) = ( 0.0000000 0.5000000 0.3404255), wk = 0.0027174 k( 306) = ( 0.0000000 0.5000000 0.3510638), wk = 0.0027174 k( 307) = ( 0.0000000 0.5000000 0.3617021), wk = 0.0027174 k( 308) = ( 0.0000000 0.5000000 0.3723404), wk = 0.0027174 k( 309) = ( 0.0000000 0.5000000 0.3829787), wk = 0.0027174 k( 310) = ( 0.0000000 0.5000000 0.3936170), wk = 0.0027174 k( 311) = ( 0.0000000 0.5000000 0.4042553), wk = 0.0027174 k( 312) = ( 0.0000000 0.5000000 0.4148936), wk = 0.0027174 k( 313) = ( 0.0000000 0.5000000 0.4255319), wk = 0.0027174 k( 314) = ( 0.0000000 0.5000000 0.4361702), wk = 0.0027174 k( 315) = ( 0.0000000 0.5000000 0.4468085), wk = 0.0027174 k( 316) = ( 0.0000000 0.5000000 0.4574468), wk = 0.0027174 k( 317) = ( 0.0000000 0.5000000 0.4680851), wk = 0.0027174 k( 318) = ( 0.0000000 0.5000000 0.4787234), wk = 0.0027174 k( 319) = ( 0.0000000 0.5000000 0.4893617), wk = 0.0027174 k( 320) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027174 k( 321) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027174 k( 322) = ( 0.5000000 0.5000000 0.0106383), wk = 0.0027174 k( 323) = ( 0.5000000 0.5000000 0.0212766), wk = 0.0027174 k( 324) = ( 0.5000000 0.5000000 0.0319149), wk = 0.0027174 k( 325) = ( 0.5000000 0.5000000 0.0425532), wk = 0.0027174 k( 326) = ( 0.5000000 0.5000000 0.0531915), wk = 0.0027174 k( 327) = ( 0.5000000 0.5000000 0.0638298), wk = 0.0027174 k( 328) = ( 0.5000000 0.5000000 0.0744681), wk = 0.0027174 k( 329) = ( 0.5000000 0.5000000 0.0851064), wk = 0.0027174 k( 330) = ( 0.5000000 0.5000000 0.0957447), wk = 0.0027174 k( 331) = ( 0.5000000 0.5000000 0.1063830), wk = 0.0027174 k( 332) = ( 0.5000000 0.5000000 0.1170213), wk = 0.0027174 k( 333) = ( 0.5000000 0.5000000 0.1276596), wk = 0.0027174 k( 334) = ( 0.5000000 0.5000000 0.1382979), wk = 0.0027174 k( 335) = ( 0.5000000 0.5000000 0.1489362), wk = 0.0027174 k( 336) = ( 0.5000000 0.5000000 0.1595745), wk = 0.0027174 k( 337) = ( 0.5000000 0.5000000 0.1702128), wk = 0.0027174 k( 338) = ( 0.5000000 0.5000000 0.1808511), wk = 0.0027174 k( 339) = ( 0.5000000 0.5000000 0.1914894), wk = 0.0027174 k( 340) = ( 0.5000000 0.5000000 0.2021277), wk = 0.0027174 k( 341) = ( 0.5000000 0.5000000 0.2127660), wk = 0.0027174 k( 342) = ( 0.5000000 0.5000000 0.2234043), wk = 0.0027174 k( 343) = ( 0.5000000 0.5000000 0.2340426), wk = 0.0027174 k( 344) = ( 0.5000000 0.5000000 0.2446809), wk = 0.0027174 k( 345) = ( 0.5000000 0.5000000 0.2553192), wk = 0.0027174 k( 346) = ( 0.5000000 0.5000000 0.2659574), wk = 0.0027174 k( 347) = ( 0.5000000 0.5000000 0.2765957), wk = 0.0027174 k( 348) = ( 0.5000000 0.5000000 0.2872340), wk = 0.0027174 k( 349) = ( 0.5000000 0.5000000 0.2978723), wk = 0.0027174 k( 350) = ( 0.5000000 0.5000000 0.3085106), wk = 0.0027174 k( 351) = ( 0.5000000 0.5000000 0.3191489), wk = 0.0027174 k( 352) = ( 0.5000000 0.5000000 0.3297872), wk = 0.0027174 k( 353) = ( 0.5000000 0.5000000 0.3404255), wk = 0.0027174 k( 354) = ( 0.5000000 0.5000000 0.3510638), wk = 0.0027174 k( 355) = ( 0.5000000 0.5000000 0.3617021), wk = 0.0027174 k( 356) = ( 0.5000000 0.5000000 0.3723404), wk = 0.0027174 k( 357) = ( 0.5000000 0.5000000 0.3829787), wk = 0.0027174 k( 358) = ( 0.5000000 0.5000000 0.3936170), wk = 0.0027174 k( 359) = ( 0.5000000 0.5000000 0.4042553), wk = 0.0027174 k( 360) = ( 0.5000000 0.5000000 0.4148936), wk = 0.0027174 k( 361) = ( 0.5000000 0.5000000 0.4255319), wk = 0.0027174 k( 362) = ( 0.5000000 0.5000000 0.4361702), wk = 0.0027174 k( 363) = ( 0.5000000 0.5000000 0.4468085), wk = 0.0027174 k( 364) = ( 0.5000000 0.5000000 0.4574468), wk = 0.0027174 k( 365) = ( 0.5000000 0.5000000 0.4680851), wk = 0.0027174 k( 366) = ( 0.5000000 0.5000000 0.4787234), wk = 0.0027174 k( 367) = ( 0.5000000 0.5000000 0.4893617), wk = 0.0027174 k( 368) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027174 Dense grid: 55429 G-vectors FFT dimensions: ( 54, 54, 40) Smooth grid: 24419 G-vectors FFT dimensions: ( 45, 45, 27) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.17 Mb ( 176, 62) NL pseudopotentials 0.17 Mb ( 88, 124) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.01 Mb ( 1540) G-vector shells 0.01 Mb ( 761) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.67 Mb ( 176, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.23 Mb ( 124, 2, 62) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./PbO2.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.9 secs Computing kpt #: 2 total cpu time spent up to now is 2.4 secs Computing kpt #: 3 total cpu time spent up to now is 2.8 secs Computing kpt #: 4 total cpu time spent up to now is 3.2 secs Computing kpt #: 5 total cpu time spent up to now is 3.6 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 5.2 secs Computing kpt #: 10 total cpu time spent up to now is 5.6 secs Computing kpt #: 11 total cpu time spent up to now is 6.1 secs Computing kpt #: 12 total cpu time spent up to now is 6.5 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 7.4 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 8.4 secs Computing kpt #: 17 total cpu time spent up to now is 8.8 secs Computing kpt #: 18 total cpu time spent up to now is 9.3 secs Computing kpt #: 19 total cpu time spent up to now is 9.8 secs Computing kpt #: 20 total cpu time spent up to now is 10.2 secs Computing kpt #: 21 total cpu time spent up to now is 10.7 secs Computing kpt #: 22 total cpu time spent up to now is 11.2 secs Computing kpt #: 23 total cpu time spent up to now is 11.6 secs Computing kpt #: 24 total cpu time spent up to now is 12.1 secs Computing kpt #: 25 total cpu time spent up to now is 12.6 secs Computing kpt #: 26 total cpu time spent up to now is 13.1 secs Computing kpt #: 27 total cpu time spent up to now is 13.5 secs Computing kpt #: 28 total cpu time spent up to now is 14.0 secs Computing kpt #: 29 total cpu time spent up to now is 14.4 secs Computing kpt #: 30 total cpu time spent up to now is 14.9 secs Computing kpt #: 31 total cpu time spent up to now is 15.3 secs Computing kpt #: 32 total cpu time spent up to now is 15.8 secs Computing kpt #: 33 total cpu time spent up to now is 16.2 secs Computing kpt #: 34 total cpu time spent up to now is 16.6 secs Computing kpt #: 35 total cpu time spent up to now is 17.0 secs Computing kpt #: 36 total cpu time spent up to now is 17.4 secs Computing kpt #: 37 total cpu time spent up to now is 17.8 secs Computing kpt #: 38 total cpu time spent up to now is 18.2 secs Computing kpt #: 39 total cpu time spent up to now is 18.6 secs Computing kpt #: 40 total cpu time spent up to now is 19.0 secs Computing kpt #: 41 total cpu time spent up to now is 19.4 secs Computing kpt #: 42 total cpu time spent up to now is 19.8 secs Computing kpt #: 43 total cpu time spent up to now is 20.2 secs Computing kpt #: 44 total cpu time spent up to now is 20.6 secs Computing kpt #: 45 total cpu time spent up to now is 21.0 secs Computing kpt #: 46 total cpu time spent up to now is 21.4 secs Computing kpt #: 47 total cpu time spent up to now is 21.7 secs Computing kpt #: 48 total cpu time spent up to now is 22.1 secs Computing kpt #: 49 total cpu time spent up to now is 22.5 secs Computing kpt #: 50 total cpu 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Computing kpt #: 66 total cpu time spent up to now is 29.1 secs Computing kpt #: 67 total cpu time spent up to now is 29.4 secs Computing kpt #: 68 total cpu time spent up to now is 30.0 secs Computing kpt #: 69 total cpu time spent up to now is 30.5 secs Computing kpt #: 70 total cpu time spent up to now is 31.1 secs Computing kpt #: 71 total cpu time spent up to now is 31.6 secs Computing kpt #: 72 total cpu time spent up to now is 32.1 secs Computing kpt #: 73 total cpu time spent up to now is 32.6 secs Computing kpt #: 74 total cpu time spent up to now is 33.0 secs Computing kpt #: 75 total cpu time spent up to now is 33.5 secs Computing kpt #: 76 total cpu time spent up to now is 34.0 secs Computing kpt #: 77 total cpu time spent up to now is 34.5 secs Computing kpt #: 78 total cpu time spent up to now is 34.9 secs Computing kpt #: 79 total cpu time spent up to now is 35.3 secs Computing kpt #: 80 total cpu time spent up to now is 35.8 secs Computing kpt #: 81 total cpu time spent up to now is 36.3 secs Computing kpt #: 82 total cpu time spent up to now is 36.7 secs Computing kpt #: 83 total cpu time spent up to now is 37.2 secs Computing kpt #: 84 total cpu time spent up to now is 37.6 secs Computing kpt #: 85 total cpu time spent up to now is 38.1 secs Computing kpt #: 86 total cpu time spent up to now is 38.6 secs Computing kpt #: 87 total cpu time spent up to now is 39.0 secs Computing kpt #: 88 total cpu time spent up to now is 39.5 secs Computing kpt #: 89 total cpu time spent up to now is 39.9 secs Computing kpt #: 90 total cpu time spent up to now is 40.4 secs Computing kpt #: 91 total cpu time spent up to now is 40.8 secs Computing kpt #: 92 total cpu time spent up to now is 41.2 secs Computing kpt #: 93 total cpu time spent up to now is 41.6 secs Computing kpt #: 94 total cpu time spent up to now is 42.0 secs Computing kpt #: 95 total cpu time spent up to now is 42.4 secs Computing kpt #: 96 total cpu time spent up to now is 42.9 secs Computing kpt #: 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Computing kpt #: 128 total cpu time spent up to now is 55.8 secs Computing kpt #: 129 total cpu time spent up to now is 56.2 secs Computing kpt #: 130 total cpu time spent up to now is 56.6 secs Computing kpt #: 131 total cpu time spent up to now is 57.1 secs Computing kpt #: 132 total cpu time spent up to now is 57.4 secs Computing kpt #: 133 total cpu time spent up to now is 57.8 secs Computing kpt #: 134 total cpu time spent up to now is 58.2 secs Computing kpt #: 135 total cpu time spent up to now is 58.6 secs Computing kpt #: 136 total cpu time spent up to now is 59.0 secs Computing kpt #: 137 total cpu time spent up to now is 59.4 secs Computing kpt #: 138 total cpu time spent up to now is 59.8 secs Computing kpt #: 139 total cpu time spent up to now is 60.2 secs Computing kpt #: 140 total cpu time spent up to now is 60.6 secs Computing kpt #: 141 total cpu time spent up to now is 61.0 secs Computing kpt #: 142 total cpu time spent up to now is 61.4 secs Computing kpt #: 143 total cpu time spent up to now is 61.8 secs Computing kpt #: 144 total cpu time spent up to now is 62.2 secs Computing kpt #: 145 total cpu time spent up to now is 62.6 secs Computing kpt #: 146 total cpu time spent up to now is 63.0 secs Computing kpt #: 147 total cpu time spent up to now is 63.4 secs Computing kpt #: 148 total cpu time spent up to now is 63.9 secs Computing kpt #: 149 total cpu time spent up to now is 64.3 secs Computing kpt #: 150 total cpu time spent up to now is 64.9 secs Computing kpt #: 151 total cpu time spent up to now is 65.4 secs Computing kpt #: 152 total cpu time spent up to now is 65.8 secs Computing kpt #: 153 total cpu time spent up to now is 66.3 secs Computing kpt #: 154 total cpu time spent up to now is 66.8 secs Computing kpt #: 155 total cpu time spent up to now is 67.3 secs Computing kpt #: 156 total cpu time spent up to now is 67.8 secs Computing kpt #: 157 total cpu time spent up to now is 68.3 secs Computing kpt #: 158 total cpu time spent up to now is 68.8 secs Computing kpt #: 159 total cpu time spent up to now is 69.4 secs Computing kpt #: 160 total cpu time spent up to now is 69.8 secs Computing kpt #: 161 total cpu time spent up to now is 70.3 secs Computing kpt #: 162 total cpu time spent up to now is 70.8 secs Computing kpt #: 163 total cpu time spent up to now is 71.3 secs Computing kpt #: 164 total cpu time spent up to now is 71.9 secs Computing kpt #: 165 total cpu time spent up to now is 72.4 secs Computing kpt #: 166 total cpu time spent up to now is 73.0 secs Computing kpt #: 167 total cpu time spent up to now is 73.5 secs Computing kpt #: 168 total cpu time spent up to now is 74.0 secs Computing kpt #: 169 total cpu time spent up to now is 74.6 secs Computing kpt #: 170 total cpu time spent up to now is 75.1 secs Computing kpt #: 171 total cpu time spent up to now is 75.6 secs Computing kpt #: 172 total cpu time spent up to now is 76.1 secs Computing kpt #: 173 total cpu time spent up to now is 76.7 secs Computing kpt #: 174 total cpu time spent up to now is 77.2 secs Computing kpt #: 175 total cpu time spent up to now is 77.8 secs Computing kpt #: 176 total cpu time spent up to now is 78.3 secs Computing kpt #: 177 total cpu time spent up to now is 78.7 secs Computing kpt #: 178 total cpu time spent up to now is 79.2 secs Computing kpt #: 179 total cpu time spent up to now is 79.7 secs Computing kpt #: 180 total cpu time spent up to now is 80.2 secs Computing kpt #: 181 total cpu time spent up to now is 80.6 secs Computing kpt #: 182 total cpu time spent up to now is 81.1 secs Computing kpt #: 183 total cpu time spent up to now is 81.6 secs Computing kpt #: 184 total cpu time spent up to now is 82.1 secs Computing kpt #: 185 total cpu time spent up to now is 82.6 secs Computing kpt #: 186 total cpu time spent up to now is 83.0 secs Computing kpt #: 187 total cpu time spent up to now is 83.5 secs Computing kpt #: 188 total cpu time spent up to now is 84.0 secs Computing kpt #: 189 total cpu time spent up to now is 84.5 secs Computing kpt #: 190 total cpu time spent up to now is 84.9 secs Computing kpt #: 191 total cpu time spent up to now is 85.4 secs Computing kpt #: 192 total cpu time spent up to now is 85.9 secs Computing kpt #: 193 total cpu time spent up to now is 86.3 secs Computing kpt #: 194 total cpu time spent up to now is 86.8 secs Computing kpt #: 195 total cpu time spent up to now is 87.3 secs Computing kpt #: 196 total cpu time spent up to now is 87.8 secs Computing kpt #: 197 total cpu time spent up to now is 88.2 secs Computing kpt #: 198 total cpu time spent up to now is 88.6 secs Computing kpt #: 199 total cpu time spent up to now is 89.1 secs Computing kpt #: 200 total cpu time spent up to now is 89.6 secs Computing kpt #: 201 total cpu time spent up to now is 90.1 secs Computing kpt #: 202 total cpu time spent up to now is 90.6 secs Computing kpt #: 203 total cpu time spent up to now is 91.2 secs Computing kpt #: 204 total cpu time spent up to now is 91.7 secs Computing kpt #: 205 total cpu time spent up to now is 92.2 secs Computing kpt #: 206 total cpu time spent up to now is 92.8 secs Computing kpt #: 207 total cpu time spent up to now is 93.3 secs Computing kpt #: 208 total cpu time spent up to now is 93.8 secs Computing kpt #: 209 total cpu time spent up to now is 94.2 secs Computing kpt #: 210 total cpu time spent up to now is 94.7 secs Computing kpt #: 211 total cpu time spent up to now is 95.2 secs Computing kpt #: 212 total cpu time spent up to now is 95.6 secs Computing kpt #: 213 total cpu time spent up to now is 96.0 secs Computing kpt #: 214 total cpu time spent up to now is 96.4 secs Computing kpt #: 215 total cpu time spent up to now is 96.9 secs Computing kpt #: 216 total cpu time spent up to now is 97.3 secs Computing kpt #: 217 total cpu time spent up to now is 97.7 secs Computing kpt #: 218 total cpu time spent up to now is 98.2 secs Computing kpt #: 219 total cpu time spent up to now is 98.6 secs Computing kpt #: 220 total cpu time spent up to now is 99.0 secs Computing kpt #: 221 total cpu time spent up to now is 100.2 secs Computing kpt #: 222 total cpu time spent up to now is 100.6 secs Computing kpt #: 223 total cpu time spent up to now is 101.1 secs Computing kpt #: 224 total cpu time spent up to now is 101.5 secs Computing kpt #: 225 total cpu time spent up to now is 102.0 secs Computing kpt #: 226 total cpu time spent up to now is 102.4 secs Computing kpt #: 227 total cpu time spent up to now is 102.9 secs Computing kpt #: 228 total cpu time spent up to now is 103.4 secs Computing kpt #: 229 total cpu time spent up to now is 103.8 secs Computing kpt #: 230 total cpu time spent up to now is 104.3 secs Computing kpt #: 231 total cpu time spent up to now is 104.7 secs Computing kpt #: 232 total cpu time spent up to now is 105.2 secs Computing kpt #: 233 total cpu time spent up to now is 105.6 secs Computing kpt #: 234 total cpu time spent up to now is 106.0 secs Computing kpt #: 235 total cpu time spent up to now is 106.5 secs Computing kpt #: 236 total cpu time spent up to now is 106.9 secs Computing kpt #: 237 total cpu time spent up to now is 107.4 secs Computing kpt #: 238 total cpu time spent up to now is 107.8 secs Computing kpt #: 239 total cpu time spent up to now is 108.3 secs Computing kpt #: 240 total cpu time spent up to now is 108.7 secs Computing kpt #: 241 total cpu time spent up to now is 109.2 secs Computing kpt #: 242 total cpu time spent up to now is 109.6 secs Computing kpt #: 243 total cpu time spent up to now is 110.0 secs Computing kpt #: 244 total cpu time spent up to now is 110.5 secs Computing kpt #: 245 total cpu time spent up to now is 110.9 secs Computing kpt #: 246 total cpu time spent up to now is 111.4 secs Computing kpt #: 247 total cpu time spent up to now is 111.9 secs Computing kpt #: 248 total cpu time spent up to now is 112.4 secs Computing kpt #: 249 total cpu time spent up to now is 112.9 secs Computing kpt #: 250 total cpu time spent up to now is 113.4 secs Computing kpt #: 251 total cpu time spent up to now is 113.9 secs Computing kpt #: 252 total cpu time spent up to now is 114.4 secs Computing kpt #: 253 total cpu time spent up to now is 114.8 secs Computing kpt #: 254 total cpu time spent up to now is 115.3 secs Computing kpt #: 255 total cpu time spent up to now is 115.8 secs Computing kpt #: 256 total cpu time spent up to now is 116.3 secs Computing kpt #: 257 total cpu time spent up to now is 116.8 secs Computing kpt #: 258 total cpu time spent up to now is 117.3 secs Computing kpt #: 259 total cpu time spent up to now is 117.8 secs Computing kpt #: 260 total cpu time spent up to now is 118.3 secs Computing kpt #: 261 total cpu time spent up to now is 118.9 secs Computing kpt #: 262 total cpu time spent up to now is 119.4 secs Computing kpt #: 263 total cpu time spent up to now is 119.9 secs Computing kpt #: 264 total cpu time spent up to now is 120.5 secs Computing kpt #: 265 total cpu time spent up to now is 121.0 secs Computing kpt #: 266 total cpu time spent up to now is 121.5 secs Computing kpt #: 267 total cpu time spent up to now is 122.0 secs Computing kpt #: 268 total cpu time spent up to now is 122.5 secs Computing kpt #: 269 total cpu time spent up to now is 123.1 secs Computing kpt #: 270 total cpu time spent up to now is 123.6 secs Computing kpt #: 271 total cpu time spent up to now is 124.2 secs Computing kpt #: 272 total cpu time spent up to now is 124.6 secs Computing kpt #: 273 total cpu time spent up to now is 125.0 secs Computing kpt #: 274 total cpu time spent up to now is 125.5 secs Computing kpt #: 275 total cpu time spent up to now is 126.0 secs Computing kpt #: 276 total cpu time spent up to now is 126.5 secs Computing kpt #: 277 total cpu time spent up to now is 126.9 secs Computing kpt #: 278 total cpu time spent up to now is 127.4 secs Computing kpt #: 279 total cpu time spent up to now is 127.8 secs Computing kpt #: 280 total cpu time spent up to now is 128.2 secs Computing kpt #: 281 total cpu time spent up to now is 128.6 secs Computing kpt #: 282 total cpu time spent up to now is 129.0 secs Computing kpt #: 283 total cpu time spent up to now is 129.4 secs Computing kpt #: 284 total cpu time spent up to now is 129.8 secs Computing kpt #: 285 total cpu time spent up to now is 130.2 secs Computing kpt #: 286 total cpu time spent up to now is 130.6 secs Computing kpt #: 287 total cpu time spent up to now is 131.0 secs Computing kpt #: 288 total cpu time spent up to now is 131.4 secs Computing kpt #: 289 total cpu time spent up to now is 131.8 secs Computing kpt #: 290 total cpu time spent up to now is 132.2 secs Computing kpt #: 291 total cpu time spent up to now is 132.6 secs Computing kpt #: 292 total cpu time spent up to now is 133.0 secs Computing kpt #: 293 total cpu time spent up to now is 133.4 secs Computing kpt #: 294 total cpu time spent up to now is 133.8 secs Computing kpt #: 295 total cpu time spent up to now is 134.2 secs Computing kpt #: 296 total cpu time spent up to now is 134.9 secs Computing kpt #: 297 total cpu time spent up to now is 135.3 secs Computing kpt #: 298 total cpu time spent up to now is 135.7 secs Computing kpt #: 299 total cpu time spent up to now is 136.1 secs Computing kpt #: 300 total cpu time spent up to now is 136.5 secs Computing kpt #: 301 total cpu time spent up to now is 136.9 secs Computing kpt #: 302 total cpu time spent up to now is 137.3 secs Computing kpt #: 303 total cpu time spent up to now is 137.7 secs Computing kpt #: 304 total cpu time spent up to now is 138.1 secs Computing kpt #: 305 total cpu time spent up to now is 138.5 secs Computing kpt #: 306 total cpu time spent up to now is 138.9 secs Computing kpt #: 307 total cpu time spent up to now is 139.3 secs Computing kpt #: 308 total cpu time spent up to now is 139.8 secs Computing kpt #: 309 total cpu time spent up to now is 140.2 secs Computing kpt #: 310 total cpu time spent up to now is 140.6 secs Computing kpt #: 311 total cpu time spent up to now is 141.0 secs Computing kpt #: 312 total cpu time spent up to now is 141.5 secs Computing kpt #: 313 total cpu time spent up to now is 141.9 secs Computing kpt #: 314 total cpu time spent up to now is 142.4 secs Computing kpt #: 315 total cpu time spent up to now is 142.8 secs Computing kpt #: 316 total cpu time spent up to now is 143.3 secs Computing kpt #: 317 total cpu time spent up to now is 143.8 secs Computing kpt #: 318 total cpu time spent up to now is 144.2 secs Computing kpt #: 319 total cpu time spent up to now is 144.7 secs Computing kpt #: 320 total cpu time spent up to now is 145.2 secs Computing kpt #: 321 total cpu time spent up to now is 145.6 secs Computing kpt #: 322 total cpu time spent up to now is 145.9 secs Computing kpt #: 323 total cpu time spent up to now is 146.3 secs Computing kpt #: 324 total cpu time spent up to now is 146.9 secs Computing kpt #: 325 total cpu time spent up to now is 147.4 secs Computing kpt #: 326 total cpu time spent up to now is 147.9 secs Computing kpt #: 327 total cpu time spent up to now is 148.3 secs Computing kpt #: 328 total cpu time spent up to now is 148.7 secs Computing kpt #: 329 total cpu time spent up to now is 149.1 secs Computing kpt #: 330 total cpu time spent up to now is 149.5 secs Computing kpt #: 331 total cpu time spent up to now is 149.9 secs Computing kpt #: 332 total cpu time spent up to now is 150.3 secs Computing kpt #: 333 total cpu time spent up to now is 150.7 secs Computing kpt #: 334 total cpu time spent up to now is 151.1 secs Computing kpt #: 335 total cpu time spent up to now is 151.5 secs Computing kpt #: 336 total cpu time spent up to now is 151.9 secs Computing kpt #: 337 total cpu time spent up to now is 152.3 secs Computing kpt #: 338 total cpu time spent up to now is 152.7 secs Computing kpt #: 339 total cpu time spent up to now is 153.1 secs Computing kpt #: 340 total cpu time spent up to now is 153.5 secs Computing kpt #: 341 total cpu time spent up to now is 153.9 secs Computing kpt #: 342 total cpu time spent up to now is 154.3 secs Computing kpt #: 343 total cpu time spent up to now is 154.7 secs Computing kpt #: 344 total cpu time spent up to now is 155.1 secs Computing kpt #: 345 total cpu time spent up to now is 155.5 secs Computing kpt #: 346 total cpu time spent up to now is 155.9 secs Computing kpt #: 347 total cpu time spent up to now is 156.3 secs Computing kpt #: 348 total cpu time spent up to now is 156.7 secs Computing kpt #: 349 total cpu time spent up to now is 157.1 secs Computing kpt #: 350 total cpu time spent up to now is 157.6 secs Computing kpt #: 351 total cpu time spent up to now is 158.0 secs Computing kpt #: 352 total cpu time spent up to now is 158.4 secs Computing kpt #: 353 total cpu time spent up to now is 158.8 secs Computing kpt #: 354 total cpu time spent up to now is 159.3 secs Computing kpt #: 355 total cpu time spent up to now is 159.7 secs Computing kpt #: 356 total cpu time spent up to now is 160.1 secs Computing kpt #: 357 total cpu time spent up to now is 160.5 secs Computing kpt #: 358 total cpu time spent up to now is 161.0 secs Computing kpt #: 359 total cpu time spent up to now is 161.4 secs Computing kpt #: 360 total cpu time spent up to now is 161.8 secs Computing kpt #: 361 total cpu time spent up to now is 162.3 secs Computing kpt #: 362 total cpu time spent up to now is 162.7 secs Computing kpt #: 363 total cpu time spent up to now is 163.2 secs Computing kpt #: 364 total cpu time spent up to now is 163.6 secs Computing kpt #: 365 total cpu time spent up to now is 164.1 secs Computing kpt #: 366 total cpu time spent up to now is 164.5 secs Computing kpt #: 367 total cpu time spent up to now is 165.0 secs Computing kpt #: 368 total cpu time spent up to now is 165.4 secs ethr = 1.92E-08, avg # of iterations = 20.2 total cpu time spent up to now is 165.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3065 PWs) bands (ev): -9.9803 -9.9803 -9.9726 -9.9726 -8.2727 -8.2727 -8.2083 -8.2083 -8.2080 -8.2080 -8.1224 -8.1224 -8.1045 -8.1045 -7.1684 -7.1684 -5.9438 -5.9438 -5.8490 -5.8490 -5.5555 -5.5555 -5.5316 -5.5316 -5.5120 -5.5120 -3.9299 -3.9299 0.3432 0.3432 4.8360 4.8360 4.9414 4.9414 5.2135 5.2135 6.3140 6.3140 6.6659 6.6659 6.6932 6.6932 7.7410 7.7410 7.8055 7.8055 7.8314 7.8314 7.8720 7.8720 7.9276 7.9276 8.4787 8.4787 12.8960 12.8960 13.8257 13.8257 14.5124 14.5124 17.5821 17.5821 k = 0.0000 0.0156-0.0000 ( 3061 PWs) bands (ev): -9.9799 -9.9799 -9.9719 -9.9719 -8.2836 -8.2836 -8.2152 -8.2152 -8.1977 -8.1977 -8.1302 -8.1302 -8.0907 -8.0907 -7.1685 -7.1685 -5.9430 -5.9430 -5.8488 -5.8488 -5.5553 -5.5553 -5.5316 -5.5316 -5.5120 -5.5120 -3.9308 -3.9308 0.3446 0.3446 4.8327 4.8327 4.9417 4.9417 5.2099 5.2099 6.3147 6.3147 6.6628 6.6628 6.6985 6.6985 7.7322 7.7322 7.8091 7.8091 7.8331 7.8331 7.8718 7.8718 7.9357 7.9357 8.4777 8.4777 12.8936 12.8936 13.8276 13.8276 14.5133 14.5133 17.5832 17.5832 k = 0.0000 0.0312-0.0000 ( 3051 PWs) bands (ev): -9.9786 -9.9786 -9.9699 -9.9699 -8.3092 -8.3092 -8.2229 -8.2229 -8.1861 -8.1861 -8.1385 -8.1385 -8.0656 -8.0656 -7.1686 -7.1686 -5.9405 -5.9405 -5.8481 -5.8481 -5.5545 -5.5545 -5.5315 -5.5315 -5.5121 -5.5121 -3.9335 -3.9335 0.3489 0.3489 4.8221 4.8221 4.9427 4.9427 5.2001 5.2001 6.3169 6.3169 6.6563 6.6563 6.7109 6.7109 7.7128 7.7128 7.8143 7.8143 7.8368 7.8368 7.8713 7.8713 7.9595 7.9595 8.4747 8.4747 12.8866 12.8866 13.8331 13.8331 14.5162 14.5162 17.5863 17.5863 k = 0.0000 0.0469-0.0000 ( 3051 PWs) bands (ev): -9.9765 -9.9765 -9.9667 -9.9667 -8.3414 -8.3414 -8.2333 -8.2333 -8.1765 -8.1765 -8.1433 -8.1433 -8.0358 -8.0358 -7.1689 -7.1689 -5.9364 -5.9364 -5.8470 -5.8470 -5.5532 -5.5532 -5.5313 -5.5313 -5.5121 -5.5121 -3.9381 -3.9381 0.3559 0.3559 4.8019 4.8019 4.9452 4.9452 5.1870 5.1870 6.3205 6.3205 6.6486 6.6486 6.7270 6.7270 7.6911 7.6911 7.8181 7.8181 7.8400 7.8400 7.8706 7.8706 7.9969 7.9969 8.4698 8.4698 12.8751 12.8751 13.8422 13.8422 14.5209 14.5209 17.5914 17.5914 k = 0.0000 0.0625-0.0000 ( 3051 PWs) bands (ev): -9.9736 -9.9736 -9.9621 -9.9621 -8.3769 -8.3769 -8.2466 -8.2466 -8.1696 -8.1696 -8.1452 -8.1452 -8.0032 -8.0032 -7.1693 -7.1693 -5.9307 -5.9307 -5.8455 -5.8455 -5.5513 -5.5513 -5.5310 -5.5310 -5.5122 -5.5122 -3.9444 -3.9444 0.3658 0.3658 4.7692 4.7692 4.9497 4.9497 5.1743 5.1743 6.3253 6.3253 6.6397 6.6397 6.7445 6.7445 7.6704 7.6704 7.8212 7.8212 7.8418 7.8418 7.8695 7.8695 8.0448 8.0448 8.4630 8.4630 12.8590 12.8590 13.8547 13.8547 14.5274 14.5274 17.5985 17.5985 k = 0.0000 0.0781-0.0000 ( 3043 PWs) bands (ev): -9.9698 -9.9698 -9.9563 -9.9563 -8.4142 -8.4142 -8.2623 -8.2623 -8.1653 -8.1653 -8.1447 -8.1447 -7.9692 -7.9692 -7.1699 -7.1699 -5.9236 -5.9236 -5.8436 -5.8436 -5.5488 -5.5488 -5.5307 -5.5307 -5.5122 -5.5122 -3.9526 -3.9526 0.3786 0.3786 4.7225 4.7225 4.9567 4.9567 5.1653 5.1653 6.3315 6.3315 6.6295 6.6295 6.7615 6.7615 7.6521 7.6521 7.8243 7.8243 7.8423 7.8423 7.8682 7.8682 8.1011 8.1011 8.4546 8.4546 12.8388 12.8388 13.8705 13.8705 14.5357 14.5357 17.6075 17.6075 k = 0.0000 0.0938-0.0000 ( 3053 PWs) bands (ev): -9.9653 -9.9653 -9.9492 -9.9492 -8.4523 -8.4523 -8.2804 -8.2804 -8.1630 -8.1630 -8.1426 -8.1426 -7.9345 -7.9345 -7.1706 -7.1706 -5.9150 -5.9150 -5.8414 -5.8414 -5.5456 -5.5456 -5.5303 -5.5303 -5.5122 -5.5122 -3.9627 -3.9627 0.3943 0.3943 4.6618 4.6618 4.9664 4.9664 5.1618 5.1618 6.3388 6.3388 6.6178 6.6178 6.7760 6.7760 7.6369 7.6369 7.8277 7.8277 7.8420 7.8420 7.8666 7.8666 8.1646 8.1646 8.4448 8.4448 12.8143 12.8143 13.8893 13.8893 14.5458 14.5458 17.6182 17.6182 k = 0.0000 0.1094-0.0000 ( 3049 PWs) bands (ev): -9.9599 -9.9599 -9.9408 -9.9408 -8.4910 -8.4910 -8.3004 -8.3004 -8.1617 -8.1617 -8.1400 -8.1400 -7.8998 -7.8998 -7.1715 -7.1715 -5.9050 -5.9050 -5.8388 -5.8388 -5.5417 -5.5417 -5.5299 -5.5299 -5.5122 -5.5122 -3.9747 -3.9747 0.4129 0.4129 4.5885 4.5885 4.9784 4.9784 5.1641 5.1641 6.3472 6.3472 6.6046 6.6046 6.7864 6.7864 7.6248 7.6248 7.8315 7.8315 7.8411 7.8411 7.8648 7.8648 8.2338 8.2338 8.4346 8.4346 12.7859 12.7859 13.9109 13.9109 14.5574 14.5574 17.6306 17.6306 k = 0.0000 0.1250-0.0000 ( 3045 PWs) bands (ev): -9.9536 -9.9536 -9.9312 -9.9312 -8.5299 -8.5299 -8.3222 -8.3222 -8.1609 -8.1609 -8.1373 -8.1373 -7.8653 -7.8653 -7.1726 -7.1726 -5.8940 -5.8940 -5.8359 -5.8359 -5.5370 -5.5370 -5.5294 -5.5294 -5.5121 -5.5121 -3.9885 -3.9885 0.4346 0.4346 4.5050 4.5050 4.9928 4.9928 5.1717 5.1717 6.3567 6.3567 6.5898 6.5898 6.7915 6.7915 7.6157 7.6157 7.8354 7.8354 7.8398 7.8398 7.8629 7.8629 8.3055 8.3055 8.4272 8.4272 12.7537 12.7537 13.9351 13.9351 14.5706 14.5706 17.6444 17.6444 k = 0.0000 0.1406-0.0000 ( 3043 PWs) bands (ev): -9.9466 -9.9466 -9.9205 -9.9205 -8.5687 -8.5687 -8.3459 -8.3459 -8.1602 -8.1602 -8.1349 -8.1349 -7.8313 -7.8313 -7.1739 -7.1739 -5.8820 -5.8820 -5.8326 -5.8326 -5.5315 -5.5315 -5.5287 -5.5287 -5.5117 -5.5117 -4.0043 -4.0043 0.4594 0.4594 4.4132 4.4132 5.0091 5.0091 5.1839 5.1839 6.3672 6.3672 6.5737 6.5737 6.7909 6.7909 7.6091 7.6091 7.8368 7.8368 7.8411 7.8411 7.8608 7.8608 8.3601 8.3601 8.4418 8.4418 12.7178 12.7178 13.9617 13.9617 14.5851 14.5851 17.6595 17.6595 k = 0.0000 0.1562-0.0000 ( 3053 PWs) bands (ev): -9.9388 -9.9388 -9.9086 -9.9086 -8.6074 -8.6074 -8.3711 -8.3711 -8.1596 -8.1596 -8.1329 -8.1329 -7.7979 -7.7979 -7.1754 -7.1754 -5.8692 -5.8692 -5.8292 -5.8292 -5.5285 -5.5285 -5.5251 -5.5251 -5.5104 -5.5104 -4.0220 -4.0220 0.4873 0.4873 4.3150 4.3150 5.0274 5.0274 5.2000 5.2000 6.3782 6.3782 6.5564 6.5564 6.7844 6.7844 7.6044 7.6044 7.8346 7.8346 7.8458 7.8458 7.8587 7.8587 8.3664 8.3664 8.5093 8.5093 12.6783 12.6783 13.9905 13.9905 14.6009 14.6009 17.6758 17.6758 k = 0.0000 0.1719-0.0000 ( 3057 PWs) bands (ev): -9.9302 -9.9302 -9.8956 -9.8956 -8.6457 -8.6457 -8.3979 -8.3979 -8.1589 -8.1589 -8.1312 -8.1312 -7.7653 -7.7653 -7.1773 -7.1773 -5.8559 -5.8559 -5.8255 -5.8255 -5.5278 -5.5278 -5.5201 -5.5201 -5.5067 -5.5067 -4.0416 -4.0416 0.5184 0.5184 4.2119 4.2119 5.0475 5.0475 5.2195 5.2195 6.3893 6.3893 6.5387 6.5387 6.7724 6.7724 7.6007 7.6007 7.8318 7.8318 7.8506 7.8506 7.8570 7.8570 8.3541 8.3541 8.5998 8.5998 12.6353 12.6353 14.0212 14.0212 14.6178 14.6178 17.6929 17.6929 k = 0.0000 0.1875-0.0000 ( 3055 PWs) bands (ev): -9.9209 -9.9209 -9.8816 -9.8816 -8.6835 -8.6835 -8.4261 -8.4261 -8.1582 -8.1582 -8.1298 -8.1298 -7.7335 -7.7335 -7.1794 -7.1794 -5.8424 -5.8424 -5.8216 -5.8216 -5.5272 -5.5272 -5.5175 -5.5175 -5.4987 -5.4987 -4.0632 -4.0632 0.5527 0.5527 4.1051 4.1051 5.0692 5.0692 5.2420 5.2420 6.3993 6.3993 6.5219 6.5219 6.7554 6.7554 7.5973 7.5973 7.8286 7.8286 7.8519 7.8519 7.8592 7.8592 8.3376 8.3376 8.6985 8.6985 12.5889 12.5889 14.0538 14.0538 14.6355 14.6355 17.7109 17.7109 k = 0.0000 0.2031-0.0000 ( 3051 PWs) bands (ev): -9.9108 -9.9108 -9.8666 -9.8666 -8.7208 -8.7208 -8.4556 -8.4556 -8.1575 -8.1575 -8.1287 -8.1287 -7.7026 -7.7026 -7.1818 -7.1818 -5.8290 -5.8290 -5.8176 -5.8176 -5.5265 -5.5265 -5.5166 -5.5166 -5.4870 -5.4870 -4.0867 -4.0867 0.5902 0.5902 3.9954 3.9954 5.0924 5.0924 5.2670 5.2670 6.4053 6.4053 6.5087 6.5087 6.7341 6.7341 7.5935 7.5935 7.8252 7.8252 7.8498 7.8498 7.8651 7.8651 8.3195 8.3195 8.8025 8.8025 12.5392 12.5392 14.0880 14.0880 14.6538 14.6538 17.7295 17.7295 k = 0.0000 0.2188-0.0000 ( 3057 PWs) bands (ev): -9.8999 -9.8999 -9.8507 -9.8507 -8.7573 -8.7573 -8.4862 -8.4862 -8.1567 -8.1567 -8.1279 -8.1279 -7.6728 -7.6728 -7.1845 -7.1845 -5.8161 -5.8161 -5.8134 -5.8134 -5.5259 -5.5259 -5.5163 -5.5163 -5.4724 -5.4724 -4.1121 -4.1121 0.6310 0.6310 3.8836 3.8836 5.1171 5.1171 5.2942 5.2942 6.4031 6.4031 6.5035 6.5035 6.7091 6.7091 7.5885 7.5885 7.8215 7.8215 7.8472 7.8472 7.8718 7.8718 8.3006 8.3006 8.9105 8.9105 12.4860 12.4860 14.1237 14.1237 14.6726 14.6726 17.7485 17.7485 k = 0.0000 0.2344-0.0000 ( 3056 PWs) bands (ev): -9.8883 -9.8883 -9.8340 -9.8340 -8.7930 -8.7930 -8.5179 -8.5179 -8.1558 -8.1558 -8.1273 -8.1273 -7.6439 -7.6439 -7.1876 -7.1876 -5.8093 -5.8093 -5.8036 -5.8036 -5.5253 -5.5253 -5.5162 -5.5162 -5.4551 -5.4551 -4.1394 -4.1394 0.6752 0.6752 3.7704 3.7704 5.1433 5.1433 5.3235 5.3235 6.3902 6.3902 6.5088 6.5088 6.6811 6.6811 7.5818 7.5818 7.8177 7.8177 7.8443 7.8443 7.8791 7.8791 8.2815 8.2815 9.0218 9.0218 12.4296 12.4296 14.1606 14.1606 14.6915 14.6915 17.7679 17.7679 k = 0.0000 0.2500-0.0000 ( 3058 PWs) bands (ev): -9.8761 -9.8761 -9.8167 -9.8167 -8.8277 -8.8277 -8.5505 -8.5505 -8.1549 -8.1549 -8.1270 -8.1270 -7.6162 -7.6162 -7.1910 -7.1910 -5.8049 -5.8049 -5.7923 -5.7923 -5.5246 -5.5246 -5.5162 -5.5162 -5.4350 -5.4350 -4.1686 -4.1686 0.7227 0.7227 3.6561 3.6561 5.1707 5.1707 5.3545 5.3545 6.3690 6.3690 6.5221 6.5221 6.6510 6.6510 7.5727 7.5727 7.8140 7.8140 7.8414 7.8414 7.8867 7.8867 8.2624 8.2624 9.1356 9.1356 12.3700 12.3700 14.1986 14.1986 14.7102 14.7102 17.7876 17.7876 k = 0.0000 0.2656-0.0000 ( 3066 PWs) bands (ev): -9.8632 -9.8632 -9.7987 -9.7987 -8.8614 -8.8614 -8.5838 -8.5838 -8.1540 -8.1540 -8.1268 -8.1268 -7.5894 -7.5894 -7.1948 -7.1948 -5.8006 -5.8006 -5.7820 -5.7820 -5.5240 -5.5240 -5.5163 -5.5163 -5.4121 -5.4121 -4.1996 -4.1996 0.7735 0.7735 3.5412 3.5412 5.1994 5.1994 5.3871 5.3871 6.3427 6.3427 6.5392 6.5392 6.6202 6.6202 7.5609 7.5609 7.8103 7.8103 7.8384 7.8384 7.8946 7.8946 8.2437 8.2437 9.2515 9.2515 12.3070 12.3070 14.2375 14.2375 14.7286 14.7286 17.8075 17.8075 k = 0.0000 0.2812-0.0000 ( 3072 PWs) bands (ev): -9.8497 -9.8497 -9.7803 -9.7803 -8.8937 -8.8937 -8.6178 -8.6178 -8.1530 -8.1530 -8.1268 -8.1268 -7.5638 -7.5638 -7.1991 -7.1991 -5.7962 -5.7962 -5.7729 -5.7729 -5.5234 -5.5234 -5.5164 -5.5164 -5.3864 -5.3864 -4.2324 -4.2324 0.8277 0.8277 3.4261 3.4261 5.2293 5.2293 5.4209 5.4209 6.3133 6.3133 6.5516 6.5516 6.5958 6.5958 7.5460 7.5460 7.8070 7.8070 7.8354 7.8354 7.9029 7.9029 8.2255 8.2255 9.3690 9.3690 12.2408 12.2408 14.2771 14.2771 14.7461 14.7461 17.8277 17.8277 k = 0.0000 0.2969-0.0000 ( 3064 PWs) bands (ev): -9.8355 -9.8355 -9.7617 -9.7617 -8.9245 -8.9245 -8.6522 -8.6522 -8.1520 -8.1520 -8.1269 -8.1269 -7.5393 -7.5393 -7.2037 -7.2037 -5.7919 -5.7919 -5.7651 -5.7651 -5.5228 -5.5228 -5.5165 -5.5165 -5.3580 -5.3580 -4.2668 -4.2668 0.8851 0.8851 3.3110 3.3110 5.2603 5.2603 5.4559 5.4559 6.2817 6.2817 6.5349 6.5349 6.6019 6.6019 7.5279 7.5279 7.8040 7.8040 7.8324 7.8324 7.9115 7.9115 8.2079 8.2079 9.4876 9.4876 12.1714 12.1714 14.3172 14.3172 14.7627 14.7627 17.8481 17.8481 k = 0.0000 0.3125-0.0000 ( 3060 PWs) bands (ev): -9.8209 -9.8209 -9.7431 -9.7431 -8.9536 -8.9536 -8.6869 -8.6869 -8.1509 -8.1509 -8.1272 -8.1272 -7.5158 -7.5158 -7.2088 -7.2088 -5.7876 -5.7876 -5.7585 -5.7585 -5.5223 -5.5223 -5.5166 -5.5166 -5.3269 -5.3269 -4.3029 -4.3029 0.9459 0.9459 3.1962 3.1962 5.2924 5.2924 5.4918 5.4918 6.2486 6.2486 6.5012 6.5012 6.6259 6.6259 7.5066 7.5066 7.8014 7.8014 7.8294 7.8294 7.9203 7.9203 8.1912 8.1912 9.6070 9.6070 12.0988 12.0988 14.3575 14.3575 14.7778 14.7778 17.8689 17.8689 k = 0.0000 0.3281-0.0000 ( 3048 PWs) bands (ev): -9.8058 -9.8058 -9.7247 -9.7247 -8.9807 -8.9807 -8.7217 -8.7217 -8.1498 -8.1498 -8.1276 -8.1276 -7.4934 -7.4934 -7.2143 -7.2143 -5.7834 -5.7834 -5.7531 -5.7531 -5.5218 -5.5218 -5.5166 -5.5166 -5.2933 -5.2933 -4.3405 -4.3405 1.0099 1.0099 3.0820 3.0820 5.3255 5.3255 5.5283 5.5283 6.2144 6.2144 6.4640 6.4640 6.6544 6.6544 7.4820 7.4820 7.7992 7.7992 7.8265 7.8265 7.9294 7.9294 8.1753 8.1753 9.7268 9.7268 12.0230 12.0230 14.3978 14.3978 14.7913 14.7913 17.8900 17.8900 k = 0.0000 0.3438-0.0000 ( 3052 PWs) bands (ev): -9.7903 -9.7903 -9.7070 -9.7070 -9.0056 -9.0056 -8.7564 -8.7564 -8.1487 -8.1487 -8.1281 -8.1281 -7.4721 -7.4721 -7.2203 -7.2203 -5.7792 -5.7792 -5.7488 -5.7488 -5.5213 -5.5213 -5.5167 -5.5167 -5.2575 -5.2575 -4.3796 -4.3796 1.0771 1.0771 2.9685 2.9685 5.3595 5.3595 5.5652 5.5652 6.1793 6.1793 6.4254 6.4254 6.6854 6.6854 7.4544 7.4544 7.7976 7.7976 7.8237 7.8237 7.9387 7.9387 8.1601 8.1601 9.8467 9.8467 11.9441 11.9441 14.4378 14.4378 14.8028 14.8028 17.9117 17.9117 k = 0.0000 0.3594-0.0000 ( 3056 PWs) bands (ev): -9.7745 -9.7745 -9.6901 -9.6901 -9.0278 -9.0278 -8.7910 -8.7910 -8.1476 -8.1476 -8.1287 -8.1287 -7.4517 -7.4517 -7.2267 -7.2267 -5.7751 -5.7751 -5.7455 -5.7455 -5.5208 -5.5208 -5.5168 -5.5168 -5.2197 -5.2197 -4.4200 -4.4200 1.1475 1.1475 2.8560 2.8560 5.3944 5.3944 5.6023 5.6023 6.1438 6.1438 6.3860 6.3860 6.7184 6.7184 7.4238 7.4238 7.7964 7.7964 7.8209 7.8209 7.9481 7.9481 8.1458 8.1458 9.9664 9.9664 11.8621 11.8621 14.4772 14.4772 14.8120 14.8120 17.9340 17.9340 k = 0.0000 0.3750-0.0000 ( 3050 PWs) bands (ev): -9.7584 -9.7584 -9.6747 -9.6747 -9.0470 -9.0470 -8.8250 -8.8250 -8.1464 -8.1464 -8.1294 -8.1294 -7.4324 -7.4324 -7.2337 -7.2337 -5.7712 -5.7712 -5.7431 -5.7431 -5.5204 -5.5204 -5.5169 -5.5169 -5.1800 -5.1800 -4.4616 -4.4616 1.2209 1.2209 2.7446 2.7446 5.4300 5.4300 5.6390 5.6390 6.1084 6.1084 6.3461 6.3461 6.7531 6.7531 7.3907 7.3907 7.7956 7.7956 7.8182 7.8182 7.9578 7.9578 8.1322 8.1322 10.0857 10.0857 11.7771 11.7771 14.5158 14.5158 14.8187 14.8187 17.9571 17.9571 k = 0.0000 0.3906-0.0000 ( 3048 PWs) bands (ev): -9.7424 -9.7424 -9.6611 -9.6611 -9.0627 -9.0627 -8.8584 -8.8584 -8.1453 -8.1453 -8.1302 -8.1302 -7.4140 -7.4140 -7.2412 -7.2412 -5.7674 -5.7674 -5.7415 -5.7415 -5.5200 -5.5200 -5.5169 -5.5169 -5.1388 -5.1388 -4.5043 -4.5043 1.2974 1.2974 2.6344 2.6344 5.4663 5.4663 5.6749 5.6749 6.0737 6.0737 6.3058 6.3058 6.7893 6.7893 7.3554 7.3554 7.7952 7.7952 7.8156 7.8156 7.9676 7.9676 8.1192 8.1192 10.2042 10.2042 11.6891 11.6891 14.5533 14.5533 14.8226 14.8226 17.9810 17.9810 k = 0.0000 0.4062-0.0000 ( 3052 PWs) bands (ev): -9.7264 -9.7264 -9.6498 -9.6498 -9.0744 -9.0744 -8.8909 -8.8909 -8.1441 -8.1441 -8.1310 -8.1310 -7.3966 -7.3966 -7.2492 -7.2492 -5.7637 -5.7637 -5.7406 -5.7406 -5.5196 -5.5196 -5.5170 -5.5170 -5.0963 -5.0963 -4.5481 -4.5481 1.3768 1.3768 2.5257 2.5257 5.5031 5.5031 5.7088 5.7088 6.0407 6.0407 6.2655 6.2655 6.8268 6.8268 7.3181 7.3181 7.7952 7.7952 7.8131 7.8131 7.9775 7.9775 8.1067 8.1067 10.3219 10.3219 11.5983 11.5983 14.5893 14.5893 14.8235 14.8235 18.0060 18.0060 k = 0.0000 0.4219-0.0000 ( 3054 PWs) bands (ev): -9.7107 -9.7107 -9.6412 -9.6412 -9.0818 -9.0818 -8.9222 -8.9222 -8.1429 -8.1429 -8.1319 -8.1319 -7.3801 -7.3801 -7.2578 -7.2578 -5.7602 -5.7602 -5.7403 -5.7403 -5.5192 -5.5192 -5.5171 -5.5171 -5.0525 -5.0525 -4.5926 -4.5926 1.4591 1.4591 2.4185 2.4185 5.5403 5.5403 5.7390 5.7390 6.0114 6.0114 6.2251 6.2251 6.8655 6.8655 7.2793 7.2793 7.7955 7.7955 7.8108 7.8108 7.9875 7.9875 8.0947 8.0947 10.4384 10.4384 11.5046 11.5046 14.6237 14.6237 14.8213 14.8213 18.0320 18.0320 k = 0.0000 0.4375-0.0000 ( 3050 PWs) bands (ev): -9.6955 -9.6955 -9.6358 -9.6358 -9.0844 -9.0844 -8.9520 -8.9520 -8.1417 -8.1417 -8.1329 -8.1329 -7.3645 -7.3645 -7.2670 -7.2670 -5.7570 -5.7570 -5.7406 -5.7406 -5.5189 -5.5189 -5.5172 -5.5172 -5.0078 -5.0078 -4.6379 -4.6379 1.5442 1.5442 2.3130 2.3130 5.5776 5.5776 5.7620 5.7620 5.9892 5.9892 6.1850 6.1850 6.9054 6.9054 7.2391 7.2391 7.7961 7.7961 7.8085 7.8085 7.9976 7.9976 8.0831 8.0831 10.5536 10.5536 11.4082 11.4082 14.6560 14.6560 14.8158 14.8158 18.0592 18.0592 k = 0.0000 0.4531-0.0000 ( 3052 PWs) bands (ev): -9.6811 -9.6811 -9.6337 -9.6337 -9.0823 -9.0823 -8.9799 -8.9799 -8.1406 -8.1406 -8.1339 -8.1339 -7.3497 -7.3497 -7.2768 -7.2768 -5.7539 -5.7539 -5.7414 -5.7414 -5.5186 -5.5186 -5.5174 -5.5174 -4.9624 -4.9624 -4.6838 -4.6838 1.6320 1.6320 2.2093 2.2093 5.6147 5.6147 5.7727 5.7727 5.9793 5.9793 6.1455 6.1455 6.9461 6.9461 7.1980 7.1980 7.7969 7.7969 7.8063 7.8063 8.0079 8.0079 8.0718 8.0718 10.6673 10.6673 11.3093 11.3093 14.6861 14.6861 14.8069 14.8069 18.0874 18.0874 k = 0.0000 0.4688-0.0000 ( 3056 PWs) bands (ev): -9.6679 -9.6679 -9.6350 -9.6350 -9.0753 -9.0753 -9.0055 -9.0055 -8.1394 -8.1394 -8.1349 -8.1349 -7.3357 -7.3357 -7.2872 -7.2872 -5.7510 -5.7510 -5.7426 -5.7426 -5.5184 -5.5184 -5.5175 -5.5175 -4.9164 -4.9164 -4.7301 -4.7301 1.7223 1.7223 2.1076 2.1076 5.6513 5.6513 5.7672 5.7672 5.9857 5.9857 6.1069 6.1069 6.9875 6.9875 7.1562 7.1562 7.7980 7.7980 7.8044 7.8044 8.0182 8.0182 8.0607 8.0607 10.7794 10.7794 11.2078 11.2078 14.7137 14.7137 14.7947 14.7947 18.1167 18.1167 k = 0.0000 0.4844-0.0000 ( 3052 PWs) bands (ev): -9.6563 -9.6563 -9.6394 -9.6394 -9.0637 -9.0637 -9.0283 -9.0283 -8.1382 -8.1382 -8.1360 -8.1360 -7.3225 -7.3225 -7.2982 -7.2982 -5.7485 -5.7485 -5.7442 -5.7442 -5.5181 -5.5181 -5.5177 -5.5177 -4.8700 -4.8700 -4.7766 -4.7766 1.8152 1.8152 2.0079 2.0079 5.6867 5.6867 5.7478 5.7478 6.0061 6.0061 6.0698 6.0698 7.0294 7.0294 7.1140 7.1140 7.7993 7.7993 7.8025 7.8025 8.0286 8.0286 8.0499 8.0499 10.8896 10.8896 11.1039 11.1039 14.7385 14.7385 14.7792 14.7792 18.1469 18.1469 k = 0.0000 0.5000-0.0000 ( 3048 PWs) bands (ev): -9.6466 -9.6466 -9.6466 -9.6466 -9.0479 -9.0479 -9.0479 -9.0479 -8.1371 -8.1371 -8.1371 -8.1371 -7.3100 -7.3100 -7.3100 -7.3100 -5.7462 -5.7462 -5.7462 -5.7462 -5.5179 -5.5179 -5.5179 -5.5179 -4.8233 -4.8233 -4.8233 -4.8233 1.9104 1.9104 1.9104 1.9104 5.7196 5.7196 5.7196 5.7196 6.0355 6.0355 6.0355 6.0355 7.0717 7.0717 7.0717 7.0717 7.8008 7.8008 7.8008 7.8008 8.0392 8.0392 8.0392 8.0392 10.9978 10.9978 10.9978 10.9978 14.7604 14.7604 14.7604 14.7604 18.1779 18.1779 k = 0.0000 0.5000-0.0000 ( 3048 PWs) bands (ev): -9.6466 -9.6466 -9.6466 -9.6466 -9.0479 -9.0479 -9.0479 -9.0479 -8.1371 -8.1371 -8.1371 -8.1371 -7.3100 -7.3100 -7.3100 -7.3100 -5.7462 -5.7462 -5.7462 -5.7462 -5.5179 -5.5179 -5.5179 -5.5179 -4.8233 -4.8233 -4.8233 -4.8233 1.9104 1.9104 1.9104 1.9104 5.7196 5.7196 5.7196 5.7196 6.0355 6.0355 6.0355 6.0355 7.0717 7.0717 7.0717 7.0717 7.8008 7.8008 7.8008 7.8008 8.0392 8.0392 8.0392 8.0392 10.9978 10.9978 10.9978 10.9978 14.7604 14.7604 14.7604 14.7604 18.1779 18.1779 k = 0.0156 0.5000-0.0000 ( 3044 PWs) bands (ev): -9.6479 -9.6479 -9.6479 -9.6479 -9.0458 -9.0458 -9.0458 -9.0458 -8.1371 -8.1371 -8.1371 -8.1371 -7.3103 -7.3103 -7.3103 -7.3103 -5.7464 -5.7464 -5.7464 -5.7464 -5.5179 -5.5179 -5.5179 -5.5179 -4.8241 -4.8241 -4.8241 -4.8241 1.9123 1.9123 1.9123 1.9123 5.7192 5.7192 5.7192 5.7192 6.0343 6.0343 6.0343 6.0343 7.0712 7.0712 7.0712 7.0712 7.8008 7.8008 7.8008 7.8008 8.0385 8.0385 8.0385 8.0385 10.9991 10.9991 10.9991 10.9991 14.7612 14.7612 14.7612 14.7612 18.1780 18.1780 k = 0.0312 0.5000-0.0000 ( 3048 PWs) bands (ev): -9.6518 -9.6518 -9.6518 -9.6518 -9.0397 -9.0397 -9.0397 -9.0397 -8.1372 -8.1372 -8.1372 -8.1372 -7.3114 -7.3114 -7.3114 -7.3114 -5.7470 -5.7470 -5.7470 -5.7470 -5.5179 -5.5179 -5.5179 -5.5179 -4.8263 -4.8263 -4.8263 -4.8263 1.9182 1.9182 1.9182 1.9182 5.7181 5.7181 5.7181 5.7181 6.0309 6.0309 6.0309 6.0309 7.0698 7.0698 7.0698 7.0698 7.8007 7.8007 7.8007 7.8007 8.0366 8.0366 8.0366 8.0366 11.0028 11.0028 11.0028 11.0028 14.7633 14.7633 14.7633 14.7633 18.1781 18.1781 k = 0.0469 0.5000-0.0000 ( 3048 PWs) bands (ev): -9.6580 -9.6580 -9.6580 -9.6580 -9.0298 -9.0298 -9.0298 -9.0298 -8.1373 -8.1373 -8.1373 -8.1373 -7.3131 -7.3131 -7.3131 -7.3131 -5.7480 -5.7480 -5.7480 -5.7480 -5.5180 -5.5180 -5.5180 -5.5180 -4.8301 -4.8301 -4.8301 -4.8301 1.9279 1.9279 1.9279 1.9279 5.7163 5.7163 5.7163 5.7163 6.0251 6.0251 6.0251 6.0251 7.0674 7.0674 7.0674 7.0674 7.8004 7.8004 7.8004 7.8004 8.0335 8.0335 8.0335 8.0335 11.0089 11.0089 11.0089 11.0089 14.7670 14.7670 14.7670 14.7670 18.1785 18.1785 k = 0.0625 0.5000-0.0000 ( 3046 PWs) bands (ev): -9.6664 -9.6664 -9.6664 -9.6664 -9.0162 -9.0162 -9.0162 -9.0162 -8.1375 -8.1375 -8.1375 -8.1375 -7.3155 -7.3155 -7.3155 -7.3155 -5.7494 -5.7494 -5.7494 -5.7494 -5.5181 -5.5181 -5.5181 -5.5181 -4.8352 -4.8352 -4.8352 -4.8352 1.9413 1.9413 1.9413 1.9413 5.7136 5.7136 5.7136 5.7136 6.0172 6.0172 6.0172 6.0172 7.0641 7.0641 7.0641 7.0641 7.8001 7.8001 7.8001 7.8001 8.0292 8.0292 8.0292 8.0292 11.0173 11.0173 11.0173 11.0173 14.7720 14.7720 14.7720 14.7720 18.1791 18.1791 k = 0.0781 0.5000-0.0000 ( 3042 PWs) bands (ev): -9.6765 -9.6765 -9.6765 -9.6765 -8.9994 -8.9994 -8.9994 -8.9994 -8.1377 -8.1377 -8.1377 -8.1377 -7.3186 -7.3186 -7.3186 -7.3186 -5.7511 -5.7511 -5.7511 -5.7511 -5.5182 -5.5182 -5.5182 -5.5182 -4.8417 -4.8417 -4.8417 -4.8417 1.9585 1.9585 1.9585 1.9585 5.7099 5.7099 5.7099 5.7099 6.0074 6.0074 6.0074 6.0074 7.0597 7.0597 7.0597 7.0597 7.7997 7.7997 7.7997 7.7997 8.0240 8.0240 8.0240 8.0240 11.0279 11.0279 11.0279 11.0279 14.7783 14.7783 14.7783 14.7783 18.1798 18.1798 k = 0.0938 0.5000-0.0000 ( 3044 PWs) bands (ev): -9.6882 -9.6882 -9.6882 -9.6882 -8.9797 -8.9797 -8.9797 -8.9797 -8.1379 -8.1379 -8.1379 -8.1379 -7.3224 -7.3224 -7.3224 -7.3224 -5.7533 -5.7533 -5.7533 -5.7533 -5.5184 -5.5184 -5.5184 -5.5184 -4.8495 -4.8495 -4.8495 -4.8495 1.9792 1.9792 1.9792 1.9792 5.7050 5.7050 5.7050 5.7050 5.9958 5.9958 5.9958 5.9958 7.0543 7.0543 7.0543 7.0543 7.7992 7.7992 7.7992 7.7992 8.0179 8.0179 8.0179 8.0179 11.0406 11.0406 11.0406 11.0406 14.7858 14.7858 14.7858 14.7858 18.1809 18.1809 k = 0.1094 0.5000-0.0000 ( 3036 PWs) bands (ev): -9.7010 -9.7010 -9.7010 -9.7010 -8.9573 -8.9573 -8.9573 -8.9573 -8.1382 -8.1382 -8.1382 -8.1382 -7.3270 -7.3270 -7.3270 -7.3270 -5.7559 -5.7559 -5.7559 -5.7559 -5.5185 -5.5185 -5.5185 -5.5185 -4.8584 -4.8584 -4.8584 -4.8584 2.0034 2.0034 2.0034 2.0034 5.6989 5.6989 5.6989 5.6989 5.9827 5.9827 5.9827 5.9827 7.0480 7.0480 7.0480 7.0480 7.7986 7.7986 7.7986 7.7986 8.0112 8.0112 8.0112 8.0112 11.0553 11.0553 11.0553 11.0553 14.7945 14.7945 14.7945 14.7945 18.1824 18.1824 k = 0.1250 0.5000-0.0000 ( 3036 PWs) bands (ev): -9.7147 -9.7147 -9.7147 -9.7147 -8.9328 -8.9328 -8.9328 -8.9328 -8.1386 -8.1386 -8.1386 -8.1386 -7.3322 -7.3322 -7.3322 -7.3322 -5.7589 -5.7589 -5.7589 -5.7589 -5.5187 -5.5187 -5.5187 -5.5187 -4.8683 -4.8683 -4.8683 -4.8683 2.0310 2.0310 2.0310 2.0310 5.6912 5.6912 5.6912 5.6912 5.9685 5.9685 5.9685 5.9685 7.0406 7.0406 7.0406 7.0406 7.7980 7.7980 7.7980 7.7980 8.0040 8.0040 8.0040 8.0040 11.0716 11.0716 11.0716 11.0716 14.8042 14.8042 14.8042 14.8042 18.1843 18.1843 k = 0.1406 0.5000-0.0000 ( 3040 PWs) bands (ev): -9.7290 -9.7290 -9.7290 -9.7290 -8.9063 -8.9063 -8.9063 -8.9063 -8.1391 -8.1391 -8.1391 -8.1391 -7.3382 -7.3382 -7.3382 -7.3382 -5.7622 -5.7622 -5.7622 -5.7622 -5.5190 -5.5190 -5.5190 -5.5190 -4.8792 -4.8792 -4.8792 -4.8792 2.0616 2.0616 2.0616 2.0616 5.6815 5.6815 5.6815 5.6815 5.9535 5.9535 5.9535 5.9535 7.0321 7.0321 7.0321 7.0321 7.7973 7.7973 7.7973 7.7973 7.9965 7.9965 7.9965 7.9965 11.0894 11.0894 11.0894 11.0894 14.8148 14.8148 14.8148 14.8148 18.1868 18.1868 k = 0.1562 0.5000-0.0000 ( 3036 PWs) bands (ev): -9.7436 -9.7436 -9.7436 -9.7436 -8.8782 -8.8782 -8.8782 -8.8782 -8.1396 -8.1396 -8.1396 -8.1396 -7.3448 -7.3448 -7.3448 -7.3448 -5.7660 -5.7660 -5.7660 -5.7660 -5.5193 -5.5193 -5.5193 -5.5193 -4.8908 -4.8908 -4.8908 -4.8908 2.0953 2.0953 2.0953 2.0953 5.6696 5.6696 5.6696 5.6696 5.9383 5.9383 5.9383 5.9383 7.0227 7.0227 7.0227 7.0227 7.7965 7.7965 7.7965 7.7965 7.9889 7.9889 7.9889 7.9889 11.1085 11.1085 11.1085 11.1085 14.8263 14.8263 14.8263 14.8263 18.1898 18.1898 k = 0.1719 0.5000-0.0000 ( 3036 PWs) bands (ev): -9.7584 -9.7584 -9.7584 -9.7584 -8.8486 -8.8486 -8.8486 -8.8486 -8.1401 -8.1401 -8.1401 -8.1401 -7.3522 -7.3522 -7.3522 -7.3522 -5.7701 -5.7701 -5.7701 -5.7701 -5.5196 -5.5196 -5.5196 -5.5196 -4.9030 -4.9030 -4.9030 -4.9030 2.1316 2.1316 2.1316 2.1316 5.6552 5.6552 5.6552 5.6552 5.9233 5.9233 5.9233 5.9233 7.0124 7.0124 7.0124 7.0124 7.7957 7.7957 7.7957 7.7957 7.9814 7.9814 7.9814 7.9814 11.1287 11.1287 11.1287 11.1287 14.8383 14.8383 14.8383 14.8383 18.1935 18.1935 k = 0.1875 0.5000-0.0000 ( 3034 PWs) bands (ev): -9.7731 -9.7731 -9.7731 -9.7731 -8.8179 -8.8179 -8.8179 -8.8179 -8.1408 -8.1408 -8.1408 -8.1408 -7.3603 -7.3603 -7.3603 -7.3603 -5.7745 -5.7745 -5.7745 -5.7745 -5.5199 -5.5199 -5.5199 -5.5199 -4.9157 -4.9157 -4.9157 -4.9157 2.1704 2.1704 2.1704 2.1704 5.6378 5.6378 5.6378 5.6378 5.9090 5.9090 5.9090 5.9090 7.0012 7.0012 7.0012 7.0012 7.7948 7.7948 7.7948 7.7948 7.9741 7.9741 7.9741 7.9741 11.1498 11.1498 11.1498 11.1498 14.8509 14.8509 14.8509 14.8509 18.1978 18.1978 k = 0.2031 0.5000-0.0000 ( 3038 PWs) bands (ev): -9.7877 -9.7877 -9.7877 -9.7877 -8.7862 -8.7862 -8.7862 -8.7862 -8.1416 -8.1416 -8.1416 -8.1416 -7.3692 -7.3692 -7.3692 -7.3692 -5.7793 -5.7793 -5.7793 -5.7793 -5.5203 -5.5203 -5.5203 -5.5203 -4.9287 -4.9287 -4.9287 -4.9287 2.2115 2.2115 2.2115 2.2115 5.6173 5.6173 5.6173 5.6173 5.8957 5.8957 5.8957 5.8957 6.9893 6.9893 6.9893 6.9893 7.7939 7.7939 7.7939 7.7939 7.9671 7.9671 7.9671 7.9671 11.1714 11.1714 11.1714 11.1714 14.8638 14.8638 14.8638 14.8638 18.2030 18.2030 k = 0.2188 0.5000-0.0000 ( 3036 PWs) bands (ev): -9.8021 -9.8021 -9.8021 -9.8021 -8.7538 -8.7538 -8.7538 -8.7538 -8.1425 -8.1425 -8.1425 -8.1425 -7.3787 -7.3787 -7.3787 -7.3787 -5.7844 -5.7844 -5.7844 -5.7844 -5.5207 -5.5207 -5.5207 -5.5207 -4.9419 -4.9419 -4.9419 -4.9419 2.2546 2.2546 2.2546 2.2546 5.5936 5.5936 5.5936 5.5936 5.8838 5.8838 5.8838 5.8838 6.9767 6.9767 6.9767 6.9767 7.7929 7.7929 7.7929 7.7929 7.9605 7.9605 7.9605 7.9605 11.1935 11.1935 11.1935 11.1935 14.8769 14.8769 14.8769 14.8769 18.2089 18.2089 k = 0.2344 0.5000-0.0000 ( 3034 PWs) bands (ev): -9.8160 -9.8160 -9.8160 -9.8160 -8.7207 -8.7207 -8.7207 -8.7207 -8.1435 -8.1435 -8.1435 -8.1435 -7.3889 -7.3889 -7.3889 -7.3889 -5.7898 -5.7898 -5.7898 -5.7898 -5.5212 -5.5212 -5.5212 -5.5212 -4.9550 -4.9550 -4.9550 -4.9550 2.2992 2.2992 2.2992 2.2992 5.5668 5.5668 5.5668 5.5668 5.8733 5.8733 5.8733 5.8733 6.9637 6.9637 6.9637 6.9637 7.7920 7.7920 7.7920 7.7920 7.9545 7.9545 7.9545 7.9545 11.2158 11.2158 11.2158 11.2158 14.8900 14.8900 14.8900 14.8900 18.2155 18.2155 k = 0.2500 0.5000-0.0000 ( 3034 PWs) bands (ev): -9.8294 -9.8294 -9.8294 -9.8294 -8.6873 -8.6873 -8.6873 -8.6873 -8.1447 -8.1447 -8.1447 -8.1447 -7.3997 -7.3997 -7.3997 -7.3997 -5.7954 -5.7954 -5.7954 -5.7954 -5.5216 -5.5216 -5.5216 -5.5216 -4.9680 -4.9680 -4.9680 -4.9680 2.3453 2.3453 2.3453 2.3453 5.5371 5.5371 5.5371 5.5371 5.8642 5.8642 5.8642 5.8642 6.9503 6.9503 6.9503 6.9503 7.7910 7.7910 7.7910 7.7910 7.9489 7.9489 7.9489 7.9489 11.2381 11.2381 11.2381 11.2381 14.9031 14.9031 14.9031 14.9031 18.2229 18.2229 k = 0.2656 0.5000-0.0000 ( 3038 PWs) bands (ev): -9.8423 -9.8423 -9.8423 -9.8423 -8.6536 -8.6536 -8.6536 -8.6536 -8.1461 -8.1461 -8.1461 -8.1461 -7.4112 -7.4112 -7.4112 -7.4112 -5.8012 -5.8012 -5.8012 -5.8012 -5.5221 -5.5221 -5.5221 -5.5221 -4.9808 -4.9808 -4.9808 -4.9808 2.3923 2.3923 2.3923 2.3923 5.5049 5.5049 5.5049 5.5049 5.8565 5.8565 5.8565 5.8565 6.9368 6.9368 6.9368 6.9368 7.7899 7.7899 7.7899 7.7899 7.9439 7.9439 7.9439 7.9439 11.2601 11.2601 11.2601 11.2601 14.9159 14.9159 14.9159 14.9159 18.2310 18.2310 k = 0.2812 0.5000-0.0000 ( 3038 PWs) bands (ev): -9.8546 -9.8546 -9.8546 -9.8546 -8.6198 -8.6198 -8.6198 -8.6198 -8.1476 -8.1476 -8.1476 -8.1476 -7.4232 -7.4232 -7.4232 -7.4232 -5.8071 -5.8071 -5.8071 -5.8071 -5.5227 -5.5227 -5.5227 -5.5227 -4.9931 -4.9931 -4.9931 -4.9931 2.4399 2.4399 2.4399 2.4399 5.4707 5.4707 5.4707 5.4707 5.8500 5.8500 5.8500 5.8500 6.9232 6.9232 6.9232 6.9232 7.7889 7.7889 7.7889 7.7889 7.9395 7.9395 7.9395 7.9395 11.2817 11.2817 11.2817 11.2817 14.9284 14.9284 14.9284 14.9284 18.2397 18.2397 k = 0.2969 0.5000-0.0000 ( 3034 PWs) bands (ev): -9.8661 -9.8661 -9.8661 -9.8661 -8.5861 -8.5861 -8.5861 -8.5861 -8.1495 -8.1495 -8.1495 -8.1495 -7.4356 -7.4356 -7.4356 -7.4356 -5.8131 -5.8131 -5.8131 -5.8131 -5.5232 -5.5232 -5.5232 -5.5232 -5.0050 -5.0050 -5.0050 -5.0050 2.4877 2.4877 2.4877 2.4877 5.4350 5.4350 5.4350 5.4350 5.8445 5.8445 5.8445 5.8445 6.9098 6.9098 6.9098 6.9098 7.7879 7.7879 7.7879 7.7879 7.9357 7.9357 7.9357 7.9357 11.3027 11.3027 11.3027 11.3027 14.9404 14.9404 14.9404 14.9404 18.2489 18.2489 k = 0.3125 0.5000-0.0000 ( 3034 PWs) bands (ev): -9.8770 -9.8770 -9.8770 -9.8770 -8.5527 -8.5527 -8.5527 -8.5527 -8.1516 -8.1516 -8.1516 -8.1516 -7.4484 -7.4484 -7.4484 -7.4484 -5.8191 -5.8191 -5.8191 -5.8191 -5.5237 -5.5237 -5.5237 -5.5237 -5.0163 -5.0163 -5.0163 -5.0163 2.5352 2.5352 2.5352 2.5352 5.3983 5.3983 5.3983 5.3983 5.8398 5.8398 5.8398 5.8398 6.8967 6.8967 6.8967 6.8967 7.7870 7.7870 7.7870 7.7870 7.9323 7.9323 7.9323 7.9323 11.3229 11.3229 11.3229 11.3229 14.9518 14.9518 14.9518 14.9518 18.2585 18.2585 k = 0.3281 0.5000-0.0000 ( 3040 PWs) bands (ev): -9.8871 -9.8871 -9.8871 -9.8871 -8.5197 -8.5197 -8.5197 -8.5197 -8.1541 -8.1541 -8.1541 -8.1541 -7.4615 -7.4615 -7.4615 -7.4615 -5.8250 -5.8250 -5.8250 -5.8250 -5.5242 -5.5242 -5.5242 -5.5242 -5.0268 -5.0268 -5.0268 -5.0268 2.5821 2.5821 2.5821 2.5821 5.3611 5.3611 5.3611 5.3611 5.8360 5.8360 5.8360 5.8360 6.8841 6.8841 6.8841 6.8841 7.7860 7.7860 7.7860 7.7860 7.9295 7.9295 7.9295 7.9295 11.3422 11.3422 11.3422 11.3422 14.9626 14.9626 14.9626 14.9626 18.2682 18.2682 k = 0.3438 0.5000-0.0000 ( 3040 PWs) bands (ev): -9.8965 -9.8965 -9.8965 -9.8965 -8.4873 -8.4873 -8.4873 -8.4873 -8.1570 -8.1570 -8.1570 -8.1570 -7.4746 -7.4746 -7.4746 -7.4746 -5.8308 -5.8308 -5.8308 -5.8308 -5.5247 -5.5247 -5.5247 -5.5247 -5.0366 -5.0366 -5.0366 -5.0366 2.6277 2.6277 2.6277 2.6277 5.3241 5.3241 5.3241 5.3241 5.8327 5.8327 5.8327 5.8327 6.8721 6.8721 6.8721 6.8721 7.7851 7.7851 7.7851 7.7851 7.9271 7.9271 7.9271 7.9271 11.3603 11.3603 11.3603 11.3603 14.9726 14.9726 14.9726 14.9726 18.2781 18.2781 k = 0.3594 0.5000-0.0000 ( 3040 PWs) bands (ev): -9.9050 -9.9050 -9.9050 -9.9050 -8.4558 -8.4558 -8.4558 -8.4558 -8.1605 -8.1605 -8.1605 -8.1605 -7.4877 -7.4877 -7.4877 -7.4877 -5.8364 -5.8364 -5.8364 -5.8364 -5.5252 -5.5252 -5.5252 -5.5252 -5.0456 -5.0456 -5.0456 -5.0456 2.6716 2.6716 2.6716 2.6716 5.2878 5.2878 5.2878 5.2878 5.8300 5.8300 5.8300 5.8300 6.8609 6.8609 6.8609 6.8609 7.7842 7.7842 7.7842 7.7842 7.9251 7.9251 7.9251 7.9251 11.3771 11.3771 11.3771 11.3771 14.9818 14.9818 14.9818 14.9818 18.2878 18.2878 k = 0.3750 0.5000-0.0000 ( 3036 PWs) bands (ev): -9.9127 -9.9127 -9.9127 -9.9127 -8.4252 -8.4252 -8.4252 -8.4252 -8.1645 -8.1645 -8.1645 -8.1645 -7.5005 -7.5005 -7.5005 -7.5005 -5.8416 -5.8416 -5.8416 -5.8416 -5.5257 -5.5257 -5.5257 -5.5257 -5.0538 -5.0538 -5.0538 -5.0538 2.7132 2.7132 2.7132 2.7132 5.2529 5.2529 5.2529 5.2529 5.8277 5.8277 5.8277 5.8277 6.8505 6.8505 6.8505 6.8505 7.7834 7.7834 7.7834 7.7834 7.9235 7.9235 7.9235 7.9235 11.3926 11.3926 11.3926 11.3926 14.9901 14.9901 14.9901 14.9901 18.2971 18.2971 k = 0.3906 0.5000-0.0000 ( 3034 PWs) bands (ev): -9.9195 -9.9195 -9.9195 -9.9195 -8.3959 -8.3959 -8.3959 -8.3959 -8.1693 -8.1693 -8.1693 -8.1693 -7.5127 -7.5127 -7.5127 -7.5127 -5.8465 -5.8465 -5.8465 -5.8465 -5.5261 -5.5261 -5.5261 -5.5261 -5.0610 -5.0610 -5.0610 -5.0610 2.7519 2.7519 2.7519 2.7519 5.2200 5.2200 5.2200 5.2200 5.8258 5.8258 5.8258 5.8258 6.8411 6.8411 6.8411 6.8411 7.7827 7.7827 7.7827 7.7827 7.9221 7.9221 7.9221 7.9221 11.4065 11.4065 11.4065 11.4065 14.9975 14.9975 14.9975 14.9975 18.3059 18.3059 k = 0.4062 0.5000-0.0000 ( 3044 PWs) bands (ev): -9.9254 -9.9254 -9.9254 -9.9254 -8.3679 -8.3679 -8.3679 -8.3679 -8.1750 -8.1750 -8.1750 -8.1750 -7.5242 -7.5242 -7.5242 -7.5242 -5.8509 -5.8509 -5.8509 -5.8509 -5.5265 -5.5265 -5.5265 -5.5265 -5.0673 -5.0673 -5.0673 -5.0673 2.7870 2.7870 2.7870 2.7870 5.1898 5.1898 5.1898 5.1898 5.8242 5.8242 5.8242 5.8242 6.8328 6.8328 6.8328 6.8328 7.7820 7.7820 7.7820 7.7820 7.9211 7.9211 7.9211 7.9211 11.4188 11.4188 11.4188 11.4188 15.0040 15.0040 15.0040 15.0040 18.3140 18.3140 k = 0.4219 0.5000-0.0000 ( 3040 PWs) bands (ev): -9.9304 -9.9304 -9.9304 -9.9304 -8.3416 -8.3416 -8.3416 -8.3416 -8.1817 -8.1817 -8.1817 -8.1817 -7.5346 -7.5346 -7.5346 -7.5346 -5.8547 -5.8547 -5.8547 -5.8547 -5.5269 -5.5269 -5.5269 -5.5269 -5.0727 -5.0727 -5.0727 -5.0727 2.8181 2.8181 2.8181 2.8181 5.1629 5.1629 5.1629 5.1629 5.8229 5.8229 5.8229 5.8229 6.8256 6.8256 6.8256 6.8256 7.7815 7.7815 7.7815 7.7815 7.9203 7.9203 7.9203 7.9203 11.4294 11.4294 11.4294 11.4294 15.0095 15.0095 15.0095 15.0095 18.3212 18.3212 k = 0.4375 0.5000-0.0000 ( 3040 PWs) bands (ev): -9.9346 -9.9346 -9.9346 -9.9346 -8.3170 -8.3170 -8.3170 -8.3170 -8.1897 -8.1897 -8.1897 -8.1897 -7.5437 -7.5437 -7.5437 -7.5437 -5.8579 -5.8579 -5.8579 -5.8579 -5.5271 -5.5271 -5.5271 -5.5271 -5.0771 -5.0771 -5.0771 -5.0771 2.8445 2.8445 2.8445 2.8445 5.1398 5.1398 5.1398 5.1398 5.8219 5.8219 5.8219 5.8219 6.8196 6.8196 6.8196 6.8196 7.7810 7.7810 7.7810 7.7810 7.9196 7.9196 7.9196 7.9196 11.4382 11.4382 11.4382 11.4382 15.0140 15.0140 15.0140 15.0140 18.3273 18.3273 k = 0.4531 0.5000-0.0000 ( 3048 PWs) bands (ev): -9.9378 -9.9378 -9.9378 -9.9378 -8.2943 -8.2943 -8.2943 -8.2943 -8.1989 -8.1989 -8.1989 -8.1989 -7.5511 -7.5511 -7.5511 -7.5511 -5.8605 -5.8605 -5.8605 -5.8605 -5.5274 -5.5274 -5.5274 -5.5274 -5.0805 -5.0805 -5.0805 -5.0805 2.8656 2.8656 2.8656 2.8656 5.1213 5.1213 5.1213 5.1213 5.8212 5.8212 5.8212 5.8212 6.8150 6.8150 6.8150 6.8150 7.7806 7.7806 7.7806 7.7806 7.9192 7.9192 7.9192 7.9192 11.4451 11.4451 11.4451 11.4451 15.0175 15.0175 15.0175 15.0175 18.3322 18.3322 k = 0.4688 0.5000-0.0000 ( 3056 PWs) bands (ev): -9.9401 -9.9401 -9.9401 -9.9401 -8.2738 -8.2738 -8.2738 -8.2738 -8.2097 -8.2097 -8.2097 -8.2097 -7.5565 -7.5565 -7.5565 -7.5565 -5.8624 -5.8624 -5.8624 -5.8624 -5.5275 -5.5275 -5.5275 -5.5275 -5.0830 -5.0830 -5.0830 -5.0830 2.8811 2.8811 2.8811 2.8811 5.1076 5.1076 5.1076 5.1076 5.8206 5.8206 5.8206 5.8206 6.8116 6.8116 6.8116 6.8116 7.7803 7.7803 7.7803 7.7803 7.9188 7.9188 7.9188 7.9188 11.4500 11.4500 11.4500 11.4500 15.0200 15.0200 15.0200 15.0200 18.3358 18.3358 k = 0.4844 0.5000-0.0000 ( 3048 PWs) bands (ev): -9.9415 -9.9415 -9.9415 -9.9415 -8.2557 -8.2557 -8.2557 -8.2557 -8.2218 -8.2218 -8.2218 -8.2218 -7.5599 -7.5599 -7.5599 -7.5599 -5.8635 -5.8635 -5.8635 -5.8635 -5.5276 -5.5276 -5.5276 -5.5276 -5.0844 -5.0844 -5.0844 -5.0844 2.8905 2.8905 2.8905 2.8905 5.0993 5.0993 5.0993 5.0993 5.8203 5.8203 5.8203 5.8203 6.8096 6.8096 6.8096 6.8096 7.7802 7.7802 7.7802 7.7802 7.9187 7.9187 7.9187 7.9187 11.4530 11.4530 11.4530 11.4530 15.0215 15.0215 15.0215 15.0215 18.3380 18.3380 k = 0.5000 0.5000-0.0000 ( 3036 PWs) bands (ev): -9.9420 -9.9420 -9.9420 -9.9420 -8.2442 -8.2442 -8.2442 -8.2442 -8.2313 -8.2313 -8.2313 -8.2313 -7.5611 -7.5611 -7.5611 -7.5611 -5.8639 -5.8639 -5.8639 -5.8639 -5.5277 -5.5277 -5.5277 -5.5277 -5.0849 -5.0849 -5.0849 -5.0849 2.8937 2.8937 2.8937 2.8937 5.0965 5.0965 5.0965 5.0965 5.8202 5.8202 5.8202 5.8202 6.8089 6.8089 6.8089 6.8089 7.7801 7.7801 7.7801 7.7801 7.9186 7.9186 7.9186 7.9186 11.4540 11.4540 11.4540 11.4540 15.0220 15.0220 15.0220 15.0220 18.3388 18.3388 k = 0.5000 0.5000-0.0000 ( 3036 PWs) bands (ev): -9.9420 -9.9420 -9.9420 -9.9420 -8.2442 -8.2442 -8.2442 -8.2442 -8.2313 -8.2313 -8.2313 -8.2313 -7.5611 -7.5611 -7.5611 -7.5611 -5.8639 -5.8639 -5.8639 -5.8639 -5.5277 -5.5277 -5.5277 -5.5277 -5.0849 -5.0849 -5.0849 -5.0849 2.8937 2.8937 2.8937 2.8937 5.0965 5.0965 5.0965 5.0965 5.8202 5.8202 5.8202 5.8202 6.8089 6.8089 6.8089 6.8089 7.7801 7.7801 7.7801 7.7801 7.9186 7.9186 7.9186 7.9186 11.4540 11.4540 11.4540 11.4540 15.0220 15.0220 15.0220 15.0220 18.3388 18.3388 k = 0.4889 0.4889-0.0000 ( 3044 PWs) bands (ev): -9.9420 -9.9420 -9.9410 -9.9410 -8.2630 -8.2630 -8.2441 -8.2441 -8.2313 -8.2313 -8.2166 -8.2166 -7.5612 -7.5612 -7.5586 -7.5586 -5.8639 -5.8639 -5.8631 -5.8631 -5.5277 -5.5277 -5.5276 -5.5276 -5.0854 -5.0854 -5.0835 -5.0835 2.8862 2.8862 2.8949 2.8949 5.0964 5.0964 5.1022 5.1022 5.8194 5.8194 5.8213 5.8213 6.8084 6.8084 6.8107 6.8107 7.7801 7.7801 7.7802 7.7802 7.9184 7.9184 7.9190 7.9190 11.4506 11.4506 11.4554 11.4554 15.0210 15.0210 15.0221 15.0221 18.3366 18.3366 k = 0.4778 0.4778-0.0000 ( 3048 PWs) bands (ev): -9.9421 -9.9421 -9.9381 -9.9381 -8.2912 -8.2912 -8.2439 -8.2439 -8.2312 -8.2312 -8.2007 -8.2007 -7.5617 -7.5617 -7.5515 -7.5515 -5.8640 -5.8640 -5.8608 -5.8608 -5.5278 -5.5278 -5.5272 -5.5272 -5.0868 -5.0868 -5.0791 -5.0791 2.8639 2.8639 2.8983 2.8983 5.0962 5.0962 5.1191 5.1191 5.8168 5.8168 5.8245 5.8245 6.8072 6.8072 6.8161 6.8161 7.7802 7.7802 7.7805 7.7805 7.9177 7.9177 7.9200 7.9200 11.4404 11.4404 11.4595 11.4595 15.0178 15.0178 15.0221 15.0221 18.3301 18.3301 k = 0.4667 0.4667-0.0000 ( 3046 PWs) bands (ev): -9.9423 -9.9423 -9.9332 -9.9332 -8.3239 -8.3239 -8.2435 -8.2435 -8.2311 -8.2311 -8.1878 -8.1878 -7.5624 -7.5624 -7.5401 -7.5401 -5.8640 -5.8640 -5.8571 -5.8571 -5.5281 -5.5281 -5.5267 -5.5267 -5.0891 -5.0891 -5.0718 -5.0718 2.8277 2.8277 2.9039 2.9039 5.0958 5.0958 5.1462 5.1462 5.8126 5.8126 5.8298 5.8298 6.8051 6.8051 6.8250 6.8250 7.7803 7.7803 7.7809 7.7809 7.9166 7.9166 7.9218 7.9218 11.4234 11.4234 11.4665 11.4665 15.0125 15.0125 15.0223 15.0223 18.3194 18.3194 k = 0.4556 0.4556-0.0000 ( 3050 PWs) bands (ev): -9.9426 -9.9426 -9.9264 -9.9264 -8.3605 -8.3605 -8.2430 -8.2430 -8.2309 -8.2309 -8.1776 -8.1776 -7.5634 -7.5634 -7.5253 -7.5253 -5.8641 -5.8641 -5.8520 -5.8520 -5.5284 -5.5284 -5.5260 -5.5260 -5.0923 -5.0923 -5.0615 -5.0615 2.7790 2.7790 2.9119 2.9119 5.0952 5.0952 5.1822 5.1822 5.8069 5.8069 5.8373 5.8373 6.8021 6.8021 6.8375 6.8375 7.7804 7.7804 7.7815 7.7815 7.9150 7.9150 7.9242 7.9242 11.3998 11.3998 11.4761 11.4761 15.0051 15.0051 15.0223 15.0223 18.3048 18.3048 k = 0.4444 0.4444-0.0000 ( 3054 PWs) bands (ev): -9.9430 -9.9430 -9.9177 -9.9177 -8.4006 -8.4006 -8.2424 -8.2424 -8.2306 -8.2306 -8.1697 -8.1697 -7.5647 -7.5647 -7.5079 -7.5079 -5.8642 -5.8642 -5.8458 -5.8458 -5.5287 -5.5287 -5.5251 -5.5251 -5.0965 -5.0965 -5.0481 -5.0481 2.7193 2.7193 2.9222 2.9222 5.0945 5.0945 5.2254 5.2254 5.7998 5.7998 5.8469 5.8469 6.7982 6.7982 6.8534 6.8534 7.7806 7.7806 7.7823 7.7823 7.9131 7.9131 7.9275 7.9275 11.3695 11.3695 11.4885 11.4885 14.9954 14.9954 15.0222 15.0222 18.2864 18.2864 k = 0.4333 0.4333-0.0000 ( 3050 PWs) bands (ev): -9.9435 -9.9435 -9.9072 -9.9072 -8.4435 -8.4435 -8.2417 -8.2417 -8.2303 -8.2303 -8.1635 -8.1635 -7.5664 -7.5664 -7.4887 -7.4887 -5.8643 -5.8643 -5.8386 -5.8386 -5.5292 -5.5292 -5.5241 -5.5241 -5.1016 -5.1016 -5.0317 -5.0317 2.6503 2.6503 2.9349 2.9349 5.0936 5.0936 5.2740 5.2740 5.7916 5.7916 5.8586 5.8586 6.7935 6.7935 6.8727 6.8727 7.7808 7.7808 7.7833 7.7833 7.9108 7.9108 7.9315 7.9315 11.3328 11.3328 11.5036 11.5036 14.9836 14.9836 15.0219 15.0219 18.2648 18.2648 k = 0.4222 0.4222-0.0000 ( 3042 PWs) bands (ev): -9.9440 -9.9440 -9.8949 -9.8949 -8.4889 -8.4889 -8.2408 -8.2408 -8.2299 -8.2299 -8.1587 -8.1587 -7.5683 -7.5683 -7.4684 -7.4684 -5.8644 -5.8644 -5.8307 -5.8307 -5.5297 -5.5297 -5.5230 -5.5230 -5.1076 -5.1076 -5.0122 -5.0122 2.5736 2.5736 2.9499 2.9499 5.0925 5.0925 5.3260 5.3260 5.7826 5.7826 5.8725 5.8725 6.7879 6.7879 6.8952 6.8952 7.7811 7.7811 7.7844 7.7844 7.9082 7.9082 7.9363 7.9363 11.2897 11.2897 11.5214 11.5214 14.9696 14.9696 15.0213 15.0213 18.2403 18.2403 k = 0.4111 0.4111-0.0000 ( 3038 PWs) bands (ev): -9.9446 -9.9446 -9.8808 -9.8808 -8.5360 -8.5360 -8.2398 -8.2398 -8.2294 -8.2294 -8.1550 -8.1550 -7.5706 -7.5706 -7.4477 -7.4477 -5.8646 -5.8646 -5.8223 -5.8223 -5.5303 -5.5303 -5.5219 -5.5219 -5.1146 -5.1146 -4.9895 -4.9895 2.4907 2.4907 2.9673 2.9673 5.0912 5.0912 5.3795 5.3795 5.7736 5.7736 5.8884 5.8884 6.7814 6.7814 6.9207 6.9207 7.7814 7.7814 7.7857 7.7857 7.9053 7.9053 7.9419 7.9419 11.2403 11.2403 11.5419 11.5419 14.9533 14.9533 15.0201 15.0201 18.2134 18.2134 k = 0.4000 0.4000-0.0000 ( 3046 PWs) bands (ev): -9.9453 -9.9453 -9.8651 -9.8651 -8.5845 -8.5845 -8.2387 -8.2387 -8.2289 -8.2289 -8.1522 -8.1522 -7.5731 -7.5731 -7.4271 -7.4271 -5.8647 -5.8647 -5.8137 -5.8137 -5.5310 -5.5310 -5.5208 -5.5208 -5.1225 -5.1225 -4.9638 -4.9638 2.4029 2.4029 2.9871 2.9871 5.0897 5.0897 5.4322 5.4322 5.7655 5.7655 5.9066 5.9066 6.7740 6.7740 6.9491 6.9491 7.7816 7.7816 7.7871 7.7871 7.9022 7.9022 7.9484 7.9484 11.1849 11.1849 11.5650 11.5650 14.9347 14.9347 15.0183 15.0183 18.1847 18.1847 k = 0.3889 0.3889-0.0000 ( 3046 PWs) bands (ev): -9.9460 -9.9460 -9.8479 -9.8479 -8.6338 -8.6338 -8.2376 -8.2376 -8.2282 -8.2282 -8.1500 -8.1500 -7.5761 -7.5761 -7.4068 -7.4068 -5.8649 -5.8649 -5.8051 -5.8051 -5.5317 -5.5317 -5.5197 -5.5197 -5.1314 -5.1314 -4.9352 -4.9352 2.3115 2.3115 3.0095 3.0095 5.0880 5.0880 5.4812 5.4812 5.7604 5.7604 5.9269 5.9269 6.7658 6.7658 6.9800 6.9800 7.7819 7.7819 7.7887 7.7887 7.8989 7.8989 7.9559 7.9559 11.1237 11.1237 11.5906 11.5906 14.9138 14.9138 15.0158 15.0158 18.1547 18.1547 k = 0.3778 0.3778-0.0000 ( 3046 PWs) bands (ev): -9.9468 -9.9468 -9.8292 -9.8292 -8.6833 -8.6833 -8.2364 -8.2364 -8.2275 -8.2275 -8.1483 -8.1483 -7.5793 -7.5793 -7.3872 -7.3872 -5.8651 -5.8651 -5.7965 -5.7965 -5.5325 -5.5325 -5.5187 -5.5187 -5.1412 -5.1412 -4.9037 -4.9037 2.2175 2.2175 3.0344 3.0344 5.0860 5.0860 5.5222 5.5222 5.7616 5.7616 5.9494 5.9494 6.7566 6.7566 7.0133 7.0133 7.7823 7.7823 7.7904 7.7904 7.8954 7.8954 7.9642 7.9642 11.0568 11.0568 11.6188 11.6188 14.8906 14.8906 15.0123 15.0123 18.1240 18.1240 k = 0.3667 0.3667-0.0000 ( 3046 PWs) bands (ev): -9.9477 -9.9477 -9.8093 -9.8093 -8.7327 -8.7327 -8.2351 -8.2351 -8.2266 -8.2266 -8.1471 -8.1471 -7.5830 -7.5830 -7.3684 -7.3684 -5.8654 -5.8654 -5.7883 -5.7883 -5.5333 -5.5333 -5.5178 -5.5178 -5.1520 -5.1520 -4.8696 -4.8696 2.1219 2.1219 3.0619 3.0619 5.0838 5.0838 5.5505 5.5505 5.7732 5.7732 5.9742 5.9742 6.7466 6.7466 7.0486 7.0486 7.7826 7.7826 7.7923 7.7923 7.8919 7.8919 7.9736 7.9736 10.9845 10.9845 11.6494 11.6494 14.8652 14.8652 15.0078 15.0078 18.0932 18.0932 k = 0.3556 0.3556-0.0000 ( 3042 PWs) bands (ev): -9.9486 -9.9486 -9.7884 -9.7884 -8.7814 -8.7814 -8.2339 -8.2339 -8.2256 -8.2256 -8.1461 -8.1461 -7.5870 -7.5870 -7.3506 -7.3506 -5.8656 -5.8656 -5.7805 -5.7805 -5.5341 -5.5341 -5.5169 -5.5169 -5.1637 -5.1637 -4.8331 -4.8331 2.0253 2.0253 3.0920 3.0920 5.0814 5.0814 5.5630 5.5630 5.7978 5.7978 6.0012 6.0012 6.7357 6.7357 7.0855 7.0855 7.7830 7.7830 7.7943 7.7943 7.8882 7.8882 7.9840 7.9840 10.9070 10.9070 11.6824 11.6824 14.8375 14.8375 15.0021 15.0021 18.0628 18.0628 k = 0.3444 0.3444-0.0000 ( 3038 PWs) bands (ev): -9.9496 -9.9496 -9.7667 -9.7667 -8.8290 -8.8290 -8.2327 -8.2327 -8.2244 -8.2244 -8.1454 -8.1454 -7.5914 -7.5914 -7.3338 -7.3338 -5.8659 -5.8659 -5.7733 -5.7733 -5.5350 -5.5350 -5.5162 -5.5162 -5.1763 -5.1763 -4.7945 -4.7945 1.9287 1.9287 3.1248 3.1248 5.0788 5.0788 5.5619 5.5619 5.8328 5.8328 6.0308 6.0308 6.7240 6.7240 7.1235 7.1235 7.7835 7.7835 7.7964 7.7964 7.8846 7.8846 7.9953 7.9953 10.8244 10.8244 11.7176 11.7176 14.8077 14.8077 14.9951 14.9951 18.0331 18.0331 k = 0.3333 0.3333-0.0000 ( 3036 PWs) bands (ev): -9.9506 -9.9506 -9.7446 -9.7446 -8.8749 -8.8749 -8.2316 -8.2316 -8.2230 -8.2230 -8.1450 -8.1450 -7.5963 -7.5963 -7.3181 -7.3181 -5.8663 -5.8663 -5.7666 -5.7666 -5.5358 -5.5358 -5.5156 -5.5156 -5.1898 -5.1898 -4.7540 -4.7540 1.8324 1.8324 3.1603 3.1603 5.0759 5.0759 5.5515 5.5515 5.8736 5.8736 6.0627 6.0627 6.7115 6.7115 7.1623 7.1623 7.7840 7.7840 7.7986 7.7986 7.8810 7.8810 8.0077 8.0077 10.7371 10.7371 11.7550 11.7550 14.7759 14.7759 14.9867 14.9867 18.0046 18.0046 k = 0.3222 0.3222-0.0000 ( 3036 PWs) bands (ev): -9.9517 -9.9517 -9.7226 -9.7226 -8.9185 -8.9185 -8.2306 -8.2306 -8.2214 -8.2214 -8.1447 -8.1447 -7.6015 -7.6015 -7.3035 -7.3035 -5.8666 -5.8666 -5.7606 -5.7606 -5.5367 -5.5367 -5.5151 -5.5151 -5.2042 -5.2042 -4.7121 -4.7121 1.7372 1.7372 3.1986 3.1986 5.0728 5.0728 5.5354 5.5354 5.9164 5.9164 6.0972 6.0972 6.6982 6.6982 7.2015 7.2015 7.7846 7.7846 7.8010 7.8010 7.8774 7.8774 8.0211 8.0211 10.6453 10.6453 11.7944 11.7944 14.7421 14.7421 14.9768 14.9768 17.9776 17.9776 k = 0.3111 0.3111-0.0000 ( 3040 PWs) bands (ev): -9.9528 -9.9528 -9.7011 -9.7011 -8.9591 -8.9591 -8.2297 -8.2297 -8.2197 -8.2197 -8.1446 -8.1446 -7.6073 -7.6073 -7.2899 -7.2899 -5.8670 -5.8670 -5.7554 -5.7554 -5.5375 -5.5375 -5.5148 -5.5148 -5.2194 -5.2194 -4.6691 -4.6691 1.6434 1.6434 3.2398 3.2398 5.0695 5.0695 5.5157 5.5157 5.9592 5.9592 6.1340 6.1340 6.6842 6.6842 7.2405 7.2405 7.7852 7.7852 7.8034 7.8034 7.8739 7.8739 8.0354 8.0354 10.5493 10.5493 11.8358 11.8358 14.7065 14.7065 14.9654 14.9654 17.9522 17.9522 k = 0.3000 0.3000-0.0000 ( 3036 PWs) bands (ev): -9.9540 -9.9540 -9.6810 -9.6810 -8.9958 -8.9958 -8.2288 -8.2288 -8.2177 -8.2177 -8.1446 -8.1446 -7.6135 -7.6135 -7.2774 -7.2774 -5.8674 -5.8674 -5.7509 -5.7509 -5.5383 -5.5383 -5.5145 -5.5145 -5.2354 -5.2354 -4.6253 -4.6253 1.5516 1.5516 3.2838 3.2838 5.0659 5.0659 5.4937 5.4937 6.0010 6.0010 6.1729 6.1729 6.6696 6.6696 7.2790 7.2790 7.7860 7.7860 7.8059 7.8059 7.8705 7.8705 8.0508 8.0508 10.4494 10.4494 11.8789 11.8789 14.6692 14.6692 14.9525 14.9525 17.9286 17.9286 k = 0.2889 0.2889-0.0000 ( 3020 PWs) bands (ev): -9.9552 -9.9552 -9.6632 -9.6632 -9.0277 -9.0277 -8.2280 -8.2280 -8.2157 -8.2157 -8.1447 -8.1447 -7.6203 -7.6203 -7.2658 -7.2658 -5.8679 -5.8679 -5.7472 -5.7472 -5.5390 -5.5390 -5.5144 -5.5144 -5.2521 -5.2521 -4.5810 -4.5810 1.4619 1.4619 3.3307 3.3307 5.0622 5.0622 5.4701 5.4701 6.0412 6.0412 6.2136 6.2136 6.6544 6.6544 7.3165 7.3165 7.7870 7.7870 7.8085 7.8085 7.8673 7.8673 8.0672 8.0672 10.3458 10.3458 11.9236 11.9236 14.6306 14.6306 14.9381 14.9381 17.9069 17.9069 k = 0.2778 0.2778-0.0000 ( 3026 PWs) bands (ev): -9.9564 -9.9564 -9.6487 -9.6487 -9.0535 -9.0535 -8.2272 -8.2272 -8.2135 -8.2135 -8.1449 -8.1449 -7.6276 -7.6276 -7.2551 -7.2551 -5.8684 -5.8684 -5.7443 -5.7443 -5.5397 -5.5397 -5.5143 -5.5143 -5.2695 -5.2695 -4.5367 -4.5367 1.3749 1.3749 3.3806 3.3806 5.0582 5.0582 5.4456 5.4456 6.0799 6.0799 6.2556 6.2556 6.6388 6.6388 7.3526 7.3526 7.7881 7.7881 7.8111 7.8111 7.8642 7.8642 8.0844 8.0844 10.2388 10.2388 11.9697 11.9697 14.5906 14.5906 14.9222 14.9222 17.8870 17.8870 k = 0.2667 0.2667-0.0000 ( 3026 PWs) bands (ev): -9.9576 -9.9576 -9.6386 -9.6386 -9.0720 -9.0720 -8.2265 -8.2265 -8.2112 -8.2112 -8.1453 -8.1453 -7.6356 -7.6356 -7.2454 -7.2454 -5.8690 -5.8690 -5.7423 -5.7423 -5.5403 -5.5403 -5.5143 -5.5143 -5.2875 -5.2875 -4.4927 -4.4927 1.2907 1.2907 3.4334 3.4334 5.0541 5.0541 5.4204 5.4204 6.1171 6.1171 6.2983 6.2983 6.6228 6.6228 7.3870 7.3870 7.7894 7.7894 7.8137 7.8137 7.8613 7.8613 8.1025 8.1025 10.1289 10.1289 12.0170 12.0170 14.5496 14.5496 14.9049 14.9049 17.8688 17.8688 k = 0.2556 0.2556-0.0000 ( 3026 PWs) bands (ev): -9.9588 -9.9588 -9.6340 -9.6340 -9.0823 -9.0823 -8.2259 -8.2259 -8.2088 -8.2088 -8.1456 -8.1456 -7.6442 -7.6442 -7.2364 -7.2364 -5.8696 -5.8696 -5.7412 -5.7412 -5.5408 -5.5408 -5.5144 -5.5144 -5.3059 -5.3059 -4.4492 -4.4492 1.2096 1.2096 3.4891 3.4891 5.0499 5.0499 5.3948 5.3948 6.1531 6.1531 6.3414 6.3414 6.6066 6.6066 7.4193 7.4193 7.7909 7.7909 7.8163 7.8163 7.8586 7.8586 8.1213 8.1213 10.0162 10.0162 12.0654 12.0654 14.5079 14.5079 14.8862 14.8862 17.8522 17.8522 k = 0.2444 0.2444-0.0000 ( 3026 PWs) bands (ev): -9.9600 -9.9600 -9.6355 -9.6355 -9.0837 -9.0837 -8.2252 -8.2252 -8.2064 -8.2064 -8.1461 -8.1461 -7.6534 -7.6534 -7.2282 -7.2282 -5.8702 -5.8702 -5.7410 -5.7410 -5.5412 -5.5412 -5.5145 -5.5145 -5.3246 -5.3246 -4.4065 -4.4065 1.1319 1.1319 3.5478 3.5478 5.0454 5.0454 5.3692 5.3692 6.1879 6.1879 6.3844 6.3844 6.5904 6.5904 7.4493 7.4493 7.7927 7.7927 7.8188 7.8188 7.8562 7.8562 8.1408 8.1408 9.9013 9.9013 12.1147 12.1147 14.4655 14.4655 14.8664 14.8664 17.8368 17.8368 k = 0.2333 0.2333-0.0000 ( 3026 PWs) bands (ev): -9.9613 -9.9613 -9.6429 -9.6429 -9.0763 -9.0763 -8.2246 -8.2246 -8.2039 -8.2039 -8.1466 -8.1466 -7.6635 -7.6635 -7.2208 -7.2208 -5.8710 -5.8710 -5.7418 -5.7418 -5.5415 -5.5415 -5.5146 -5.5146 -5.3434 -5.3434 -4.3649 -4.3649 1.0576 1.0576 3.6093 3.6093 5.0408 5.0408 5.3438 5.3438 6.2216 6.2216 6.4269 6.4269 6.5743 6.5743 7.4766 7.4766 7.7949 7.7949 7.8212 7.8212 7.8541 7.8541 8.1610 8.1610 9.7844 9.7844 12.1645 12.1645 14.4228 14.4228 14.8455 14.8455 17.8225 17.8225 k = 0.2222 0.2222-0.0000 ( 3039 PWs) bands (ev): -9.9625 -9.9625 -9.6558 -9.6558 -9.0607 -9.0607 -8.2241 -8.2241 -8.2014 -8.2014 -8.1472 -8.1472 -7.6743 -7.6743 -7.2141 -7.2141 -5.8718 -5.8718 -5.7437 -5.7437 -5.5417 -5.5417 -5.5148 -5.5148 -5.3623 -5.3623 -4.3246 -4.3246 0.9870 0.9870 3.6736 3.6736 5.0361 5.0361 5.3187 5.3187 6.2540 6.2540 6.4682 6.4682 6.5589 6.5589 7.5011 7.5011 7.7974 7.7974 7.8234 7.8234 7.8523 7.8523 8.1816 8.1816 9.6660 9.6660 12.2147 12.2147 14.3801 14.3801 14.8237 14.8237 17.8090 17.8090 k = 0.2111 0.2111-0.0000 ( 3041 PWs) bands (ev): -9.9637 -9.9637 -9.6729 -9.6729 -9.0379 -9.0379 -8.2235 -8.2235 -8.1989 -8.1989 -8.1478 -8.1478 -7.6860 -7.6860 -7.2080 -7.2080 -5.8727 -5.8727 -5.7466 -5.7466 -5.5418 -5.5418 -5.5150 -5.5150 -5.3809 -5.3809 -4.2859 -4.2859 0.9201 0.9201 3.7407 3.7407 5.0313 5.0313 5.2942 5.2942 6.2851 6.2851 6.5064 6.5064 6.5462 6.5462 7.5227 7.5227 7.8002 7.8002 7.8253 7.8253 7.8510 7.8510 8.2025 8.2025 9.5465 9.5465 12.2651 12.2651 14.3374 14.3374 14.8013 14.8013 17.7959 17.7959 k = 0.2000 0.2000-0.0000 ( 3037 PWs) bands (ev): -9.9649 -9.9649 -9.6933 -9.6933 -9.0092 -9.0092 -8.2230 -8.2230 -8.1963 -8.1963 -8.1485 -8.1485 -7.6986 -7.6986 -7.2025 -7.2025 -5.8737 -5.8737 -5.7507 -5.7507 -5.5419 -5.5419 -5.5152 -5.5152 -5.3991 -5.3991 -4.2488 -4.2488 0.8571 0.8571 3.8103 3.8103 5.0263 5.0263 5.2705 5.2705 6.3145 6.3145 6.5208 6.5208 6.5568 6.5568 7.5414 7.5414 7.8034 7.8034 7.8267 7.8267 7.8503 7.8503 8.2238 8.2238 9.4265 9.4265 12.3154 12.3154 14.2951 14.2951 14.7784 14.7784 17.7830 17.7830 k = 0.1889 0.1889-0.0000 ( 3041 PWs) bands (ev): -9.9661 -9.9661 -9.7158 -9.7158 -8.9756 -8.9756 -8.2225 -8.2225 -8.1938 -8.1938 -8.1492 -8.1492 -7.7122 -7.7122 -7.1975 -7.1975 -5.8749 -5.8749 -5.7559 -5.7559 -5.5418 -5.5418 -5.5154 -5.5154 -5.4167 -5.4167 -4.2135 -4.2135 0.7980 0.7980 3.8822 3.8822 5.0211 5.0211 5.2478 5.2478 6.3416 6.3416 6.5110 6.5110 6.5917 6.5917 7.5571 7.5571 7.8069 7.8069 7.8276 7.8276 7.8502 7.8502 8.2451 8.2451 9.3064 9.3064 12.3653 12.3653 14.2534 14.2534 14.7553 14.7553 17.7700 17.7700 k = 0.1778 0.1778-0.0000 ( 3045 PWs) bands (ev): -9.9673 -9.9673 -9.7394 -9.7394 -8.9381 -8.9381 -8.2220 -8.2220 -8.1912 -8.1912 -8.1500 -8.1500 -7.7269 -7.7269 -7.1931 -7.1931 -5.8763 -5.8763 -5.7622 -5.7622 -5.5417 -5.5417 -5.5156 -5.5156 -5.4333 -5.4333 -4.1802 -4.1802 0.7427 0.7427 3.9564 3.9564 5.0158 5.0158 5.2264 5.2264 6.3653 6.3653 6.5012 6.5012 6.6272 6.6272 7.5700 7.5700 7.8107 7.8107 7.8279 7.8279 7.8507 7.8507 8.2664 8.2664 9.1868 9.1868 12.4146 12.4146 14.2125 14.2125 14.7322 14.7322 17.7568 17.7568 k = 0.1667 0.1667-0.0000 ( 3051 PWs) bands (ev): -9.9684 -9.9684 -9.7635 -9.7635 -8.8976 -8.8976 -8.2216 -8.2216 -8.1887 -8.1887 -8.1508 -8.1508 -7.7428 -7.7428 -7.1892 -7.1892 -5.8779 -5.8779 -5.7695 -5.7695 -5.5415 -5.5415 -5.5158 -5.5158 -5.4489 -5.4489 -4.1490 -4.1490 0.6914 0.6914 4.0324 4.0324 5.0104 5.0104 5.2064 5.2064 6.3836 6.3836 6.4954 6.4954 6.6610 6.6610 7.5803 7.5803 7.8146 7.8146 7.8278 7.8278 7.8517 7.8517 8.2875 8.2875 9.0684 9.0684 12.4631 12.4631 14.1726 14.1726 14.7093 14.7093 17.7433 17.7433 k = 0.1556 0.1556-0.0000 ( 3055 PWs) bands (ev): -9.9695 -9.9695 -9.7875 -9.7875 -8.8547 -8.8547 -8.2212 -8.2212 -8.1862 -8.1862 -8.1516 -8.1516 -7.7598 -7.7598 -7.1857 -7.1857 -5.8798 -5.8798 -5.7778 -5.7778 -5.5413 -5.5413 -5.5160 -5.5160 -5.4633 -5.4633 -4.1198 -4.1198 0.6439 0.6439 4.1098 4.1098 5.0047 5.0047 5.1882 5.1882 6.3941 6.3941 6.4967 6.4967 6.6921 6.6921 7.5882 7.5882 7.8186 7.8186 7.8274 7.8274 7.8530 7.8530 8.3082 8.3082 8.9518 8.9518 12.5104 12.5104 14.1339 14.1339 14.6868 14.6868 17.7293 17.7293 k = 0.1444 0.1444-0.0000 ( 3049 PWs) bands (ev): -9.9705 -9.9705 -9.8110 -9.8110 -8.8099 -8.8099 -8.2208 -8.2208 -8.1838 -8.1838 -8.1524 -8.1524 -7.7782 -7.7782 -7.1827 -7.1827 -5.8822 -5.8822 -5.7867 -5.7867 -5.5412 -5.5412 -5.5162 -5.5162 -5.4762 -5.4762 -4.0928 -4.0928 0.6002 0.6002 4.1883 4.1883 4.9987 4.9987 5.1719 5.1719 6.3959 6.3959 6.5058 6.5058 6.7201 6.7201 7.5944 7.5944 7.8222 7.8222 7.8272 7.8272 7.8546 7.8546 8.3285 8.3285 8.8378 8.8378 12.5563 12.5563 14.0966 14.0966 14.6650 14.6650 17.7150 17.7150 k = 0.1333 0.1333-0.0000 ( 3053 PWs) bands (ev): -9.9714 -9.9714 -9.8335 -9.8335 -8.7637 -8.7637 -8.2204 -8.2204 -8.1815 -8.1815 -8.1533 -8.1533 -7.7979 -7.7979 -7.1800 -7.1800 -5.8851 -5.8851 -5.7960 -5.7960 -5.5411 -5.5411 -5.5166 -5.5166 -5.4875 -5.4875 -4.0679 -4.0679 0.5603 0.5603 4.2671 4.2671 4.9926 4.9926 5.1580 5.1580 6.3913 6.3913 6.5205 6.5205 6.7441 6.7441 7.5991 7.5991 7.8240 7.8240 7.8284 7.8284 7.8562 7.8562 8.3481 8.3481 8.7271 8.7271 12.6005 12.6005 14.0609 14.0609 14.6441 14.6441 17.7003 17.7003 k = 0.1222 0.1222-0.0000 ( 3045 PWs) bands (ev): -9.9724 -9.9724 -9.8549 -9.8549 -8.7166 -8.7166 -8.2201 -8.2201 -8.1792 -8.1792 -8.1542 -8.1542 -7.8190 -7.8190 -7.1777 -7.1777 -5.8886 -5.8886 -5.8053 -5.8053 -5.5412 -5.5412 -5.5173 -5.5173 -5.4969 -5.4969 -4.0452 -4.0452 0.5241 0.5241 4.3456 4.3456 4.9862 4.9862 5.1467 5.1467 6.3834 6.3834 6.5377 6.5377 6.7637 6.7637 7.6031 7.6031 7.8238 7.8238 7.8315 7.8315 7.8580 7.8580 8.3668 8.3668 8.6205 8.6205 12.6427 12.6427 14.0269 14.0269 14.6243 14.6243 17.6855 17.6855 k = 0.1111 0.1111-0.0000 ( 3045 PWs) bands (ev): -9.9732 -9.9732 -9.8749 -9.8749 -8.6688 -8.6688 -8.2197 -8.2197 -8.1772 -8.1772 -8.1550 -8.1550 -7.8417 -7.8417 -7.1758 -7.1758 -5.8930 -5.8930 -5.8142 -5.8142 -5.5415 -5.5415 -5.5187 -5.5187 -5.5041 -5.5041 -4.0246 -4.0246 0.4915 0.4915 4.4227 4.4227 4.9797 4.9797 5.1384 5.1384 6.3741 6.3741 6.5554 6.5554 6.7780 6.7780 7.6072 7.6072 7.8230 7.8230 7.8347 7.8347 7.8597 7.8597 8.3844 8.3844 8.5189 8.5189 12.6827 12.6827 13.9950 13.9950 14.6057 14.6057 17.6707 17.6707 k = 0.1000 0.1000-0.0000 ( 3045 PWs) bands (ev): -9.9740 -9.9740 -9.8933 -9.8933 -8.6207 -8.6207 -8.2194 -8.2194 -8.1754 -8.1754 -8.1557 -8.1557 -7.8658 -7.8658 -7.1741 -7.1741 -5.8982 -5.8982 -5.8222 -5.8222 -5.5422 -5.5422 -5.5211 -5.5211 -5.5085 -5.5085 -4.0062 -4.0062 0.4624 0.4624 4.4973 4.4973 4.9731 4.9731 5.1334 5.1334 6.3645 6.3645 6.5727 6.5727 6.7865 6.7865 7.6120 7.6120 7.8222 7.8222 7.8376 7.8376 7.8614 7.8614 8.3997 8.3997 8.4242 8.4242 12.7201 12.7201 13.9651 13.9651 14.5885 14.5885 17.6564 17.6564 k = 0.0889 0.0889-0.0000 ( 3045 PWs) bands (ev): -9.9748 -9.9748 -9.9100 -9.9100 -8.5727 -8.5727 -8.2192 -8.2192 -8.1740 -8.1740 -8.1560 -8.1560 -7.8914 -7.8914 -7.1727 -7.1727 -5.9044 -5.9044 -5.8291 -5.8291 -5.5434 -5.5434 -5.5242 -5.5242 -5.5107 -5.5107 -3.9899 -3.9899 0.4368 0.4368 4.5680 4.5680 4.9667 4.9667 5.1321 5.1321 6.3552 6.3552 6.5889 6.5889 6.7888 6.7888 7.6184 7.6184 7.8214 7.8214 7.8399 7.8399 7.8631 7.8631 8.3324 8.3324 8.4172 8.4172 12.7547 12.7547 13.9376 13.9376 14.5729 14.5729 17.6426 17.6426 k = 0.0778 0.0778-0.0000 ( 3053 PWs) bands (ev): -9.9755 -9.9755 -9.9250 -9.9250 -8.5251 -8.5251 -8.2189 -8.2189 -8.1733 -8.1733 -8.1559 -8.1559 -7.9185 -7.9185 -7.1716 -7.1716 -5.9111 -5.9111 -5.8348 -5.8348 -5.5452 -5.5452 -5.5269 -5.5269 -5.5116 -5.5116 -3.9756 -3.9756 0.4144 0.4144 4.6330 4.6330 4.9606 4.9606 5.1349 5.1349 6.3464 6.3464 6.6037 6.6037 6.7850 6.7850 7.6270 7.6270 7.8205 7.8205 7.8417 7.8417 7.8648 7.8648 8.2500 8.2500 8.4309 8.4309 12.7861 12.7861 13.9127 13.9127 14.5589 14.5589 17.6296 17.6296 k = 0.0667 0.0667-0.0000 ( 3049 PWs) bands (ev): -9.9761 -9.9761 -9.9380 -9.9380 -8.4783 -8.4783 -8.2187 -8.2187 -8.1735 -8.1735 -8.1549 -8.1549 -7.9470 -7.9470 -7.1707 -7.1707 -5.9182 -5.9182 -5.8392 -5.8392 -5.5473 -5.5473 -5.5289 -5.5289 -5.5119 -5.5119 -3.9633 -3.9633 0.3952 0.3952 4.6905 4.6905 4.9551 4.9551 5.1422 5.1422 6.3384 6.3384 6.6171 6.6171 6.7756 6.7756 7.6385 7.6385 7.8197 7.8197 7.8428 7.8428 7.8665 7.8665 8.1748 8.1748 8.4431 8.4431 12.8142 12.8142 13.8905 13.8905 14.5467 14.5467 17.6178 17.6178 k = 0.0556 0.0556-0.0000 ( 3057 PWs) bands (ev): -9.9768 -9.9768 -9.9491 -9.9491 -8.4327 -8.4327 -8.2184 -8.2184 -8.1750 -8.1750 -8.1530 -8.1530 -7.9765 -7.9765 -7.1699 -7.1699 -5.9250 -5.9250 -5.8426 -5.8426 -5.5495 -5.5495 -5.5301 -5.5301 -5.5121 -5.5121 -3.9530 -3.9530 0.3791 0.3791 4.7387 4.7387 4.9505 4.9505 5.1537 5.1537 6.3313 6.3313 6.6290 6.6290 6.7616 6.7616 7.6532 7.6532 7.8188 7.8188 7.8432 7.8432 7.8680 7.8680 8.1074 8.1074 8.4538 8.4538 12.8384 12.8384 13.8713 13.8713 14.5363 14.5363 17.6074 17.6074 k = 0.0444 0.0444-0.0000 ( 3053 PWs) bands (ev): -9.9774 -9.9774 -9.9581 -9.9581 -8.3889 -8.3889 -8.2181 -8.2181 -8.1779 -8.1779 -8.1499 -8.1499 -8.0068 -8.0068 -7.1693 -7.1693 -5.9313 -5.9313 -5.8451 -5.8451 -5.5516 -5.5516 -5.5308 -5.5308 -5.5121 -5.5121 -3.9446 -3.9446 0.3661 0.3661 4.7767 4.7767 4.9468 4.9468 5.1686 5.1686 6.3253 6.3253 6.6394 6.6394 6.7448 6.7448 7.6709 7.6709 7.8178 7.8178 7.8425 7.8425 7.8694 7.8694 8.0483 8.0483 8.4626 8.4626 12.8588 12.8588 13.8552 13.8552 14.5277 14.5277 17.5985 17.5985 k = 0.0333 0.0333-0.0000 ( 3049 PWs) bands (ev): -9.9781 -9.9781 -9.9650 -9.9650 -8.3480 -8.3480 -8.2176 -8.2176 -8.1825 -8.1825 -8.1455 -8.1455 -8.0369 -8.0369 -7.1689 -7.1689 -5.9365 -5.9365 -5.8469 -5.8469 -5.5533 -5.5533 -5.5312 -5.5312 -5.5121 -5.5121 -3.9382 -3.9382 0.3561 0.3561 4.8044 4.8044 4.9442 4.9442 5.1848 5.1848 6.3205 6.3205 6.6484 6.6484 6.7272 6.7272 7.6912 7.6912 7.8164 7.8164 7.8406 7.8406 7.8705 7.8705 7.9986 7.9986 8.4696 8.4696 12.8749 12.8749 13.8424 13.8424 14.5210 14.5210 17.5915 17.5915 k = 0.0222 0.0222-0.0000 ( 3051 PWs) bands (ev): -9.9790 -9.9790 -9.9695 -9.9695 -8.3117 -8.3117 -8.2166 -8.2166 -8.1892 -8.1892 -8.1392 -8.1392 -8.0657 -8.0657 -7.1686 -7.1686 -5.9405 -5.9405 -5.8481 -5.8481 -5.5545 -5.5545 -5.5315 -5.5315 -5.5120 -5.5120 -3.9336 -3.9336 0.3489 0.3489 4.8226 4.8226 4.9425 4.9425 5.1995 5.1995 6.3169 6.3169 6.6562 6.6562 6.7111 6.7111 7.7128 7.7128 7.8137 7.8137 7.8371 7.8371 7.8713 7.8713 7.9602 7.9602 8.4747 8.4747 12.8865 12.8865 13.8332 13.8332 14.5162 14.5162 17.5863 17.5863 k = 0.0111 0.0111-0.0000 ( 3057 PWs) bands (ev): -9.9799 -9.9799 -9.9719 -9.9719 -8.2840 -8.2840 -8.2142 -8.2142 -8.1984 -8.1984 -8.1303 -8.1303 -8.0906 -8.0906 -7.1685 -7.1685 -5.9430 -5.9430 -5.8488 -5.8488 -5.5553 -5.5553 -5.5316 -5.5316 -5.5120 -5.5120 -3.9308 -3.9308 0.3447 0.3447 4.8327 4.8327 4.9417 4.9417 5.2098 5.2098 6.3147 6.3147 6.6628 6.6628 6.6985 6.6985 7.7321 7.7321 7.8090 7.8090 7.8331 7.8331 7.8718 7.8718 7.9358 7.9358 8.4777 8.4777 12.8936 12.8936 13.8276 13.8276 14.5133 14.5133 17.5832 17.5832 k = 0.0000 0.0000 0.0000 ( 3065 PWs) bands (ev): -9.9803 -9.9803 -9.9726 -9.9726 -8.2727 -8.2727 -8.2083 -8.2083 -8.2080 -8.2080 -8.1224 -8.1224 -8.1045 -8.1045 -7.1684 -7.1684 -5.9438 -5.9438 -5.8490 -5.8490 -5.5555 -5.5555 -5.5316 -5.5316 -5.5120 -5.5120 -3.9299 -3.9299 0.3432 0.3432 4.8360 4.8360 4.9414 4.9414 5.2135 5.2135 6.3140 6.3140 6.6659 6.6659 6.6932 6.6932 7.7410 7.7410 7.8055 7.8055 7.8314 7.8314 7.8720 7.8720 7.9276 7.9276 8.4787 8.4787 12.8960 12.8960 13.8257 13.8257 14.5124 14.5124 17.5821 17.5821 k = 0.0000 0.0000 0.0000 ( 3065 PWs) bands (ev): -9.9803 -9.9803 -9.9726 -9.9726 -8.2727 -8.2727 -8.2083 -8.2083 -8.2080 -8.2080 -8.1224 -8.1224 -8.1045 -8.1045 -7.1684 -7.1684 -5.9438 -5.9438 -5.8490 -5.8490 -5.5555 -5.5555 -5.5316 -5.5316 -5.5120 -5.5120 -3.9299 -3.9299 0.3432 0.3432 4.8360 4.8360 4.9414 4.9414 5.2135 5.2135 6.3140 6.3140 6.6659 6.6659 6.6932 6.6932 7.7410 7.7410 7.8055 7.8055 7.8314 7.8314 7.8720 7.8720 7.9276 7.9276 8.4787 8.4787 12.8960 12.8960 13.8257 13.8257 14.5124 14.5124 17.5821 17.5821 k = 0.0000 0.0000 0.0156 ( 3065 PWs) bands (ev): -9.9797 -9.9797 -9.9717 -9.9717 -8.2774 -8.2774 -8.2490 -8.2490 -8.1681 -8.1681 -8.1445 -8.1445 -8.0783 -8.0783 -7.1684 -7.1684 -5.9431 -5.9431 -5.8476 -5.8476 -5.5552 -5.5552 -5.5316 -5.5316 -5.5116 -5.5116 -3.9307 -3.9307 0.3426 0.3426 4.8367 4.8367 4.9414 4.9414 5.2143 5.2143 6.3143 6.3143 6.5641 6.5641 6.7860 6.7860 7.7385 7.7385 7.8081 7.8081 7.8226 7.8226 7.8769 7.8769 7.9319 7.9319 8.4780 8.4780 12.8970 12.8970 13.8302 13.8302 14.5169 14.5169 17.5738 17.5738 k = 0.0000 0.0000 0.0311 ( 3050 PWs) bands (ev): -9.9779 -9.9779 -9.9690 -9.9690 -8.2923 -8.2923 -8.2904 -8.2904 -8.1670 -8.1670 -8.1288 -8.1288 -8.0429 -8.0429 -7.1682 -7.1682 -5.9409 -5.9409 -5.8434 -5.8434 -5.5541 -5.5541 -5.5314 -5.5314 -5.5104 -5.5104 -3.9330 -3.9330 0.3405 0.3405 4.8388 4.8388 4.9414 4.9414 5.2168 5.2168 6.3150 6.3150 6.4435 6.4435 6.8795 6.8795 7.7291 7.7291 7.8020 7.8020 7.8176 7.8176 7.8856 7.8856 7.9453 7.9453 8.4758 8.4758 12.9000 12.9000 13.8436 13.8436 14.5303 14.5303 17.5499 17.5499 k = 0.0000 0.0000 0.0467 ( 3050 PWs) bands (ev): -9.9749 -9.9749 -9.9646 -9.9646 -8.3324 -8.3324 -8.3169 -8.3169 -8.1820 -8.1820 -8.0904 -8.0904 -8.0062 -8.0062 -7.1679 -7.1679 -5.9374 -5.9374 -5.8364 -5.8364 -5.5524 -5.5524 -5.5311 -5.5311 -5.5082 -5.5082 -3.9369 -3.9369 0.3372 0.3372 4.8422 4.8422 4.9413 4.9413 5.2208 5.2208 6.3028 6.3028 6.3313 6.3313 6.9590 6.9590 7.7109 7.7109 7.7743 7.7743 7.8341 7.8341 7.8937 7.8937 7.9703 7.9703 8.4720 8.4720 12.9051 12.9051 13.8658 13.8658 14.5526 14.5526 17.5131 17.5131 k = 0.0000 0.0000 0.0623 ( 3050 PWs) bands (ev): -9.9707 -9.9707 -9.9584 -9.9584 -8.3748 -8.3748 -8.3492 -8.3492 -8.1909 -8.1909 -8.0530 -8.0530 -7.9694 -7.9694 -7.1676 -7.1676 -5.9325 -5.9325 -5.8267 -5.8267 -5.5503 -5.5503 -5.5307 -5.5307 -5.5049 -5.5049 -3.9423 -3.9423 0.3326 0.3326 4.8468 4.8468 4.9411 4.9411 5.2266 5.2266 6.1834 6.1834 6.3237 6.3237 7.0222 7.0222 7.6849 7.6849 7.7407 7.7407 7.8530 7.8530 7.9001 7.9001 8.0115 8.0115 8.4668 8.4668 12.9120 12.9120 13.8966 13.8966 14.5835 14.5835 17.4668 17.4668 k = 0.0000 0.0000 0.0778 ( 3050 PWs) bands (ev): -9.9654 -9.9654 -9.9505 -9.9505 -8.4175 -8.4175 -8.3861 -8.3861 -8.1960 -8.1960 -8.0166 -8.0166 -7.9329 -7.9329 -7.1671 -7.1671 -5.9265 -5.9265 -5.8143 -5.8143 -5.5478 -5.5478 -5.5301 -5.5301 -5.5001 -5.5001 -3.9493 -3.9493 0.3268 0.3268 4.8526 4.8526 4.9409 4.9409 5.2340 5.2340 6.0513 6.0513 6.3272 6.3272 7.0687 7.0687 7.6525 7.6525 7.7016 7.7016 7.8691 7.8691 7.9048 7.9048 8.0723 8.0723 8.4601 8.4601 12.9207 12.9207 13.9356 13.9356 14.6228 14.6228 17.4138 17.4138 k = 0.0000 0.0000 0.0934 ( 3050 PWs) bands (ev): -9.9589 -9.9589 -9.9409 -9.9409 -8.4605 -8.4605 -8.4257 -8.4257 -8.1990 -8.1990 -7.9813 -7.9813 -7.8969 -7.8969 -7.1667 -7.1667 -5.9195 -5.9195 -5.7993 -5.7993 -5.5453 -5.5453 -5.5293 -5.5293 -5.4936 -5.4936 -3.9579 -3.9579 0.3199 0.3199 4.8592 4.8592 4.9406 4.9406 5.2431 5.2431 5.9172 5.9172 6.3320 6.3320 7.0993 7.0993 7.6147 7.6147 7.6569 7.6569 7.8811 7.8811 7.9081 7.9081 8.1518 8.1518 8.4519 8.4519 12.9310 12.9310 13.9825 13.9825 14.6700 14.6700 17.3563 17.3563 k = 0.0000 0.0000 0.1090 ( 3050 PWs) bands (ev): -9.9513 -9.9513 -9.9296 -9.9296 -8.5036 -8.5036 -8.4669 -8.4669 -8.2007 -8.2007 -7.9472 -7.9472 -7.8617 -7.8617 -7.1662 -7.1662 -5.9117 -5.9117 -5.7817 -5.7817 -5.5428 -5.5428 -5.5283 -5.5283 -5.4851 -5.4851 -3.9680 -3.9680 0.3120 0.3120 4.8664 4.8664 4.9402 4.9402 5.2539 5.2539 5.7824 5.7824 6.3380 6.3380 7.1157 7.1157 7.5725 7.5725 7.6070 7.6070 7.8895 7.8895 7.9102 7.9102 8.2465 8.2465 8.4423 8.4423 12.9428 12.9428 14.0369 14.0369 14.7248 14.7248 17.2961 17.2961 k = 0.0000 0.0000 0.1245 ( 3054 PWs) bands (ev): -9.9425 -9.9425 -9.9167 -9.9167 -8.5468 -8.5468 -8.5090 -8.5090 -8.2016 -8.2016 -7.9142 -7.9142 -7.8275 -7.8275 -7.1658 -7.1658 -5.9032 -5.9032 -5.7618 -5.7618 -5.5405 -5.5405 -5.5271 -5.5271 -5.4744 -5.4744 -3.9798 -3.9798 0.3031 0.3031 4.8735 4.8735 4.9397 4.9397 5.2664 5.2664 5.6480 5.6480 6.3448 6.3448 7.1203 7.1203 7.5264 7.5264 7.5521 7.5521 7.8954 7.8954 7.9112 7.9112 8.3523 8.3523 8.4313 8.4313 12.9558 12.9558 14.0983 14.0983 14.7867 14.7867 17.2346 17.2346 k = 0.0000 0.0000 0.1401 ( 3038 PWs) bands (ev): -9.9327 -9.9327 -9.9022 -9.9022 -8.5899 -8.5899 -8.5516 -8.5516 -8.2020 -8.2020 -7.8824 -7.8824 -7.7942 -7.7942 -7.1654 -7.1654 -5.8942 -5.8942 -5.7396 -5.7396 -5.5384 -5.5384 -5.5254 -5.5254 -5.4613 -5.4613 -3.9931 -3.9931 0.2935 0.2935 4.8794 4.8794 4.9392 4.9392 5.2806 5.2806 5.5153 5.5153 6.3527 6.3527 7.1147 7.1147 7.4771 7.4771 7.4926 7.4926 7.8994 7.8994 7.9113 7.9113 8.4188 8.4188 8.4663 8.4663 12.9699 12.9699 14.1662 14.1662 14.8552 14.8552 17.1729 17.1729 k = 0.0000 0.0000 0.1557 ( 3050 PWs) bands (ev): -9.9218 -9.9218 -9.8862 -9.8862 -8.6328 -8.6328 -8.5944 -8.5944 -8.2020 -8.2020 -7.8519 -7.8519 -7.7620 -7.7620 -7.1651 -7.1651 -5.8850 -5.8850 -5.7154 -5.7154 -5.5365 -5.5365 -5.5233 -5.5233 -5.4457 -5.4457 -4.0081 -4.0081 0.2833 0.2833 4.8820 4.8820 4.9386 4.9386 5.2964 5.2964 5.3868 5.3868 6.3614 6.3614 7.1006 7.1006 7.4254 7.4254 7.4288 7.4288 7.9020 7.9020 7.9105 7.9105 8.4049 8.4049 8.5859 8.5859 12.9848 12.9848 14.2401 14.2401 14.9298 14.9298 17.1117 17.1117 k = 0.0000 0.0000 0.1713 ( 3050 PWs) bands (ev): -9.9099 -9.9099 -9.8687 -9.8687 -8.6755 -8.6755 -8.6372 -8.6372 -8.2017 -8.2017 -7.8226 -7.8226 -7.7308 -7.7308 -7.1650 -7.1650 -5.8758 -5.8758 -5.6896 -5.6896 -5.5348 -5.5348 -5.5204 -5.5204 -5.4275 -5.4275 -4.0247 -4.0247 0.2725 0.2725 4.8763 4.8763 4.9381 4.9381 5.2676 5.2676 5.3139 5.3139 6.3711 6.3711 7.0788 7.0788 7.3611 7.3611 7.3721 7.3721 7.9036 7.9036 7.9091 7.9091 8.3897 8.3897 8.7094 8.7094 13.0002 13.0002 14.3194 14.3194 15.0098 15.0098 17.0520 17.0520 k = 0.0000 0.0000 0.1868 ( 3050 PWs) bands (ev): -9.8970 -9.8970 -9.8497 -9.8497 -8.7179 -8.7179 -8.6798 -8.6798 -8.2010 -8.2010 -7.7946 -7.7946 -7.7009 -7.7009 -7.1651 -7.1651 -5.8666 -5.8666 -5.6627 -5.6627 -5.5332 -5.5332 -5.5163 -5.5163 -5.4068 -5.4068 -4.0429 -4.0429 0.2614 0.2614 4.8517 4.8517 4.9376 4.9376 5.1684 5.1684 5.3329 5.3329 6.3817 6.3817 7.0500 7.0500 7.2901 7.2901 7.3179 7.3179 7.9041 7.9041 7.9070 7.9070 8.3732 8.3732 8.8355 8.8355 13.0159 13.0159 14.4037 14.4037 15.0947 15.0947 16.9945 16.9945 k = 0.0000 0.0000 0.2024 ( 3050 PWs) bands (ev): -9.8832 -9.8832 -9.8295 -9.8295 -8.7598 -8.7598 -8.7221 -8.7221 -8.2001 -8.2001 -7.7677 -7.7677 -7.6720 -7.6720 -7.1653 -7.1653 -5.8576 -5.8576 -5.6355 -5.6355 -5.5317 -5.5317 -5.5102 -5.5102 -5.3837 -5.3837 -4.0627 -4.0627 0.2502 0.2502 4.7926 4.7926 4.9372 4.9372 5.1047 5.1047 5.3534 5.3534 6.3931 6.3931 7.0146 7.0146 7.2161 7.2161 7.2639 7.2639 7.9038 7.9038 7.9042 7.9042 8.3553 8.3553 8.9631 8.9631 13.0315 13.0315 14.4923 14.4923 15.1837 15.1837 16.9397 16.9397 k = 0.0000 0.0000 0.2180 ( 3050 PWs) bands (ev): -9.8684 -9.8684 -9.8080 -9.8080 -8.8013 -8.8013 -8.7640 -8.7640 -8.1989 -8.1989 -7.7421 -7.7421 -7.6443 -7.6443 -7.1658 -7.1658 -5.8489 -5.8489 -5.6097 -5.6097 -5.5303 -5.5303 -5.5008 -5.5008 -5.3581 -5.3581 -4.0842 -4.0842 0.2391 0.2391 4.6974 4.6974 4.9369 4.9369 5.0782 5.0782 5.3752 5.3752 6.4055 6.4055 6.9731 6.9731 7.1397 7.1397 7.2106 7.2106 7.9009 7.9009 7.9028 7.9028 8.3361 8.3361 9.0916 9.0916 13.0469 13.0469 14.5849 14.5849 15.2763 15.2763 16.8885 16.8885 k = 0.0000 0.0000 0.2335 ( 3054 PWs) bands (ev): -9.8528 -9.8528 -9.7853 -9.7853 -8.8422 -8.8422 -8.8054 -8.8054 -8.1974 -8.1974 -7.7177 -7.7177 -7.6178 -7.6178 -7.1666 -7.1666 -5.8406 -5.8406 -5.5873 -5.5873 -5.5289 -5.5289 -5.4861 -5.4861 -5.3302 -5.3302 -4.1073 -4.1073 0.2282 0.2282 4.5810 4.5810 4.9369 4.9369 5.0741 5.0741 5.3983 5.3983 6.4188 6.4188 6.9258 6.9258 7.0615 7.0615 7.1584 7.1584 7.8969 7.8969 7.9011 7.9011 8.3157 8.3157 9.2203 9.2203 13.0616 13.0616 14.6809 14.6809 15.3715 15.3715 16.8414 16.8414 k = 0.0000 0.0000 0.2491 ( 3062 PWs) bands (ev): -9.8364 -9.8364 -9.7615 -9.7615 -8.8825 -8.8825 -8.8462 -8.8462 -8.1955 -8.1955 -7.6945 -7.6945 -7.5923 -7.5923 -7.1677 -7.1677 -5.8326 -5.8326 -5.5704 -5.5704 -5.5275 -5.5275 -5.4642 -5.4642 -5.3002 -5.3002 -4.1320 -4.1320 0.2177 0.2177 4.4550 4.4550 4.9372 4.9372 5.0805 5.0805 5.4224 5.4224 6.4329 6.4329 6.8738 6.8738 6.9818 6.9818 7.1075 7.1075 7.8923 7.8923 7.8986 7.8986 8.2941 8.2941 9.3488 9.3488 13.0755 13.0755 14.7798 14.7798 15.4685 15.4685 16.7992 16.7992 k = 0.0000 0.0000 0.2647 ( 3062 PWs) bands (ev): -9.8192 -9.8192 -9.7369 -9.7369 -8.9220 -8.9220 -8.8864 -8.8864 -8.1933 -8.1933 -7.6724 -7.6724 -7.5680 -7.5680 -7.1691 -7.1691 -5.8249 -5.8249 -5.5588 -5.5588 -5.5261 -5.5261 -5.4355 -5.4355 -5.2682 -5.2682 -4.1584 -4.1584 0.2079 0.2079 4.3247 4.3247 4.9378 4.9378 5.0920 5.0920 5.4474 5.4474 6.4478 6.4478 6.8180 6.8180 6.9012 6.9012 7.0577 7.0577 7.8872 7.8872 7.8955 7.8955 8.2713 8.2713 9.4767 9.4767 13.0883 13.0883 14.8811 14.8811 15.5662 15.5662 16.7629 16.7629 k = 0.0000 0.0000 0.2802 ( 3074 PWs) bands (ev): -9.8013 -9.8013 -9.7113 -9.7113 -8.9608 -8.9608 -8.9257 -8.9257 -8.1906 -8.1906 -7.6515 -7.6515 -7.5448 -7.5448 -7.1708 -7.1708 -5.8176 -5.8176 -5.5511 -5.5511 -5.5247 -5.5247 -5.4016 -5.4016 -5.2343 -5.2343 -4.1863 -4.1863 0.1989 0.1989 4.1926 4.1926 4.9389 4.9389 5.1060 5.1060 5.4731 5.4731 6.4635 6.4635 6.7598 6.7598 6.8203 6.8203 7.0085 7.0085 7.8814 7.8814 7.8918 7.8918 8.2473 8.2473 9.6037 9.6037 13.0996 13.0996 14.9845 14.9845 15.6635 15.6635 16.7334 16.7334 k = 0.0000 0.0000 0.2958 ( 3074 PWs) bands (ev): -9.7827 -9.7827 -9.6851 -9.6851 -8.9987 -8.9987 -8.9643 -8.9643 -8.1874 -8.1874 -7.6318 -7.6318 -7.5226 -7.5226 -7.1728 -7.1728 -5.8105 -5.8105 -5.5457 -5.5457 -5.5232 -5.5232 -5.3642 -5.3642 -5.1989 -5.1989 -4.2157 -4.2157 0.1909 0.1909 4.0599 4.0599 4.9405 4.9405 5.1210 5.1210 5.4991 5.4991 6.4800 6.4800 6.7003 6.7003 6.7396 6.7396 6.9597 6.9597 7.8751 7.8751 7.8874 7.8874 8.2223 8.2223 9.7295 9.7295 13.1093 13.1093 15.0893 15.0893 15.7587 15.7587 16.7122 16.7122 k = 0.0000 0.0000 0.3114 ( 3074 PWs) bands (ev): -9.7635 -9.7635 -9.6584 -9.6584 -9.0358 -9.0358 -9.0019 -9.0019 -8.1837 -8.1837 -7.6131 -7.6131 -7.5015 -7.5015 -7.1752 -7.1752 -5.8036 -5.8036 -5.5416 -5.5416 -5.5218 -5.5218 -5.3247 -5.3247 -5.1622 -5.1622 -4.2466 -4.2466 0.1842 0.1842 3.9273 3.9273 4.9426 4.9426 5.1362 5.1362 5.5251 5.5251 6.4970 6.4970 6.6410 6.6410 6.6598 6.6598 6.9108 6.9108 7.8681 7.8681 7.8824 7.8824 8.1962 8.1962 9.8540 9.8540 13.1171 13.1171 15.1954 15.1954 15.8500 15.8500 16.7009 16.7009 k = 0.0000 0.0000 0.3269 ( 3074 PWs) bands (ev): -9.7438 -9.7438 -9.6312 -9.6312 -9.0719 -9.0719 -9.0385 -9.0385 -8.1794 -8.1794 -7.5957 -7.5957 -7.4814 -7.4814 -7.1779 -7.1779 -5.7967 -5.7967 -5.5382 -5.5382 -5.5204 -5.5204 -5.2836 -5.2836 -5.1243 -5.1243 -4.2789 -4.2789 0.1790 0.1790 3.7951 3.7951 4.9453 4.9453 5.1506 5.1506 5.5507 5.5507 6.5140 6.5140 6.5815 6.5815 6.5833 6.5833 6.8618 6.8618 7.8605 7.8605 7.8766 7.8766 8.1691 8.1691 9.9768 9.9768 13.1228 13.1228 15.3021 15.3021 15.9349 15.9349 16.7017 16.7017 k = 0.0000 0.0000 0.3425 ( 3082 PWs) bands (ev): -9.7236 -9.7236 -9.6039 -9.6039 -9.1070 -9.1070 -9.0740 -9.0740 -8.1744 -8.1744 -7.5793 -7.5793 -7.4622 -7.4622 -7.1810 -7.1810 -5.7899 -5.7899 -5.5354 -5.5354 -5.5189 -5.5189 -5.2417 -5.2417 -5.0856 -5.0856 -4.3125 -4.3125 0.1754 0.1754 3.6638 3.6638 4.9486 4.9486 5.1638 5.1638 5.5752 5.5752 6.5056 6.5056 6.5173 6.5173 6.5419 6.5419 6.8126 6.8126 7.8523 7.8523 7.8703 7.8703 8.1410 8.1410 10.0978 10.0978 13.1262 13.1262 15.4092 15.4092 16.0109 16.0109 16.7168 16.7168 k = 0.0000 0.0000 0.3581 ( 3074 PWs) bands (ev): -9.7030 -9.7030 -9.5765 -9.5765 -9.1410 -9.1410 -9.1084 -9.1084 -8.1687 -8.1687 -7.5641 -7.5641 -7.4440 -7.4440 -7.1843 -7.1843 -5.7830 -5.7830 -5.5328 -5.5328 -5.5174 -5.5174 -5.1992 -5.1992 -5.0462 -5.0462 -4.3472 -4.3472 0.1736 0.1736 3.5334 3.5334 4.9526 4.9526 5.1749 5.1749 5.5980 5.5980 6.4332 6.4332 6.4698 6.4698 6.5544 6.5544 6.7637 6.7637 7.8435 7.8435 7.8632 7.8632 8.1121 8.1121 10.2170 10.2170 13.1272 13.1272 15.5162 15.5162 16.0758 16.0758 16.7481 16.7481 k = 0.0000 0.0000 0.3736 ( 3074 PWs) bands (ev): -9.6820 -9.6820 -9.5494 -9.5494 -9.1739 -9.1739 -9.1416 -9.1416 -8.1621 -8.1621 -7.5502 -7.5502 -7.4267 -7.4267 -7.1879 -7.1879 -5.7760 -5.7760 -5.5304 -5.5304 -5.5159 -5.5159 -5.1567 -5.1567 -5.0064 -5.0064 -4.3830 -4.3830 0.1738 0.1738 3.4043 3.4043 4.9573 4.9573 5.1835 5.1835 5.6178 5.6178 6.3654 6.3654 6.4208 6.4208 6.5710 6.5710 6.7162 6.7162 7.8341 7.8341 7.8555 7.8555 8.0822 8.0822 10.3340 10.3340 13.1256 13.1256 15.6228 15.6228 16.1288 16.1288 16.7963 16.7963 k = 0.0000 0.0000 0.3892 ( 3086 PWs) bands (ev): -9.6608 -9.6608 -9.5227 -9.5227 -9.2057 -9.2057 -9.1734 -9.1734 -8.1546 -8.1546 -7.5375 -7.5375 -7.4102 -7.4102 -7.1917 -7.1917 -5.7687 -5.7687 -5.5281 -5.5281 -5.5144 -5.5144 -5.1144 -5.1144 -4.9664 -4.9664 -4.4197 -4.4197 0.1762 0.1762 3.2764 3.2764 4.9626 4.9626 5.1889 5.1889 5.6334 5.6334 6.3039 6.3039 6.3762 6.3762 6.5822 6.5822 6.6748 6.6748 7.8241 7.8241 7.8472 7.8472 8.0515 8.0515 10.4488 10.4488 13.1213 13.1213 15.7286 15.7286 16.1708 16.1708 16.8599 16.8599 k = 0.0000 0.0000 0.4048 ( 3078 PWs) bands (ev): -9.6393 -9.6393 -9.4969 -9.4969 -9.2363 -9.2363 -9.2036 -9.2036 -8.1461 -8.1461 -7.5261 -7.5261 -7.3946 -7.3946 -7.1957 -7.1957 -5.7611 -5.7611 -5.5259 -5.5259 -5.5128 -5.5128 -5.0729 -5.0729 -4.9265 -4.9265 -4.4568 -4.4568 0.1810 0.1810 3.1500 3.1500 4.9686 4.9686 5.1907 5.1907 5.6429 5.6429 6.2507 6.2507 6.3369 6.3369 6.5714 6.5714 6.6558 6.6558 7.8135 7.8135 7.8381 7.8381 8.0201 8.0201 10.5614 10.5614 13.1142 13.1142 15.8332 15.8332 16.2043 16.2043 16.9362 16.9362 k = 0.0000 0.0000 0.4203 ( 3062 PWs) bands (ev): -9.6177 -9.6177 -9.4722 -9.4722 -9.2656 -9.2656 -9.2321 -9.2321 -8.1365 -8.1365 -7.5161 -7.5161 -7.3799 -7.3799 -7.1998 -7.1998 -5.7530 -5.7530 -5.5237 -5.5237 -5.5113 -5.5113 -5.0326 -5.0326 -4.8868 -4.8868 -4.4941 -4.4941 0.1883 0.1883 3.0251 3.0251 4.9752 4.9752 5.1883 5.1883 5.6445 5.6445 6.2078 6.2078 6.3037 6.3037 6.5332 6.5332 6.6648 6.6648 7.8024 7.8024 7.8285 7.8285 7.9879 7.9879 10.6715 10.6715 13.1044 13.1044 15.9363 15.9363 16.2322 16.2322 17.0218 17.0218 k = 0.0000 0.0000 0.4359 ( 3050 PWs) bands (ev): -9.5961 -9.5961 -9.4493 -9.4493 -9.2937 -9.2937 -9.2583 -9.2583 -8.1258 -8.1258 -7.5075 -7.5075 -7.3659 -7.3659 -7.2040 -7.2040 -5.7445 -5.7445 -5.5216 -5.5216 -5.5098 -5.5098 -4.9944 -4.9944 -4.8476 -4.8476 -4.5309 -4.5309 0.1982 0.1982 2.9018 2.9018 4.9823 4.9823 5.1817 5.1817 5.6365 5.6365 6.1772 6.1772 6.2768 6.2768 6.4850 6.4850 6.6842 6.6842 7.7907 7.7907 7.8182 7.8182 7.9551 7.9551 10.7792 10.7792 13.0916 13.0916 16.0376 16.0376 16.2571 16.2571 17.1137 17.1137 k = 0.0000 0.0000 0.4515 ( 3050 PWs) bands (ev): -9.5745 -9.5745 -9.4293 -9.4293 -9.3204 -9.3204 -9.2813 -9.2813 -8.1138 -8.1138 -7.5006 -7.5006 -7.3528 -7.3528 -7.2080 -7.2080 -5.7354 -5.7354 -5.5195 -5.5195 -5.5083 -5.5083 -4.9591 -4.9591 -4.8092 -4.8092 -4.5663 -4.5663 0.2108 0.2108 2.7804 2.7804 4.9899 4.9899 5.1708 5.1708 5.6187 5.6187 6.1593 6.1593 6.2564 6.2564 6.4339 6.4339 6.7072 6.7072 7.7786 7.7786 7.8073 7.8073 7.9216 7.9216 10.8844 10.8844 13.0758 13.0758 16.1365 16.1365 16.2810 16.2810 17.2092 17.2092 k = 0.0000 0.0000 0.4671 ( 3054 PWs) bands (ev): -9.5530 -9.5530 -9.4142 -9.4142 -9.3457 -9.3457 -9.2994 -9.2994 -8.1005 -8.1005 -7.4954 -7.4954 -7.3404 -7.3404 -7.2120 -7.2120 -5.7256 -5.7256 -5.5174 -5.5174 -5.5068 -5.5068 -4.9285 -4.9285 -4.7716 -4.7716 -4.5986 -4.5986 0.2264 0.2264 2.6607 2.6607 4.9975 4.9975 5.1557 5.1557 5.5922 5.5922 6.1534 6.1534 6.2422 6.2422 6.3820 6.3820 6.7320 6.7320 7.7661 7.7661 7.7958 7.7958 7.8876 7.8876 10.9870 10.9870 13.0572 13.0572 16.2329 16.2329 16.3055 16.3055 17.3064 17.3064 k = 0.0000 0.0000 0.4826 ( 3058 PWs) bands (ev): -9.5319 -9.5319 -9.4072 -9.4072 -9.3694 -9.3694 -9.3094 -9.3094 -8.0858 -8.0858 -7.4921 -7.4921 -7.3287 -7.3287 -7.2156 -7.2156 -5.7150 -5.7150 -5.5154 -5.5154 -5.5054 -5.5054 -4.9052 -4.9052 -4.7351 -4.7351 -4.6253 -4.6253 0.2449 0.2449 2.5431 2.5431 5.0051 5.0051 5.1371 5.1371 5.5594 5.5594 6.1573 6.1573 6.2335 6.2335 6.3303 6.3303 6.7581 6.7581 7.7532 7.7532 7.7838 7.7838 7.8530 7.8530 11.0869 11.0869 13.0357 13.0357 16.3262 16.3262 16.3315 16.3315 17.4037 17.4037 k = 0.0000 0.0000 0.4982 ( 3066 PWs) bands (ev): -9.5112 -9.5112 -9.4106 -9.4106 -9.3915 -9.3915 -9.3092 -9.3092 -8.0697 -8.0697 -7.4907 -7.4907 -7.3178 -7.3178 -7.2189 -7.2189 -5.7037 -5.7037 -5.5134 -5.5134 -5.5040 -5.5040 -4.8930 -4.8930 -4.7000 -4.7000 -4.6426 -4.6426 0.2666 0.2666 2.4274 2.4274 5.0121 5.0121 5.1154 5.1154 5.5232 5.5232 6.1687 6.1687 6.2275 6.2275 6.2813 6.2813 6.7851 6.7851 7.7401 7.7401 7.7714 7.7714 7.8180 7.8180 11.1843 11.1843 13.0113 13.0113 16.3595 16.3595 16.4161 16.4161 17.4997 17.4997 k = 0.0000 0.0000 0.5138 ( 3066 PWs) bands (ev): -9.4917 -9.4917 -9.4218 -9.4218 -9.4113 -9.4113 -9.3014 -9.3014 -8.0522 -8.0522 -7.4914 -7.4914 -7.3076 -7.3076 -7.2218 -7.2218 -5.6914 -5.6914 -5.5115 -5.5115 -5.5026 -5.5026 -4.8951 -4.8951 -4.6663 -4.6663 -4.6473 -4.6473 0.2914 0.2914 2.3139 2.3139 5.0180 5.0180 5.0915 5.0915 5.4867 5.4867 6.1852 6.1852 6.2079 6.2079 6.2508 6.2508 6.8130 6.8130 7.7268 7.7268 7.7586 7.7586 7.7826 7.7826 11.2790 11.2790 12.9842 12.9842 16.3899 16.3899 16.5022 16.5022 17.5932 17.5932 k = 0.0000 0.0000 0.5293 ( 3070 PWs) bands (ev): -9.4754 -9.4754 -9.4368 -9.4368 -9.4268 -9.4268 -9.2903 -9.2903 -8.0333 -8.0333 -7.4943 -7.4943 -7.2981 -7.2981 -7.2242 -7.2242 -5.6781 -5.6781 -5.5096 -5.5096 -5.5013 -5.5013 -4.9114 -4.9114 -4.6396 -4.6396 -4.6343 -4.6343 0.3195 0.3195 2.2026 2.2026 5.0220 5.0220 5.0661 5.0661 5.4523 5.4523 6.1628 6.1628 6.2051 6.2051 6.2501 6.2501 6.8418 6.8418 7.7135 7.7135 7.7454 7.7454 7.7469 7.7469 11.3711 11.3711 12.9543 12.9543 16.4229 16.4229 16.5839 16.5839 17.6829 17.6829 k = 0.0000 0.0000 0.5449 ( 3070 PWs) bands (ev): -9.4701 -9.4701 -9.4528 -9.4528 -9.4303 -9.4303 -9.2786 -9.2786 -8.0131 -8.0131 -7.4993 -7.4993 -7.2893 -7.2893 -7.2261 -7.2261 -5.6637 -5.6637 -5.5078 -5.5078 -5.5001 -5.5001 -4.9382 -4.9382 -4.6232 -4.6232 -4.6041 -4.6041 0.3509 0.3509 2.0935 2.0935 5.0232 5.0232 5.0401 5.0401 5.4223 5.4223 6.1124 6.1124 6.2269 6.2269 6.2585 6.2585 6.8712 6.8712 7.6998 7.6998 7.7112 7.7112 7.7321 7.7321 11.4607 11.4607 12.9218 12.9218 16.4585 16.4585 16.6608 16.6608 17.7675 17.7675 k = 0.0000 0.0000 0.5605 ( 3062 PWs) bands (ev): -9.4791 -9.4791 -9.4687 -9.4687 -9.4185 -9.4185 -9.2675 -9.2675 -7.9915 -7.9915 -7.5066 -7.5066 -7.2812 -7.2812 -7.2274 -7.2274 -5.6482 -5.6482 -5.5060 -5.5060 -5.4989 -5.4989 -4.9714 -4.9714 -4.6020 -4.6020 -4.5759 -4.5759 0.3856 0.3856 1.9869 1.9869 5.0141 5.0141 5.0205 5.0205 5.3989 5.3989 6.0615 6.0615 6.2495 6.2495 6.2705 6.2705 6.9014 6.9014 7.6736 7.6736 7.6882 7.6882 7.7187 7.7187 11.5476 11.5476 12.8867 12.8867 16.4966 16.4966 16.7322 16.7322 17.8456 17.8456 k = 0.0000 0.0000 0.5760 ( 3062 PWs) bands (ev): -9.4922 -9.4922 -9.4838 -9.4838 -9.4017 -9.4017 -9.2579 -9.2579 -7.9687 -7.9687 -7.5161 -7.5161 -7.2737 -7.2737 -7.2283 -7.2283 -5.6314 -5.6314 -5.5044 -5.5044 -5.4978 -5.4978 -5.0082 -5.0082 -4.5790 -4.5790 -4.5498 -4.5498 0.4238 0.4238 1.8827 1.8827 4.9889 4.9889 5.0135 5.0135 5.3832 5.3832 6.0109 6.0109 6.2722 6.2722 6.2846 6.2846 6.9323 6.9323 7.6373 7.6373 7.6754 7.6754 7.7054 7.7054 11.6321 11.6321 12.8490 12.8490 16.5370 16.5370 16.7975 16.7975 17.9153 17.9153 k = 0.0000 0.0000 0.5916 ( 3070 PWs) bands (ev): -9.5052 -9.5052 -9.4979 -9.4979 -9.3841 -9.3841 -9.2498 -9.2498 -7.9448 -7.9448 -7.5277 -7.5277 -7.2669 -7.2669 -7.2289 -7.2289 -5.6134 -5.6134 -5.5028 -5.5028 -5.4968 -5.4968 -5.0469 -5.0469 -4.5558 -4.5558 -4.5260 -4.5260 0.4653 0.4653 1.7811 1.7811 4.9650 4.9650 5.0020 5.0020 5.3761 5.3761 5.9610 5.9610 6.2943 6.2943 6.3000 6.3000 6.9638 6.9638 7.6007 7.6007 7.6634 7.6634 7.6922 7.6922 11.7140 11.7140 12.8089 12.8089 16.5795 16.5795 16.8560 16.8560 17.9749 17.9749 k = 0.0000 0.0000 0.6072 ( 3070 PWs) bands (ev): -9.5173 -9.5173 -9.5108 -9.5108 -9.3667 -9.3667 -9.2435 -9.2435 -7.9200 -7.9200 -7.5413 -7.5413 -7.2607 -7.2607 -7.2291 -7.2291 -5.5940 -5.5940 -5.5013 -5.5013 -5.4959 -5.4959 -5.0865 -5.0865 -4.5334 -4.5334 -4.5046 -4.5046 0.5103 0.5103 1.6821 1.6821 4.9429 4.9429 4.9868 4.9868 5.3770 5.3770 5.9119 5.9119 6.3152 6.3152 6.3158 6.3158 6.9959 6.9959 7.5638 7.5638 7.6523 7.6523 7.6795 7.6795 11.7935 11.7935 12.7665 12.7665 16.6237 16.6237 16.9069 16.9069 18.0227 18.0227 k = 0.0000 0.0000 0.6227 ( 3070 PWs) bands (ev): -9.5281 -9.5281 -9.5224 -9.5224 -9.3499 -9.3499 -9.2391 -9.2391 -7.8944 -7.8944 -7.5569 -7.5569 -7.2551 -7.2551 -7.2292 -7.2292 -5.5732 -5.5732 -5.5000 -5.5000 -5.4951 -5.4951 -5.1263 -5.1263 -4.5124 -4.5124 -4.4857 -4.4857 0.5588 0.5588 1.5858 1.5858 4.9231 4.9231 4.9692 4.9692 5.3853 5.3853 5.8639 5.8639 6.3315 6.3315 6.3345 6.3345 7.0286 7.0286 7.5269 7.5269 7.6422 7.6422 7.6672 7.6672 11.8706 11.8706 12.7217 12.7217 16.6692 16.6692 16.9492 16.9492 18.0580 18.0580 k = 0.0000 0.0000 0.6383 ( 3066 PWs) bands (ev): -9.5375 -9.5375 -9.5325 -9.5325 -9.3337 -9.3337 -9.2366 -9.2366 -7.8681 -7.8681 -7.5742 -7.5742 -7.2502 -7.2502 -7.2292 -7.2292 -5.5510 -5.5510 -5.4987 -5.4987 -5.4943 -5.4943 -5.1659 -5.1659 -4.4933 -4.4933 -4.4695 -4.4695 0.6107 0.6107 1.4922 1.4922 4.9060 4.9060 4.9505 4.9505 5.3996 5.3996 5.8171 5.8171 6.3466 6.3466 6.3518 6.3518 7.0618 7.0618 7.4900 7.4900 7.6332 7.6332 7.6558 7.6558 11.9454 11.9454 12.6747 12.6747 16.7155 16.7155 16.9821 16.9821 18.0813 18.0813 k = 0.0000 0.0000 0.6539 ( 3058 PWs) bands (ev): -9.5454 -9.5454 -9.5413 -9.5413 -9.3185 -9.3185 -9.2360 -9.2360 -7.8414 -7.8414 -7.5933 -7.5933 -7.2458 -7.2458 -7.2291 -7.2291 -5.5275 -5.5275 -5.4976 -5.4976 -5.4934 -5.4934 -5.2048 -5.2048 -4.4764 -4.4764 -4.4559 -4.4559 0.6660 0.6660 1.4016 1.4016 4.8919 4.8919 4.9321 4.9321 5.4190 5.4190 5.7716 5.7716 6.3605 6.3605 6.3667 6.3667 7.0956 7.0956 7.4531 7.4531 7.6257 7.6257 7.6453 7.6453 12.0179 12.0179 12.6255 12.6255 16.7619 16.7619 17.0048 17.0048 18.0943 18.0943 k = 0.0000 0.0000 0.6694 ( 3046 PWs) bands (ev): -9.5519 -9.5519 -9.5485 -9.5485 -9.3043 -9.3043 -9.2372 -9.2372 -7.8145 -7.8145 -7.6138 -7.6138 -7.2421 -7.2421 -7.2292 -7.2292 -5.5043 -5.5043 -5.4967 -5.4967 -5.4909 -5.4909 -5.2429 -5.2429 -4.4620 -4.4620 -4.4451 -4.4451 0.7248 0.7248 1.3138 1.3138 4.8809 4.8809 4.9149 4.9149 5.4426 5.4426 5.7275 5.7275 6.3728 6.3728 6.3791 6.3791 7.1298 7.1298 7.4163 7.4163 7.6197 7.6197 7.6359 7.6359 12.0882 12.0882 12.5741 12.5741 16.8078 16.8078 17.0169 17.0169 18.0994 18.0994 k = 0.0000 0.0000 0.6850 ( 3054 PWs) bands (ev): -9.5568 -9.5568 -9.5543 -9.5543 -9.2911 -9.2911 -9.2402 -9.2402 -7.7875 -7.7875 -7.6358 -7.6358 -7.2388 -7.2388 -7.2295 -7.2295 -5.4958 -5.4958 -5.4953 -5.4953 -5.4726 -5.4726 -5.2800 -5.2800 -4.4500 -4.4500 -4.4372 -4.4372 0.7869 0.7869 1.2291 1.2291 4.8732 4.8732 4.8997 4.8997 5.4697 5.4697 5.6849 5.6849 6.3832 6.3832 6.3886 6.3886 7.1645 7.1645 7.3796 7.3796 7.6153 7.6153 7.6278 7.6278 12.1563 12.1563 12.5207 12.5207 16.8521 16.8521 17.0183 17.0183 18.0991 18.0991 k = 0.0000 0.0000 0.7006 ( 3054 PWs) bands (ev): -9.5602 -9.5602 -9.5585 -9.5585 -9.2791 -9.2791 -9.2449 -9.2449 -7.7607 -7.7607 -7.6589 -7.6589 -7.2362 -7.2362 -7.2301 -7.2301 -5.4952 -5.4952 -5.4944 -5.4944 -5.4449 -5.4449 -5.3158 -5.3158 -4.4408 -4.4408 -4.4321 -4.4321 0.8524 0.8524 1.1474 1.1474 4.8691 4.8691 4.8872 4.8872 5.4998 5.4998 5.6439 5.6439 6.3911 6.3911 6.3951 6.3951 7.1995 7.1995 7.3431 7.3431 7.6128 7.6128 7.6213 7.6213 12.2222 12.2222 12.4651 12.4651 16.8939 16.8939 17.0094 17.0094 18.0960 18.0960 k = 0.0000 0.0000 0.7161 ( 3038 PWs) bands (ev): -9.5621 -9.5621 -9.5613 -9.5613 -9.2684 -9.2684 -9.2512 -9.2512 -7.7343 -7.7343 -7.6832 -7.6832 -7.2340 -7.2340 -7.2310 -7.2310 -5.4947 -5.4947 -5.4942 -5.4942 -5.4150 -5.4150 -5.3504 -5.3504 -4.4343 -4.4343 -4.4300 -4.4300 0.9213 0.9213 1.0688 1.0688 4.8684 4.8684 4.8776 4.8776 5.5325 5.5325 5.6048 5.6048 6.3965 6.3965 6.3986 6.3986 7.2350 7.2350 7.3068 7.3068 7.6122 7.6122 7.6165 7.6165 12.2861 12.2861 12.4075 12.4075 16.9320 16.9320 16.9912 16.9912 18.0914 18.0914 k = 0.0000 0.0000 0.7317 ( 3046 PWs) bands (ev): -9.5625 -9.5625 -9.5625 -9.5625 -9.2591 -9.2591 -9.2591 -9.2591 -7.7084 -7.7084 -7.7084 -7.7084 -7.2323 -7.2323 -7.2323 -7.2323 -5.4944 -5.4944 -5.4944 -5.4944 -5.3835 -5.3835 -5.3835 -5.3835 -4.4307 -4.4307 -4.4307 -4.4307 0.9934 0.9934 0.9934 0.9934 4.8713 4.8713 4.8713 4.8713 5.5676 5.5676 5.5676 5.5676 6.3991 6.3991 6.3991 6.3991 7.2707 7.2707 7.2707 7.2707 7.6134 7.6134 7.6134 7.6134 12.3478 12.3478 12.3478 12.3478 16.9649 16.9649 16.9649 16.9649 18.0902 18.0902 k = 0.0000 0.0000 0.7317 ( 3046 PWs) bands (ev): -9.5625 -9.5625 -9.5625 -9.5625 -9.2591 -9.2591 -9.2591 -9.2591 -7.7084 -7.7084 -7.7084 -7.7084 -7.2323 -7.2323 -7.2323 -7.2323 -5.4944 -5.4944 -5.4944 -5.4944 -5.3835 -5.3835 -5.3835 -5.3835 -4.4307 -4.4307 -4.4307 -4.4307 0.9934 0.9934 0.9934 0.9934 4.8713 4.8713 4.8713 4.8713 5.5676 5.5676 5.5676 5.5676 6.3991 6.3991 6.3991 6.3991 7.2707 7.2707 7.2707 7.2707 7.6134 7.6134 7.6134 7.6134 12.3478 12.3478 12.3478 12.3478 16.9649 16.9649 16.9649 16.9649 18.0902 18.0902 k = 0.0000 0.0156 0.7317 ( 3046 PWs) bands (ev): -9.5649 -9.5649 -9.5638 -9.5638 -9.2579 -9.2579 -9.2552 -9.2552 -7.7114 -7.7114 -7.7067 -7.7067 -7.2333 -7.2333 -7.2310 -7.2310 -5.4973 -5.4973 -5.4914 -5.4914 -5.3905 -5.3905 -5.3785 -5.3785 -4.4324 -4.4324 -4.4268 -4.4268 0.9927 0.9927 0.9956 0.9956 4.8478 4.8478 4.8901 4.8901 5.5578 5.5578 5.5619 5.5619 6.3919 6.3919 6.4253 6.4253 7.2714 7.2714 7.2716 7.2716 7.6130 7.6130 7.6135 7.6135 12.3472 12.3472 12.3497 12.3497 16.9208 16.9208 17.0017 17.0017 18.0808 18.0808 k = 0.0000 0.0312 0.7317 ( 3060 PWs) bands (ev): -9.5708 -9.5708 -9.5689 -9.5689 -9.2517 -9.2517 -9.2465 -9.2465 -7.7157 -7.7157 -7.7063 -7.7063 -7.2342 -7.2342 -7.2296 -7.2296 -5.5003 -5.5003 -5.4885 -5.4885 -5.3997 -5.3997 -5.3759 -5.3759 -4.4318 -4.4318 -4.4207 -4.4207 0.9933 0.9933 0.9990 0.9990 4.8192 4.8192 4.9045 4.9045 5.5357 5.5357 5.5398 5.5398 6.4046 6.4046 6.4677 6.4677 7.2736 7.2736 7.2739 7.2739 7.6125 7.6125 7.6135 7.6135 12.3477 12.3477 12.3527 12.3527 16.8702 16.8702 17.0305 17.0305 18.0730 18.0730 k = 0.0000 0.0469 0.7317 ( 3060 PWs) bands (ev): -9.5798 -9.5798 -9.5772 -9.5772 -9.2411 -9.2411 -9.2334 -9.2334 -7.7213 -7.7213 -7.7073 -7.7073 -7.2347 -7.2347 -7.2280 -7.2280 -5.5033 -5.5033 -5.4858 -5.4858 -5.4107 -5.4107 -5.3754 -5.3754 -4.4289 -4.4289 -4.4126 -4.4126 0.9953 0.9953 1.0038 1.0038 4.7854 4.7854 4.9147 4.9147 5.5028 5.5028 5.5054 5.5054 6.4353 6.4353 6.5226 6.5226 7.2773 7.2773 7.2776 7.2776 7.6119 7.6119 7.6135 7.6135 12.3495 12.3495 12.3569 12.3569 16.8139 16.8139 17.0505 17.0505 18.0673 18.0673 k = 0.0000 0.0625 0.7317 ( 3056 PWs) bands (ev): -9.5912 -9.5912 -9.5881 -9.5881 -9.2265 -9.2265 -9.2167 -9.2167 -7.7281 -7.7281 -7.7096 -7.7096 -7.2351 -7.2351 -7.2262 -7.2262 -5.5063 -5.5063 -5.4831 -5.4831 -5.4233 -5.4233 -5.3772 -5.3772 -4.4238 -4.4238 -4.4026 -4.4026 0.9987 0.9987 1.0099 1.0099 4.7462 4.7462 4.9208 4.9208 5.4540 5.4540 5.4705 5.4705 6.4806 6.4806 6.5864 6.5864 7.2825 7.2825 7.2827 7.2827 7.6112 7.6112 7.6133 7.6133 12.3524 12.3524 12.3623 12.3623 16.7528 16.7528 17.0614 17.0614 18.0645 18.0645 k = 0.0000 0.0781 0.7317 ( 3064 PWs) bands (ev): -9.6042 -9.6042 -9.6010 -9.6010 -9.2088 -9.2088 -9.1971 -9.1971 -7.7361 -7.7361 -7.7134 -7.7134 -7.2352 -7.2352 -7.2244 -7.2244 -5.5093 -5.5093 -5.4809 -5.4809 -5.4371 -5.4371 -5.3810 -5.3810 -4.4165 -4.4165 -4.3911 -4.3911 1.0034 1.0034 1.0172 1.0172 4.7016 4.7016 4.9229 4.9229 5.3970 5.3970 5.4338 5.4338 6.5368 6.5368 6.6562 6.6562 7.2890 7.2890 7.2891 7.2891 7.6106 7.6106 7.6133 7.6133 12.3565 12.3565 12.3688 12.3688 16.6874 16.6874 17.0629 17.0629 18.0650 18.0650 k = 0.0000 0.0938 0.7317 ( 3064 PWs) bands (ev): -9.6184 -9.6184 -9.6151 -9.6151 -9.1884 -9.1884 -9.1750 -9.1750 -7.7453 -7.7453 -7.7185 -7.7185 -7.2351 -7.2351 -7.2224 -7.2224 -5.5123 -5.5123 -5.4797 -5.4797 -5.4513 -5.4513 -5.3867 -5.3867 -4.4073 -4.4073 -4.3781 -4.3781 1.0094 1.0094 1.0258 1.0258 4.6518 4.6518 4.9207 4.9207 5.3354 5.3354 5.3972 5.3972 6.6008 6.6008 6.7297 6.7297 7.2968 7.2968 7.2969 7.2969 7.6102 7.6102 7.6135 7.6135 12.3618 12.3618 12.3763 12.3763 16.6184 16.6184 17.0553 17.0553 18.0690 18.0690 k = 0.0000 0.1094 0.7317 ( 3068 PWs) bands (ev): -9.6334 -9.6334 -9.6301 -9.6301 -9.1660 -9.1660 -9.1509 -9.1509 -7.7555 -7.7555 -7.7251 -7.7251 -7.2347 -7.2347 -7.2204 -7.2204 -5.5154 -5.5154 -5.4828 -5.4828 -5.4623 -5.4623 -5.3942 -5.3942 -4.3963 -4.3963 -4.3638 -4.3638 1.0168 1.0168 1.0356 1.0356 4.5972 4.5972 4.9136 4.9136 5.2721 5.2721 5.3620 5.3620 6.6700 6.6700 6.8053 6.8053 7.3055 7.3055 7.3060 7.3060 7.6103 7.6103 7.6142 7.6142 12.3682 12.3682 12.3849 12.3849 16.5464 16.5464 17.0390 17.0390 18.0763 18.0763 k = 0.0000 0.1250 0.7317 ( 3068 PWs) bands (ev): -9.6487 -9.6487 -9.6456 -9.6456 -9.1419 -9.1419 -9.1252 -9.1252 -7.7669 -7.7669 -7.7329 -7.7329 -7.2341 -7.2341 -7.2183 -7.2183 -5.5184 -5.5184 -5.4947 -5.4947 -5.4654 -5.4654 -5.4031 -5.4031 -4.3838 -4.3838 -4.3486 -4.3486 1.0255 1.0255 1.0465 1.0465 4.5384 4.5384 4.9003 4.9003 5.2103 5.2103 5.3287 5.3287 6.7421 6.7421 6.8815 6.8815 7.3153 7.3153 7.3162 7.3162 7.6110 7.6110 7.6156 7.6156 12.3757 12.3757 12.3945 12.3945 16.4718 16.4718 17.0147 17.0147 18.0869 18.0869 k = 0.0000 0.1406 0.7317 ( 3068 PWs) bands (ev): -9.6641 -9.6641 -9.6613 -9.6613 -9.1164 -9.1164 -9.0981 -9.0981 -7.7793 -7.7793 -7.7422 -7.7422 -7.2334 -7.2334 -7.2162 -7.2162 -5.5215 -5.5215 -5.5115 -5.5115 -5.4644 -5.4644 -5.4133 -5.4133 -4.3699 -4.3699 -4.3326 -4.3326 1.0354 1.0354 1.0585 1.0585 4.4762 4.4762 4.8789 4.8789 5.1532 5.1532 5.2975 5.2975 6.8155 6.8155 6.9571 6.9571 7.3260 7.3260 7.3275 7.3275 7.6129 7.6129 7.6181 7.6181 12.3842 12.3842 12.4051 12.4051 16.3952 16.3952 16.9836 16.9836 18.1001 18.1001 k = 0.0000 0.1562 0.7317 ( 3062 PWs) bands (ev): -9.6795 -9.6795 -9.6769 -9.6769 -9.0898 -9.0898 -9.0700 -9.0700 -7.7928 -7.7928 -7.7528 -7.7528 -7.2324 -7.2324 -7.2142 -7.2142 -5.5299 -5.5299 -5.5247 -5.5247 -5.4624 -5.4624 -5.4245 -5.4245 -4.3549 -4.3549 -4.3159 -4.3159 1.0466 1.0466 1.0715 1.0715 4.4112 4.4112 4.8474 4.8474 5.1042 5.1042 5.2686 5.2686 6.8887 6.8887 7.0308 7.0308 7.3376 7.3376 7.3399 7.3399 7.6164 7.6164 7.6222 7.6222 12.3938 12.3938 12.4165 12.4165 16.3171 16.3171 16.9466 16.9466 18.1155 18.1155 k = 0.0000 0.1719 0.7317 ( 3062 PWs) bands (ev): -9.6947 -9.6947 -9.6924 -9.6924 -9.0622 -9.0622 -9.0408 -9.0408 -7.8072 -7.8072 -7.7647 -7.7647 -7.2313 -7.2313 -7.2121 -7.2121 -5.5489 -5.5489 -5.5280 -5.5280 -5.4601 -5.4601 -5.4364 -5.4364 -4.3390 -4.3390 -4.2989 -4.2989 1.0589 1.0589 1.0854 1.0854 4.3441 4.3441 4.8046 4.8046 5.0652 5.0652 5.2417 5.2417 6.9602 6.9602 7.1010 7.1010 7.3503 7.3503 7.3532 7.3532 7.6223 7.6223 7.6283 7.6283 12.4043 12.4043 12.4287 12.4287 16.2377 16.2377 16.9047 16.9047 18.1327 18.1327 k = 0.0000 0.1875 0.7317 ( 3060 PWs) bands (ev): -9.7095 -9.7095 -9.7075 -9.7075 -9.0338 -9.0338 -9.0108 -9.0108 -7.8226 -7.8226 -7.7779 -7.7779 -7.2301 -7.2301 -7.2101 -7.2101 -5.5681 -5.5681 -5.5315 -5.5315 -5.4577 -5.4577 -5.4488 -5.4488 -4.3224 -4.3224 -4.2816 -4.2816 1.0723 1.0723 1.1003 1.1003 4.2757 4.2757 4.7520 4.7520 5.0356 5.0356 5.2167 5.2167 7.0283 7.0283 7.1659 7.1659 7.3645 7.3645 7.3675 7.3675 7.6314 7.6314 7.6373 7.6373 12.4158 12.4158 12.4416 12.4416 16.1576 16.1576 16.8589 16.8589 18.1512 18.1512 k = 0.0000 0.2031 0.7317 ( 3058 PWs) bands (ev): -9.7239 -9.7239 -9.7222 -9.7222 -9.0047 -9.0047 -8.9802 -8.9802 -7.8389 -7.8389 -7.7923 -7.7923 -7.2287 -7.2287 -7.2081 -7.2081 -5.5874 -5.5874 -5.5353 -5.5353 -5.4612 -5.4612 -5.4553 -5.4553 -4.3054 -4.3054 -4.2643 -4.2643 1.0867 1.0867 1.1158 1.1158 4.2066 4.2066 4.6925 4.6925 5.0129 5.0129 5.1934 5.1934 7.0915 7.0915 7.2229 7.2229 7.3810 7.3810 7.3829 7.3829 7.6449 7.6449 7.6501 7.6501 12.4280 12.4280 12.4552 12.4552 16.0772 16.0772 16.8103 16.8103 18.1705 18.1705 k = 0.0000 0.2188 0.7317 ( 3066 PWs) bands (ev): -9.7377 -9.7377 -9.7363 -9.7363 -8.9752 -8.9752 -8.9490 -8.9490 -7.8561 -7.8561 -7.8080 -7.8080 -7.2273 -7.2273 -7.2062 -7.2062 -5.6065 -5.6065 -5.5396 -5.5396 -5.4734 -5.4734 -5.4530 -5.4530 -4.2882 -4.2882 -4.2470 -4.2470 1.1021 1.1021 1.1321 1.1321 4.1374 4.1374 4.6291 4.6291 4.9949 4.9949 5.1716 5.1716 7.1478 7.1478 7.2690 7.2690 7.3996 7.3996 7.4010 7.4010 7.6644 7.6644 7.6676 7.6676 12.4411 12.4411 12.4693 12.4693 15.9968 15.9968 16.7594 16.7594 18.1904 18.1904 k = 0.0000 0.2344 0.7317 ( 3062 PWs) bands (ev): -9.7511 -9.7511 -9.7500 -9.7500 -8.9451 -8.9451 -8.9172 -8.9172 -7.8741 -7.8741 -7.8248 -7.8248 -7.2258 -7.2258 -7.2044 -7.2044 -5.6253 -5.6253 -5.5445 -5.5445 -5.4849 -5.4849 -5.4507 -5.4507 -4.2710 -4.2710 -4.2300 -4.2300 1.1182 1.1182 1.1489 1.1489 4.0686 4.0686 4.5640 4.5640 4.9797 4.9797 5.1513 5.1513 7.1957 7.1957 7.3024 7.3024 7.4177 7.4177 7.4246 7.4246 7.6909 7.6909 7.6910 7.6910 12.4549 12.4549 12.4838 12.4838 15.9169 15.9169 16.7072 16.7072 18.2106 18.2106 k = 0.0000 0.2500 0.7317 ( 3058 PWs) bands (ev): -9.7638 -9.7638 -9.7630 -9.7630 -8.9148 -8.9148 -8.8851 -8.8851 -7.8930 -7.8930 -7.8428 -7.8428 -7.2243 -7.2243 -7.2026 -7.2026 -5.6436 -5.6436 -5.5505 -5.5505 -5.4952 -5.4952 -5.4485 -5.4485 -4.2538 -4.2538 -4.2133 -4.2133 1.1351 1.1351 1.1662 1.1662 4.0007 4.0007 4.4988 4.4988 4.9664 4.9664 5.1323 5.1323 7.2341 7.2341 7.3243 7.3243 7.4370 7.4370 7.4498 7.4498 7.7207 7.7207 7.7251 7.7251 12.4692 12.4692 12.4987 12.4987 15.8378 15.8378 16.6544 16.6544 18.2309 18.2309 k = 0.0000 0.2656 0.7317 ( 3064 PWs) bands (ev): -9.7759 -9.7759 -9.7753 -9.7753 -8.8842 -8.8842 -8.8527 -8.8527 -7.9125 -7.9125 -7.8618 -7.8618 -7.2227 -7.2227 -7.2010 -7.2010 -5.6613 -5.6613 -5.5575 -5.5575 -5.5041 -5.5041 -5.4463 -5.4463 -4.2370 -4.2370 -4.1971 -4.1971 1.1526 1.1526 1.1837 1.1837 3.9342 3.9342 4.4345 4.4345 4.9543 4.9543 5.1145 5.1145 7.2634 7.2634 7.3381 7.3381 7.4567 7.4567 7.4736 7.4736 7.7568 7.7568 7.7658 7.7658 12.4841 12.4841 12.5138 12.5138 15.7601 15.7601 16.6014 16.6014 18.2380 18.2380 k = 0.0000 0.2812 0.7317 ( 3064 PWs) bands (ev): -9.7873 -9.7873 -9.7870 -9.7870 -8.8534 -8.8534 -8.8200 -8.8200 -7.9328 -7.9328 -7.8818 -7.8818 -7.2212 -7.2212 -7.1994 -7.1994 -5.6782 -5.6782 -5.5658 -5.5658 -5.5114 -5.5114 -5.4443 -5.4443 -4.2206 -4.2206 -4.1814 -4.1814 1.1706 1.1706 1.2015 1.2015 3.8694 3.8694 4.3718 4.3718 4.9431 4.9431 5.0979 5.0979 7.2846 7.2846 7.3468 7.3468 7.4761 7.4761 7.4947 7.4947 7.7984 7.7984 7.8114 7.8114 12.4994 12.4994 12.5290 12.5290 15.6840 15.6840 16.5489 16.5489 18.2449 18.2449 k = 0.0000 0.2969 0.7317 ( 3068 PWs) bands (ev): -9.7980 -9.7980 -9.7979 -9.7979 -8.8227 -8.8227 -8.7873 -8.7873 -7.9536 -7.9536 -7.9027 -7.9027 -7.2197 -7.2197 -7.1980 -7.1980 -5.6944 -5.6944 -5.5750 -5.5750 -5.5172 -5.5172 -5.4424 -5.4424 -4.2048 -4.2048 -4.1664 -4.1664 1.1888 1.1888 1.2192 1.2192 3.8068 3.8068 4.3113 4.3113 4.9326 4.9326 5.0824 5.0824 7.2994 7.2994 7.3520 7.3520 7.4945 7.4945 7.5131 7.5131 7.8441 7.8441 7.8596 7.8596 12.5150 12.5150 12.5441 12.5441 15.6100 15.6100 16.4974 16.4974 18.2516 18.2516 k = 0.0000 0.3125 0.7317 ( 3062 PWs) bands (ev): -9.8081 -9.8081 -9.8079 -9.8079 -8.7920 -8.7920 -8.7545 -8.7545 -7.9750 -7.9750 -7.9245 -7.9245 -7.2182 -7.2182 -7.1966 -7.1966 -5.7097 -5.7097 -5.5848 -5.5848 -5.5217 -5.5217 -5.4406 -5.4406 -4.1897 -4.1897 -4.1522 -4.1522 1.2071 1.2071 1.2367 1.2367 3.7468 3.7468 4.2534 4.2534 4.9228 4.9228 5.0680 5.0680 7.3096 7.3096 7.3550 7.3550 7.5116 7.5116 7.5292 7.5292 7.8921 7.8921 7.9086 7.9086 12.5307 12.5307 12.5591 12.5591 15.5386 15.5386 16.4474 16.4474 18.2581 18.2581 k = 0.0000 0.3281 0.7317 ( 3050 PWs) bands (ev): -9.8175 -9.8175 -9.8172 -9.8172 -8.7615 -8.7615 -8.7219 -8.7219 -7.9968 -7.9968 -7.9470 -7.9470 -7.2169 -7.2169 -7.1954 -7.1954 -5.7240 -5.7240 -5.5947 -5.5947 -5.5253 -5.5253 -5.4390 -5.4390 -4.1754 -4.1754 -4.1388 -4.1388 1.2252 1.2252 1.2539 1.2539 3.6897 3.6897 4.1986 4.1986 4.9136 4.9136 5.0547 5.0547 7.3164 7.3164 7.3564 7.3564 7.5274 7.5274 7.5436 7.5436 7.9407 7.9407 7.9568 7.9568 12.5464 12.5464 12.5737 12.5737 15.4703 15.4703 16.3995 16.3995 18.2642 18.2642 k = 0.0000 0.3438 0.7317 ( 3050 PWs) bands (ev): -9.8262 -9.8262 -9.8256 -9.8256 -8.7314 -8.7314 -8.6894 -8.6894 -8.0190 -8.0190 -7.9701 -7.9701 -7.2155 -7.2155 -7.1942 -7.1942 -5.7373 -5.7373 -5.6044 -5.6044 -5.5282 -5.5282 -5.4374 -5.4374 -4.1620 -4.1620 -4.1264 -4.1264 1.2431 1.2431 1.2706 1.2706 3.6359 3.6359 4.1472 4.1472 4.9050 4.9050 5.0426 5.0426 7.3208 7.3208 7.3566 7.3566 7.5417 7.5417 7.5566 7.5566 7.9884 7.9884 8.0030 8.0030 12.5619 12.5619 12.5878 12.5878 15.4056 15.4056 16.3539 16.3539 18.2700 18.2700 k = 0.0000 0.3594 0.7317 ( 3054 PWs) bands (ev): -9.8341 -9.8341 -9.8334 -9.8334 -8.7018 -8.7018 -8.6575 -8.6575 -8.0413 -8.0413 -7.9937 -7.9937 -7.2143 -7.2143 -7.1932 -7.1932 -5.7495 -5.7495 -5.6138 -5.6138 -5.5305 -5.5305 -5.4360 -5.4360 -4.1496 -4.1496 -4.1149 -4.1149 1.2604 1.2604 1.2865 1.2865 3.5858 3.5858 4.0995 4.0995 4.8971 4.8971 5.0315 5.0315 7.3235 7.3235 7.3560 7.3560 7.5547 7.5547 7.5683 7.5683 8.0343 8.0343 8.0466 8.0466 12.5770 12.5770 12.6013 12.6013 15.3449 15.3449 16.3111 16.3111 18.2754 18.2754 k = 0.0000 0.3750 0.7317 ( 3054 PWs) bands (ev): -9.8412 -9.8412 -9.8403 -9.8403 -8.6730 -8.6730 -8.6261 -8.6261 -8.0635 -8.0635 -8.0175 -8.0175 -7.2132 -7.2132 -7.1923 -7.1923 -5.7605 -5.7605 -5.6224 -5.6224 -5.5324 -5.5324 -5.4347 -5.4347 -4.1383 -4.1383 -4.1045 -4.1045 1.2769 1.2769 1.3014 1.3014 3.5397 3.5397 4.0559 4.0559 4.8900 4.8900 5.0215 5.0215 7.3249 7.3249 7.3550 7.3550 7.5665 7.5665 7.5789 7.5789 8.0772 8.0772 8.0868 8.0868 12.5914 12.5914 12.6139 12.6139 15.2887 15.2887 16.2717 16.2717 18.2804 18.2804 k = 0.0000 0.3906 0.7317 ( 3054 PWs) bands (ev): -9.8474 -9.8474 -9.8464 -9.8464 -8.6452 -8.6452 -8.5956 -8.5956 -8.0854 -8.0854 -8.0413 -8.0413 -7.2122 -7.2122 -7.1915 -7.1915 -5.7703 -5.7703 -5.6303 -5.6303 -5.5340 -5.5340 -5.4336 -5.4336 -4.1282 -4.1282 -4.0952 -4.0952 1.2923 1.2923 1.3153 1.3153 3.4980 3.4980 4.0167 4.0167 4.8835 4.8835 5.0127 5.0127 7.3256 7.3256 7.3536 7.3536 7.5769 7.5769 7.5883 7.5883 8.1166 8.1166 8.1232 8.1232 12.6049 12.6049 12.6255 12.6255 15.2377 15.2377 16.2358 16.2358 18.2849 18.2849 k = 0.0000 0.4062 0.7317 ( 3058 PWs) bands (ev): -9.8529 -9.8529 -9.8517 -9.8517 -8.6189 -8.6189 -8.5664 -8.5664 -8.1067 -8.1067 -8.0647 -8.0647 -7.2113 -7.2113 -7.1908 -7.1908 -5.7789 -5.7789 -5.6374 -5.6374 -5.5353 -5.5353 -5.4326 -5.4326 -4.1193 -4.1193 -4.0870 -4.0870 1.3063 1.3063 1.3277 1.3277 3.4609 3.4609 3.9820 3.9820 4.8778 4.8778 5.0050 5.0050 7.3257 7.3257 7.3522 7.3522 7.5861 7.5861 7.5966 7.5966 8.1517 8.1517 8.1554 8.1554 12.6174 12.6174 12.6360 12.6360 15.1921 15.1921 16.2040 16.2040 18.2888 18.2888 k = 0.0000 0.4219 0.7317 ( 3050 PWs) bands (ev): -9.8575 -9.8575 -9.8562 -9.8562 -8.5944 -8.5944 -8.5389 -8.5389 -8.1268 -8.1268 -8.0873 -8.0873 -7.2105 -7.2105 -7.1902 -7.1902 -5.7862 -5.7862 -5.6434 -5.6434 -5.5364 -5.5364 -5.4318 -5.4318 -4.1116 -4.1116 -4.0800 -4.0800 1.3188 1.3188 1.3387 1.3387 3.4289 3.4289 3.9522 3.9522 4.8729 4.8729 4.9985 4.9985 7.3254 7.3254 7.3508 7.3508 7.5940 7.5940 7.6038 7.6038 8.1822 8.1822 8.1831 8.1831 12.6284 12.6284 12.6452 12.6452 15.1527 15.1527 16.1764 16.1764 18.2923 18.2923 k = 0.0000 0.4375 0.7317 ( 3046 PWs) bands (ev): -9.8613 -9.8613 -9.8599 -9.8599 -8.5725 -8.5725 -8.5139 -8.5139 -8.1452 -8.1452 -8.1083 -8.1083 -7.2099 -7.2099 -7.1898 -7.1898 -5.7923 -5.7923 -5.6485 -5.6485 -5.5372 -5.5372 -5.4311 -5.4311 -4.1053 -4.1053 -4.0743 -4.0743 1.3293 1.3293 1.3479 1.3479 3.4023 3.4023 3.9275 3.9275 4.8689 4.8689 4.9931 4.9931 7.3251 7.3251 7.3495 7.3495 7.6004 7.6004 7.6096 7.6096 8.2061 8.2061 8.2077 8.2077 12.6379 12.6379 12.6529 12.6529 15.1197 15.1197 16.1535 16.1535 18.2951 18.2951 k = 0.0000 0.4531 0.7317 ( 3050 PWs) bands (ev): -9.8642 -9.8642 -9.8628 -9.8628 -8.5539 -8.5539 -8.4922 -8.4922 -8.1610 -8.1610 -8.1268 -8.1268 -7.2094 -7.2094 -7.1894 -7.1894 -5.7970 -5.7970 -5.6524 -5.6524 -5.5378 -5.5378 -5.4305 -5.4305 -4.1004 -4.1004 -4.0698 -4.0698 1.3378 1.3378 1.3552 1.3552 3.3813 3.3813 3.9081 3.9081 4.8657 4.8657 4.9889 4.9889 7.3247 7.3247 7.3484 7.3484 7.6055 7.6055 7.6143 7.6143 8.2241 8.2241 8.2278 8.2278 12.6455 12.6455 12.6591 12.6591 15.0935 15.0935 16.1354 16.1354 18.2974 18.2974 k = 0.0000 0.4688 0.7317 ( 3056 PWs) bands (ev): -9.8663 -9.8663 -9.8649 -9.8649 -8.5395 -8.5395 -8.4752 -8.4752 -8.1734 -8.1734 -8.1416 -8.1416 -7.2091 -7.2091 -7.1891 -7.1891 -5.8003 -5.8003 -5.6553 -5.6553 -5.5383 -5.5383 -5.4302 -5.4302 -4.0969 -4.0969 -4.0666 -4.0666 1.3440 1.3440 1.3606 1.3606 3.3661 3.3661 3.8941 3.8941 4.8634 4.8634 4.9859 4.9859 7.3243 7.3243 7.3475 7.3475 7.6092 7.6092 7.6176 7.6176 8.2371 8.2371 8.2423 8.2423 12.6511 12.6511 12.6635 12.6635 15.0746 15.0746 16.1223 16.1223 18.2990 18.2990 k = 0.0000 0.4844 0.7317 ( 3056 PWs) bands (ev): -9.8676 -9.8676 -9.8661 -9.8661 -8.5303 -8.5303 -8.4641 -8.4641 -8.1814 -8.1814 -8.1513 -8.1513 -7.2089 -7.2089 -7.1890 -7.1890 -5.8024 -5.8024 -5.6570 -5.6570 -5.5386 -5.5386 -5.4299 -5.4299 -4.0947 -4.0947 -4.0646 -4.0646 1.3478 1.3478 1.3638 1.3638 3.3569 3.3569 3.8857 3.8857 4.8621 4.8621 4.9841 4.9841 7.3241 7.3241 7.3470 7.3470 7.6114 7.6114 7.6196 7.6196 8.2449 8.2449 8.2510 8.2510 12.6545 12.6545 12.6663 12.6663 15.0632 15.0632 16.1144 16.1144 18.2999 18.2999 k = 0.0000 0.5000 0.7317 ( 3052 PWs) bands (ev): -9.8680 -9.8680 -9.8665 -9.8665 -8.5272 -8.5272 -8.4603 -8.4603 -8.1841 -8.1841 -8.1547 -8.1547 -7.2088 -7.2088 -7.1889 -7.1889 -5.8031 -5.8031 -5.6576 -5.6576 -5.5387 -5.5387 -5.4299 -5.4299 -4.0940 -4.0940 -4.0640 -4.0640 1.3491 1.3491 1.3649 1.3649 3.3538 3.3538 3.8828 3.8828 4.8616 4.8616 4.9835 4.9835 7.3240 7.3240 7.3469 7.3469 7.6121 7.6121 7.6203 7.6203 8.2475 8.2475 8.2540 8.2540 12.6557 12.6557 12.6672 12.6672 15.0594 15.0594 16.1117 16.1117 18.3003 18.3003 k = 0.0000 0.5000 0.7317 ( 3052 PWs) bands (ev): -9.8680 -9.8680 -9.8665 -9.8665 -8.5272 -8.5272 -8.4603 -8.4603 -8.1841 -8.1841 -8.1547 -8.1547 -7.2088 -7.2088 -7.1889 -7.1889 -5.8031 -5.8031 -5.6576 -5.6576 -5.5387 -5.5387 -5.4299 -5.4299 -4.0940 -4.0940 -4.0640 -4.0640 1.3491 1.3491 1.3649 1.3649 3.3538 3.3538 3.8828 3.8828 4.8616 4.8616 4.9835 4.9835 7.3240 7.3240 7.3469 7.3469 7.6121 7.6121 7.6203 7.6203 8.2475 8.2475 8.2540 8.2540 12.6557 12.6557 12.6672 12.6672 15.0594 15.0594 16.1117 16.1117 18.3003 18.3003 k = 0.0156 0.5000 0.7317 ( 3056 PWs) bands (ev): -9.8676 -9.8676 -9.8661 -9.8661 -8.5304 -8.5304 -8.4646 -8.4646 -8.1801 -8.1801 -8.1518 -8.1518 -7.2089 -7.2089 -7.1890 -7.1890 -5.8023 -5.8023 -5.6569 -5.6569 -5.5386 -5.5386 -5.4299 -5.4299 -4.0947 -4.0947 -4.0646 -4.0646 1.3460 1.3460 1.3614 1.3614 3.3588 3.3588 3.8873 3.8873 4.8610 4.8610 4.9832 4.9832 7.3250 7.3250 7.3479 7.3479 7.6127 7.6127 7.6208 7.6208 8.2458 8.2458 8.2525 8.2525 12.6520 12.6520 12.6620 12.6620 15.0643 15.0643 16.1142 16.1142 18.3006 18.3006 k = 0.0312 0.5000 0.7317 ( 3060 PWs) bands (ev): -9.8664 -9.8664 -9.8649 -9.8649 -8.5395 -8.5395 -8.4769 -8.4769 -8.1687 -8.1687 -8.1435 -8.1435 -7.2091 -7.2091 -7.1892 -7.1892 -5.8000 -5.8000 -5.6549 -5.6549 -5.5383 -5.5383 -5.4301 -5.4301 -4.0967 -4.0967 -4.0663 -4.0663 1.3369 1.3369 1.3508 1.3508 3.3735 3.3735 3.9008 3.9008 4.8593 4.8593 4.9823 4.9823 7.3281 7.3281 7.3509 7.3509 7.6144 7.6144 7.6225 7.6225 8.2405 8.2405 8.2479 8.2479 12.6408 12.6408 12.6468 12.6468 15.0789 15.0789 16.1217 16.1217 18.3016 18.3016 k = 0.0469 0.5000 0.7317 ( 3060 PWs) bands (ev): -9.8645 -9.8645 -9.8630 -9.8630 -8.5540 -8.5540 -8.4956 -8.4956 -8.1516 -8.1516 -8.1304 -8.1304 -7.2094 -7.2094 -7.1896 -7.1896 -5.7962 -5.7962 -5.6516 -5.6516 -5.5379 -5.5379 -5.4303 -5.4303 -4.1000 -4.1000 -4.0693 -4.0693 1.3221 1.3221 1.3337 1.3337 3.3975 3.3975 3.9228 3.9228 4.8565 4.8565 4.9809 4.9809 7.3331 7.3331 7.3559 7.3559 7.6172 7.6172 7.6253 7.6253 8.2317 8.2317 8.2404 8.2404 12.6219 12.6219 12.6226 12.6226 15.1026 15.1026 16.1339 16.1339 18.3032 18.3032 k = 0.0625 0.5000 0.7317 ( 3060 PWs) bands (ev): -9.8617 -9.8617 -9.8602 -9.8602 -8.5727 -8.5727 -8.5188 -8.5188 -8.1306 -8.1306 -8.1137 -8.1137 -7.2099 -7.2099 -7.1902 -7.1902 -5.7909 -5.7909 -5.6470 -5.6470 -5.5374 -5.5374 -5.4307 -5.4307 -4.1047 -4.1047 -4.0735 -4.0735 1.3018 1.3018 1.3105 1.3105 3.4302 3.4302 3.9529 3.9529 4.8530 4.8530 4.9792 4.9792 7.3400 7.3400 7.3628 7.3628 7.6212 7.6212 7.6292 7.6292 8.2194 8.2194 8.2299 8.2299 12.5883 12.5883 12.5974 12.5974 15.1348 15.1348 16.1507 16.1507 18.3054 18.3054 k = 0.0781 0.5000 0.7317 ( 3060 PWs) bands (ev): -9.8582 -9.8582 -9.8566 -9.8566 -8.5948 -8.5948 -8.5452 -8.5452 -8.1070 -8.1070 -8.0941 -8.0941 -7.2105 -7.2105 -7.1908 -7.1908 -5.7841 -5.7841 -5.6411 -5.6411 -5.5367 -5.5367 -5.4311 -5.4311 -4.1107 -4.1107 -4.0788 -4.0788 1.2766 1.2766 1.2820 1.2820 3.4706 3.4706 3.9904 3.9904 4.8488 4.8488 4.9773 4.9773 7.3486 7.3486 7.3715 7.3715 7.6262 7.6262 7.6341 7.6341 8.2036 8.2036 8.2163 8.2163 12.5468 12.5468 12.5659 12.5659 15.1745 15.1745 16.1715 16.1715 18.3083 18.3083 k = 0.0938 0.5000 0.7317 ( 3064 PWs) bands (ev): -9.8539 -9.8539 -9.8523 -9.8523 -8.6195 -8.6195 -8.5738 -8.5738 -8.0819 -8.0819 -8.0725 -8.0725 -7.2113 -7.2113 -7.1917 -7.1917 -5.7758 -5.7758 -5.6340 -5.6340 -5.5358 -5.5358 -5.4317 -5.4317 -4.1179 -4.1179 -4.0853 -4.0853 1.2472 1.2472 1.2491 1.2491 3.5178 3.5178 4.0343 4.0343 4.8445 4.8445 4.9756 4.9756 7.3588 7.3588 7.3817 7.3817 7.6323 7.6323 7.6401 7.6401 8.1842 8.1842 8.1998 8.1998 12.4986 12.4986 12.5285 12.5285 15.2205 15.2205 16.1961 16.1961 18.3117 18.3117 k = 0.1094 0.5000 0.7317 ( 3068 PWs) bands (ev): -9.8489 -9.8489 -9.8472 -9.8472 -8.6460 -8.6460 -8.6038 -8.6038 -8.0560 -8.0560 -8.0497 -8.0497 -7.2122 -7.2122 -7.1927 -7.1927 -5.7661 -5.7661 -5.6256 -5.6256 -5.5347 -5.5347 -5.4324 -5.4324 -4.1264 -4.1264 -4.0929 -4.0929 1.2125 1.2125 1.2141 1.2141 3.5708 3.5708 4.0836 4.0836 4.8406 4.8406 4.9744 4.9744 7.3705 7.3705 7.3933 7.3933 7.6395 7.6395 7.6471 7.6471 8.1614 8.1614 8.1802 8.1802 12.4447 12.4447 12.4858 12.4858 15.2720 15.2720 16.2240 16.2240 18.3156 18.3156 k = 0.1250 0.5000 0.7317 ( 3068 PWs) bands (ev): -9.8431 -9.8431 -9.8413 -9.8413 -8.6739 -8.6739 -8.6349 -8.6349 -8.0297 -8.0297 -8.0260 -8.0260 -7.2132 -7.2132 -7.1939 -7.1939 -5.7550 -5.7550 -5.6161 -5.6161 -5.5335 -5.5335 -5.4331 -5.4331 -4.1362 -4.1362 -4.1016 -4.1016 1.1730 1.1730 1.1780 1.1780 3.6284 3.6284 4.1371 4.1371 4.8379 4.8379 4.9742 4.9742 7.3833 7.3833 7.4061 7.4061 7.6477 7.6477 7.6551 7.6551 8.1350 8.1350 8.1576 8.1576 12.3864 12.3864 12.4384 12.4384 15.3278 15.3278 16.2545 16.2545 18.2931 18.2931 k = 0.1406 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.8365 -9.8365 -9.8347 -9.8347 -8.7028 -8.7028 -8.6666 -8.6666 -8.0033 -8.0033 -8.0019 -8.0019 -7.2144 -7.2144 -7.1952 -7.1952 -5.7425 -5.7425 -5.6055 -5.6055 -5.5321 -5.5321 -5.4340 -5.4340 -4.1471 -4.1471 -4.1115 -4.1115 1.1313 1.1313 1.1395 1.1395 3.6894 3.6894 4.1931 4.1931 4.8374 4.8374 4.9754 4.9754 7.3972 7.3972 7.4198 7.4198 7.6568 7.6568 7.6639 7.6639 8.1052 8.1052 8.1321 8.1321 12.3247 12.3247 12.3871 12.3871 15.3870 15.3870 16.2872 16.2872 18.2620 18.2620 k = 0.1562 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.8292 -9.8292 -9.8273 -9.8273 -8.7324 -8.7324 -8.6987 -8.6987 -7.9776 -7.9776 -7.9772 -7.9772 -7.2157 -7.2157 -7.1967 -7.1967 -5.7287 -5.7287 -5.5938 -5.5938 -5.5304 -5.5304 -5.4349 -5.4349 -4.1591 -4.1591 -4.1224 -4.1224 1.0883 1.0883 1.0992 1.0992 3.7527 3.7527 4.2497 4.2497 4.8407 4.8407 4.9788 4.9788 7.4117 7.4117 7.4343 7.4343 7.6668 7.6668 7.6736 7.6736 8.0720 8.0720 8.1037 8.1037 12.2606 12.2606 12.3324 12.3324 15.4486 15.4486 16.3216 16.3216 18.2298 18.2298 k = 0.1719 0.5000 0.7317 ( 3076 PWs) bands (ev): -9.8212 -9.8212 -9.8192 -9.8192 -8.7624 -8.7624 -8.7310 -8.7310 -7.9535 -7.9535 -7.9516 -7.9516 -7.2171 -7.2171 -7.1983 -7.1983 -5.7137 -5.7137 -5.5813 -5.5813 -5.5284 -5.5284 -5.4359 -5.4359 -4.1722 -4.1722 -4.1343 -4.1343 1.0443 1.0443 1.0577 1.0577 3.8171 3.8171 4.3045 4.3045 4.8497 4.8497 4.9851 4.9851 7.4268 7.4268 7.4491 7.4491 7.6776 7.6776 7.6840 7.6840 8.0355 8.0355 8.0724 8.0724 12.1949 12.1949 12.2752 12.2752 15.5120 15.5120 16.3570 16.3570 18.1969 18.1969 k = 0.1875 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.8125 -9.8125 -9.8104 -9.8104 -8.7928 -8.7928 -8.7634 -8.7634 -7.9296 -7.9296 -7.9264 -7.9264 -7.2186 -7.2186 -7.2001 -7.2001 -5.6975 -5.6975 -5.5682 -5.5682 -5.5260 -5.5260 -5.4370 -5.4370 -4.1863 -4.1863 -4.1472 -4.1472 1.0001 1.0001 1.0154 1.0154 3.8812 3.8812 4.3545 4.3545 4.8669 4.8669 4.9952 4.9952 7.4420 7.4420 7.4640 7.4640 7.6891 7.6891 7.6951 7.6951 7.9958 7.9958 8.0383 8.0383 12.1285 12.1285 12.2160 12.2160 15.5764 15.5764 16.3931 16.3931 18.1639 18.1639 k = 0.2031 0.5000 0.7317 ( 3080 PWs) bands (ev): -9.8031 -9.8031 -9.8009 -9.8009 -8.8232 -8.8232 -8.7957 -8.7957 -7.9061 -7.9061 -7.9020 -7.9020 -7.2202 -7.2202 -7.2020 -7.2020 -5.6802 -5.6802 -5.5549 -5.5549 -5.5227 -5.5227 -5.4382 -5.4382 -4.2013 -4.2013 -4.1611 -4.1611 0.9561 0.9561 0.9729 0.9729 3.9439 3.9439 4.3968 4.3968 4.8952 4.8952 5.0099 5.0099 7.4570 7.4570 7.4785 7.4785 7.7012 7.7012 7.7066 7.7066 7.9532 7.9532 8.0017 8.0017 12.0621 12.0621 12.1554 12.1554 15.6411 15.6411 16.4293 16.4293 18.1312 18.1312 k = 0.2188 0.5000 0.7317 ( 3080 PWs) bands (ev): -9.7930 -9.7930 -9.7907 -9.7907 -8.8536 -8.8536 -8.8279 -8.8279 -7.8832 -7.8832 -7.8783 -7.8783 -7.2219 -7.2219 -7.2041 -7.2041 -5.6618 -5.6618 -5.5426 -5.5426 -5.5174 -5.5174 -5.4394 -5.4394 -4.2172 -4.2172 -4.1759 -4.1759 0.9126 0.9126 0.9307 0.9307 4.0037 4.0037 4.4292 4.4292 4.9362 4.9362 5.0304 5.0304 7.4715 7.4715 7.4922 7.4922 7.7136 7.7136 7.7184 7.7184 7.9081 7.9081 7.9628 7.9628 11.9964 11.9964 12.0941 12.0941 15.7059 15.7059 16.4650 16.4650 18.0993 18.0993 k = 0.2344 0.5000 0.7317 ( 3080 PWs) bands (ev): -9.7824 -9.7824 -9.7799 -9.7799 -8.8839 -8.8839 -8.8598 -8.8598 -7.8610 -7.8610 -7.8555 -7.8555 -7.2237 -7.2237 -7.2063 -7.2063 -5.6426 -5.6426 -5.5334 -5.5334 -5.5082 -5.5082 -5.4407 -5.4407 -4.2337 -4.2337 -4.1914 -4.1914 0.8701 0.8701 0.8889 0.8889 4.0595 4.0595 4.4510 4.4510 4.9904 4.9904 5.0577 5.0577 7.4848 7.4848 7.5042 7.5042 7.7260 7.7260 7.7303 7.7303 7.8614 7.8614 7.9221 7.9221 11.9320 11.9320 12.0327 12.0327 15.7701 15.7701 16.4999 16.4999 18.0687 18.0687 k = 0.2500 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.7711 -9.7711 -9.7685 -9.7685 -8.9140 -8.9140 -8.8913 -8.8913 -7.8395 -7.8395 -7.8336 -7.8336 -7.2255 -7.2255 -7.2086 -7.2086 -5.6226 -5.6226 -5.5277 -5.5277 -5.4948 -5.4948 -5.4420 -5.4420 -4.2509 -4.2509 -4.2077 -4.2077 0.8288 0.8288 0.8481 0.8481 4.1100 4.1100 4.4634 4.4634 5.0564 5.0564 5.0926 5.0926 7.4962 7.4962 7.5133 7.5133 7.7375 7.7375 7.7415 7.7415 7.8151 7.8151 7.8808 7.8808 11.8695 11.8695 11.9717 11.9717 15.8334 15.8334 16.5334 16.5334 18.0398 18.0398 k = 0.2656 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.7592 -9.7592 -9.7565 -9.7565 -8.9436 -8.9436 -8.9225 -8.9225 -7.8189 -7.8189 -7.8127 -7.8127 -7.2275 -7.2275 -7.2111 -7.2111 -5.6020 -5.6020 -5.5239 -5.5239 -5.4791 -5.4791 -5.4433 -5.4433 -4.2686 -4.2686 -4.2247 -4.2247 0.7890 0.7890 0.8084 0.8084 4.1546 4.1546 4.4684 4.4684 5.1320 5.1320 5.1357 5.1357 7.5043 7.5043 7.5169 7.5169 7.7417 7.7417 7.7509 7.7509 7.7777 7.7777 7.8410 7.8410 11.8092 11.8092 11.9117 11.9117 15.8956 15.8956 16.5651 16.5651 18.0130 18.0130 k = 0.2812 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.7468 -9.7468 -9.7440 -9.7440 -8.9729 -8.9729 -8.9530 -8.9530 -7.7991 -7.7991 -7.7928 -7.7928 -7.2294 -7.2294 -7.2136 -7.2136 -5.5810 -5.5810 -5.5208 -5.5208 -5.4622 -5.4622 -5.4444 -5.4444 -4.2866 -4.2866 -4.2422 -4.2422 0.7510 0.7510 0.7702 0.7702 4.1928 4.1928 4.4679 4.4679 5.1872 5.1872 5.2150 5.2150 7.5073 7.5073 7.5107 7.5107 7.7180 7.7180 7.7533 7.7533 7.7741 7.7741 7.8097 7.8097 11.7517 11.7517 11.8530 11.8530 15.9563 15.9563 16.5944 16.5944 17.9890 17.9890 k = 0.2969 0.5000 0.7317 ( 3080 PWs) bands (ev): -9.7340 -9.7340 -9.7310 -9.7310 -9.0015 -9.0015 -8.9830 -8.9830 -7.7804 -7.7804 -7.7741 -7.7741 -7.2313 -7.2313 -7.2163 -7.2163 -5.5598 -5.5598 -5.5181 -5.5181 -5.4454 -5.4454 -5.4449 -5.4449 -4.3048 -4.3048 -4.2602 -4.2602 0.7150 0.7150 0.7338 0.7338 4.2247 4.2247 4.4637 4.4637 5.2470 5.2470 5.3034 5.3034 7.4886 7.4886 7.5017 7.5017 7.6921 7.6921 7.7385 7.7385 7.7844 7.7844 7.8001 7.8001 11.6972 11.6972 11.7962 11.7962 16.0155 16.0155 16.6209 16.6209 17.9680 17.9680 k = 0.3125 0.5000 0.7317 ( 3084 PWs) bands (ev): -9.7208 -9.7208 -9.7177 -9.7177 -9.0295 -9.0295 -9.0122 -9.0122 -7.7627 -7.7627 -7.7565 -7.7565 -7.2333 -7.2333 -7.2190 -7.2190 -5.5387 -5.5387 -5.5154 -5.5154 -5.4460 -5.4460 -5.4275 -5.4275 -4.3229 -4.3229 -4.2784 -4.2784 0.6811 0.6811 0.6992 0.6992 4.2507 4.2507 4.4570 4.4570 5.3145 5.3145 5.3958 5.3958 7.4480 7.4480 7.4836 7.4836 7.6790 7.6790 7.7171 7.7171 7.7960 7.7960 7.8054 7.8054 11.6461 11.6461 11.7417 11.7417 16.0728 16.0728 16.6442 16.6442 17.9506 17.9506 k = 0.3281 0.5000 0.7317 ( 3088 PWs) bands (ev): -9.7072 -9.7072 -9.7040 -9.7040 -9.0567 -9.0567 -9.0406 -9.0406 -7.7461 -7.7461 -7.7401 -7.7401 -7.2352 -7.2352 -7.2217 -7.2217 -5.5185 -5.5185 -5.5128 -5.5128 -5.4458 -5.4458 -5.4103 -5.4103 -4.3408 -4.3408 -4.2968 -4.2968 0.6495 0.6495 0.6667 0.6667 4.2714 4.2714 4.4487 4.4487 5.3889 5.3889 5.4912 5.4912 7.3923 7.3923 7.4505 7.4505 7.6767 7.6767 7.7026 7.7026 7.8075 7.8075 7.8144 7.8144 11.5987 11.5987 11.6898 11.6898 16.1283 16.1283 16.6638 16.6638 17.9372 17.9372 k = 0.3438 0.5000 0.7317 ( 3080 PWs) bands (ev): -9.6935 -9.6935 -9.6902 -9.6902 -9.0829 -9.0829 -9.0680 -9.0680 -7.7306 -7.7306 -7.7250 -7.7250 -7.2370 -7.2370 -7.2244 -7.2244 -5.5102 -5.5102 -5.5002 -5.5002 -5.4438 -5.4438 -5.3937 -5.3937 -4.3582 -4.3582 -4.3151 -4.3151 0.6204 0.6204 0.6365 0.6365 4.2878 4.2878 4.4394 4.4394 5.4691 5.4691 5.5886 5.5886 7.3266 7.3266 7.4036 7.4036 7.6804 7.6804 7.6968 7.6968 7.8185 7.8185 7.8240 7.8240 11.5552 11.5552 11.6409 11.6409 16.1819 16.1819 16.6793 16.6793 17.9282 17.9282 k = 0.3594 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.6796 -9.6796 -9.6763 -9.6763 -9.1080 -9.1080 -9.0944 -9.0944 -7.7164 -7.7164 -7.7111 -7.7111 -7.2388 -7.2388 -7.2272 -7.2272 -5.5076 -5.5076 -5.4859 -5.4859 -5.4381 -5.4381 -5.3778 -5.3778 -4.3748 -4.3748 -4.3333 -4.3333 0.5938 0.5938 0.6087 0.6087 4.3006 4.3006 4.4297 4.4297 5.5541 5.5541 5.6873 5.6873 7.2542 7.2542 7.3461 7.3461 7.6870 7.6870 7.6971 7.6971 7.8288 7.8288 7.8333 7.8333 11.5159 11.5159 11.5953 11.5953 16.2333 16.2333 16.6906 16.6906 17.9238 17.9238 k = 0.3750 0.5000 0.7317 ( 3076 PWs) bands (ev): -9.6659 -9.6659 -9.6625 -9.6625 -9.1318 -9.1318 -9.1194 -9.1194 -7.7034 -7.7034 -7.6986 -7.6986 -7.2404 -7.2404 -7.2298 -7.2298 -5.5050 -5.5050 -5.4777 -5.4777 -5.4270 -5.4270 -5.3631 -5.3631 -4.3904 -4.3904 -4.3510 -4.3510 0.5699 0.5699 0.5834 0.5834 4.3107 4.3107 4.4198 4.4198 5.6431 5.6431 5.7868 5.7868 7.1769 7.1769 7.2809 7.2809 7.6948 7.6948 7.7010 7.7010 7.8382 7.8382 7.8419 7.8419 11.4809 11.4809 11.5532 11.5532 16.2827 16.2827 16.6972 16.6972 17.9244 17.9244 k = 0.3906 0.5000 0.7317 ( 3080 PWs) bands (ev): -9.6524 -9.6524 -9.6491 -9.6491 -9.1541 -9.1541 -9.1429 -9.1429 -7.6918 -7.6918 -7.6875 -7.6875 -7.2418 -7.2418 -7.2324 -7.2324 -5.5024 -5.5024 -5.4744 -5.4744 -5.4118 -5.4118 -5.3499 -5.3499 -4.4047 -4.4047 -4.3680 -4.3680 0.5487 0.5487 0.5607 0.5607 4.3187 4.3187 4.4101 4.4101 5.7350 5.7350 5.8863 5.8863 7.0961 7.0961 7.2100 7.2100 7.7029 7.7029 7.7065 7.7065 7.8466 7.8466 7.8497 7.8497 11.4503 11.4503 11.5150 11.5150 16.3298 16.3298 16.6993 16.6993 17.9300 17.9300 k = 0.4062 0.5000 0.7317 ( 3076 PWs) bands (ev): -9.6394 -9.6394 -9.6362 -9.6362 -9.1746 -9.1746 -9.1647 -9.1647 -7.6815 -7.6815 -7.6778 -7.6778 -7.2431 -7.2431 -7.2348 -7.2348 -5.4998 -5.4998 -5.4739 -5.4739 -5.3951 -5.3951 -5.3383 -5.3383 -4.4174 -4.4174 -4.3840 -4.3840 0.5303 0.5303 0.5408 0.5408 4.3253 4.3253 4.4008 4.4008 5.8290 5.8290 5.9855 5.9855 7.0125 7.0125 7.1348 7.1348 7.7106 7.7106 7.7127 7.7127 7.8539 7.8539 7.8565 7.8565 11.4243 11.4243 11.4807 11.4807 16.3747 16.3747 16.6966 16.6966 17.9405 17.9405 k = 0.4219 0.5000 0.7317 ( 3076 PWs) bands (ev): -9.6273 -9.6273 -9.6243 -9.6243 -9.1929 -9.1929 -9.1844 -9.1844 -7.6727 -7.6727 -7.6695 -7.6695 -7.2441 -7.2441 -7.2371 -7.2371 -5.4972 -5.4972 -5.4746 -5.4746 -5.3784 -5.3784 -5.3289 -5.3289 -4.4281 -4.4281 -4.3989 -4.3989 0.5148 0.5148 0.5236 0.5236 4.3309 4.3309 4.3918 4.3918 5.9244 5.9244 6.0833 6.0833 6.9272 6.9272 7.0561 7.0561 7.7176 7.7176 7.7187 7.7187 7.8602 7.8602 7.8623 7.8623 11.4029 11.4029 11.4507 11.4507 16.4173 16.4173 16.6894 16.6894 17.9558 17.9558 k = 0.4375 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.6164 -9.6164 -9.6137 -9.6137 -9.2086 -9.2086 -9.2016 -9.2016 -7.6653 -7.6653 -7.6628 -7.6628 -7.2448 -7.2448 -7.2391 -7.2391 -5.4946 -5.4946 -5.4760 -5.4760 -5.3629 -5.3629 -5.3218 -5.3218 -4.4366 -4.4366 -4.4123 -4.4123 0.5022 0.5022 0.5093 0.5093 4.3359 4.3359 4.3835 4.3835 6.0203 6.0203 6.1786 6.1786 6.8413 6.8413 6.9748 6.9748 7.7236 7.7236 7.7242 7.7242 7.8653 7.8653 7.8670 7.8670 11.3863 11.3863 11.4250 11.4250 16.4576 16.4576 16.6778 16.6778 17.9758 17.9758 k = 0.4531 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.6071 -9.6071 -9.6049 -9.6049 -9.2213 -9.2213 -9.2159 -9.2159 -7.6595 -7.6595 -7.6576 -7.6576 -7.2452 -7.2452 -7.2410 -7.2410 -5.4920 -5.4920 -5.4778 -5.4778 -5.3489 -5.3489 -5.3173 -5.3173 -4.4427 -4.4427 -4.4238 -4.4238 0.4926 0.4926 0.4980 0.4980 4.3407 4.3407 4.3757 4.3757 6.1155 6.1155 6.2689 6.2689 6.7577 6.7577 6.8918 6.8918 7.7284 7.7284 7.7287 7.7287 7.8694 7.8694 7.8706 7.8706 11.3745 11.3745 11.4037 11.4037 16.4954 16.4954 16.6621 16.6621 17.9999 17.9999 k = 0.4688 0.5000 0.7317 ( 3076 PWs) bands (ev): -9.5999 -9.5999 -9.5983 -9.5983 -9.2306 -9.2306 -9.2268 -9.2268 -7.6552 -7.6552 -7.6539 -7.6539 -7.2454 -7.2454 -7.2425 -7.2425 -5.4894 -5.4894 -5.4799 -5.4799 -5.3371 -5.3371 -5.3156 -5.3156 -4.4462 -4.4462 -4.4333 -4.4333 0.4860 0.4860 0.4896 0.4896 4.3455 4.3455 4.3685 4.3685 6.2085 6.2085 6.3469 6.3469 6.6833 6.6833 6.8086 6.8086 7.7320 7.7320 7.7320 7.7320 7.8723 7.8723 7.8731 7.8731 11.3674 11.3674 11.3870 11.3870 16.5306 16.5306 16.6424 16.6424 18.0280 18.0280 k = 0.4844 0.5000 0.7317 ( 3076 PWs) bands (ev): -9.5951 -9.5951 -9.5943 -9.5943 -9.2359 -9.2359 -9.2340 -9.2340 -7.6525 -7.6525 -7.6519 -7.6519 -7.2451 -7.2451 -7.2437 -7.2437 -5.4869 -5.4869 -5.4821 -5.4821 -5.3276 -5.3276 -5.3167 -5.3167 -4.4470 -4.4470 -4.4404 -4.4404 0.4823 0.4823 0.4841 0.4841 4.3506 4.3506 4.3620 4.3620 6.2956 6.2956 6.3902 6.3902 6.6408 6.6408 6.7288 6.7288 7.7341 7.7341 7.7341 7.7341 7.8741 7.8741 7.8745 7.8745 11.3652 11.3652 11.3750 11.3750 16.5631 16.5631 16.6192 16.6192 18.0594 18.0594 k = 0.5000 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.5933 -9.5933 -9.5933 -9.5933 -9.2371 -9.2371 -9.2371 -9.2371 -7.6514 -7.6514 -7.6514 -7.6514 -7.2446 -7.2446 -7.2446 -7.2446 -5.4845 -5.4845 -5.4845 -5.4845 -5.3207 -5.3207 -5.3207 -5.3207 -4.4451 -4.4451 -4.4451 -4.4451 0.4817 0.4817 0.4817 0.4817 4.3561 4.3561 4.3561 4.3561 6.3662 6.3662 6.3662 6.3662 6.6628 6.6628 6.6628 6.6628 7.7348 7.7348 7.7348 7.7348 7.8749 7.8749 7.8749 7.8749 11.3677 11.3677 11.3677 11.3677 16.5927 16.5927 16.5927 16.5927 18.0938 18.0938 k = 0.5000 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.5933 -9.5933 -9.5933 -9.5933 -9.2371 -9.2371 -9.2371 -9.2371 -7.6514 -7.6514 -7.6514 -7.6514 -7.2446 -7.2446 -7.2446 -7.2446 -5.4845 -5.4845 -5.4845 -5.4845 -5.3207 -5.3207 -5.3207 -5.3207 -4.4451 -4.4451 -4.4451 -4.4451 0.4817 0.4817 0.4817 0.4817 4.3561 4.3561 4.3561 4.3561 6.3662 6.3662 6.3662 6.3662 6.6628 6.6628 6.6628 6.6628 7.7348 7.7348 7.7348 7.7348 7.8749 7.8749 7.8749 7.8749 11.3677 11.3677 11.3677 11.3677 16.5927 16.5927 16.5927 16.5927 18.0938 18.0938 k = 0.4889 0.4889 0.7317 ( 3076 PWs) bands (ev): -9.5963 -9.5963 -9.5932 -9.5932 -9.2373 -9.2373 -9.2326 -9.2326 -7.6530 -7.6530 -7.6514 -7.6514 -7.2452 -7.2452 -7.2437 -7.2437 -5.4869 -5.4869 -5.4821 -5.4821 -5.3278 -5.3278 -5.3165 -5.3165 -4.4473 -4.4473 -4.4401 -4.4401 0.4820 0.4820 0.4845 0.4845 4.3506 4.3506 4.3620 4.3620 6.2891 6.2891 6.4012 6.4012 6.6297 6.6297 6.7353 6.7353 7.7338 7.7338 7.7344 7.7344 7.8740 7.8740 7.8746 7.8746 11.3651 11.3651 11.3751 11.3751 16.5627 16.5627 16.6196 16.6196 18.0592 18.0592 k = 0.4778 0.4778 0.7317 ( 3080 PWs) bands (ev): -9.6050 -9.6050 -9.5931 -9.5931 -9.2374 -9.2374 -9.2201 -9.2201 -7.6576 -7.6576 -7.6516 -7.6516 -7.2455 -7.2455 -7.2423 -7.2423 -5.4895 -5.4895 -5.4799 -5.4799 -5.3385 -5.3385 -5.3142 -5.3142 -4.4482 -4.4482 -4.4313 -4.4313 0.4839 0.4839 0.4917 0.4917 4.3455 4.3455 4.3686 4.3686 6.1791 6.1791 6.4127 6.4127 6.6174 6.6174 6.8380 6.8380 7.7308 7.7308 7.7331 7.7331 7.8717 7.8717 7.8736 7.8736 11.3674 11.3674 11.3873 11.3873 16.5287 16.5287 16.6444 16.6444 18.0271 18.0271 k = 0.4667 0.4667 0.7317 ( 3074 PWs) bands (ev): -9.6181 -9.6181 -9.5929 -9.5929 -9.2375 -9.2375 -9.2006 -9.2006 -7.6652 -7.6652 -7.6520 -7.6520 -7.2456 -7.2456 -7.2406 -7.2406 -5.4920 -5.4920 -5.4778 -5.4778 -5.3530 -5.3530 -5.3130 -5.3130 -4.4485 -4.4485 -4.4183 -4.4183 0.4872 0.4872 0.5037 0.5037 4.3408 4.3408 4.3758 4.3758 6.0536 6.0536 6.4163 6.4163 6.6112 6.6112 6.9524 6.9524 7.7259 7.7259 7.7309 7.7309 7.8679 7.8679 7.8720 7.8720 11.3743 11.3743 11.4043 11.4043 16.4899 16.4899 16.6682 16.6682 17.9974 17.9974 k = 0.4556 0.4556 0.7317 ( 3068 PWs) bands (ev): -9.6345 -9.6345 -9.5926 -9.5926 -9.2377 -9.2377 -9.1754 -9.1754 -7.6758 -7.6758 -7.6525 -7.6525 -7.2457 -7.2457 -7.2383 -7.2383 -5.4946 -5.4946 -5.4760 -5.4760 -5.3711 -5.3711 -5.3125 -5.3125 -4.4485 -4.4485 -4.4014 -4.4014 0.4917 0.4917 0.5203 0.5203 4.3364 4.3364 4.3836 4.3836 5.9214 5.9214 6.4171 6.4171 6.6061 6.6061 7.0695 7.0695 7.7191 7.7191 7.7278 7.7278 7.8626 7.8626 7.8697 7.8697 11.3859 11.3859 11.4263 11.4263 16.4461 16.4461 16.6920 16.6920 17.9701 17.9701 k = 0.4444 0.4444 0.7317 ( 3072 PWs) bands (ev): -9.6528 -9.6528 -9.5923 -9.5923 -9.2379 -9.2379 -9.1456 -9.1456 -7.6892 -7.6892 -7.6531 -7.6531 -7.2456 -7.2456 -7.2357 -7.2357 -5.4972 -5.4972 -5.4748 -5.4748 -5.3920 -5.3920 -5.3125 -5.3125 -4.4485 -4.4485 -4.3813 -4.3813 0.4975 0.4975 0.5414 0.5414 4.3320 4.3320 4.3921 4.3921 5.7866 5.7866 6.4166 6.4166 6.6009 6.6009 7.1851 7.1851 7.7107 7.7107 7.7239 7.7239 7.8558 7.8558 7.8668 7.8668 11.4019 11.4019 11.4532 11.4532 16.3971 16.3971 16.7163 16.7163 17.9447 17.9447 k = 0.4333 0.4333 0.7317 ( 3076 PWs) bands (ev): -9.6723 -9.6723 -9.5919 -9.5919 -9.2381 -9.2381 -9.1123 -9.1123 -7.7054 -7.7054 -7.6539 -7.6539 -7.2456 -7.2456 -7.2328 -7.2328 -5.4998 -5.4998 -5.4745 -5.4745 -5.4146 -5.4146 -5.3127 -5.3127 -4.4483 -4.4483 -4.3586 -4.3586 0.5046 0.5046 0.5671 0.5671 4.3275 4.3275 4.4014 4.4014 5.6512 5.6512 6.4154 6.4154 6.5951 6.5951 7.2969 7.2969 7.7008 7.7008 7.7191 7.7191 7.8476 7.8476 7.8632 7.8632 11.4220 11.4220 11.4850 11.4850 16.3432 16.3432 16.7419 16.7419 17.9211 17.9211 k = 0.4222 0.4222 0.7317 ( 3076 PWs) bands (ev): -9.6922 -9.6922 -9.5914 -9.5914 -9.2384 -9.2384 -9.0762 -9.0762 -7.7241 -7.7241 -7.6548 -7.6548 -7.2454 -7.2454 -7.2297 -7.2297 -5.5024 -5.5024 -5.4773 -5.4773 -5.4361 -5.4361 -5.3131 -5.3131 -4.4481 -4.4481 -4.3343 -4.3343 0.5128 0.5128 0.5970 0.5970 4.3226 4.3226 4.4114 4.4114 5.5167 5.5167 6.4137 6.4137 6.5884 6.5884 7.4037 7.4037 7.6898 7.6898 7.7135 7.7135 7.8381 7.8381 7.8591 7.8591 11.4461 11.4461 11.5219 11.5219 16.2849 16.2849 16.7690 16.7690 17.8989 17.8989 k = 0.4111 0.4111 0.7317 ( 3080 PWs) bands (ev): -9.7119 -9.7119 -9.5909 -9.5909 -9.2388 -9.2388 -9.0380 -9.0380 -7.7454 -7.7454 -7.6559 -7.6559 -7.2453 -7.2453 -7.2264 -7.2264 -5.5051 -5.5051 -5.4884 -5.4884 -5.4504 -5.4504 -5.3137 -5.3137 -4.4478 -4.4478 -4.3089 -4.3089 0.5222 0.5222 0.6311 0.6311 4.3171 4.3171 4.4221 4.4221 5.3843 5.3843 6.4115 6.4115 6.5809 6.5809 7.5039 7.5039 7.6782 7.6782 7.7072 7.7072 7.8272 7.8272 7.8545 7.8545 11.4738 11.4738 11.5639 11.5639 16.2228 16.2228 16.7978 16.7978 17.8779 17.8779 k = 0.4000 0.4000 0.7317 ( 3080 PWs) bands (ev): -9.7311 -9.7311 -9.5903 -9.5903 -9.2392 -9.2392 -8.9979 -8.9979 -7.7690 -7.7690 -7.6570 -7.6570 -7.2451 -7.2451 -7.2231 -7.2231 -5.5118 -5.5118 -5.5054 -5.5054 -5.4552 -5.4552 -5.3145 -5.3145 -4.4475 -4.4475 -4.2832 -4.2832 0.5327 0.5327 0.6691 0.6691 4.3104 4.3104 4.4336 4.4336 5.2554 5.2554 6.4088 6.4088 6.5724 6.5724 7.5945 7.5945 7.6683 7.6683 7.7003 7.7003 7.8151 7.8151 7.8494 7.8494 11.5045 11.5045 11.6109 11.6109 16.1575 16.1575 16.8284 16.8284 17.8580 17.8580 k = 0.3889 0.3889 0.7317 ( 3088 PWs) bands (ev): -9.7495 -9.7495 -9.5897 -9.5897 -9.2396 -9.2396 -8.9565 -8.9565 -7.7949 -7.7949 -7.6583 -7.6583 -7.2448 -7.2448 -7.2198 -7.2198 -5.5359 -5.5359 -5.5091 -5.5091 -5.4560 -5.4560 -5.3153 -5.3153 -4.4472 -4.4472 -4.2576 -4.2576 0.5443 0.5443 0.7107 0.7107 4.3017 4.3017 4.4458 4.4458 5.1313 5.1313 6.4057 6.4057 6.5630 6.5630 7.6399 7.6399 7.6852 7.6852 7.7027 7.7027 7.8019 7.8019 7.8440 7.8440 11.5380 11.5380 11.6630 11.6630 16.0899 16.0899 16.8607 16.8607 17.8389 17.8389 k = 0.3778 0.3778 0.7317 ( 3084 PWs) bands (ev): -9.7670 -9.7670 -9.5889 -9.5889 -9.2400 -9.2400 -8.9140 -8.9140 -7.8228 -7.8228 -7.6597 -7.6597 -7.2446 -7.2446 -7.2165 -7.2165 -5.5620 -5.5620 -5.5115 -5.5115 -5.4556 -5.4556 -5.3164 -5.3164 -4.4469 -4.4469 -4.2327 -4.2327 0.5568 0.5568 0.7556 0.7556 4.2901 4.2901 4.4587 4.4587 5.0138 5.0138 6.4020 6.4020 6.5525 6.5525 7.6313 7.6313 7.6814 7.6814 7.7680 7.7680 7.7894 7.7894 7.8392 7.8392 11.5737 11.5737 11.7199 11.7199 16.0207 16.0207 16.8944 16.8944 17.8209 17.8209 k = 0.3667 0.3667 0.7317 ( 3084 PWs) bands (ev): -9.7833 -9.7833 -9.5882 -9.5882 -9.2406 -9.2406 -8.8708 -8.8708 -7.8527 -7.8527 -7.6612 -7.6612 -7.2443 -7.2443 -7.2134 -7.2134 -5.5877 -5.5877 -5.5138 -5.5138 -5.4547 -5.4547 -5.3175 -5.3175 -4.4465 -4.4465 -4.2089 -4.2089 0.5703 0.5703 0.8034 0.8034 4.2739 4.2739 4.4722 4.4722 4.9052 4.9052 6.3978 6.3978 6.5412 6.5412 7.6181 7.6181 7.6721 7.6721 7.7708 7.7708 7.8212 7.8212 7.8523 7.8523 11.6111 11.6111 11.7813 11.7813 15.9509 15.9509 16.9294 16.9294 17.8038 17.8038 k = 0.3556 0.3556 0.7317 ( 3084 PWs) bands (ev): -9.7984 -9.7984 -9.5874 -9.5874 -9.2411 -9.2411 -8.8270 -8.8270 -7.8843 -7.8843 -7.6627 -7.6627 -7.2440 -7.2440 -7.2104 -7.2104 -5.6123 -5.6123 -5.5159 -5.5159 -5.4538 -5.4538 -5.3187 -5.3187 -4.4460 -4.4460 -4.1864 -4.1864 0.5846 0.5846 0.8536 0.8536 4.2510 4.2510 4.4863 4.4863 4.8085 4.8085 6.3930 6.3930 6.5289 6.5289 7.6044 7.6044 7.6618 7.6618 7.7548 7.7548 7.8200 7.8200 7.9081 7.9081 11.6500 11.6500 11.8468 11.8468 15.8813 15.8813 16.9653 16.9653 17.7879 17.7879 k = 0.3444 0.3444 0.7317 ( 3082 PWs) bands (ev): -9.8121 -9.8121 -9.5865 -9.5865 -9.2417 -9.2417 -8.7830 -8.7830 -7.9174 -7.9174 -7.6643 -7.6643 -7.2437 -7.2437 -7.2077 -7.2077 -5.6355 -5.6355 -5.5178 -5.5178 -5.4528 -5.4528 -5.3201 -5.3201 -4.4456 -4.4456 -4.1657 -4.1657 0.5997 0.5997 0.9056 0.9056 4.2190 4.2190 4.5006 4.5006 4.7270 4.7270 6.3872 6.3872 6.5160 6.5160 7.5910 7.5910 7.6507 7.6507 7.7375 7.7375 7.8133 7.8133 7.9610 7.9610 11.6897 11.6897 11.9156 11.9156 15.8129 15.8129 17.0015 17.0015 17.7734 17.7734 k = 0.3333 0.3333 0.7317 ( 3086 PWs) bands (ev): -9.8244 -9.8244 -9.5856 -9.5856 -9.2423 -9.2423 -8.7391 -8.7391 -7.9517 -7.9517 -7.6660 -7.6660 -7.2434 -7.2434 -7.2052 -7.2052 -5.6567 -5.6567 -5.5196 -5.5196 -5.4519 -5.4519 -5.3216 -5.3216 -4.4452 -4.4452 -4.1468 -4.1468 0.6155 0.6155 0.9589 0.9589 4.1761 4.1761 4.5148 4.5148 4.6637 4.6637 6.3803 6.3803 6.5025 6.5025 7.5781 7.5781 7.6389 7.6389 7.7195 7.7195 7.8056 7.8056 8.0058 8.0058 11.7301 11.7301 11.9870 11.9870 15.7468 15.7468 17.0376 17.0376 17.7607 17.7607 k = 0.3222 0.3222 0.7317 ( 3082 PWs) bands (ev): -9.8352 -9.8352 -9.5847 -9.5847 -9.2429 -9.2429 -8.6957 -8.6957 -7.9870 -7.9870 -7.6678 -7.6678 -7.2431 -7.2431 -7.2029 -7.2029 -5.6759 -5.6759 -5.5213 -5.5213 -5.4510 -5.4510 -5.3232 -5.3232 -4.4447 -4.4447 -4.1301 -4.1301 0.6318 0.6318 1.0127 1.0127 4.1228 4.1228 4.5278 4.5278 4.6201 4.6201 6.3720 6.3720 6.4888 6.4888 7.5660 7.5660 7.6264 7.6264 7.7008 7.7008 7.7974 7.7974 8.0421 8.0421 11.7707 11.7707 12.0599 12.0599 15.6840 15.6840 17.0729 17.0729 17.7501 17.7501 k = 0.3111 0.3111 0.7317 ( 3078 PWs) bands (ev): -9.8445 -9.8445 -9.5837 -9.5837 -9.2436 -9.2436 -8.6534 -8.6534 -8.0225 -8.0225 -7.6696 -7.6696 -7.2428 -7.2428 -7.2009 -7.2009 -5.6928 -5.6928 -5.5228 -5.5228 -5.4503 -5.4503 -5.3249 -5.3249 -4.4442 -4.4442 -4.1156 -4.1156 0.6487 0.6487 1.0661 1.0661 4.0621 4.0621 4.5367 4.5367 4.5969 4.5969 6.3618 6.3618 6.4753 6.4753 7.5550 7.5550 7.6132 7.6132 7.6814 7.6814 7.7889 7.7889 8.0696 8.0696 11.8112 11.8112 12.1332 12.1332 15.6258 15.6258 17.1066 17.1066 17.7422 17.7422 k = 0.3000 0.3000 0.7317 ( 3070 PWs) bands (ev): -9.8523 -9.8523 -9.5827 -9.5827 -9.2443 -9.2443 -8.6128 -8.6128 -8.0577 -8.0577 -7.6714 -7.6714 -7.2425 -7.2425 -7.1992 -7.1992 -5.7073 -5.7073 -5.5242 -5.5242 -5.4497 -5.4497 -5.3267 -5.3267 -4.4437 -4.4437 -4.1035 -4.1035 0.6660 0.6660 1.1182 1.1182 3.9986 3.9986 4.5379 4.5379 4.5942 4.5942 6.3492 6.3492 6.4626 6.4626 7.5451 7.5451 7.5995 7.5995 7.6616 7.6616 7.7801 7.7801 8.0885 8.0885 11.8512 11.8512 12.2055 12.2055 15.5733 15.5733 17.1379 17.1379 17.7376 17.7376 k = 0.2889 0.2889 0.7317 ( 3074 PWs) bands (ev): -9.8585 -9.8585 -9.5817 -9.5817 -9.2450 -9.2450 -8.5752 -8.5752 -8.0915 -8.0915 -7.6733 -7.6733 -7.2422 -7.2422 -7.1978 -7.1978 -5.7192 -5.7192 -5.5254 -5.5254 -5.4492 -5.4492 -5.3286 -5.3286 -4.4432 -4.4432 -4.0939 -4.0939 0.6837 0.6837 1.1680 1.1680 3.9367 3.9367 4.5357 4.5357 4.6046 4.6046 6.3337 6.3337 6.4510 6.4510 7.5366 7.5366 7.5853 7.5853 7.6414 7.6414 7.7711 7.7711 8.0989 8.0989 11.8906 11.8906 12.2755 12.2755 15.5280 15.5280 17.1659 17.1659 17.7368 17.7368 k = 0.2778 0.2778 0.7317 ( 3066 PWs) bands (ev): -9.8631 -9.8631 -9.5806 -9.5806 -9.2457 -9.2457 -8.5420 -8.5420 -8.1223 -8.1223 -7.6752 -7.6752 -7.2419 -7.2419 -7.1966 -7.1966 -5.7286 -5.7286 -5.5264 -5.5264 -5.4489 -5.4489 -5.3306 -5.3306 -4.4427 -4.4427 -4.0868 -4.0868 0.7016 0.7016 1.2143 1.2143 3.8801 3.8801 4.5352 4.5352 4.6201 4.6201 6.3152 6.3152 6.4408 6.4408 7.5294 7.5294 7.5706 7.5706 7.6209 7.6209 7.7620 7.7620 8.1009 8.1009 11.9290 11.9290 12.3417 12.3417 15.4910 15.4910 17.1899 17.1899 17.7402 17.7402 k = 0.2667 0.2667 0.7317 ( 3066 PWs) bands (ev): -9.8660 -9.8660 -9.5795 -9.5795 -9.2465 -9.2465 -8.5157 -8.5157 -8.1476 -8.1476 -7.6771 -7.6771 -7.2415 -7.2415 -7.1958 -7.1958 -5.7352 -5.7352 -5.5272 -5.5272 -5.4487 -5.4487 -5.3326 -5.3326 -4.4421 -4.4421 -4.0823 -4.0823 0.7196 0.7196 1.2559 1.2559 3.8315 3.8315 4.5380 4.5380 4.6376 4.6376 6.2936 6.2936 6.4321 6.4321 7.5236 7.5236 7.5556 7.5556 7.6002 7.6002 7.7527 7.7527 8.0948 8.0948 11.9662 11.9662 12.4027 12.4027 15.4638 15.4638 17.2092 17.2092 17.7483 17.7483 k = 0.2556 0.2556 0.7317 ( 3068 PWs) bands (ev): -9.8673 -9.8673 -9.5785 -9.5785 -9.2472 -9.2472 -8.4997 -8.4997 -8.1641 -8.1641 -7.6789 -7.6789 -7.2412 -7.2412 -7.1952 -7.1952 -5.7391 -5.7391 -5.5279 -5.5279 -5.4487 -5.4487 -5.3347 -5.3347 -4.4416 -4.4416 -4.0804 -4.0804 0.7377 0.7377 1.2917 1.2917 3.7933 3.7933 4.5440 4.5440 4.6563 4.6563 6.2690 6.2690 6.4248 6.4248 7.5190 7.5190 7.5404 7.5404 7.5794 7.5794 7.7433 7.7433 8.0808 8.0808 12.0020 12.0020 12.4571 12.4571 15.4475 15.4475 17.2236 17.2236 17.7608 17.7608 k = 0.2444 0.2444 0.7317 ( 3070 PWs) bands (ev): -9.8670 -9.8670 -9.5774 -9.5774 -9.2480 -9.2480 -8.4968 -8.4968 -8.1689 -8.1689 -7.6808 -7.6808 -7.2409 -7.2409 -7.1949 -7.1949 -5.7403 -5.7403 -5.5283 -5.5283 -5.4488 -5.4488 -5.3369 -5.3369 -4.4411 -4.4411 -4.0811 -4.0811 0.7558 0.7558 1.3206 1.3206 3.7672 3.7672 4.5528 4.5528 4.6755 4.6755 6.2418 6.2418 6.4186 6.4186 7.5145 7.5145 7.5263 7.5263 7.5586 7.5586 7.7339 7.7339 8.0591 8.0591 12.0363 12.0363 12.5038 12.5038 15.4430 15.4430 17.2331 17.2331 17.7774 17.7774 k = 0.2333 0.2333 0.7317 ( 3070 PWs) bands (ev): -9.8650 -9.8650 -9.5763 -9.5763 -9.2488 -9.2488 -8.5081 -8.5081 -8.1610 -8.1610 -7.6826 -7.6826 -7.2406 -7.2406 -7.1950 -7.1950 -5.7387 -5.7387 -5.5286 -5.5286 -5.4491 -5.4491 -5.3391 -5.3391 -4.4406 -4.4406 -4.0844 -4.0844 0.7737 0.7737 1.3420 1.3420 3.7543 3.7543 4.5643 4.5643 4.6951 4.6951 6.2123 6.2123 6.4134 6.4134 7.5045 7.5045 7.5187 7.5187 7.5380 7.5380 7.7244 7.7244 8.0299 8.0299 12.0689 12.0689 12.5420 12.5420 15.4510 15.4510 17.2382 17.2382 17.7973 17.7973 k = 0.2222 0.2222 0.7317 ( 3062 PWs) bands (ev): -9.8614 -9.8614 -9.5753 -9.5753 -9.2496 -9.2496 -8.5313 -8.5313 -8.1426 -8.1426 -7.6844 -7.6844 -7.2403 -7.2403 -7.1953 -7.1953 -5.7345 -5.7345 -5.5286 -5.5286 -5.4496 -5.4496 -5.3413 -5.3413 -4.4401 -4.4401 -4.0902 -4.0902 0.7914 0.7914 1.3553 1.3553 3.7553 3.7553 4.5782 4.5782 4.7149 4.7149 6.1807 6.1807 6.4089 6.4089 7.4892 7.4892 7.5151 7.5151 7.5201 7.5201 7.7148 7.7148 7.9936 7.9936 12.0997 12.0997 12.5710 12.5710 15.4719 15.4719 17.2394 17.2394 17.8195 17.8195 k = 0.2111 0.2111 0.7317 ( 3058 PWs) bands (ev): -9.8562 -9.8562 -9.5742 -9.5742 -9.2503 -9.2503 -8.5630 -8.5630 -8.1171 -8.1171 -7.6862 -7.6862 -7.2400 -7.2400 -7.1959 -7.1959 -5.7277 -5.7277 -5.5284 -5.5284 -5.4502 -5.4502 -5.3436 -5.3436 -4.4396 -4.4396 -4.0985 -4.0985 0.8087 0.8087 1.3604 1.3604 3.7705 3.7705 4.5945 4.5945 4.7347 4.7347 6.1474 6.1474 6.4051 6.4051 7.4730 7.4730 7.4966 7.4966 7.5194 7.5194 7.7052 7.7052 7.9504 7.9504 12.1285 12.1285 12.5909 12.5909 15.5055 15.5055 17.2375 17.2375 17.8430 17.8430 k = 0.2000 0.2000 0.7317 ( 3060 PWs) bands (ev): -9.8493 -9.8493 -9.5732 -9.5732 -9.2511 -9.2511 -8.6005 -8.6005 -8.0874 -8.0874 -7.6879 -7.6879 -7.2397 -7.2397 -7.1967 -7.1967 -5.7183 -5.7183 -5.5281 -5.5281 -5.4510 -5.4510 -5.3458 -5.3458 -4.4391 -4.4391 -4.1091 -4.1091 0.8257 0.8257 1.3576 1.3576 3.7993 3.7993 4.6133 4.6133 4.7543 4.7543 6.1125 6.1125 6.4018 6.4018 7.4564 7.4564 7.4768 7.4768 7.5218 7.5218 7.6954 7.6954 7.9008 7.9008 12.1553 12.1553 12.6020 12.6020 15.5513 15.5513 17.2330 17.2330 17.8668 17.8668 k = 0.1889 0.1889 0.7317 ( 3056 PWs) bands (ev): -9.8408 -9.8408 -9.5721 -9.5721 -9.2519 -9.2519 -8.6415 -8.6415 -8.0555 -8.0555 -7.6896 -7.6896 -7.2395 -7.2395 -7.1978 -7.1978 -5.7064 -5.7064 -5.5275 -5.5275 -5.4521 -5.4521 -5.3480 -5.3480 -4.4386 -4.4386 -4.1221 -4.1221 0.8422 0.8422 1.3477 1.3477 3.8412 3.8412 4.6345 4.6345 4.7737 4.7737 6.0764 6.0764 6.3989 6.3989 7.4396 7.4396 7.4574 7.4574 7.5254 7.5254 7.6851 7.6851 7.8454 7.8454 12.1802 12.1802 12.6050 12.6050 15.6085 15.6085 17.2268 17.2268 17.8900 17.8900 k = 0.1778 0.1778 0.7317 ( 3048 PWs) bands (ev): -9.8307 -9.8307 -9.5711 -9.5711 -9.2526 -9.2526 -8.6847 -8.6847 -8.0228 -8.0228 -7.6912 -7.6912 -7.2392 -7.2392 -7.1992 -7.1992 -5.6922 -5.6922 -5.5267 -5.5267 -5.4532 -5.4532 -5.3502 -5.3502 -4.4381 -4.4381 -4.1372 -4.1372 0.8581 0.8581 1.3315 1.3315 3.8947 3.8947 4.6584 4.6584 4.7927 4.7927 6.0392 6.0392 6.3964 6.3964 7.4228 7.4228 7.4386 7.4386 7.5300 7.5300 7.6729 7.6729 7.7859 7.7859 12.2030 12.2030 12.6008 12.6008 15.6757 15.6757 17.2191 17.2191 17.9120 17.9120 k = 0.1667 0.1667 0.7317 ( 3052 PWs) bands (ev): -9.8191 -9.8191 -9.5702 -9.5702 -9.2534 -9.2534 -8.7293 -8.7293 -7.9901 -7.9901 -7.6927 -7.6927 -7.2389 -7.2389 -7.2008 -7.2008 -5.6759 -5.6759 -5.5257 -5.5257 -5.4546 -5.4546 -5.3523 -5.3523 -4.4377 -4.4377 -4.1543 -4.1543 0.8733 0.8733 1.3102 1.3102 3.9585 3.9585 4.6851 4.6851 4.8111 4.8111 6.0011 6.0011 6.3942 6.3942 7.4059 7.4059 7.4203 7.4203 7.5350 7.5350 7.6538 7.6538 7.7280 7.7280 12.2237 12.2237 12.5905 12.5905 15.7517 15.7517 17.2105 17.2105 17.9323 17.9323 k = 0.1556 0.1556 0.7317 ( 3056 PWs) bands (ev): -9.8059 -9.8059 -9.5693 -9.5693 -9.2541 -9.2541 -8.7746 -8.7746 -7.9582 -7.9582 -7.6942 -7.6942 -7.2387 -7.2387 -7.2026 -7.2026 -5.6576 -5.6576 -5.5245 -5.5245 -5.4561 -5.4561 -5.3543 -5.3543 -4.4373 -4.4373 -4.1733 -4.1733 0.8879 0.8879 1.2849 1.2849 4.0307 4.0307 4.7151 4.7151 4.8289 4.8289 5.9624 5.9624 6.3924 6.3924 7.3888 7.3888 7.4028 7.4028 7.5397 7.5397 7.6120 7.6120 7.6889 7.6889 12.2426 12.2426 12.5753 12.5753 15.8349 15.8349 17.2012 17.2012 17.9506 17.9506 k = 0.1444 0.1444 0.7317 ( 3056 PWs) bands (ev): -9.7912 -9.7912 -9.5684 -9.5684 -9.2547 -9.2547 -8.8202 -8.8202 -7.9273 -7.9273 -7.6955 -7.6955 -7.2384 -7.2384 -7.2046 -7.2046 -5.6376 -5.6376 -5.5230 -5.5230 -5.4578 -5.4578 -5.3563 -5.3563 -4.4369 -4.4369 -4.1938 -4.1938 0.9016 0.9016 1.2569 1.2569 4.1095 4.1095 4.7488 4.7488 4.8457 4.8457 5.9234 5.9234 6.3908 6.3908 7.3708 7.3708 7.3861 7.3861 7.5296 7.5296 7.5602 7.5602 7.6712 7.6712 12.2594 12.2594 12.5566 12.5566 15.9238 15.9238 17.1915 17.1915 17.9668 17.9668 k = 0.1333 0.1333 0.7317 ( 3060 PWs) bands (ev): -9.7751 -9.7751 -9.5676 -9.5676 -9.2554 -9.2554 -8.8656 -8.8656 -7.8978 -7.8978 -7.6968 -7.6968 -7.2382 -7.2382 -7.2068 -7.2068 -5.6162 -5.6162 -5.5213 -5.5213 -5.4597 -5.4597 -5.3582 -5.3582 -4.4365 -4.4365 -4.2157 -4.2157 0.9146 0.9146 1.2272 1.2272 4.1927 4.1927 4.7869 4.7869 4.8615 4.8615 5.8843 5.8843 6.3894 6.3894 7.3498 7.3498 7.3703 7.3703 7.4613 7.4613 7.5586 7.5586 7.6606 7.6606 12.2745 12.2745 12.5353 12.5353 16.0168 16.0168 17.1815 17.1815 17.9810 17.9810 k = 0.1222 0.1222 0.7317 ( 3064 PWs) bands (ev): -9.7577 -9.7577 -9.5668 -9.5668 -9.2560 -9.2560 -8.9107 -8.9107 -7.8699 -7.8699 -7.6980 -7.6980 -7.2379 -7.2379 -7.2091 -7.2091 -5.5938 -5.5938 -5.5192 -5.5192 -5.4617 -5.4617 -5.3599 -5.3599 -4.4361 -4.4361 -4.2386 -4.2386 0.9267 0.9267 1.1968 1.1968 4.2779 4.2779 4.8304 4.8304 4.8760 4.8760 5.8455 5.8455 6.3883 6.3883 7.3151 7.3151 7.3554 7.3554 7.3933 7.3933 7.5646 7.5646 7.6524 7.6524 12.2878 12.2878 12.5125 12.5125 16.1124 16.1124 17.1713 17.1713 17.9935 17.9935 k = 0.1111 0.1111 0.7317 ( 3064 PWs) bands (ev): -9.7389 -9.7389 -9.5660 -9.5660 -9.2566 -9.2566 -8.9550 -8.9550 -7.8439 -7.8439 -7.6992 -7.6992 -7.2377 -7.2377 -7.2116 -7.2116 -5.5708 -5.5708 -5.5168 -5.5168 -5.4637 -5.4637 -5.3616 -5.3616 -4.4358 -4.4358 -4.2623 -4.2623 0.9379 0.9379 1.1666 1.1666 4.3625 4.3625 4.8803 4.8803 4.8891 4.8891 5.8072 5.8072 6.3874 6.3874 7.2461 7.2461 7.3414 7.3414 7.3548 7.3548 7.5714 7.5714 7.6454 7.6454 12.2994 12.2994 12.4891 12.4891 16.2092 16.2092 17.1607 17.1607 18.0044 18.0044 k = 0.1000 0.1000 0.7317 ( 3068 PWs) bands (ev): -9.7191 -9.7191 -9.5654 -9.5654 -9.2571 -9.2571 -8.9985 -8.9985 -7.8198 -7.8198 -7.7002 -7.7002 -7.2374 -7.2374 -7.2140 -7.2140 -5.5484 -5.5484 -5.5133 -5.5133 -5.4657 -5.4657 -5.3632 -5.3632 -4.4355 -4.4355 -4.2862 -4.2862 0.9481 0.9481 1.1374 1.1374 4.4440 4.4440 4.9002 4.9002 4.9383 4.9383 5.7699 5.7699 6.3867 6.3867 7.1554 7.1554 7.3285 7.3285 7.3349 7.3349 7.5781 7.5781 7.6392 7.6392 12.3095 12.3095 12.4660 12.4660 16.3057 16.3057 17.1498 17.1498 18.0142 18.0142 k = 0.0889 0.0889 0.7317 ( 3076 PWs) bands (ev): -9.6982 -9.6982 -9.5648 -9.5648 -9.2576 -9.2576 -9.0406 -9.0406 -7.7979 -7.7979 -7.7011 -7.7011 -7.2371 -7.2371 -7.2166 -7.2166 -5.5291 -5.5291 -5.5070 -5.5070 -5.4674 -5.4674 -5.3647 -5.3647 -4.4352 -4.4352 -4.3100 -4.3100 0.9573 0.9573 1.1097 1.1097 4.5197 4.5197 4.9094 4.9094 5.0050 5.0050 5.7340 5.7340 6.3861 6.3861 7.0569 7.0569 7.3168 7.3168 7.3205 7.3205 7.5847 7.5847 7.6338 7.6338 12.3181 12.3181 12.4438 12.4438 16.4006 16.4006 17.1384 17.1384 18.0232 18.0232 k = 0.0778 0.0778 0.7317 ( 3076 PWs) bands (ev): -9.6767 -9.6767 -9.5642 -9.5642 -9.2580 -9.2580 -9.0812 -9.0812 -7.7783 -7.7783 -7.7020 -7.7020 -7.2368 -7.2368 -7.2190 -7.2190 -5.5182 -5.5182 -5.4942 -5.4942 -5.4677 -5.4677 -5.3662 -5.3662 -4.4349 -4.4349 -4.3332 -4.3332 0.9655 0.9655 1.0842 1.0842 4.5880 4.5880 4.9164 4.9164 5.0805 5.0805 5.7000 5.7000 6.3857 6.3857 6.9551 6.9551 7.3062 7.3062 7.3087 7.3087 7.5908 7.5908 7.6290 7.6290 12.3254 12.3254 12.4231 12.4231 16.4925 16.4925 17.1261 17.1261 18.0315 18.0315 k = 0.0667 0.0667 0.7317 ( 3060 PWs) bands (ev): -9.6547 -9.6547 -9.5637 -9.5637 -9.2584 -9.2584 -9.1198 -9.1198 -7.7610 -7.7610 -7.7027 -7.7027 -7.2364 -7.2364 -7.2214 -7.2214 -5.5131 -5.5131 -5.4832 -5.4832 -5.4615 -5.4615 -5.3676 -5.3676 -4.4347 -4.4347 -4.3551 -4.3551 0.9726 0.9726 1.0613 1.0613 4.6482 4.6482 4.9208 4.9208 5.1637 5.1637 5.6684 5.6684 6.3854 6.3854 6.8519 6.8519 7.2970 7.2970 7.2987 7.2987 7.5964 7.5964 7.6249 7.6249 12.3315 12.3315 12.4043 12.4043 16.5803 16.5803 17.1126 17.1126 18.0395 18.0395 k = 0.0556 0.0556 0.7317 ( 3062 PWs) bands (ev): -9.6329 -9.6329 -9.5633 -9.5633 -9.2587 -9.2587 -9.1558 -9.1558 -7.7462 -7.7462 -7.7034 -7.7034 -7.2360 -7.2360 -7.2237 -7.2237 -5.5096 -5.5096 -5.4817 -5.4817 -5.4458 -5.4458 -5.3690 -5.3690 -4.4344 -4.4344 -4.3753 -4.3753 0.9787 0.9787 1.0414 1.0414 4.7007 4.7007 4.9221 4.9221 5.2519 5.2519 5.6400 5.6400 6.3852 6.3852 6.7497 6.7497 7.2890 7.2890 7.2902 7.2902 7.6013 7.6013 7.6214 7.6214 12.3365 12.3365 12.3878 12.3878 16.6626 16.6626 17.0973 17.0973 18.0474 18.0474 k = 0.0444 0.0444 0.7317 ( 3066 PWs) bands (ev): -9.6119 -9.6119 -9.5630 -9.5630 -9.2590 -9.2590 -9.1885 -9.1885 -7.7338 -7.7338 -7.7041 -7.7041 -7.2355 -7.2355 -7.2259 -7.2259 -5.5064 -5.5064 -5.4833 -5.4833 -5.4288 -5.4288 -5.3706 -5.3706 -4.4342 -4.4342 -4.3930 -4.3930 0.9837 0.9837 1.0247 1.0247 4.7461 4.7461 4.9201 4.9201 5.3410 5.3410 5.6153 5.6153 6.3852 6.3852 6.6511 6.6511 7.2824 7.2824 7.2833 7.2833 7.6055 7.6055 7.6186 7.6186 12.3404 12.3404 12.3740 12.3740 16.7385 16.7385 17.0795 17.0795 18.0552 18.0552 k = 0.0333 0.0333 0.7317 ( 3062 PWs) bands (ev): -9.5927 -9.5927 -9.5627 -9.5627 -9.2592 -9.2592 -9.2168 -9.2168 -7.7240 -7.7240 -7.7047 -7.7047 -7.2349 -7.2349 -7.2278 -7.2278 -5.5034 -5.5034 -5.4858 -5.4858 -5.4134 -5.4134 -5.3725 -5.3725 -4.4339 -4.4339 -4.4078 -4.4078 0.9876 0.9876 1.0115 1.0115 4.7854 4.7854 4.9143 4.9143 5.4256 5.4256 5.5952 5.5952 6.3855 6.3855 6.5602 6.5602 7.2773 7.2773 7.2778 7.2778 7.6089 7.6089 7.6163 7.6163 12.3434 12.3434 12.3630 12.3630 16.8070 16.8070 17.0584 17.0584 18.0633 18.0633 k = 0.0222 0.0222 0.7317 ( 3062 PWs) bands (ev): -9.5769 -9.5769 -9.5625 -9.5625 -9.2593 -9.2593 -9.2391 -9.2391 -7.7166 -7.7166 -7.7055 -7.7055 -7.2342 -7.2342 -7.2295 -7.2295 -5.5004 -5.5004 -5.4885 -5.4885 -5.4006 -5.4006 -5.3749 -5.3749 -4.4335 -4.4335 -4.4190 -4.4190 0.9904 0.9904 1.0019 1.0019 4.8191 4.8191 4.9044 4.9044 5.4981 5.4981 5.5802 5.5802 6.3864 6.3864 6.4833 6.4833 7.2736 7.2736 7.2739 7.2739 7.6113 7.6113 7.6147 7.6147 12.3455 12.3455 12.3550 12.3550 16.8677 16.8677 17.0330 17.0330 18.0717 18.0717 k = 0.0111 0.0111 0.7317 ( 3050 PWs) bands (ev): -9.5663 -9.5663 -9.5624 -9.5624 -9.2594 -9.2594 -9.2537 -9.2537 -7.7115 -7.7115 -7.7065 -7.7065 -7.2333 -7.2333 -7.2310 -7.2310 -5.4974 -5.4974 -5.4914 -5.4914 -5.3907 -5.3907 -5.3784 -5.3784 -4.4326 -4.4326 -4.4265 -4.4265 0.9922 0.9922 0.9960 0.9960 4.8477 4.8477 4.8902 4.8902 5.5488 5.5488 5.5710 5.5710 6.3892 6.3892 6.4280 6.4280 7.2714 7.2714 7.2716 7.2716 7.6128 7.6128 7.6138 7.6138 12.3468 12.3468 12.3501 12.3501 16.9202 16.9202 17.0021 17.0021 18.0806 18.0806 k = 0.0000 0.0000 0.7317 ( 3046 PWs) bands (ev): -9.5625 -9.5625 -9.5625 -9.5625 -9.2591 -9.2591 -9.2591 -9.2591 -7.7084 -7.7084 -7.7084 -7.7084 -7.2323 -7.2323 -7.2323 -7.2323 -5.4944 -5.4944 -5.4944 -5.4944 -5.3835 -5.3835 -5.3835 -5.3835 -4.4307 -4.4307 -4.4307 -4.4307 0.9934 0.9934 0.9934 0.9934 4.8713 4.8713 4.8713 4.8713 5.5676 5.5676 5.5676 5.5676 6.3991 6.3991 6.3991 6.3991 7.2707 7.2707 7.2707 7.2707 7.6134 7.6134 7.6134 7.6134 12.3478 12.3478 12.3478 12.3478 16.9649 16.9649 16.9649 16.9649 18.0902 18.0902 k = 0.0000 0.5000-0.0000 ( 3048 PWs) bands (ev): -9.6466 -9.6466 -9.6466 -9.6466 -9.0479 -9.0479 -9.0479 -9.0479 -8.1371 -8.1371 -8.1371 -8.1371 -7.3100 -7.3100 -7.3100 -7.3100 -5.7462 -5.7462 -5.7462 -5.7462 -5.5179 -5.5179 -5.5179 -5.5179 -4.8233 -4.8233 -4.8233 -4.8233 1.9104 1.9104 1.9104 1.9104 5.7196 5.7196 5.7196 5.7196 6.0355 6.0355 6.0355 6.0355 7.0717 7.0717 7.0717 7.0717 7.8008 7.8008 7.8008 7.8008 8.0392 8.0392 8.0392 8.0392 10.9978 10.9978 10.9978 10.9978 14.7604 14.7604 14.7604 14.7604 18.1779 18.1779 k = 0.0000 0.5000 0.0156 ( 3048 PWs) bands (ev): -9.6462 -9.6462 -9.6454 -9.6454 -9.0528 -9.0528 -9.0455 -9.0455 -8.1434 -8.1434 -8.1296 -8.1296 -7.3149 -7.3149 -7.3049 -7.3049 -5.7479 -5.7479 -5.7437 -5.7437 -5.5206 -5.5206 -5.5152 -5.5152 -4.8234 -4.8234 -4.8220 -4.8220 1.9090 1.9090 1.9110 1.9110 5.6572 5.6572 5.7561 5.7561 6.0062 6.0062 6.0881 6.0881 7.0687 7.0687 7.0733 7.0733 7.7978 7.7978 7.7996 7.7996 8.0382 8.0382 8.0393 8.0393 11.0002 11.0002 11.0002 11.0002 14.7604 14.7604 14.7676 14.7676 18.1346 18.1346 k = 0.0000 0.5000 0.0311 ( 3056 PWs) bands (ev): -9.6442 -9.6442 -9.6425 -9.6425 -9.0602 -9.0602 -9.0457 -9.0457 -8.1484 -8.1484 -8.1210 -8.1210 -7.3194 -7.3194 -7.2995 -7.2995 -5.7488 -5.7488 -5.7405 -5.7405 -5.5233 -5.5233 -5.5126 -5.5126 -4.8221 -4.8221 -4.8194 -4.8194 1.9066 1.9066 1.9106 1.9106 5.5839 5.5839 5.7475 5.7475 6.0195 6.0195 6.1489 6.1489 7.0643 7.0643 7.0736 7.0736 7.7907 7.7907 7.7943 7.7943 8.0365 8.0365 8.0386 8.0386 11.0071 11.0071 11.0072 11.0072 14.7675 14.7675 14.7819 14.7819 18.0865 18.0865 k = 0.0000 0.5000 0.0467 ( 3054 PWs) bands (ev): -9.6405 -9.6405 -9.6380 -9.6380 -9.0700 -9.0700 -9.0485 -9.0485 -8.1521 -8.1521 -8.1114 -8.1114 -7.3236 -7.3236 -7.2939 -7.2939 -5.7491 -5.7491 -5.7366 -5.7366 -5.5260 -5.5260 -5.5100 -5.5100 -4.8195 -4.8195 -4.8155 -4.8155 1.9035 1.9035 1.9094 1.9094 5.5057 5.5057 5.7019 5.7019 6.0672 6.0672 6.2116 6.2116 7.0584 7.0584 7.0729 7.0729 7.7798 7.7798 7.7851 7.7851 8.0340 8.0340 8.0372 8.0372 11.0187 11.0187 11.0188 11.0188 14.7817 14.7817 14.8032 14.8032 18.0341 18.0341 k = 0.0000 0.5000 0.0623 ( 3058 PWs) bands (ev): -9.6354 -9.6354 -9.6319 -9.6319 -9.0820 -9.0820 -9.0537 -9.0537 -8.1544 -8.1544 -8.1011 -8.1011 -7.3274 -7.3274 -7.2883 -7.2883 -5.7486 -5.7486 -5.7321 -5.7321 -5.5287 -5.5287 -5.5074 -5.5074 -4.8156 -4.8156 -4.8103 -4.8103 1.8994 1.8994 1.9073 1.9073 5.4249 5.4249 5.6397 5.6397 6.1288 6.1288 6.2735 6.2735 7.0508 7.0508 7.0712 7.0712 7.7655 7.7655 7.7723 7.7723 8.0307 8.0307 8.0349 8.0349 11.0346 11.0346 11.0350 11.0350 14.8027 14.8027 14.8312 14.8312 17.9779 17.9779 k = 0.0000 0.5000 0.0778 ( 3058 PWs) bands (ev): -9.6287 -9.6287 -9.6241 -9.6241 -9.0961 -9.0961 -9.0614 -9.0614 -8.1554 -8.1554 -8.0902 -8.0902 -7.3308 -7.3308 -7.2825 -7.2825 -5.7475 -5.7475 -5.7269 -5.7269 -5.5314 -5.5314 -5.5050 -5.5050 -4.8104 -4.8104 -4.8038 -4.8038 1.8945 1.8945 1.9042 1.9042 5.3429 5.3429 5.5707 5.5707 6.1943 6.1943 6.3328 6.3328 7.0416 7.0416 7.0690 7.0690 7.7484 7.7484 7.7567 7.7567 8.0266 8.0266 8.0319 8.0319 11.0548 11.0548 11.0555 11.0555 14.8304 14.8304 14.8659 14.8659 17.9182 17.9182 k = 0.0000 0.5000 0.0934 ( 3058 PWs) bands (ev): -9.6207 -9.6207 -9.6146 -9.6146 -9.1120 -9.1120 -9.0711 -9.0711 -8.1551 -8.1551 -8.0790 -8.0790 -7.3336 -7.3336 -7.2766 -7.2766 -5.7458 -5.7458 -5.7211 -5.7211 -5.5340 -5.5340 -5.5026 -5.5026 -4.8038 -4.8038 -4.7961 -4.7961 1.8887 1.8887 1.9002 1.9002 5.2602 5.2602 5.4988 5.4988 6.2593 6.2593 6.3883 6.3883 7.0308 7.0308 7.0665 7.0665 7.7293 7.7293 7.7388 7.7388 8.0217 8.0217 8.0281 8.0281 11.0791 11.0791 11.0802 11.0802 14.8644 14.8644 14.9068 14.9068 17.8556 17.8556 k = 0.0000 0.5000 0.1090 ( 3062 PWs) bands (ev): -9.6113 -9.6113 -9.6037 -9.6037 -9.1295 -9.1295 -9.0828 -9.0828 -8.1537 -8.1537 -8.0675 -8.0675 -7.3360 -7.3360 -7.2707 -7.2707 -5.7436 -5.7436 -5.7149 -5.7149 -5.5366 -5.5366 -5.5003 -5.5003 -4.7959 -4.7959 -4.7870 -4.7870 1.8820 1.8820 1.8952 1.8952 5.1774 5.1774 5.4256 5.4256 6.3217 6.3217 6.4383 6.4383 7.0186 7.0186 7.0645 7.0645 7.7089 7.7089 7.7194 7.7194 8.0161 8.0161 8.0235 8.0235 11.1071 11.1071 11.1088 11.1088 14.9043 14.9043 14.9536 14.9536 17.7906 17.7906 k = 0.0000 0.5000 0.1245 ( 3050 PWs) bands (ev): -9.6007 -9.6007 -9.5911 -9.5911 -9.1485 -9.1485 -9.0961 -9.0961 -8.1512 -8.1512 -8.0561 -8.0561 -7.3378 -7.3378 -7.2649 -7.2649 -5.7409 -5.7409 -5.7082 -5.7082 -5.5391 -5.5391 -5.4981 -5.4981 -4.7865 -4.7865 -4.7767 -4.7767 1.8744 1.8744 1.8892 1.8892 5.0948 5.0948 5.3521 5.3521 6.3794 6.3794 6.4813 6.4813 7.0058 7.0058 7.0639 7.0639 7.6883 7.6883 7.6994 7.6994 8.0097 8.0097 8.0181 8.0181 11.1387 11.1387 11.1412 11.1412 14.9497 14.9497 15.0059 15.0059 17.7238 17.7238 k = 0.0000 0.5000 0.1401 ( 3052 PWs) bands (ev): -9.5891 -9.5891 -9.5771 -9.5771 -9.1687 -9.1687 -9.1107 -9.1107 -8.1479 -8.1479 -8.0449 -8.0449 -7.3391 -7.3391 -7.2591 -7.2591 -5.7378 -5.7378 -5.7013 -5.7013 -5.5415 -5.5415 -5.4960 -5.4960 -4.7758 -4.7758 -4.7651 -4.7651 1.8660 1.8660 1.8821 1.8821 5.0128 5.0128 5.2789 5.2789 6.4303 6.4303 6.5154 6.5154 6.9935 6.9935 7.0658 7.0658 7.6682 7.6682 7.6798 7.6798 8.0026 8.0026 8.0120 8.0120 11.1735 11.1735 11.1770 11.1770 15.0000 15.0000 15.0633 15.0633 17.6556 17.6556 k = 0.0000 0.5000 0.1557 ( 3052 PWs) bands (ev): -9.5767 -9.5767 -9.5618 -9.5618 -9.1899 -9.1899 -9.1262 -9.1262 -8.1438 -8.1438 -8.0340 -8.0340 -7.3398 -7.3398 -7.2534 -7.2534 -5.7345 -5.7345 -5.6941 -5.6941 -5.5438 -5.5438 -5.4940 -5.4940 -4.7636 -4.7636 -4.7522 -4.7522 1.8566 1.8566 1.8741 1.8741 4.9315 4.9315 5.2063 5.2063 6.4718 6.4718 6.5386 6.5386 6.9836 6.9836 7.0716 7.0716 7.6496 7.6496 7.6614 7.6614 7.9949 7.9949 8.0052 8.0052 11.2114 11.2114 11.2160 11.2160 15.0547 15.0547 15.1252 15.1252 17.5868 17.5868 k = 0.0000 0.5000 0.1713 ( 3054 PWs) bands (ev): -9.5637 -9.5637 -9.5451 -9.5451 -9.2118 -9.2118 -9.1422 -9.1422 -8.1392 -8.1392 -8.0237 -8.0237 -7.3399 -7.3399 -7.2477 -7.2477 -5.7310 -5.7310 -5.6868 -5.6868 -5.5460 -5.5460 -5.4920 -5.4920 -4.7501 -4.7501 -4.7380 -4.7380 1.8463 1.8463 1.8650 1.8650 4.8513 4.8513 5.1347 5.1347 6.5007 6.5007 6.5496 6.5496 6.9788 6.9788 7.0821 7.0821 7.6333 7.6333 7.6451 7.6451 7.9864 7.9864 7.9976 7.9976 11.2521 11.2521 11.2579 11.2579 15.1132 15.1132 15.1912 15.1912 17.5180 17.5180 k = 0.0000 0.5000 0.1868 ( 3056 PWs) bands (ev): -9.5506 -9.5506 -9.5274 -9.5274 -9.2341 -9.2341 -9.1580 -9.1580 -8.1341 -8.1341 -8.0139 -8.0139 -7.3394 -7.3394 -7.2423 -7.2423 -5.7275 -5.7275 -5.6795 -5.6795 -5.5481 -5.5481 -5.4902 -5.4902 -4.7352 -4.7352 -4.7226 -4.7226 1.8351 1.8351 1.8548 1.8548 4.7723 4.7723 5.0644 5.0644 6.5140 6.5140 6.5475 6.5475 6.9815 6.9815 7.0976 7.0976 7.6199 7.6199 7.6318 7.6318 7.9774 7.9774 7.9893 7.9893 11.2953 11.2953 11.3024 11.3024 15.1745 15.1745 15.2606 15.2606 17.4499 17.4499 k = 0.0000 0.5000 0.2024 ( 3056 PWs) bands (ev): -9.5377 -9.5377 -9.5090 -9.5090 -9.2564 -9.2564 -9.1730 -9.1730 -8.1287 -8.1287 -8.0049 -8.0049 -7.3383 -7.3383 -7.2370 -7.2370 -5.7239 -5.7239 -5.6724 -5.6724 -5.5500 -5.5500 -5.4884 -5.4884 -4.7189 -4.7189 -4.7060 -4.7060 1.8230 1.8230 1.8435 1.8435 4.6947 4.6947 4.9955 4.9955 6.5102 6.5102 6.5329 6.5329 6.9933 6.9933 7.1174 7.1174 7.6099 7.6099 7.6221 7.6221 7.9678 7.9678 7.9803 7.9803 11.3407 11.3407 11.3492 11.3492 15.2379 15.2379 15.3329 15.3329 17.3832 17.3832 k = 0.0000 0.5000 0.2180 ( 3056 PWs) bands (ev): -9.5259 -9.5259 -9.4903 -9.4903 -9.2779 -9.2779 -9.1865 -9.1865 -8.1231 -8.1231 -7.9967 -7.9967 -7.3366 -7.3366 -7.2319 -7.2319 -5.7205 -5.7205 -5.6654 -5.6654 -5.5518 -5.5518 -5.4867 -5.4867 -4.7014 -4.7014 -4.6882 -4.6882 1.8100 1.8100 1.8312 1.8312 4.6187 4.6187 4.9284 4.9284 6.4898 6.4898 6.5070 6.5070 7.0134 7.0134 7.1401 7.1401 7.6039 7.6039 7.6167 7.6167 7.9576 7.9576 7.9707 7.9707 11.3881 11.3881 11.3981 11.3981 15.3023 15.3023 15.4074 15.4074 17.3190 17.3190 k = 0.0000 0.5000 0.2335 ( 3064 PWs) bands (ev): -9.5158 -9.5158 -9.4723 -9.4723 -9.2978 -9.2978 -9.1975 -9.1975 -8.1174 -8.1174 -7.9893 -7.9893 -7.3344 -7.3344 -7.2270 -7.2270 -5.7174 -5.7174 -5.6586 -5.6586 -5.5534 -5.5534 -5.4850 -5.4850 -4.6825 -4.6825 -4.6693 -4.6693 1.7962 1.7962 1.8179 1.8179 4.5444 4.5444 4.8631 4.8631 6.4555 6.4555 6.4713 6.4713 7.0394 7.0394 7.1639 7.1639 7.6021 7.6021 7.6159 7.6159 7.9469 7.9469 7.9605 7.9605 11.4372 11.4372 11.4487 11.4487 15.3666 15.3666 15.4835 15.4835 17.2582 17.2582 k = 0.0000 0.5000 0.2491 ( 3072 PWs) bands (ev): -9.5085 -9.5085 -9.4571 -9.4571 -9.3139 -9.3139 -9.2048 -9.2048 -8.1118 -8.1118 -7.9830 -7.9830 -7.3316 -7.3316 -7.2223 -7.2223 -5.7145 -5.7145 -5.6523 -5.6523 -5.5548 -5.5548 -5.4833 -5.4833 -4.6624 -4.6624 -4.6492 -4.6492 1.7815 1.7815 1.8035 1.8035 4.4720 4.4720 4.7998 4.7998 6.4102 6.4102 6.4275 6.4275 7.0684 7.0684 7.1872 7.1872 7.6047 7.6047 7.6201 7.6201 7.9358 7.9358 7.9496 7.9496 11.4879 11.4879 11.5008 11.5008 15.4295 15.4295 15.5604 15.5604 17.2020 17.2020 k = 0.0000 0.5000 0.2647 ( 3072 PWs) bands (ev): -9.5049 -9.5049 -9.4481 -9.4481 -9.3226 -9.3226 -9.2076 -9.2076 -8.1063 -8.1063 -7.9776 -7.9776 -7.3282 -7.3282 -7.2179 -7.2179 -5.7121 -5.7121 -5.6464 -5.6464 -5.5560 -5.5560 -5.4817 -5.4817 -4.6412 -4.6412 -4.6282 -4.6282 1.7659 1.7659 1.7881 1.7881 4.4017 4.4017 4.7386 4.7386 6.3565 6.3565 6.3772 6.3772 7.0980 7.0980 7.2089 7.2089 7.6118 7.6118 7.6294 7.6294 7.9244 7.9244 7.9382 7.9382 11.5397 11.5397 11.5541 11.5541 15.4895 15.4895 15.6374 15.6374 17.1518 17.1518 k = 0.0000 0.5000 0.2802 ( 3064 PWs) bands (ev): -9.5056 -9.5056 -9.4491 -9.4491 -9.3201 -9.3201 -9.2050 -9.2050 -8.1010 -8.1010 -7.9732 -7.9732 -7.3245 -7.3245 -7.2137 -7.2137 -5.7101 -5.7101 -5.6411 -5.6411 -5.5570 -5.5570 -5.4800 -5.4800 -4.6189 -4.6189 -4.6063 -4.6063 1.7497 1.7497 1.7717 1.7717 4.3334 4.3334 4.6796 4.6796 6.2964 6.2964 6.3217 6.3217 7.1266 7.1266 7.2281 7.2281 7.6234 7.6234 7.6434 7.6434 7.9127 7.9127 7.9263 7.9263 11.5926 11.5926 11.6083 11.6083 15.5449 15.5449 15.7137 15.7137 17.1091 17.1091 k = 0.0000 0.5000 0.2958 ( 3060 PWs) bands (ev): -9.5107 -9.5107 -9.4600 -9.4600 -9.3066 -9.3066 -9.1968 -9.1968 -8.0960 -8.0960 -7.9698 -7.9698 -7.3202 -7.3202 -7.2098 -7.2098 -5.7086 -5.7086 -5.6363 -5.6363 -5.5577 -5.5577 -5.4783 -5.4783 -4.5956 -4.5956 -4.5835 -4.5835 1.7327 1.7327 1.7545 1.7545 4.2674 4.2674 4.6230 4.6230 6.2317 6.2317 6.2622 6.2622 7.1531 7.1531 7.2444 7.2444 7.6394 7.6394 7.6617 7.6617 7.9008 7.9008 7.9140 7.9140 11.6462 11.6462 11.6632 11.6632 15.5939 15.5939 15.7884 15.7884 17.0756 17.0756 k = 0.0000 0.5000 0.3114 ( 3068 PWs) bands (ev): -9.5200 -9.5200 -9.4772 -9.4772 -9.2855 -9.2855 -9.1834 -9.1834 -8.0914 -8.0914 -7.9674 -7.9674 -7.3156 -7.3156 -7.2062 -7.2062 -5.7077 -5.7077 -5.6322 -5.6322 -5.5581 -5.5581 -5.4765 -5.4765 -4.5714 -4.5714 -4.5601 -4.5601 1.7150 1.7150 1.7364 1.7364 4.2036 4.2036 4.5687 4.5687 6.1636 6.1636 6.1995 6.1995 7.1767 7.1767 7.2580 7.2580 7.6594 7.6594 7.6835 7.6835 7.8890 7.8890 7.9012 7.9012 11.7003 11.7003 11.7185 11.7185 15.6345 15.6345 15.8606 15.8606 17.0530 17.0530 k = 0.0000 0.5000 0.3269 ( 3060 PWs) bands (ev): -9.5327 -9.5327 -9.4976 -9.4976 -9.2599 -9.2599 -9.1654 -9.1654 -8.0872 -8.0872 -7.9661 -7.9661 -7.3107 -7.3107 -7.2029 -7.2029 -5.7075 -5.7075 -5.6287 -5.6287 -5.5583 -5.5583 -5.4746 -5.4746 -4.5465 -4.5465 -4.5360 -4.5360 1.6968 1.6968 1.7176 1.7176 4.1422 4.1422 4.5168 4.5168 6.0930 6.0930 6.1346 6.1346 7.1975 7.1975 7.2691 7.2691 7.6830 7.6830 7.7078 7.7078 7.8776 7.8776 7.8881 7.8881 11.7548 11.7548 11.7739 11.7739 15.6652 15.6652 15.9293 15.9293 17.0426 17.0426 k = 0.0000 0.5000 0.3425 ( 3054 PWs) bands (ev): -9.5480 -9.5480 -9.5196 -9.5196 -9.2315 -9.2315 -9.1435 -9.1435 -8.0835 -8.0835 -7.9657 -7.9657 -7.3055 -7.3055 -7.1998 -7.1998 -5.7079 -5.7079 -5.6260 -5.6260 -5.5582 -5.5582 -5.4727 -5.4727 -4.5210 -4.5210 -4.5114 -4.5114 1.6782 1.6782 1.6981 1.6981 4.0832 4.0832 4.4673 4.4673 6.0208 6.0208 6.0680 6.0680 7.2154 7.2154 7.2780 7.2780 7.7095 7.7095 7.7332 7.7332 7.8673 7.8673 7.8747 7.8747 11.8093 11.8093 11.8292 11.8292 15.6849 15.6849 15.9937 15.9937 17.0456 17.0456 k = 0.0000 0.5000 0.3581 ( 3046 PWs) bands (ev): -9.5652 -9.5652 -9.5422 -9.5422 -9.2012 -9.2012 -9.1186 -9.1186 -8.0802 -8.0802 -7.9663 -7.9663 -7.3001 -7.3001 -7.1971 -7.1971 -5.7089 -5.7089 -5.6240 -5.6240 -5.5579 -5.5579 -5.4707 -5.4707 -4.4949 -4.4949 -4.4865 -4.4865 1.6592 1.6592 1.6782 1.6782 4.0265 4.0265 4.4203 4.4203 5.9477 5.9477 6.0006 6.0006 7.2307 7.2307 7.2851 7.2851 7.7382 7.7382 7.7576 7.7576 7.8594 7.8594 7.8612 7.8612 11.8636 11.8636 11.8842 11.8842 15.6930 15.6930 16.0526 16.0526 17.0620 17.0620 k = 0.0000 0.5000 0.3736 ( 3056 PWs) bands (ev): -9.5836 -9.5836 -9.5650 -9.5650 -9.1695 -9.1695 -9.0912 -9.0912 -8.0776 -8.0776 -7.9679 -7.9679 -7.2945 -7.2945 -7.1946 -7.1946 -5.7106 -5.7106 -5.6226 -5.6226 -5.5573 -5.5573 -5.4686 -5.4686 -4.4685 -4.4685 -4.4614 -4.4614 1.6399 1.6399 1.6578 1.6578 3.9723 3.9723 4.3755 4.3755 5.8742 5.8742 5.9327 5.9327 7.2437 7.2437 7.2909 7.2909 7.7682 7.7682 7.7767 7.7767 7.8479 7.8479 7.8576 7.8576 11.9176 11.9176 11.9385 11.9385 15.6900 15.6900 16.1053 16.1053 17.0914 17.0914 k = 0.0000 0.5000 0.3892 ( 3056 PWs) bands (ev): -9.6027 -9.6027 -9.5877 -9.5877 -9.1367 -9.1367 -9.0618 -9.0618 -8.0756 -8.0756 -7.9704 -7.9704 -7.2889 -7.2889 -7.1924 -7.1924 -5.7130 -5.7130 -5.6218 -5.6218 -5.5566 -5.5566 -5.4664 -5.4664 -4.4418 -4.4418 -4.4362 -4.4362 1.6205 1.6205 1.6371 1.6371 3.9204 3.9204 4.3331 4.3331 5.8009 5.8009 5.8650 5.8650 7.2549 7.2549 7.2956 7.2956 7.7849 7.7849 7.7976 7.7976 7.8362 7.8362 7.8672 7.8672 11.9711 11.9711 11.9921 11.9921 15.6770 15.6770 16.1509 16.1509 17.1324 17.1324 k = 0.0000 0.5000 0.4048 ( 3058 PWs) bands (ev): -9.6222 -9.6222 -9.6099 -9.6099 -9.1030 -9.1030 -9.0309 -9.0309 -8.0742 -8.0742 -7.9738 -7.9738 -7.2831 -7.2831 -7.1905 -7.1905 -5.7159 -5.7159 -5.6217 -5.6217 -5.5557 -5.5557 -5.4642 -5.4642 -4.4151 -4.4151 -4.4111 -4.4111 1.6011 1.6011 1.6163 1.6163 3.8709 3.8709 4.2930 4.2930 5.7283 5.7283 5.7978 5.7978 7.2646 7.2646 7.2995 7.2995 7.7824 7.7824 7.8108 7.8108 7.8410 7.8410 7.8876 7.8876 12.0238 12.0238 12.0447 12.0447 15.6554 15.6554 16.1889 16.1889 17.1834 17.1834 k = 0.0000 0.5000 0.4203 ( 3054 PWs) bands (ev): -9.6418 -9.6418 -9.6317 -9.6317 -9.0687 -9.0687 -8.9989 -8.9989 -8.0735 -8.0735 -7.9782 -7.9782 -7.2774 -7.2774 -7.1889 -7.1889 -5.7195 -5.7195 -5.6220 -5.6220 -5.5546 -5.5546 -5.4619 -5.4619 -4.3884 -4.3884 -4.3861 -4.3861 1.5818 1.5818 1.5955 1.5955 3.8238 3.8238 4.2551 4.2551 5.6568 5.6568 5.7316 5.7316 7.2731 7.2731 7.3027 7.3027 7.7742 7.7742 7.8006 7.8006 7.8695 7.8695 7.9135 7.9135 12.0755 12.0755 12.0960 12.0960 15.6270 15.6270 16.2191 16.2191 17.2424 17.2424 k = 0.0000 0.5000 0.4359 ( 3038 PWs) bands (ev): -9.6612 -9.6612 -9.6529 -9.6529 -9.0339 -9.0339 -8.9658 -8.9658 -8.0735 -8.0735 -7.9833 -7.9833 -7.2716 -7.2716 -7.1876 -7.1876 -5.7235 -5.7235 -5.6229 -5.6229 -5.5535 -5.5535 -5.4595 -5.4595 -4.3620 -4.3620 -4.3615 -4.3615 1.5628 1.5628 1.5749 1.5749 3.7790 3.7790 4.2193 4.2193 5.5868 5.5868 5.6666 5.6666 7.2806 7.2806 7.3055 7.3055 7.7637 7.7637 7.7872 7.7872 7.9009 7.9009 7.9412 7.9412 12.1261 12.1261 12.1460 12.1460 15.5935 15.5935 16.2414 16.2414 17.3075 17.3075 k = 0.0000 0.5000 0.4515 ( 3042 PWs) bands (ev): -9.6803 -9.6803 -9.6734 -9.6734 -8.9988 -8.9988 -8.9321 -8.9321 -8.0743 -8.0743 -7.9893 -7.9893 -7.2660 -7.2660 -7.1865 -7.1865 -5.7280 -5.7280 -5.6241 -5.6241 -5.5524 -5.5524 -5.4571 -5.4571 -4.3373 -4.3373 -4.3359 -4.3359 1.5441 1.5441 1.5545 1.5545 3.7365 3.7365 4.1856 4.1856 5.5186 5.5186 5.6033 5.6033 7.2874 7.2874 7.3078 7.3078 7.7523 7.7523 7.7733 7.7733 7.9323 7.9323 7.9694 7.9694 12.1753 12.1753 12.1943 12.1943 15.5563 15.5563 16.2563 16.2563 17.3771 17.3771 k = 0.0000 0.5000 0.4671 ( 3042 PWs) bands (ev): -9.6988 -9.6988 -9.6931 -9.6931 -8.9635 -8.9635 -8.8979 -8.8979 -8.0759 -8.0759 -7.9961 -7.9961 -7.2605 -7.2605 -7.1857 -7.1857 -5.7329 -5.7329 -5.6257 -5.6257 -5.5512 -5.5512 -5.4548 -5.4548 -4.3138 -4.3138 -4.3103 -4.3103 1.5260 1.5260 1.5345 1.5345 3.6963 3.6963 4.1538 4.1538 5.4526 5.4526 5.5419 5.5419 7.2934 7.2934 7.3099 7.3099 7.7406 7.7406 7.7594 7.7594 7.9631 7.9631 7.9972 7.9972 12.2231 12.2231 12.2409 12.2409 15.5166 15.5166 16.2643 16.2643 17.4496 17.4496 k = 0.0000 0.5000 0.4826 ( 3042 PWs) bands (ev): -9.7168 -9.7168 -9.7119 -9.7119 -8.9281 -8.9281 -8.8635 -8.8635 -8.0783 -8.0783 -8.0037 -8.0037 -7.2551 -7.2551 -7.1851 -7.1851 -5.7381 -5.7381 -5.6276 -5.6276 -5.5500 -5.5500 -5.4524 -5.4524 -4.2909 -4.2909 -4.2853 -4.2853 1.5084 1.5084 1.5151 1.5151 3.6583 3.6583 4.1239 4.1239 5.3890 5.3890 5.4827 5.4827 7.2990 7.2990 7.3117 7.3117 7.7288 7.7288 7.7456 7.7456 7.9930 7.9930 8.0242 8.0242 12.2692 12.2692 12.2856 12.2856 15.4757 15.4757 16.2663 16.2663 17.5237 17.5237 k = 0.0000 0.5000 0.4982 ( 3042 PWs) bands (ev): -9.7340 -9.7340 -9.7298 -9.7298 -8.8929 -8.8929 -8.8290 -8.8290 -8.0815 -8.0815 -8.0121 -8.0121 -7.2499 -7.2499 -7.1847 -7.1847 -5.7436 -5.7436 -5.6297 -5.6297 -5.5488 -5.5488 -5.4501 -5.4501 -4.2689 -4.2689 -4.2611 -4.2611 1.4916 1.4916 1.4963 1.4963 3.6225 3.6225 4.0959 4.0959 5.3282 5.3282 5.4259 5.4259 7.3042 7.3042 7.3133 7.3133 7.7173 7.7173 7.7321 7.7321 8.0218 8.0218 8.0502 8.0502 12.3135 12.3135 12.3282 12.3282 15.4342 15.4342 16.2632 16.2632 17.5985 17.5985 k = 0.0000 0.5000 0.5138 ( 3034 PWs) bands (ev): -9.7504 -9.7504 -9.7468 -9.7468 -8.8579 -8.8579 -8.7945 -8.7945 -8.0855 -8.0855 -8.0212 -8.0212 -7.2449 -7.2449 -7.1845 -7.1845 -5.7492 -5.7492 -5.6320 -5.6320 -5.5477 -5.5477 -5.4478 -5.4478 -4.2478 -4.2478 -4.2379 -4.2379 1.4757 1.4757 1.4784 1.4784 3.5889 3.5889 4.0696 4.0696 5.2704 5.2704 5.3719 5.3719 7.3090 7.3090 7.3148 7.3148 7.7060 7.7060 7.7189 7.7189 8.0492 8.0492 8.0751 8.0751 12.3558 12.3558 12.3687 12.3687 15.3930 15.3930 16.2561 16.2561 17.6728 17.6728 k = 0.0000 0.5000 0.5293 ( 3046 PWs) bands (ev): -9.7659 -9.7659 -9.7628 -9.7628 -8.8233 -8.8233 -8.7604 -8.7604 -8.0904 -8.0904 -8.0310 -8.0310 -7.2402 -7.2402 -7.1845 -7.1845 -5.7550 -5.7550 -5.6345 -5.6345 -5.5466 -5.5466 -5.4456 -5.4456 -4.2278 -4.2278 -4.2157 -4.2157 1.4606 1.4606 1.4613 1.4613 3.5575 3.5575 4.0450 4.0450 5.2158 5.2158 5.3207 5.3207 7.3136 7.3136 7.3161 7.3161 7.6952 7.6952 7.7062 7.7062 8.0753 8.0753 8.0986 8.0986 12.3959 12.3959 12.4068 12.4068 15.3527 15.3527 16.2459 16.2459 17.7459 17.7459 k = 0.0000 0.5000 0.5449 ( 3058 PWs) bands (ev): -9.7805 -9.7805 -9.7778 -9.7778 -8.7893 -8.7893 -8.7267 -8.7267 -8.0961 -8.0961 -8.0414 -8.0414 -7.2358 -7.2358 -7.1846 -7.1846 -5.7607 -5.7607 -5.6370 -5.6370 -5.5455 -5.5455 -5.4434 -5.4434 -4.2089 -4.2089 -4.1946 -4.1946 1.4453 1.4453 1.4465 1.4465 3.5282 3.5282 4.0221 4.0221 5.1647 5.1647 5.2727 5.2727 7.3173 7.3173 7.3179 7.3179 7.6849 7.6849 7.6939 7.6939 8.0997 8.0997 8.1208 8.1208 12.4338 12.4338 12.4425 12.4425 15.3136 15.3136 16.2334 16.2334 17.8170 17.8170 k = 0.0000 0.5000 0.5605 ( 3058 PWs) bands (ev): -9.7941 -9.7941 -9.7917 -9.7917 -8.7561 -8.7561 -8.6937 -8.6937 -8.1027 -8.1027 -8.0524 -8.0524 -7.2316 -7.2316 -7.1849 -7.1849 -5.7664 -5.7664 -5.6396 -5.6396 -5.5445 -5.5445 -5.4414 -5.4414 -4.1913 -4.1913 -4.1748 -4.1748 1.4303 1.4303 1.4335 1.4335 3.5010 3.5010 4.0008 4.0008 5.1171 5.1171 5.2279 5.2279 7.3184 7.3184 7.3219 7.3219 7.6752 7.6752 7.6821 7.6821 8.1226 8.1226 8.1414 8.1414 12.4693 12.4693 12.4757 12.4757 15.2764 15.2764 16.2194 16.2194 17.8855 17.8855 k = 0.0000 0.5000 0.5760 ( 3048 PWs) bands (ev): -9.8066 -9.8066 -9.8044 -9.8044 -8.7238 -8.7238 -8.6615 -8.6615 -8.1101 -8.1101 -8.0638 -8.0638 -7.2278 -7.2278 -7.1853 -7.1853 -5.7719 -5.7719 -5.6422 -5.6422 -5.5436 -5.5436 -5.4395 -5.4395 -4.1749 -4.1749 -4.1563 -4.1563 1.4165 1.4165 1.4215 1.4215 3.4761 3.4761 3.9811 3.9811 5.0734 5.0734 5.1865 5.1865 7.3193 7.3193 7.3257 7.3257 7.6662 7.6662 7.6711 7.6711 8.1437 8.1437 8.1604 8.1604 12.5023 12.5023 12.5064 12.5064 15.2412 15.2412 16.2048 16.2048 17.9506 17.9506 k = 0.0000 0.5000 0.5916 ( 3056 PWs) bands (ev): -9.8181 -9.8181 -9.8161 -9.8161 -8.6928 -8.6928 -8.6304 -8.6304 -8.1182 -8.1182 -8.0757 -8.0757 -7.2242 -7.2242 -7.1857 -7.1857 -5.7772 -5.7772 -5.6447 -5.6447 -5.5427 -5.5427 -5.4378 -5.4378 -4.1599 -4.1599 -4.1394 -4.1394 1.4038 1.4038 1.4107 1.4107 3.4533 3.4533 3.9631 3.9631 5.0335 5.0335 5.1487 5.1487 7.3202 7.3202 7.3293 7.3293 7.6578 7.6578 7.6607 7.6607 8.1630 8.1630 8.1779 8.1779 12.5326 12.5326 12.5343 12.5343 15.2085 15.2085 16.1900 16.1900 18.0118 18.0118 k = 0.0000 0.5000 0.6072 ( 3052 PWs) bands (ev): -9.8284 -9.8284 -9.8265 -9.8265 -8.6632 -8.6632 -8.6007 -8.6007 -8.1269 -8.1269 -8.0877 -8.0877 -7.2210 -7.2210 -7.1862 -7.1862 -5.7822 -5.7822 -5.6471 -5.6471 -5.5419 -5.5419 -5.4362 -5.4362 -4.1463 -4.1463 -4.1240 -4.1240 1.3924 1.3924 1.4010 1.4010 3.4328 3.4328 3.9468 3.9468 4.9977 4.9977 5.1145 5.1145 7.3210 7.3210 7.3327 7.3327 7.6501 7.6501 7.6511 7.6511 8.1804 8.1804 8.1936 8.1936 12.5594 12.5594 12.5601 12.5601 15.1785 15.1785 16.1755 16.1755 18.0684 18.0684 k = 0.0000 0.5000 0.6227 ( 3046 PWs) bands (ev): -9.8376 -9.8376 -9.8358 -9.8358 -8.6354 -8.6354 -8.5726 -8.5726 -8.1361 -8.1361 -8.0998 -8.0998 -7.2182 -7.2182 -7.1867 -7.1867 -5.7868 -5.7868 -5.6494 -5.6494 -5.5412 -5.5412 -5.4347 -5.4347 -4.1342 -4.1342 -4.1102 -4.1102 1.3823 1.3823 1.3925 1.3925 3.4146 3.4146 3.9322 3.9322 4.9659 4.9659 5.0842 5.0842 7.3217 7.3217 7.3357 7.3357 7.6424 7.6424 7.6433 7.6433 8.1960 8.1960 8.2076 8.2076 12.5818 12.5818 12.5847 12.5847 15.1515 15.1515 16.1619 16.1619 18.1201 18.1201 k = 0.0000 0.5000 0.6383 ( 3046 PWs) bands (ev): -9.8456 -9.8456 -9.8439 -9.8439 -8.6097 -8.6097 -8.5464 -8.5464 -8.1455 -8.1455 -8.1117 -8.1117 -7.2157 -7.2157 -7.1872 -7.1872 -5.7909 -5.7909 -5.6514 -5.6514 -5.5405 -5.5405 -5.4335 -5.4335 -4.1237 -4.1237 -4.0981 -4.0981 1.3736 1.3736 1.3851 1.3851 3.3986 3.3986 3.9194 3.9194 4.9383 4.9383 5.0577 5.0577 7.3223 7.3223 7.3385 7.3385 7.6347 7.6347 7.6373 7.6373 8.2095 8.2095 8.2198 8.2198 12.6013 12.6013 12.6062 12.6062 15.1276 15.1276 16.1494 16.1494 18.1661 18.1661 k = 0.0000 0.5000 0.6539 ( 3052 PWs) bands (ev): -9.8524 -9.8524 -9.8508 -9.8508 -8.5865 -8.5865 -8.5227 -8.5227 -8.1550 -8.1550 -8.1229 -8.1229 -7.2136 -7.2136 -7.1877 -7.1877 -5.7945 -5.7945 -5.6532 -5.6532 -5.5400 -5.5400 -5.4324 -5.4324 -4.1147 -4.1147 -4.0878 -4.0878 1.3661 1.3661 1.3789 1.3789 3.3850 3.3850 3.9084 3.9084 4.9149 4.9149 5.0351 5.0351 7.3228 7.3228 7.3409 7.3409 7.6280 7.6280 7.6322 7.6322 8.2211 8.2211 8.2302 8.2302 12.6178 12.6178 12.6246 12.6246 15.1071 15.1071 16.1383 16.1383 18.2060 18.2060 k = 0.0000 0.5000 0.6694 ( 3052 PWs) bands (ev): -9.8580 -9.8580 -9.8564 -9.8564 -8.5664 -8.5664 -8.5018 -8.5018 -8.1640 -8.1640 -8.1332 -8.1332 -7.2119 -7.2119 -7.1881 -7.1881 -5.7975 -5.7975 -5.6547 -5.6547 -5.5395 -5.5395 -5.4315 -5.4315 -4.1073 -4.1073 -4.0793 -4.0793 1.3600 1.3600 1.3739 1.3739 3.3739 3.3739 3.8993 3.8993 4.8957 4.8957 5.0166 5.0166 7.3233 7.3233 7.3430 7.3430 7.6223 7.6223 7.6279 7.6279 8.2306 8.2306 8.2387 8.2387 12.6314 12.6314 12.6398 12.6398 15.0901 15.0901 16.1290 16.1290 18.2393 18.2393 k = 0.0000 0.5000 0.6850 ( 3052 PWs) bands (ev): -9.8624 -9.8624 -9.8608 -9.8608 -8.5499 -8.5499 -8.4845 -8.4845 -8.1720 -8.1720 -8.1421 -8.1421 -7.2105 -7.2105 -7.1884 -7.1884 -5.7999 -5.7999 -5.6560 -5.6560 -5.5391 -5.5391 -5.4308 -5.4308 -4.1015 -4.1015 -4.0726 -4.0726 1.3552 1.3552 1.3699 1.3699 3.3651 3.3651 3.8921 3.8921 4.8808 4.8808 5.0022 5.0022 7.3236 7.3236 7.3447 7.3447 7.6179 7.6179 7.6246 7.6246 8.2380 8.2380 8.2454 8.2454 12.6420 12.6420 12.6518 12.6518 15.0767 15.0767 16.1215 16.1215 18.2657 18.2657 k = 0.0000 0.5000 0.7006 ( 3056 PWs) bands (ev): -9.8655 -9.8655 -9.8640 -9.8640 -8.5375 -8.5375 -8.4713 -8.4713 -8.1784 -8.1784 -8.1489 -8.1489 -7.2096 -7.2096 -7.1887 -7.1887 -5.8016 -5.8016 -5.6569 -5.6569 -5.5389 -5.5389 -5.4303 -5.4303 -4.0973 -4.0973 -4.0678 -4.0678 1.3518 1.3518 1.3671 1.3671 3.3589 3.3589 3.8870 3.8870 4.8701 4.8701 4.9918 4.9918 7.3238 7.3238 7.3459 7.3459 7.6147 7.6147 7.6222 7.6222 8.2433 8.2433 8.2501 8.2501 12.6496 12.6496 12.6603 12.6603 15.0671 15.0671 16.1161 16.1161 18.2848 18.2848 k = 0.0000 0.5000 0.7161 ( 3052 PWs) bands (ev): -9.8674 -9.8674 -9.8659 -9.8659 -8.5298 -8.5298 -8.4631 -8.4631 -8.1826 -8.1826 -8.1532 -8.1532 -7.2090 -7.2090 -7.1889 -7.1889 -5.8027 -5.8027 -5.6574 -5.6574 -5.5387 -5.5387 -5.4300 -5.4300 -4.0948 -4.0948 -4.0649 -4.0649 1.3498 1.3498 1.3655 1.3655 3.3551 3.3551 3.8839 3.8839 4.8637 4.8637 4.9856 4.9856 7.3240 7.3240 7.3466 7.3466 7.6127 7.6127 7.6207 7.6207 8.2465 8.2465 8.2530 8.2530 12.6542 12.6542 12.6655 12.6655 15.0613 15.0613 16.1128 16.1128 18.2964 18.2964 k = 0.0000 0.5000 0.7317 ( 3052 PWs) bands (ev): -9.8680 -9.8680 -9.8665 -9.8665 -8.5272 -8.5272 -8.4603 -8.4603 -8.1841 -8.1841 -8.1547 -8.1547 -7.2088 -7.2088 -7.1889 -7.1889 -5.8031 -5.8031 -5.6576 -5.6576 -5.5387 -5.5387 -5.4299 -5.4299 -4.0940 -4.0940 -4.0640 -4.0640 1.3491 1.3491 1.3649 1.3649 3.3538 3.3538 3.8828 3.8828 4.8616 4.8616 4.9835 4.9835 7.3240 7.3240 7.3469 7.3469 7.6121 7.6121 7.6203 7.6203 8.2475 8.2475 8.2540 8.2540 12.6557 12.6557 12.6672 12.6672 15.0594 15.0594 16.1117 16.1117 18.3003 18.3003 k = 0.5000 0.5000-0.0000 ( 3036 PWs) bands (ev): -9.9420 -9.9420 -9.9420 -9.9420 -8.2442 -8.2442 -8.2442 -8.2442 -8.2313 -8.2313 -8.2313 -8.2313 -7.5611 -7.5611 -7.5611 -7.5611 -5.8639 -5.8639 -5.8639 -5.8639 -5.5277 -5.5277 -5.5277 -5.5277 -5.0849 -5.0849 -5.0849 -5.0849 2.8937 2.8937 2.8937 2.8937 5.0965 5.0965 5.0965 5.0965 5.8202 5.8202 5.8202 5.8202 6.8089 6.8089 6.8089 6.8089 7.7801 7.7801 7.7801 7.7801 7.9186 7.9186 7.9186 7.9186 11.4540 11.4540 11.4540 11.4540 15.0220 15.0220 15.0220 15.0220 18.3388 18.3388 k = 0.5000 0.5000 0.0156 ( 3036 PWs) bands (ev): -9.9413 -9.9413 -9.9413 -9.9413 -8.2777 -8.2777 -8.2777 -8.2777 -8.1988 -8.1988 -8.1988 -8.1988 -7.5606 -7.5606 -7.5606 -7.5606 -5.8628 -5.8628 -5.8628 -5.8628 -5.5274 -5.5274 -5.5274 -5.5274 -5.0850 -5.0850 -5.0850 -5.0850 2.8900 2.8900 2.8900 2.8900 5.0976 5.0976 5.0976 5.0976 5.8220 5.8220 5.8220 5.8220 6.8053 6.8053 6.8053 6.8053 7.7810 7.7810 7.7810 7.7810 7.9186 7.9186 7.9186 7.9186 11.4545 11.4545 11.4545 11.4545 15.0250 15.0250 15.0250 15.0250 18.3378 18.3378 k = 0.5000 0.5000 0.0311 ( 3036 PWs) bands (ev): -9.9391 -9.9391 -9.9391 -9.9391 -8.3177 -8.3177 -8.3177 -8.3177 -8.1617 -8.1617 -8.1617 -8.1617 -7.5594 -7.5594 -7.5594 -7.5594 -5.8594 -5.8594 -5.8594 -5.8594 -5.5266 -5.5266 -5.5266 -5.5266 -5.0853 -5.0853 -5.0853 -5.0853 2.8789 2.8789 2.8789 2.8789 5.1011 5.1011 5.1011 5.1011 5.8272 5.8272 5.8272 5.8272 6.7945 6.7945 6.7945 6.7945 7.7837 7.7837 7.7837 7.7837 7.9185 7.9185 7.9185 7.9185 11.4559 11.4559 11.4559 11.4559 15.0338 15.0338 15.0338 15.0338 18.3348 18.3348 k = 0.5000 0.5000 0.0467 ( 3032 PWs) bands (ev): -9.9356 -9.9356 -9.9356 -9.9356 -8.3586 -8.3586 -8.3586 -8.3586 -8.1256 -8.1256 -8.1256 -8.1256 -7.5572 -7.5572 -7.5572 -7.5572 -5.8539 -5.8539 -5.8539 -5.8539 -5.5253 -5.5253 -5.5253 -5.5253 -5.0858 -5.0858 -5.0858 -5.0858 2.8606 2.8606 2.8606 2.8606 5.1068 5.1068 5.1068 5.1068 5.8359 5.8359 5.8359 5.8359 6.7769 6.7769 6.7769 6.7769 7.7879 7.7879 7.7879 7.7879 7.9183 7.9183 7.9183 7.9183 11.4582 11.4582 11.4582 11.4582 15.0484 15.0484 15.0484 15.0484 18.3299 18.3299 k = 0.5000 0.5000 0.0623 ( 3040 PWs) bands (ev): -9.9307 -9.9307 -9.9307 -9.9307 -8.4001 -8.4001 -8.4001 -8.4001 -8.0909 -8.0909 -8.0909 -8.0909 -7.5542 -7.5542 -7.5542 -7.5542 -5.8462 -5.8462 -5.8462 -5.8462 -5.5234 -5.5234 -5.5234 -5.5234 -5.0866 -5.0866 -5.0866 -5.0866 2.8353 2.8353 2.8353 2.8353 5.1146 5.1146 5.1146 5.1146 5.8477 5.8477 5.8477 5.8477 6.7527 6.7527 6.7527 6.7527 7.7936 7.7936 7.7936 7.7936 7.9180 7.9180 7.9180 7.9180 11.4614 11.4614 11.4614 11.4614 15.0687 15.0687 15.0687 15.0687 18.3230 18.3230 k = 0.5000 0.5000 0.0778 ( 3040 PWs) bands (ev): -9.9244 -9.9244 -9.9244 -9.9244 -8.4421 -8.4421 -8.4421 -8.4421 -8.0576 -8.0576 -8.0576 -8.0576 -7.5503 -7.5503 -7.5503 -7.5503 -5.8365 -5.8365 -5.8365 -5.8365 -5.5209 -5.5209 -5.5209 -5.5209 -5.0874 -5.0874 -5.0874 -5.0874 2.8034 2.8034 2.8034 2.8034 5.1247 5.1247 5.1247 5.1247 5.8623 5.8623 5.8623 5.8623 6.7223 6.7223 6.7223 6.7223 7.8003 7.8003 7.8003 7.8003 7.9177 7.9177 7.9177 7.9177 11.4653 11.4653 11.4653 11.4653 15.0944 15.0944 15.0944 15.0944 18.3141 18.3141 k = 0.5000 0.5000 0.0934 ( 3028 PWs) bands (ev): -9.9167 -9.9167 -9.9167 -9.9167 -8.4845 -8.4845 -8.4845 -8.4845 -8.0259 -8.0259 -8.0259 -8.0259 -7.5455 -7.5455 -7.5455 -7.5455 -5.8248 -5.8248 -5.8248 -5.8248 -5.5177 -5.5177 -5.5177 -5.5177 -5.0885 -5.0885 -5.0885 -5.0885 2.7652 2.7652 2.7652 2.7652 5.1368 5.1368 5.1368 5.1368 5.8795 5.8795 5.8795 5.8795 6.6864 6.6864 6.6864 6.6864 7.8079 7.8079 7.8079 7.8079 7.9173 7.9173 7.9173 7.9173 11.4700 11.4700 11.4700 11.4700 15.1255 15.1255 15.1255 15.1255 18.3033 18.3033 k = 0.5000 0.5000 0.1090 ( 3036 PWs) bands (ev): -9.9078 -9.9078 -9.9078 -9.9078 -8.5271 -8.5271 -8.5271 -8.5271 -7.9959 -7.9959 -7.9959 -7.9959 -7.5398 -7.5398 -7.5398 -7.5398 -5.8114 -5.8114 -5.8114 -5.8114 -5.5136 -5.5136 -5.5136 -5.5136 -5.0897 -5.0897 -5.0897 -5.0897 2.7211 2.7211 2.7211 2.7211 5.1510 5.1510 5.1510 5.1510 5.8989 5.8989 5.8989 5.8989 6.6454 6.6454 6.6454 6.6454 7.8160 7.8160 7.8160 7.8160 7.9169 7.9169 7.9169 7.9169 11.4753 11.4753 11.4753 11.4753 15.1615 15.1615 15.1615 15.1615 18.2907 18.2907 k = 0.5000 0.5000 0.1245 ( 3036 PWs) bands (ev): -9.8975 -9.8975 -9.8975 -9.8975 -8.5698 -8.5698 -8.5698 -8.5698 -7.9676 -7.9676 -7.9676 -7.9676 -7.5333 -7.5333 -7.5333 -7.5333 -5.7965 -5.7965 -5.7965 -5.7965 -5.5087 -5.5087 -5.5087 -5.5087 -5.0910 -5.0910 -5.0910 -5.0910 2.6717 2.6717 2.6717 2.6717 5.1670 5.1670 5.1670 5.1670 5.9199 5.9199 5.9199 5.9199 6.6000 6.6000 6.6000 6.6000 7.8244 7.8244 7.8244 7.8244 7.9164 7.9164 7.9164 7.9164 11.4810 11.4810 11.4810 11.4810 15.2023 15.2023 15.2023 15.2023 18.2762 18.2762 k = 0.5000 0.5000 0.1401 ( 3036 PWs) bands (ev): -9.8859 -9.8859 -9.8859 -9.8859 -8.6125 -8.6125 -8.6125 -8.6125 -7.9411 -7.9411 -7.9411 -7.9411 -7.5259 -7.5259 -7.5259 -7.5259 -5.7802 -5.7802 -5.7802 -5.7802 -5.5026 -5.5026 -5.5026 -5.5026 -5.0924 -5.0924 -5.0924 -5.0924 2.6174 2.6174 2.6174 2.6174 5.1849 5.1849 5.1849 5.1849 5.9420 5.9420 5.9420 5.9420 6.5510 6.5510 6.5510 6.5510 7.8328 7.8328 7.8328 7.8328 7.9158 7.9158 7.9158 7.9158 11.4872 11.4872 11.4872 11.4872 15.2474 15.2474 15.2474 15.2474 18.2600 18.2600 k = 0.5000 0.5000 0.1557 ( 3044 PWs) bands (ev): -9.8732 -9.8732 -9.8732 -9.8732 -8.6551 -8.6551 -8.6551 -8.6551 -7.9165 -7.9165 -7.9165 -7.9165 -7.5177 -7.5177 -7.5177 -7.5177 -5.7630 -5.7630 -5.7630 -5.7630 -5.4953 -5.4953 -5.4953 -5.4953 -5.0938 -5.0938 -5.0938 -5.0938 2.5587 2.5587 2.5587 2.5587 5.2045 5.2045 5.2045 5.2045 5.9644 5.9644 5.9644 5.9644 6.4992 6.4992 6.4992 6.4992 7.8411 7.8411 7.8411 7.8411 7.9153 7.9153 7.9153 7.9153 11.4935 11.4935 11.4935 11.4935 15.2965 15.2965 15.2965 15.2965 18.2423 18.2423 k = 0.5000 0.5000 0.1713 ( 3032 PWs) bands (ev): -9.8592 -9.8592 -9.8592 -9.8592 -8.6975 -8.6975 -8.6975 -8.6975 -7.8936 -7.8936 -7.8936 -7.8936 -7.5087 -7.5087 -7.5087 -7.5087 -5.7452 -5.7452 -5.7452 -5.7452 -5.4864 -5.4864 -5.4864 -5.4864 -5.0953 -5.0953 -5.0953 -5.0953 2.4960 2.4960 2.4960 2.4960 5.2256 5.2256 5.2256 5.2256 5.9864 5.9864 5.9864 5.9864 6.4458 6.4458 6.4458 6.4458 7.8490 7.8490 7.8490 7.8490 7.9147 7.9147 7.9147 7.9147 11.5000 11.5000 11.5000 11.5000 15.3493 15.3493 15.3493 15.3493 18.2231 18.2231 k = 0.5000 0.5000 0.1868 ( 3040 PWs) bands (ev): -9.8442 -9.8442 -9.8442 -9.8442 -8.7396 -8.7396 -8.7396 -8.7396 -7.8725 -7.8725 -7.8725 -7.8725 -7.4990 -7.4990 -7.4990 -7.4990 -5.7271 -5.7271 -5.7271 -5.7271 -5.4758 -5.4758 -5.4758 -5.4758 -5.0966 -5.0966 -5.0966 -5.0966 2.4299 2.4299 2.4299 2.4299 5.2481 5.2481 5.2481 5.2481 6.0064 6.0064 6.0064 6.0064 6.3922 6.3922 6.3922 6.3922 7.8564 7.8564 7.8564 7.8564 7.9141 7.9141 7.9141 7.9141 11.5064 11.5064 11.5064 11.5064 15.4052 15.4052 15.4052 15.4052 18.2027 18.2027 k = 0.5000 0.5000 0.2024 ( 3056 PWs) bands (ev): -9.8280 -9.8280 -9.8280 -9.8280 -8.7814 -8.7814 -8.7814 -8.7814 -7.8532 -7.8532 -7.8532 -7.8532 -7.4887 -7.4887 -7.4887 -7.4887 -5.7093 -5.7093 -5.7093 -5.7093 -5.4633 -5.4633 -5.4633 -5.4633 -5.0978 -5.0978 -5.0978 -5.0978 2.3609 2.3609 2.3609 2.3609 5.2719 5.2719 5.2719 5.2719 6.0220 6.0220 6.0220 6.0220 6.3413 6.3413 6.3413 6.3413 7.8632 7.8632 7.8632 7.8632 7.9134 7.9134 7.9134 7.9134 11.5126 11.5126 11.5126 11.5126 15.4639 15.4639 15.4639 15.4639 18.1813 18.1813 k = 0.5000 0.5000 0.2180 ( 3056 PWs) bands (ev): -9.8108 -9.8108 -9.8108 -9.8108 -8.8227 -8.8227 -8.8227 -8.8227 -7.8356 -7.8356 -7.8356 -7.8356 -7.4778 -7.4778 -7.4778 -7.4778 -5.6921 -5.6921 -5.6921 -5.6921 -5.4486 -5.4486 -5.4486 -5.4486 -5.0986 -5.0986 -5.0986 -5.0986 2.2893 2.2893 2.2893 2.2893 5.2966 5.2966 5.2966 5.2966 6.0290 6.0290 6.0290 6.0290 6.2974 6.2974 6.2974 6.2974 7.8693 7.8693 7.8693 7.8693 7.9128 7.9128 7.9128 7.9128 11.5184 11.5184 11.5184 11.5184 15.5249 15.5249 15.5249 15.5249 18.1592 18.1592 k = 0.5000 0.5000 0.2335 ( 3056 PWs) bands (ev): -9.7927 -9.7927 -9.7927 -9.7927 -8.8634 -8.8634 -8.8634 -8.8634 -7.8195 -7.8195 -7.8195 -7.8195 -7.4666 -7.4666 -7.4666 -7.4666 -5.6759 -5.6759 -5.6759 -5.6759 -5.4317 -5.4317 -5.4317 -5.4317 -5.0990 -5.0990 -5.0990 -5.0990 2.2155 2.2155 2.2155 2.2155 5.3219 5.3219 5.3219 5.3219 6.0215 6.0215 6.0215 6.0215 6.2670 6.2670 6.2670 6.2670 7.8746 7.8746 7.8746 7.8746 7.9123 7.9123 7.9123 7.9123 11.5237 11.5237 11.5237 11.5237 15.5878 15.5878 15.5878 15.5878 18.1366 18.1366 k = 0.5000 0.5000 0.2491 ( 3068 PWs) bands (ev): -9.7737 -9.7737 -9.7737 -9.7737 -8.9035 -8.9035 -8.9035 -8.9035 -7.8048 -7.8048 -7.8048 -7.8048 -7.4550 -7.4550 -7.4550 -7.4550 -5.6610 -5.6610 -5.6610 -5.6610 -5.4127 -5.4127 -5.4127 -5.4127 -5.0987 -5.0987 -5.0987 -5.0987 2.1400 2.1400 2.1400 2.1400 5.3473 5.3473 5.3473 5.3473 5.9954 5.9954 5.9954 5.9954 6.2547 6.2547 6.2547 6.2547 7.8790 7.8790 7.8790 7.8790 7.9118 7.9118 7.9118 7.9118 11.5284 11.5284 11.5284 11.5284 15.6520 15.6520 15.6520 15.6520 18.1140 18.1140 k = 0.5000 0.5000 0.2647 ( 3068 PWs) bands (ev): -9.7539 -9.7539 -9.7539 -9.7539 -8.9429 -8.9429 -8.9429 -8.9429 -7.7914 -7.7914 -7.7914 -7.7914 -7.4433 -7.4433 -7.4433 -7.4433 -5.6475 -5.6475 -5.6475 -5.6475 -5.3920 -5.3920 -5.3920 -5.3920 -5.0972 -5.0972 -5.0972 -5.0972 2.0632 2.0632 2.0632 2.0632 5.3721 5.3721 5.3721 5.3721 5.9539 5.9539 5.9539 5.9539 6.2581 6.2581 6.2581 6.2581 7.8825 7.8825 7.8825 7.8825 7.9113 7.9113 7.9113 7.9113 11.5323 11.5323 11.5323 11.5323 15.7172 15.7172 15.7172 15.7172 18.0916 18.0916 k = 0.5000 0.5000 0.2802 ( 3060 PWs) bands (ev): -9.7333 -9.7333 -9.7333 -9.7333 -8.9816 -8.9816 -8.9816 -8.9816 -7.7793 -7.7793 -7.7793 -7.7793 -7.4315 -7.4315 -7.4315 -7.4315 -5.6353 -5.6353 -5.6353 -5.6353 -5.3701 -5.3701 -5.3701 -5.3701 -5.0943 -5.0943 -5.0943 -5.0943 1.9854 1.9854 1.9854 1.9854 5.3949 5.3949 5.3949 5.3949 5.9043 5.9043 5.9043 5.9043 6.2712 6.2712 6.2712 6.2712 7.8852 7.8852 7.8852 7.8852 7.9108 7.9108 7.9108 7.9108 11.5354 11.5354 11.5354 11.5354 15.7828 15.7828 15.7828 15.7828 18.0697 18.0697 k = 0.5000 0.5000 0.2958 ( 3076 PWs) bands (ev): -9.7121 -9.7121 -9.7121 -9.7121 -9.0194 -9.0194 -9.0194 -9.0194 -7.7682 -7.7682 -7.7682 -7.7682 -7.4197 -7.4197 -7.4197 -7.4197 -5.6245 -5.6245 -5.6245 -5.6245 -5.3480 -5.3480 -5.3480 -5.3480 -5.0893 -5.0893 -5.0893 -5.0893 1.9070 1.9070 1.9070 1.9070 5.4137 5.4137 5.4137 5.4137 5.8534 5.8534 5.8534 5.8534 6.2895 6.2895 6.2895 6.2895 7.8869 7.8869 7.8869 7.8869 7.9103 7.9103 7.9103 7.9103 11.5374 11.5374 11.5374 11.5374 15.8483 15.8483 15.8483 15.8483 18.0488 18.0488 k = 0.5000 0.5000 0.3114 ( 3076 PWs) bands (ev): -9.6903 -9.6903 -9.6903 -9.6903 -9.0564 -9.0564 -9.0564 -9.0564 -7.7580 -7.7580 -7.7580 -7.7580 -7.4080 -7.4080 -7.4080 -7.4080 -5.6147 -5.6147 -5.6147 -5.6147 -5.3267 -5.3267 -5.3267 -5.3267 -5.0815 -5.0815 -5.0815 -5.0815 1.8282 1.8282 1.8282 1.8282 5.4252 5.4252 5.4252 5.4252 5.8074 5.8074 5.8074 5.8074 6.3102 6.3102 6.3102 6.3102 7.8880 7.8880 7.8880 7.8880 7.9096 7.9096 7.9096 7.9096 11.5385 11.5385 11.5385 11.5385 15.9131 15.9131 15.9131 15.9131 18.0291 18.0291 k = 0.5000 0.5000 0.3269 ( 3076 PWs) bands (ev): -9.6681 -9.6681 -9.6681 -9.6681 -9.0924 -9.0924 -9.0924 -9.0924 -7.7487 -7.7487 -7.7487 -7.7487 -7.3966 -7.3966 -7.3966 -7.3966 -5.6059 -5.6059 -5.6059 -5.6059 -5.3072 -5.3072 -5.3072 -5.3072 -5.0701 -5.0701 -5.0701 -5.0701 1.7495 1.7495 1.7495 1.7495 5.4243 5.4243 5.4243 5.4243 5.7725 5.7725 5.7725 5.7725 6.3321 6.3321 6.3321 6.3321 7.8883 7.8883 7.8883 7.8883 7.9087 7.9087 7.9087 7.9087 11.5384 11.5384 11.5384 11.5384 15.9770 15.9770 15.9770 15.9770 18.0109 18.0109 k = 0.5000 0.5000 0.3425 ( 3076 PWs) bands (ev): -9.6455 -9.6455 -9.6455 -9.6455 -9.1273 -9.1273 -9.1273 -9.1273 -7.7401 -7.7401 -7.7401 -7.7401 -7.3854 -7.3854 -7.3854 -7.3854 -5.5978 -5.5978 -5.5978 -5.5978 -5.2907 -5.2907 -5.2907 -5.2907 -5.0544 -5.0544 -5.0544 -5.0544 1.6710 1.6710 1.6710 1.6710 5.4067 5.4067 5.4067 5.4067 5.7543 5.7543 5.7543 5.7543 6.3543 6.3543 6.3543 6.3543 7.8881 7.8881 7.8881 7.8881 7.9074 7.9074 7.9074 7.9074 11.5372 11.5372 11.5372 11.5372 16.0392 16.0392 16.0392 16.0392 17.9946 17.9946 k = 0.5000 0.5000 0.3581 ( 3084 PWs) bands (ev): -9.6227 -9.6227 -9.6227 -9.6227 -9.1612 -9.1612 -9.1612 -9.1612 -7.7322 -7.7322 -7.7322 -7.7322 -7.3745 -7.3745 -7.3745 -7.3745 -5.5904 -5.5904 -5.5904 -5.5904 -5.2778 -5.2778 -5.2778 -5.2778 -5.0341 -5.0341 -5.0341 -5.0341 1.5932 1.5932 1.5932 1.5932 5.3717 5.3717 5.3717 5.3717 5.7538 5.7538 5.7538 5.7538 6.3763 6.3763 6.3763 6.3763 7.8874 7.8874 7.8874 7.8874 7.9057 7.9057 7.9057 7.9057 11.5348 11.5348 11.5348 11.5348 16.0994 16.0994 16.0994 16.0994 17.9803 17.9803 k = 0.5000 0.5000 0.3736 ( 3084 PWs) bands (ev): -9.5997 -9.5997 -9.5997 -9.5997 -9.1940 -9.1940 -9.1940 -9.1940 -7.7249 -7.7249 -7.7249 -7.7249 -7.3639 -7.3639 -7.3639 -7.3639 -5.5834 -5.5834 -5.5834 -5.5834 -5.2685 -5.2685 -5.2685 -5.2685 -5.0094 -5.0094 -5.0094 -5.0094 1.5162 1.5162 1.5162 1.5162 5.3234 5.3234 5.3234 5.3234 5.7675 5.7675 5.7675 5.7675 6.3979 6.3979 6.3979 6.3979 7.8863 7.8863 7.8863 7.8863 7.9035 7.9035 7.9035 7.9035 11.5313 11.5313 11.5313 11.5313 16.1571 16.1571 16.1571 16.1571 17.9683 17.9683 k = 0.5000 0.5000 0.3892 ( 3092 PWs) bands (ev): -9.5768 -9.5768 -9.5768 -9.5768 -9.2255 -9.2255 -9.2255 -9.2255 -7.7181 -7.7181 -7.7181 -7.7181 -7.3538 -7.3538 -7.3538 -7.3538 -5.5768 -5.5768 -5.5768 -5.5768 -5.2625 -5.2625 -5.2625 -5.2625 -4.9810 -4.9810 -4.9810 -4.9810 1.4404 1.4404 1.4404 1.4404 5.2667 5.2667 5.2667 5.2667 5.7905 5.7905 5.7905 5.7905 6.4189 6.4189 6.4189 6.4189 7.8846 7.8846 7.8846 7.8846 7.9009 7.9009 7.9009 7.9009 11.5266 11.5266 11.5266 11.5266 16.2119 16.2119 16.2119 16.2119 17.9587 17.9587 k = 0.5000 0.5000 0.4048 ( 3092 PWs) bands (ev): -9.5539 -9.5539 -9.5539 -9.5539 -9.2557 -9.2557 -9.2557 -9.2557 -7.7118 -7.7118 -7.7118 -7.7118 -7.3440 -7.3440 -7.3440 -7.3440 -5.5705 -5.5705 -5.5705 -5.5705 -5.2593 -5.2593 -5.2593 -5.2593 -4.9497 -4.9497 -4.9497 -4.9497 1.3659 1.3659 1.3659 1.3659 5.2054 5.2054 5.2054 5.2054 5.8194 5.8194 5.8194 5.8194 6.4391 6.4391 6.4391 6.4391 7.8822 7.8822 7.8822 7.8822 7.8980 7.8980 7.8980 7.8980 11.5210 11.5210 11.5210 11.5210 16.2634 16.2634 16.2634 16.2634 17.9517 17.9517 k = 0.5000 0.5000 0.4203 ( 3092 PWs) bands (ev): -9.5315 -9.5315 -9.5315 -9.5315 -9.2844 -9.2844 -9.2844 -9.2844 -7.7059 -7.7059 -7.7059 -7.7059 -7.3347 -7.3347 -7.3347 -7.3347 -5.5645 -5.5645 -5.5645 -5.5645 -5.2582 -5.2582 -5.2582 -5.2582 -4.9164 -4.9164 -4.9164 -4.9164 1.2931 1.2931 1.2931 1.2931 5.1420 5.1420 5.1420 5.1420 5.8520 5.8520 5.8520 5.8520 6.4586 6.4586 6.4586 6.4586 7.8790 7.8790 7.8790 7.8790 7.8952 7.8952 7.8952 7.8952 11.5143 11.5143 11.5143 11.5143 16.3111 16.3111 16.3111 16.3111 17.9474 17.9474 k = 0.5000 0.5000 0.4359 ( 3084 PWs) bands (ev): -9.5096 -9.5096 -9.5096 -9.5096 -9.3116 -9.3116 -9.3116 -9.3116 -7.7004 -7.7004 -7.7004 -7.7004 -7.3259 -7.3259 -7.3259 -7.3259 -5.5586 -5.5586 -5.5586 -5.5586 -5.2587 -5.2587 -5.2587 -5.2587 -4.8817 -4.8817 -4.8817 -4.8817 1.2221 1.2221 1.2221 1.2221 5.0779 5.0779 5.0779 5.0779 5.8867 5.8867 5.8867 5.8867 6.4772 6.4772 6.4772 6.4772 7.8748 7.8748 7.8748 7.8748 7.8926 7.8926 7.8926 7.8926 11.5068 11.5068 11.5068 11.5068 16.3550 16.3550 16.3550 16.3550 17.9456 17.9456 k = 0.5000 0.5000 0.4515 ( 3092 PWs) bands (ev): -9.4888 -9.4888 -9.4888 -9.4888 -9.3366 -9.3366 -9.3366 -9.3366 -7.6953 -7.6953 -7.6953 -7.6953 -7.3175 -7.3175 -7.3175 -7.3175 -5.5529 -5.5529 -5.5529 -5.5529 -5.2605 -5.2605 -5.2605 -5.2605 -4.8463 -4.8463 -4.8463 -4.8463 1.1533 1.1533 1.1533 1.1533 5.0141 5.0141 5.0141 5.0141 5.9229 5.9229 5.9229 5.9229 6.4948 6.4948 6.4948 6.4948 7.8694 7.8694 7.8694 7.8694 7.8903 7.8903 7.8903 7.8903 11.4985 11.4985 11.4985 11.4985 16.3947 16.3947 16.3947 16.3947 17.9464 17.9464 k = 0.5000 0.5000 0.4671 ( 3092 PWs) bands (ev): -9.4701 -9.4701 -9.4701 -9.4701 -9.3588 -9.3588 -9.3588 -9.3588 -7.6905 -7.6905 -7.6905 -7.6905 -7.3095 -7.3095 -7.3095 -7.3095 -5.5472 -5.5472 -5.5472 -5.5472 -5.2632 -5.2632 -5.2632 -5.2632 -4.8107 -4.8107 -4.8107 -4.8107 1.0867 1.0867 1.0867 1.0867 4.9514 4.9514 4.9514 4.9514 5.9597 5.9597 5.9597 5.9597 6.5116 6.5116 6.5116 6.5116 7.8629 7.8629 7.8629 7.8629 7.8884 7.8884 7.8884 7.8884 11.4896 11.4896 11.4896 11.4896 16.4302 16.4302 16.4302 16.4302 17.9497 17.9497 k = 0.5000 0.5000 0.4826 ( 3100 PWs) bands (ev): -9.4559 -9.4559 -9.4559 -9.4559 -9.3758 -9.3758 -9.3758 -9.3758 -7.6860 -7.6860 -7.6860 -7.6860 -7.3021 -7.3021 -7.3021 -7.3021 -5.5418 -5.5418 -5.5418 -5.5418 -5.2666 -5.2666 -5.2666 -5.2666 -4.7753 -4.7753 -4.7753 -4.7753 1.0227 1.0227 1.0227 1.0227 4.8903 4.8903 4.8903 4.8903 5.9967 5.9967 5.9967 5.9967 6.5275 6.5275 6.5275 6.5275 7.8555 7.8555 7.8555 7.8555 7.8867 7.8867 7.8867 7.8867 11.4801 11.4801 11.4801 11.4801 16.4614 16.4614 16.4614 16.4614 17.9552 17.9552 k = 0.5000 0.5000 0.4982 ( 3092 PWs) bands (ev): -9.4511 -9.4511 -9.4511 -9.4511 -9.3825 -9.3825 -9.3825 -9.3825 -7.6819 -7.6819 -7.6819 -7.6819 -7.2951 -7.2951 -7.2951 -7.2951 -5.5364 -5.5364 -5.5364 -5.5364 -5.2705 -5.2705 -5.2705 -5.2705 -4.7406 -4.7406 -4.7406 -4.7406 0.9615 0.9615 0.9615 0.9615 4.8313 4.8313 4.8313 4.8313 6.0336 6.0336 6.0336 6.0336 6.5425 6.5425 6.5425 6.5425 7.8472 7.8472 7.8472 7.8472 7.8852 7.8852 7.8852 7.8852 11.4702 11.4702 11.4702 11.4702 16.4885 16.4885 16.4885 16.4885 17.9627 17.9627 k = 0.5000 0.5000 0.5138 ( 3092 PWs) bands (ev): -9.4585 -9.4585 -9.4585 -9.4585 -9.3765 -9.3765 -9.3765 -9.3765 -7.6780 -7.6780 -7.6780 -7.6780 -7.2885 -7.2885 -7.2885 -7.2885 -5.5311 -5.5311 -5.5311 -5.5311 -5.2747 -5.2747 -5.2747 -5.2747 -4.7068 -4.7068 -4.7068 -4.7068 0.9031 0.9031 0.9031 0.9031 4.7746 4.7746 4.7746 4.7746 6.0699 6.0699 6.0699 6.0699 6.5567 6.5567 6.5567 6.5567 7.8384 7.8384 7.8384 7.8384 7.8839 7.8839 7.8839 7.8839 11.4602 11.4602 11.4602 11.4602 16.5115 16.5115 16.5115 16.5115 17.9719 17.9719 k = 0.5000 0.5000 0.5293 ( 3092 PWs) bands (ev): -9.4725 -9.4725 -9.4725 -9.4725 -9.3633 -9.3633 -9.3633 -9.3633 -7.6743 -7.6743 -7.6743 -7.6743 -7.2824 -7.2824 -7.2824 -7.2824 -5.5259 -5.5259 -5.5259 -5.5259 -5.2792 -5.2792 -5.2792 -5.2792 -4.6741 -4.6741 -4.6741 -4.6741 0.8479 0.8479 0.8479 0.8479 4.7206 4.7206 4.7206 4.7206 6.1053 6.1053 6.1053 6.1053 6.5700 6.5700 6.5700 6.5700 7.8290 7.8290 7.8290 7.8290 7.8826 7.8826 7.8826 7.8826 11.4500 11.4500 11.4500 11.4500 16.5307 16.5307 16.5307 16.5307 17.9825 17.9825 k = 0.5000 0.5000 0.5449 ( 3092 PWs) bands (ev): -9.4883 -9.4883 -9.4883 -9.4883 -9.3479 -9.3479 -9.3479 -9.3479 -7.6710 -7.6710 -7.6710 -7.6710 -7.2768 -7.2768 -7.2768 -7.2768 -5.5209 -5.5209 -5.5209 -5.5209 -5.2838 -5.2838 -5.2838 -5.2838 -4.6429 -4.6429 -4.6429 -4.6429 0.7960 0.7960 0.7960 0.7960 4.6695 4.6695 4.6695 4.6695 6.1396 6.1396 6.1396 6.1396 6.5824 6.5824 6.5824 6.5824 7.8192 7.8192 7.8192 7.8192 7.8815 7.8815 7.8815 7.8815 11.4399 11.4399 11.4399 11.4399 16.5465 16.5465 16.5465 16.5465 17.9940 17.9940 k = 0.5000 0.5000 0.5605 ( 3076 PWs) bands (ev): -9.5039 -9.5039 -9.5039 -9.5039 -9.3322 -9.3322 -9.3322 -9.3322 -7.6679 -7.6679 -7.6679 -7.6679 -7.2716 -7.2716 -7.2716 -7.2716 -5.5160 -5.5160 -5.5160 -5.5160 -5.2884 -5.2884 -5.2884 -5.2884 -4.6134 -4.6134 -4.6134 -4.6134 0.7476 0.7476 0.7476 0.7476 4.6217 4.6217 4.6217 4.6217 6.1724 6.1724 6.1724 6.1724 6.5941 6.5941 6.5941 6.5941 7.8092 7.8092 7.8092 7.8092 7.8805 7.8805 7.8805 7.8805 11.4300 11.4300 11.4300 11.4300 16.5591 16.5591 16.5591 16.5591 18.0061 18.0061 k = 0.5000 0.5000 0.5760 ( 3084 PWs) bands (ev): -9.5188 -9.5188 -9.5188 -9.5188 -9.3170 -9.3170 -9.3170 -9.3170 -7.6651 -7.6651 -7.6651 -7.6651 -7.2669 -7.2669 -7.2669 -7.2669 -5.5113 -5.5113 -5.5113 -5.5113 -5.2930 -5.2930 -5.2930 -5.2930 -4.5858 -4.5858 -4.5858 -4.5858 0.7028 0.7028 0.7028 0.7028 4.5773 4.5773 4.5773 4.5773 6.2035 6.2035 6.2035 6.2035 6.6049 6.6049 6.6049 6.6049 7.7991 7.7991 7.7991 7.7991 7.8795 7.8795 7.8795 7.8795 11.4204 11.4204 11.4204 11.4204 16.5690 16.5690 16.5690 16.5690 18.0185 18.0185 k = 0.5000 0.5000 0.5916 ( 3084 PWs) bands (ev): -9.5326 -9.5326 -9.5326 -9.5326 -9.3027 -9.3027 -9.3027 -9.3027 -7.6625 -7.6625 -7.6625 -7.6625 -7.2627 -7.2627 -7.2627 -7.2627 -5.5068 -5.5068 -5.5068 -5.5068 -5.2975 -5.2975 -5.2975 -5.2975 -4.5602 -4.5602 -4.5602 -4.5602 0.6618 0.6618 0.6618 0.6618 4.5365 4.5365 4.5365 4.5365 6.2326 6.2326 6.2326 6.2326 6.6150 6.6150 6.6150 6.6150 7.7891 7.7891 7.7891 7.7891 7.8787 7.8787 7.8787 7.8787 11.4113 11.4113 11.4113 11.4113 16.5765 16.5765 16.5765 16.5765 18.0307 18.0307 k = 0.5000 0.5000 0.6072 ( 3084 PWs) bands (ev): -9.5451 -9.5451 -9.5451 -9.5451 -9.2895 -9.2895 -9.2895 -9.2895 -7.6602 -7.6602 -7.6602 -7.6602 -7.2589 -7.2589 -7.2589 -7.2589 -5.5026 -5.5026 -5.5026 -5.5026 -5.3018 -5.3018 -5.3018 -5.3018 -4.5369 -4.5369 -4.5369 -4.5369 0.6247 0.6247 0.6247 0.6247 4.4995 4.4995 4.4995 4.4995 6.2593 6.2593 6.2593 6.2593 6.6242 6.6242 6.6242 6.6242 7.7794 7.7794 7.7794 7.7794 7.8779 7.8779 7.8779 7.8779 11.4028 11.4028 11.4028 11.4028 16.5821 16.5821 16.5821 16.5821 18.0425 18.0425 k = 0.5000 0.5000 0.6227 ( 3084 PWs) bands (ev): -9.5563 -9.5563 -9.5563 -9.5563 -9.2776 -9.2776 -9.2776 -9.2776 -7.6581 -7.6581 -7.6581 -7.6581 -7.2555 -7.2555 -7.2555 -7.2555 -5.4988 -5.4988 -5.4988 -5.4988 -5.3058 -5.3058 -5.3058 -5.3058 -4.5159 -4.5159 -4.5159 -4.5159 0.5917 0.5917 0.5917 0.5917 4.4665 4.4665 4.4665 4.4665 6.2835 6.2835 6.2835 6.2835 6.6327 6.6327 6.6327 6.6327 7.7702 7.7702 7.7702 7.7702 7.8772 7.8772 7.8772 7.8772 11.3950 11.3950 11.3950 11.3950 16.5861 16.5861 16.5861 16.5861 18.0536 18.0536 k = 0.5000 0.5000 0.6383 ( 3068 PWs) bands (ev): -9.5660 -9.5660 -9.5660 -9.5660 -9.2671 -9.2671 -9.2671 -9.2671 -7.6564 -7.6564 -7.6564 -7.6564 -7.2526 -7.2526 -7.2526 -7.2526 -5.4952 -5.4952 -5.4952 -5.4952 -5.3094 -5.3094 -5.3094 -5.3094 -4.4975 -4.4975 -4.4975 -4.4975 0.5628 0.5628 0.5628 0.5628 4.4376 4.4376 4.4376 4.4376 6.3049 6.3049 6.3049 6.3049 6.6402 6.6402 6.6402 6.6402 7.7616 7.7616 7.7616 7.7616 7.8766 7.8766 7.8766 7.8766 11.3881 11.3881 11.3881 11.3881 16.5888 16.5888 16.5888 16.5888 18.0637 18.0637 k = 0.5000 0.5000 0.6539 ( 3088 PWs) bands (ev): -9.5743 -9.5743 -9.5743 -9.5743 -9.2581 -9.2581 -9.2581 -9.2581 -7.6548 -7.6548 -7.6548 -7.6548 -7.2502 -7.2502 -7.2502 -7.2502 -5.4921 -5.4921 -5.4921 -5.4921 -5.3127 -5.3127 -5.3127 -5.3127 -4.4817 -4.4817 -4.4817 -4.4817 0.5382 0.5382 0.5382 0.5382 4.4129 4.4129 4.4129 4.4129 6.3234 6.3234 6.3234 6.3234 6.6468 6.6468 6.6468 6.6468 7.7539 7.7539 7.7539 7.7539 7.8761 7.8761 7.8761 7.8761 11.3820 11.3820 11.3820 11.3820 16.5905 16.5905 16.5905 16.5905 18.0725 18.0725 k = 0.5000 0.5000 0.6694 ( 3088 PWs) bands (ev): -9.5811 -9.5811 -9.5811 -9.5811 -9.2506 -9.2506 -9.2506 -9.2506 -7.6536 -7.6536 -7.6536 -7.6536 -7.2482 -7.2482 -7.2482 -7.2482 -5.4895 -5.4895 -5.4895 -5.4895 -5.3155 -5.3155 -5.3155 -5.3155 -4.4686 -4.4686 -4.4686 -4.4686 0.5180 0.5180 0.5180 0.5180 4.3926 4.3926 4.3926 4.3926 6.3386 6.3386 6.3386 6.3386 6.6524 6.6524 6.6524 6.6524 7.7473 7.7473 7.7473 7.7473 7.8756 7.8756 7.8756 7.8756 11.3769 11.3769 11.3769 11.3769 16.5916 16.5916 16.5916 16.5916 18.0800 18.0800 k = 0.5000 0.5000 0.6850 ( 3088 PWs) bands (ev): -9.5864 -9.5864 -9.5864 -9.5864 -9.2447 -9.2447 -9.2447 -9.2447 -7.6526 -7.6526 -7.6526 -7.6526 -7.2466 -7.2466 -7.2466 -7.2466 -5.4873 -5.4873 -5.4873 -5.4873 -5.3177 -5.3177 -5.3177 -5.3177 -4.4584 -4.4584 -4.4584 -4.4584 0.5022 0.5022 0.5022 0.5022 4.3766 4.3766 4.3766 4.3766 6.3507 6.3507 6.3507 6.3507 6.6569 6.6569 6.6569 6.6569 7.7420 7.7420 7.7420 7.7420 7.8753 7.8753 7.8753 7.8753 11.3729 11.3729 11.3729 11.3729 16.5922 16.5922 16.5922 16.5922 18.0859 18.0859 k = 0.5000 0.5000 0.7006 ( 3088 PWs) bands (ev): -9.5902 -9.5902 -9.5902 -9.5902 -9.2405 -9.2405 -9.2405 -9.2405 -7.6519 -7.6519 -7.6519 -7.6519 -7.2455 -7.2455 -7.2455 -7.2455 -5.4858 -5.4858 -5.4858 -5.4858 -5.3194 -5.3194 -5.3194 -5.3194 -4.4510 -4.4510 -4.4510 -4.4510 0.4908 0.4908 0.4908 0.4908 4.3652 4.3652 4.3652 4.3652 6.3593 6.3593 6.3593 6.3593 6.6602 6.6602 6.6602 6.6602 7.7381 7.7381 7.7381 7.7381 7.8751 7.8751 7.8751 7.8751 11.3700 11.3700 11.3700 11.3700 16.5925 16.5925 16.5925 16.5925 18.0902 18.0902 k = 0.5000 0.5000 0.7161 ( 3072 PWs) bands (ev): -9.5925 -9.5925 -9.5925 -9.5925 -9.2379 -9.2379 -9.2379 -9.2379 -7.6515 -7.6515 -7.6515 -7.6515 -7.2448 -7.2448 -7.2448 -7.2448 -5.4848 -5.4848 -5.4848 -5.4848 -5.3204 -5.3204 -5.3204 -5.3204 -4.4465 -4.4465 -4.4465 -4.4465 0.4840 0.4840 0.4840 0.4840 4.3583 4.3583 4.3583 4.3583 6.3645 6.3645 6.3645 6.3645 6.6622 6.6622 6.6622 6.6622 7.7357 7.7357 7.7357 7.7357 7.8749 7.8749 7.8749 7.8749 11.3683 11.3683 11.3683 11.3683 16.5927 16.5927 16.5927 16.5927 18.0929 18.0929 k = 0.5000 0.5000 0.7317 ( 3072 PWs) bands (ev): -9.5933 -9.5933 -9.5933 -9.5933 -9.2371 -9.2371 -9.2371 -9.2371 -7.6514 -7.6514 -7.6514 -7.6514 -7.2446 -7.2446 -7.2446 -7.2446 -5.4845 -5.4845 -5.4845 -5.4845 -5.3207 -5.3207 -5.3207 -5.3207 -4.4451 -4.4451 -4.4451 -4.4451 0.4817 0.4817 0.4817 0.4817 4.3561 4.3561 4.3561 4.3561 6.3662 6.3662 6.3662 6.3662 6.6628 6.6628 6.6628 6.6628 7.7348 7.7348 7.7348 7.7348 7.8749 7.8749 7.8749 7.8749 11.3677 11.3677 11.3677 11.3677 16.5927 16.5927 16.5927 16.5927 18.0938 18.0938 Writing output data file PbO2.save init_run : 0.17s CPU 0.31s WALL ( 1 calls) electrons : 161.16s CPU 163.90s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.01s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 161.14s CPU 163.89s 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 : 0.03s CPU 0.05s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.04s WALL ( 368 calls) cegterg : 149.21s CPU 151.46s WALL ( 508 calls) Called by sum_band: Called by *egterg: h_psi : 72.58s CPU 74.30s WALL ( 8321 calls) s_psi : 4.22s CPU 4.20s WALL ( 8321 calls) g_psi : 0.22s CPU 0.21s WALL ( 7445 calls) cdiaghg : 65.08s CPU 65.96s WALL ( 7813 calls) cegterg:over : 6.09s CPU 6.15s WALL ( 7445 calls) cegterg:upda : 4.52s CPU 4.42s WALL ( 7445 calls) cegterg:last : 2.67s CPU 2.66s WALL ( 1244 calls) cdiaghg:chol : 3.56s CPU 3.62s WALL ( 7813 calls) cdiaghg:inve : 2.72s CPU 2.62s WALL ( 7813 calls) cdiaghg:para : 4.10s CPU 4.15s WALL ( 15626 calls) Called by h_psi: h_psi:vloc : 62.25s CPU 63.84s WALL ( 8321 calls) h_psi:vnl : 10.09s CPU 10.25s WALL ( 8321 calls) add_vuspsi : 4.98s CPU 5.06s WALL ( 8321 calls) General routines calbec : 5.07s CPU 5.17s WALL ( 8321 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 57.97s CPU 59.18s WALL ( 962260 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.20s CPU 0.25s WALL ( 736 calls) Parallel routines fft_scatter : 23.33s CPU 24.20s WALL ( 962283 calls) PWSCF : 2m58.46s CPU 3m18.31s WALL This run was terminated on: 21: 0: 3 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. 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