Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 20:34:31 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: ./KCdAs.save/ file Cd.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4D 4D renormalized file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 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 104 27 8 8354 1071 174 Max 105 28 9 8363 1103 178 Sum 3761 973 293 300897 39161 6333 bravais-lattice index = 14 lattice parameter (alat) = 8.5983 a.u. unit-cell volume = 1102.8499 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 41.0000 Ry charge density cutoff = 639.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.598253 celldm(2)= 1.000000 celldm(3)= 1.734945 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.734945 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.576387 ) PseudoPot. # 1 for Cd read from file: /users/gautes/Pseudo/Cd.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1d41bce1441572f114805845d9d822b0 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1239 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for As read from file: /users/gautes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1209 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for K read from file: /users/gautes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Cd 12.00 112.41100 Cd( 1.00) As 5.00 74.92160 As( 1.00) K 9.00 39.09830 K( 1.00) 16 Sym. Ops., with inversion, found (12 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) f =( -0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) f =( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) f =( 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 9 inversion cryst. s( 9) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 9) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(10) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(10) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) f =( -0.5000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) f =( -0.5000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) double point group D_4h(4/mmm) there are 14 classes and 4 irreducible representations the character table: E -E 2C4 -2C4 C2 2C2' 2C2'' i -i 2S4 -2S4 s_h -C2 -2C2' -2C2' -s_h G_6+ 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 2.00 -2.00 1.41 -1.41 0.00 G_7+ 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 2.00 -2.00 -1.41 1.41 0.00 G_6- 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 -2.00 2.00 -1.41 1.41 0.00 G_7- 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 -2.00 2.00 1.41 -1.41 0.00 2s_v 2s_d -2s_v -2s_d G_6+ 0.00 0.00 G_7+ 0.00 0.00 G_6- 0.00 0.00 G_7- 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C4 7 8 90 deg rotation - cart. axis [0,0,-1] -2C4 -7 -8 90 deg rotation - cart. axis [0,0,-1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 2C2'-2C2' 3 -3 4 -4 180 deg rotation - cart. axis [0,1,0] 2C2''-2C2' 5 -5 6 -6 180 deg rotation - cart. axis [1,1,0] i 9 inversion -i -9 inversion E 2S4 15 16 inv. 90 deg rotation - cart. axis [0,0,-1] -2S4 -15 -16 inv. 90 deg rotation - cart. axis [0,0,-1] E s_h -s_h 10 -10 inv. 180 deg rotation - cart. axis [0,0,1] 2s_v-2s_v 11 -11 12 -12 inv. 180 deg rotation - cart. axis [0,1,0] 2s_d-2s_d 13 -13 14 -14 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 307 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 2) = ( 0.0000000 0.0142857 -0.0000000), wk = 0.0032573 k( 3) = ( 0.0000000 0.0285714 -0.0000000), wk = 0.0032573 k( 4) = ( 0.0000000 0.0428571 -0.0000000), wk = 0.0032573 k( 5) = ( 0.0000000 0.0571429 -0.0000000), wk = 0.0032573 k( 6) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0032573 k( 7) = ( 0.0000000 0.0857143 -0.0000000), wk = 0.0032573 k( 8) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0032573 k( 9) = ( 0.0000000 0.1142857 -0.0000000), wk = 0.0032573 k( 10) = ( 0.0000000 0.1285714 -0.0000000), wk = 0.0032573 k( 11) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0032573 k( 12) = ( 0.0000000 0.1571429 -0.0000000), wk = 0.0032573 k( 13) = ( 0.0000000 0.1714286 -0.0000000), wk = 0.0032573 k( 14) = ( 0.0000000 0.1857143 -0.0000000), wk = 0.0032573 k( 15) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0032573 k( 16) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0032573 k( 17) = ( 0.0000000 0.2285714 -0.0000000), wk = 0.0032573 k( 18) = ( 0.0000000 0.2428571 -0.0000000), wk = 0.0032573 k( 19) = ( 0.0000000 0.2571429 -0.0000000), wk = 0.0032573 k( 20) = ( 0.0000000 0.2714286 -0.0000000), wk = 0.0032573 k( 21) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0032573 k( 22) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0032573 k( 23) = ( 0.0000000 0.3142857 -0.0000000), wk = 0.0032573 k( 24) = ( 0.0000000 0.3285714 -0.0000000), wk = 0.0032573 k( 25) = ( 0.0000000 0.3428571 -0.0000000), wk = 0.0032573 k( 26) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0032573 k( 27) = ( 0.0000000 0.3714286 -0.0000000), wk = 0.0032573 k( 28) = ( 0.0000000 0.3857143 -0.0000000), wk = 0.0032573 k( 29) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0032573 k( 30) = ( 0.0000000 0.4142857 -0.0000000), wk = 0.0032573 k( 31) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0032573 k( 32) = ( 0.0000000 0.4428571 -0.0000000), wk = 0.0032573 k( 33) = ( 0.0000000 0.4571429 -0.0000000), wk = 0.0032573 k( 34) = ( 0.0000000 0.4714286 -0.0000000), wk = 0.0032573 k( 35) = ( 0.0000000 0.4857143 -0.0000000), wk = 0.0032573 k( 36) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032573 k( 37) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032573 k( 38) = ( 0.0142857 0.5000000 -0.0000000), wk = 0.0032573 k( 39) = ( 0.0285714 0.5000000 -0.0000000), wk = 0.0032573 k( 40) = ( 0.0428571 0.5000000 -0.0000000), wk = 0.0032573 k( 41) = ( 0.0571429 0.5000000 -0.0000000), wk = 0.0032573 k( 42) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0032573 k( 43) = ( 0.0857143 0.5000000 -0.0000000), wk = 0.0032573 k( 44) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0032573 k( 45) = ( 0.1142857 0.5000000 -0.0000000), wk = 0.0032573 k( 46) = ( 0.1285714 0.5000000 -0.0000000), wk = 0.0032573 k( 47) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0032573 k( 48) = ( 0.1571429 0.5000000 -0.0000000), wk = 0.0032573 k( 49) = ( 0.1714286 0.5000000 -0.0000000), wk = 0.0032573 k( 50) = ( 0.1857143 0.5000000 -0.0000000), wk = 0.0032573 k( 51) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0032573 k( 52) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0032573 k( 53) = ( 0.2285714 0.5000000 -0.0000000), wk = 0.0032573 k( 54) = ( 0.2428571 0.5000000 -0.0000000), wk = 0.0032573 k( 55) = ( 0.2571429 0.5000000 -0.0000000), wk = 0.0032573 k( 56) = ( 0.2714286 0.5000000 -0.0000000), wk = 0.0032573 k( 57) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0032573 k( 58) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0032573 k( 59) = ( 0.3142857 0.5000000 -0.0000000), wk = 0.0032573 k( 60) = ( 0.3285714 0.5000000 -0.0000000), wk = 0.0032573 k( 61) = ( 0.3428571 0.5000000 -0.0000000), wk = 0.0032573 k( 62) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0032573 k( 63) = ( 0.3714286 0.5000000 -0.0000000), wk = 0.0032573 k( 64) = ( 0.3857143 0.5000000 -0.0000000), wk = 0.0032573 k( 65) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0032573 k( 66) = ( 0.4142857 0.5000000 -0.0000000), wk = 0.0032573 k( 67) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0032573 k( 68) = ( 0.4428571 0.5000000 -0.0000000), wk = 0.0032573 k( 69) = ( 0.4571429 0.5000000 -0.0000000), wk = 0.0032573 k( 70) = ( 0.4714286 0.5000000 -0.0000000), wk = 0.0032573 k( 71) = ( 0.4857143 0.5000000 -0.0000000), wk = 0.0032573 k( 72) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032573 k( 73) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032573 k( 74) = ( 0.4897959 0.4897959 -0.0000000), wk = 0.0032573 k( 75) = ( 0.4795918 0.4795918 -0.0000000), wk = 0.0032573 k( 76) = ( 0.4693878 0.4693878 -0.0000000), wk = 0.0032573 k( 77) = ( 0.4591837 0.4591837 -0.0000000), wk = 0.0032573 k( 78) = ( 0.4489796 0.4489796 -0.0000000), wk = 0.0032573 k( 79) = ( 0.4387755 0.4387755 -0.0000000), wk = 0.0032573 k( 80) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0032573 k( 81) = ( 0.4183674 0.4183673 -0.0000000), wk = 0.0032573 k( 82) = ( 0.4081633 0.4081633 -0.0000000), wk = 0.0032573 k( 83) = ( 0.3979592 0.3979592 -0.0000000), wk = 0.0032573 k( 84) = ( 0.3877551 0.3877551 -0.0000000), wk = 0.0032573 k( 85) = ( 0.3775510 0.3775510 -0.0000000), wk = 0.0032573 k( 86) = ( 0.3673469 0.3673469 -0.0000000), wk = 0.0032573 k( 87) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0032573 k( 88) = ( 0.3469388 0.3469388 -0.0000000), wk = 0.0032573 k( 89) = ( 0.3367347 0.3367347 -0.0000000), wk = 0.0032573 k( 90) = ( 0.3265306 0.3265306 -0.0000000), wk = 0.0032573 k( 91) = ( 0.3163265 0.3163265 -0.0000000), wk = 0.0032573 k( 92) = ( 0.3061224 0.3061224 -0.0000000), wk = 0.0032573 k( 93) = ( 0.2959184 0.2959184 -0.0000000), wk = 0.0032573 k( 94) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0032573 k( 95) = ( 0.2755102 0.2755102 -0.0000000), wk = 0.0032573 k( 96) = ( 0.2653061 0.2653061 -0.0000000), wk = 0.0032573 k( 97) = ( 0.2551020 0.2551020 -0.0000000), wk = 0.0032573 k( 98) = ( 0.2448980 0.2448980 -0.0000000), wk = 0.0032573 k( 99) = ( 0.2346939 0.2346939 -0.0000000), wk = 0.0032573 k( 100) = ( 0.2244898 0.2244898 -0.0000000), wk = 0.0032573 k( 101) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0032573 k( 102) = ( 0.2040816 0.2040816 -0.0000000), wk = 0.0032573 k( 103) = ( 0.1938776 0.1938775 -0.0000000), wk = 0.0032573 k( 104) = ( 0.1836735 0.1836735 -0.0000000), wk = 0.0032573 k( 105) = ( 0.1734694 0.1734694 -0.0000000), wk = 0.0032573 k( 106) = ( 0.1632653 0.1632653 -0.0000000), wk = 0.0032573 k( 107) = ( 0.1530612 0.1530612 -0.0000000), wk = 0.0032573 k( 108) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0032573 k( 109) = ( 0.1326531 0.1326531 -0.0000000), wk = 0.0032573 k( 110) = ( 0.1224490 0.1224490 -0.0000000), wk = 0.0032573 k( 111) = ( 0.1122449 0.1122449 -0.0000000), wk = 0.0032573 k( 112) = ( 0.1020408 0.1020408 -0.0000000), wk = 0.0032573 k( 113) = ( 0.0918367 0.0918367 -0.0000000), wk = 0.0032573 k( 114) = ( 0.0816327 0.0816326 -0.0000000), wk = 0.0032573 k( 115) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0032573 k( 116) = ( 0.0612245 0.0612245 -0.0000000), wk = 0.0032573 k( 117) = ( 0.0510204 0.0510204 -0.0000000), wk = 0.0032573 k( 118) = ( 0.0408163 0.0408163 -0.0000000), wk = 0.0032573 k( 119) = ( 0.0306122 0.0306122 -0.0000000), wk = 0.0032573 k( 120) = ( 0.0204082 0.0204082 -0.0000000), wk = 0.0032573 k( 121) = ( 0.0102041 0.0102041 -0.0000000), wk = 0.0032573 k( 122) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 124) = ( 0.0000000 0.0000000 0.0144097), wk = 0.0032573 k( 125) = ( 0.0000000 0.0000000 0.0288194), wk = 0.0032573 k( 126) = ( 0.0000000 0.0000000 0.0432290), wk = 0.0032573 k( 127) = ( 0.0000000 0.0000000 0.0576387), wk = 0.0032573 k( 128) = ( 0.0000000 0.0000000 0.0720484), wk = 0.0032573 k( 129) = ( 0.0000000 0.0000000 0.0864581), wk = 0.0032573 k( 130) = ( 0.0000000 0.0000000 0.1008677), wk = 0.0032573 k( 131) = ( 0.0000000 0.0000000 0.1152774), wk = 0.0032573 k( 132) = ( 0.0000000 0.0000000 0.1296871), wk = 0.0032573 k( 133) = ( 0.0000000 0.0000000 0.1440968), wk = 0.0032573 k( 134) = ( 0.0000000 0.0000000 0.1585065), wk = 0.0032573 k( 135) = ( 0.0000000 0.0000000 0.1729161), wk = 0.0032573 k( 136) = ( 0.0000000 0.0000000 0.1873258), wk = 0.0032573 k( 137) = ( 0.0000000 0.0000000 0.2017355), wk = 0.0032573 k( 138) = ( 0.0000000 0.0000000 0.2161452), wk = 0.0032573 k( 139) = ( 0.0000000 0.0000000 0.2305549), wk = 0.0032573 k( 140) = ( 0.0000000 0.0000000 0.2449645), wk = 0.0032573 k( 141) = ( 0.0000000 0.0000000 0.2593742), wk = 0.0032573 k( 142) = ( 0.0000000 0.0000000 0.2737839), wk = 0.0032573 k( 143) = ( 0.0000000 0.0000000 0.2881936), wk = 0.0032573 k( 144) = ( 0.0000000 0.0000000 0.2881936), wk = 0.0032573 k( 145) = ( 0.0000000 0.0142857 0.2881936), wk = 0.0032573 k( 146) = ( 0.0000000 0.0285714 0.2881936), wk = 0.0032573 k( 147) = ( 0.0000000 0.0428571 0.2881936), wk = 0.0032573 k( 148) = ( 0.0000000 0.0571429 0.2881936), wk = 0.0032573 k( 149) = ( 0.0000000 0.0714286 0.2881936), wk = 0.0032573 k( 150) = ( 0.0000000 0.0857143 0.2881936), wk = 0.0032573 k( 151) = ( 0.0000000 0.1000000 0.2881936), wk = 0.0032573 k( 152) = ( 0.0000000 0.1142857 0.2881936), wk = 0.0032573 k( 153) = ( 0.0000000 0.1285714 0.2881936), wk = 0.0032573 k( 154) = ( 0.0000000 0.1428571 0.2881936), wk = 0.0032573 k( 155) = ( 0.0000000 0.1571429 0.2881936), wk = 0.0032573 k( 156) = ( 0.0000000 0.1714286 0.2881936), wk = 0.0032573 k( 157) = ( 0.0000000 0.1857143 0.2881936), wk = 0.0032573 k( 158) = ( 0.0000000 0.2000000 0.2881936), wk = 0.0032573 k( 159) = ( 0.0000000 0.2142857 0.2881936), wk = 0.0032573 k( 160) = ( 0.0000000 0.2285714 0.2881936), wk = 0.0032573 k( 161) = ( 0.0000000 0.2428571 0.2881936), wk = 0.0032573 k( 162) = ( 0.0000000 0.2571429 0.2881936), wk = 0.0032573 k( 163) = ( 0.0000000 0.2714286 0.2881936), wk = 0.0032573 k( 164) = ( 0.0000000 0.2857143 0.2881936), wk = 0.0032573 k( 165) = ( 0.0000000 0.3000000 0.2881936), wk = 0.0032573 k( 166) = ( 0.0000000 0.3142857 0.2881936), wk = 0.0032573 k( 167) = ( 0.0000000 0.3285714 0.2881936), wk = 0.0032573 k( 168) = ( 0.0000000 0.3428571 0.2881936), wk = 0.0032573 k( 169) = ( 0.0000000 0.3571429 0.2881936), wk = 0.0032573 k( 170) = ( 0.0000000 0.3714286 0.2881936), wk = 0.0032573 k( 171) = ( 0.0000000 0.3857143 0.2881936), wk = 0.0032573 k( 172) = ( 0.0000000 0.4000000 0.2881936), wk = 0.0032573 k( 173) = ( 0.0000000 0.4142857 0.2881936), wk = 0.0032573 k( 174) = ( 0.0000000 0.4285714 0.2881936), wk = 0.0032573 k( 175) = ( 0.0000000 0.4428571 0.2881936), wk = 0.0032573 k( 176) = ( 0.0000000 0.4571429 0.2881936), wk = 0.0032573 k( 177) = ( 0.0000000 0.4714286 0.2881936), wk = 0.0032573 k( 178) = ( 0.0000000 0.4857143 0.2881936), wk = 0.0032573 k( 179) = ( 0.0000000 0.5000000 0.2881936), wk = 0.0032573 k( 180) = ( 0.0000000 0.5000000 0.2881936), wk = 0.0032573 k( 181) = ( 0.0142857 0.5000000 0.2881936), wk = 0.0032573 k( 182) = ( 0.0285714 0.5000000 0.2881936), wk = 0.0032573 k( 183) = ( 0.0428571 0.5000000 0.2881936), wk = 0.0032573 k( 184) = ( 0.0571429 0.5000000 0.2881936), wk = 0.0032573 k( 185) = ( 0.0714286 0.5000000 0.2881936), wk = 0.0032573 k( 186) = ( 0.0857143 0.5000000 0.2881936), wk = 0.0032573 k( 187) = ( 0.1000000 0.5000000 0.2881936), wk = 0.0032573 k( 188) = ( 0.1142857 0.5000000 0.2881936), wk = 0.0032573 k( 189) = ( 0.1285714 0.5000000 0.2881936), wk = 0.0032573 k( 190) = ( 0.1428571 0.5000000 0.2881936), wk = 0.0032573 k( 191) = ( 0.1571429 0.5000000 0.2881936), wk = 0.0032573 k( 192) = ( 0.1714286 0.5000000 0.2881936), wk = 0.0032573 k( 193) = ( 0.1857143 0.5000000 0.2881936), wk = 0.0032573 k( 194) = ( 0.2000000 0.5000000 0.2881936), wk = 0.0032573 k( 195) = ( 0.2142857 0.5000000 0.2881936), wk = 0.0032573 k( 196) = ( 0.2285714 0.5000000 0.2881936), wk = 0.0032573 k( 197) = ( 0.2428571 0.5000000 0.2881936), wk = 0.0032573 k( 198) = ( 0.2571429 0.5000000 0.2881936), wk = 0.0032573 k( 199) = ( 0.2714286 0.5000000 0.2881936), wk = 0.0032573 k( 200) = ( 0.2857143 0.5000000 0.2881936), wk = 0.0032573 k( 201) = ( 0.3000000 0.5000000 0.2881936), wk = 0.0032573 k( 202) = ( 0.3142857 0.5000000 0.2881936), wk = 0.0032573 k( 203) = ( 0.3285714 0.5000000 0.2881936), wk = 0.0032573 k( 204) = ( 0.3428571 0.5000000 0.2881936), wk = 0.0032573 k( 205) = ( 0.3571429 0.5000000 0.2881936), wk = 0.0032573 k( 206) = ( 0.3714286 0.5000000 0.2881936), wk = 0.0032573 k( 207) = ( 0.3857143 0.5000000 0.2881936), wk = 0.0032573 k( 208) = ( 0.4000000 0.5000000 0.2881936), wk = 0.0032573 k( 209) = ( 0.4142857 0.5000000 0.2881936), wk = 0.0032573 k( 210) = ( 0.4285714 0.5000000 0.2881936), wk = 0.0032573 k( 211) = ( 0.4428571 0.5000000 0.2881936), wk = 0.0032573 k( 212) = ( 0.4571429 0.5000000 0.2881936), wk = 0.0032573 k( 213) = ( 0.4714286 0.5000000 0.2881936), wk = 0.0032573 k( 214) = ( 0.4857143 0.5000000 0.2881936), wk = 0.0032573 k( 215) = ( 0.5000000 0.5000000 0.2881936), wk = 0.0032573 k( 216) = ( 0.5000000 0.5000000 0.2881936), wk = 0.0032573 k( 217) = ( 0.4897959 0.4897959 0.2881936), wk = 0.0032573 k( 218) = ( 0.4795918 0.4795918 0.2881936), wk = 0.0032573 k( 219) = ( 0.4693878 0.4693878 0.2881936), wk = 0.0032573 k( 220) = ( 0.4591837 0.4591837 0.2881936), wk = 0.0032573 k( 221) = ( 0.4489796 0.4489796 0.2881936), wk = 0.0032573 k( 222) = ( 0.4387755 0.4387755 0.2881936), wk = 0.0032573 k( 223) = ( 0.4285714 0.4285714 0.2881936), wk = 0.0032573 k( 224) = ( 0.4183674 0.4183673 0.2881936), wk = 0.0032573 k( 225) = ( 0.4081633 0.4081633 0.2881936), wk = 0.0032573 k( 226) = ( 0.3979592 0.3979592 0.2881936), wk = 0.0032573 k( 227) = ( 0.3877551 0.3877551 0.2881936), wk = 0.0032573 k( 228) = ( 0.3775510 0.3775510 0.2881936), wk = 0.0032573 k( 229) = ( 0.3673469 0.3673469 0.2881936), wk = 0.0032573 k( 230) = ( 0.3571429 0.3571429 0.2881936), wk = 0.0032573 k( 231) = ( 0.3469388 0.3469388 0.2881936), wk = 0.0032573 k( 232) = ( 0.3367347 0.3367347 0.2881936), wk = 0.0032573 k( 233) = ( 0.3265306 0.3265306 0.2881936), wk = 0.0032573 k( 234) = ( 0.3163265 0.3163265 0.2881936), wk = 0.0032573 k( 235) = ( 0.3061224 0.3061224 0.2881936), wk = 0.0032573 k( 236) = ( 0.2959184 0.2959184 0.2881936), wk = 0.0032573 k( 237) = ( 0.2857143 0.2857143 0.2881936), wk = 0.0032573 k( 238) = ( 0.2755102 0.2755102 0.2881936), wk = 0.0032573 k( 239) = ( 0.2653061 0.2653061 0.2881936), wk = 0.0032573 k( 240) = ( 0.2551020 0.2551020 0.2881936), wk = 0.0032573 k( 241) = ( 0.2448980 0.2448980 0.2881936), wk = 0.0032573 k( 242) = ( 0.2346939 0.2346939 0.2881936), wk = 0.0032573 k( 243) = ( 0.2244898 0.2244898 0.2881936), wk = 0.0032573 k( 244) = ( 0.2142857 0.2142857 0.2881936), wk = 0.0032573 k( 245) = ( 0.2040816 0.2040816 0.2881936), wk = 0.0032573 k( 246) = ( 0.1938776 0.1938775 0.2881936), wk = 0.0032573 k( 247) = ( 0.1836735 0.1836735 0.2881936), wk = 0.0032573 k( 248) = ( 0.1734694 0.1734694 0.2881936), wk = 0.0032573 k( 249) = ( 0.1632653 0.1632653 0.2881936), wk = 0.0032573 k( 250) = ( 0.1530612 0.1530612 0.2881936), wk = 0.0032573 k( 251) = ( 0.1428571 0.1428571 0.2881936), wk = 0.0032573 k( 252) = ( 0.1326531 0.1326531 0.2881936), wk = 0.0032573 k( 253) = ( 0.1224490 0.1224490 0.2881936), wk = 0.0032573 k( 254) = ( 0.1122449 0.1122449 0.2881936), wk = 0.0032573 k( 255) = ( 0.1020408 0.1020408 0.2881936), wk = 0.0032573 k( 256) = ( 0.0918367 0.0918367 0.2881936), wk = 0.0032573 k( 257) = ( 0.0816327 0.0816326 0.2881936), wk = 0.0032573 k( 258) = ( 0.0714286 0.0714286 0.2881936), wk = 0.0032573 k( 259) = ( 0.0612245 0.0612245 0.2881936), wk = 0.0032573 k( 260) = ( 0.0510204 0.0510204 0.2881936), wk = 0.0032573 k( 261) = ( 0.0408163 0.0408163 0.2881936), wk = 0.0032573 k( 262) = ( 0.0306122 0.0306122 0.2881936), wk = 0.0032573 k( 263) = ( 0.0204082 0.0204082 0.2881936), wk = 0.0032573 k( 264) = ( 0.0102041 0.0102041 0.2881936), wk = 0.0032573 k( 265) = ( 0.0000000 0.0000000 0.2881936), wk = 0.0032573 k( 266) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032573 k( 267) = ( 0.0000000 0.5000000 0.0144097), wk = 0.0032573 k( 268) = ( 0.0000000 0.5000000 0.0288194), wk = 0.0032573 k( 269) = ( 0.0000000 0.5000000 0.0432290), wk = 0.0032573 k( 270) = ( 0.0000000 0.5000000 0.0576387), wk = 0.0032573 k( 271) = ( 0.0000000 0.5000000 0.0720484), wk = 0.0032573 k( 272) = ( 0.0000000 0.5000000 0.0864581), wk = 0.0032573 k( 273) = ( 0.0000000 0.5000000 0.1008677), wk = 0.0032573 k( 274) = ( 0.0000000 0.5000000 0.1152774), wk = 0.0032573 k( 275) = ( 0.0000000 0.5000000 0.1296871), wk = 0.0032573 k( 276) = ( 0.0000000 0.5000000 0.1440968), wk = 0.0032573 k( 277) = ( 0.0000000 0.5000000 0.1585065), wk = 0.0032573 k( 278) = ( 0.0000000 0.5000000 0.1729161), wk = 0.0032573 k( 279) = ( 0.0000000 0.5000000 0.1873258), wk = 0.0032573 k( 280) = ( 0.0000000 0.5000000 0.2017355), wk = 0.0032573 k( 281) = ( 0.0000000 0.5000000 0.2161452), wk = 0.0032573 k( 282) = ( 0.0000000 0.5000000 0.2305549), wk = 0.0032573 k( 283) = ( 0.0000000 0.5000000 0.2449645), wk = 0.0032573 k( 284) = ( 0.0000000 0.5000000 0.2593742), wk = 0.0032573 k( 285) = ( 0.0000000 0.5000000 0.2737839), wk = 0.0032573 k( 286) = ( 0.0000000 0.5000000 0.2881936), wk = 0.0032573 k( 287) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032573 k( 288) = ( 0.5000000 0.5000000 0.0144097), wk = 0.0032573 k( 289) = ( 0.5000000 0.5000000 0.0288194), wk = 0.0032573 k( 290) = ( 0.5000000 0.5000000 0.0432290), wk = 0.0032573 k( 291) = ( 0.5000000 0.5000000 0.0576387), wk = 0.0032573 k( 292) = ( 0.5000000 0.5000000 0.0720484), wk = 0.0032573 k( 293) = ( 0.5000000 0.5000000 0.0864581), wk = 0.0032573 k( 294) = ( 0.5000000 0.5000000 0.1008677), wk = 0.0032573 k( 295) = ( 0.5000000 0.5000000 0.1152774), wk = 0.0032573 k( 296) = ( 0.5000000 0.5000000 0.1296871), wk = 0.0032573 k( 297) = ( 0.5000000 0.5000000 0.1440968), wk = 0.0032573 k( 298) = ( 0.5000000 0.5000000 0.1585065), wk = 0.0032573 k( 299) = ( 0.5000000 0.5000000 0.1729161), wk = 0.0032573 k( 300) = ( 0.5000000 0.5000000 0.1873258), wk = 0.0032573 k( 301) = ( 0.5000000 0.5000000 0.2017355), wk = 0.0032573 k( 302) = ( 0.5000000 0.5000000 0.2161452), wk = 0.0032573 k( 303) = ( 0.5000000 0.5000000 0.2305549), wk = 0.0032573 k( 304) = ( 0.5000000 0.5000000 0.2449645), wk = 0.0032573 k( 305) = ( 0.5000000 0.5000000 0.2593742), wk = 0.0032573 k( 306) = ( 0.5000000 0.5000000 0.2737839), wk = 0.0032573 k( 307) = ( 0.5000000 0.5000000 0.2881936), wk = 0.0032573 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 2) = ( 0.0000000 0.0142857 0.0000000), wk = 0.0032573 k( 3) = ( 0.0000000 0.0285714 -0.0000000), wk = 0.0032573 k( 4) = ( 0.0000000 0.0428571 -0.0000000), wk = 0.0032573 k( 5) = ( 0.0000000 0.0571429 -0.0000000), wk = 0.0032573 k( 6) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0032573 k( 7) = ( 0.0000000 0.0857143 -0.0000000), wk = 0.0032573 k( 8) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0032573 k( 9) = ( 0.0000000 0.1142857 -0.0000000), wk = 0.0032573 k( 10) = ( 0.0000000 0.1285714 -0.0000000), wk = 0.0032573 k( 11) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0032573 k( 12) = ( 0.0000000 0.1571429 -0.0000000), wk = 0.0032573 k( 13) = ( 0.0000000 0.1714286 -0.0000000), wk = 0.0032573 k( 14) = ( 0.0000000 0.1857143 0.0000000), wk = 0.0032573 k( 15) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0032573 k( 16) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0032573 k( 17) = ( 0.0000000 0.2285714 -0.0000000), wk = 0.0032573 k( 18) = ( 0.0000000 0.2428571 -0.0000000), wk = 0.0032573 k( 19) = ( 0.0000000 0.2571429 -0.0000000), wk = 0.0032573 k( 20) = ( 0.0000000 0.2714286 -0.0000000), wk = 0.0032573 k( 21) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0032573 k( 22) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0032573 k( 23) = ( 0.0000000 0.3142857 -0.0000000), wk = 0.0032573 k( 24) = ( 0.0000000 0.3285714 -0.0000000), wk = 0.0032573 k( 25) = ( 0.0000000 0.3428571 -0.0000000), wk = 0.0032573 k( 26) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0032573 k( 27) = ( 0.0000000 0.3714286 0.0000000), wk = 0.0032573 k( 28) = ( 0.0000000 0.3857143 0.0000000), wk = 0.0032573 k( 29) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0032573 k( 30) = ( 0.0000000 0.4142857 0.0000000), wk = 0.0032573 k( 31) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0032573 k( 32) = ( 0.0000000 0.4428571 0.0000000), wk = 0.0032573 k( 33) = ( 0.0000000 0.4571429 -0.0000000), wk = 0.0032573 k( 34) = ( 0.0000000 0.4714286 0.0000000), wk = 0.0032573 k( 35) = ( 0.0000000 0.4857143 -0.0000000), wk = 0.0032573 k( 36) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032573 k( 37) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032573 k( 38) = ( 0.0142857 0.5000000 -0.0000000), wk = 0.0032573 k( 39) = ( 0.0285714 0.5000000 -0.0000000), wk = 0.0032573 k( 40) = ( 0.0428571 0.5000000 0.0000000), wk = 0.0032573 k( 41) = ( 0.0571429 0.5000000 0.0000000), wk = 0.0032573 k( 42) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0032573 k( 43) = ( 0.0857143 0.5000000 -0.0000000), wk = 0.0032573 k( 44) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0032573 k( 45) = ( 0.1142857 0.5000000 -0.0000000), wk = 0.0032573 k( 46) = ( 0.1285714 0.5000000 -0.0000000), wk = 0.0032573 k( 47) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0032573 k( 48) = ( 0.1571429 0.5000000 -0.0000000), wk = 0.0032573 k( 49) = ( 0.1714286 0.5000000 -0.0000000), wk = 0.0032573 k( 50) = ( 0.1857143 0.5000000 0.0000000), wk = 0.0032573 k( 51) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0032573 k( 52) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0032573 k( 53) = ( 0.2285714 0.5000000 -0.0000000), wk = 0.0032573 k( 54) = ( 0.2428571 0.5000000 -0.0000000), wk = 0.0032573 k( 55) = ( 0.2571429 0.5000000 0.0000000), wk = 0.0032573 k( 56) = ( 0.2714286 0.5000000 0.0000000), wk = 0.0032573 k( 57) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0032573 k( 58) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0032573 k( 59) = ( 0.3142857 0.5000000 -0.0000000), wk = 0.0032573 k( 60) = ( 0.3285714 0.5000000 -0.0000000), wk = 0.0032573 k( 61) = ( 0.3428571 0.5000000 -0.0000000), wk = 0.0032573 k( 62) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0032573 k( 63) = ( 0.3714286 0.5000000 0.0000000), wk = 0.0032573 k( 64) = ( 0.3857143 0.5000000 -0.0000000), wk = 0.0032573 k( 65) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0032573 k( 66) = ( 0.4142857 0.5000000 -0.0000000), wk = 0.0032573 k( 67) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0032573 k( 68) = ( 0.4428571 0.5000000 -0.0000000), wk = 0.0032573 k( 69) = ( 0.4571429 0.5000000 -0.0000000), wk = 0.0032573 k( 70) = ( 0.4714286 0.5000000 -0.0000000), wk = 0.0032573 k( 71) = ( 0.4857143 0.5000000 -0.0000000), wk = 0.0032573 k( 72) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032573 k( 73) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032573 k( 74) = ( 0.4897959 0.4897959 -0.0000000), wk = 0.0032573 k( 75) = ( 0.4795918 0.4795918 -0.0000000), wk = 0.0032573 k( 76) = ( 0.4693878 0.4693878 -0.0000000), wk = 0.0032573 k( 77) = ( 0.4591837 0.4591837 -0.0000000), wk = 0.0032573 k( 78) = ( 0.4489796 0.4489796 -0.0000000), wk = 0.0032573 k( 79) = ( 0.4387755 0.4387755 -0.0000000), wk = 0.0032573 k( 80) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0032573 k( 81) = ( 0.4183674 0.4183674 -0.0000000), wk = 0.0032573 k( 82) = ( 0.4081633 0.4081633 -0.0000000), wk = 0.0032573 k( 83) = ( 0.3979592 0.3979592 -0.0000000), wk = 0.0032573 k( 84) = ( 0.3877551 0.3877551 -0.0000000), wk = 0.0032573 k( 85) = ( 0.3775510 0.3775510 -0.0000000), wk = 0.0032573 k( 86) = ( 0.3673469 0.3673469 -0.0000000), wk = 0.0032573 k( 87) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0032573 k( 88) = ( 0.3469388 0.3469388 -0.0000000), wk = 0.0032573 k( 89) = ( 0.3367347 0.3367347 -0.0000000), wk = 0.0032573 k( 90) = ( 0.3265306 0.3265306 -0.0000000), wk = 0.0032573 k( 91) = ( 0.3163265 0.3163265 -0.0000000), wk = 0.0032573 k( 92) = ( 0.3061224 0.3061224 -0.0000000), wk = 0.0032573 k( 93) = ( 0.2959184 0.2959184 0.0000000), wk = 0.0032573 k( 94) = ( 0.2857143 0.2857143 0.0000000), wk = 0.0032573 k( 95) = ( 0.2755102 0.2755102 0.0000000), wk = 0.0032573 k( 96) = ( 0.2653061 0.2653061 -0.0000000), wk = 0.0032573 k( 97) = ( 0.2551020 0.2551020 -0.0000000), wk = 0.0032573 k( 98) = ( 0.2448980 0.2448980 -0.0000000), wk = 0.0032573 k( 99) = ( 0.2346939 0.2346939 -0.0000000), wk = 0.0032573 k( 100) = ( 0.2244898 0.2244898 -0.0000000), wk = 0.0032573 k( 101) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0032573 k( 102) = ( 0.2040816 0.2040816 -0.0000000), wk = 0.0032573 k( 103) = ( 0.1938776 0.1938776 -0.0000000), wk = 0.0032573 k( 104) = ( 0.1836735 0.1836735 -0.0000000), wk = 0.0032573 k( 105) = ( 0.1734694 0.1734694 -0.0000000), wk = 0.0032573 k( 106) = ( 0.1632653 0.1632653 -0.0000000), wk = 0.0032573 k( 107) = ( 0.1530612 0.1530612 -0.0000000), wk = 0.0032573 k( 108) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0032573 k( 109) = ( 0.1326531 0.1326531 -0.0000000), wk = 0.0032573 k( 110) = ( 0.1224490 0.1224490 -0.0000000), wk = 0.0032573 k( 111) = ( 0.1122449 0.1122449 -0.0000000), wk = 0.0032573 k( 112) = ( 0.1020408 0.1020408 -0.0000000), wk = 0.0032573 k( 113) = ( 0.0918367 0.0918367 0.0000000), wk = 0.0032573 k( 114) = ( 0.0816327 0.0816327 -0.0000000), wk = 0.0032573 k( 115) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0032573 k( 116) = ( 0.0612245 0.0612245 -0.0000000), wk = 0.0032573 k( 117) = ( 0.0510204 0.0510204 -0.0000000), wk = 0.0032573 k( 118) = ( 0.0408163 0.0408163 -0.0000000), wk = 0.0032573 k( 119) = ( 0.0306122 0.0306122 -0.0000000), wk = 0.0032573 k( 120) = ( 0.0204082 0.0204082 -0.0000000), wk = 0.0032573 k( 121) = ( 0.0102041 0.0102041 -0.0000000), wk = 0.0032573 k( 122) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 124) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0032573 k( 125) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0032573 k( 126) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0032573 k( 127) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0032573 k( 128) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0032573 k( 129) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0032573 k( 130) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0032573 k( 131) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0032573 k( 132) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0032573 k( 133) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0032573 k( 134) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0032573 k( 135) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0032573 k( 136) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0032573 k( 137) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0032573 k( 138) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0032573 k( 139) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0032573 k( 140) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0032573 k( 141) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0032573 k( 142) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0032573 k( 143) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032573 k( 144) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032573 k( 145) = ( 0.0000000 0.0142857 0.5000000), wk = 0.0032573 k( 146) = ( 0.0000000 0.0285714 0.5000000), wk = 0.0032573 k( 147) = ( 0.0000000 0.0428571 0.5000000), wk = 0.0032573 k( 148) = ( 0.0000000 0.0571429 0.5000000), wk = 0.0032573 k( 149) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0032573 k( 150) = ( 0.0000000 0.0857143 0.5000000), wk = 0.0032573 k( 151) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0032573 k( 152) = ( 0.0000000 0.1142857 0.5000000), wk = 0.0032573 k( 153) = ( 0.0000000 0.1285714 0.5000000), wk = 0.0032573 k( 154) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0032573 k( 155) = ( 0.0000000 0.1571429 0.5000000), wk = 0.0032573 k( 156) = ( 0.0000000 0.1714286 0.5000000), wk = 0.0032573 k( 157) = ( 0.0000000 0.1857143 0.5000000), wk = 0.0032573 k( 158) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0032573 k( 159) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0032573 k( 160) = ( 0.0000000 0.2285714 0.5000000), wk = 0.0032573 k( 161) = ( 0.0000000 0.2428571 0.5000000), wk = 0.0032573 k( 162) = ( 0.0000000 0.2571429 0.5000000), wk = 0.0032573 k( 163) = ( 0.0000000 0.2714286 0.5000000), wk = 0.0032573 k( 164) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0032573 k( 165) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0032573 k( 166) = ( 0.0000000 0.3142857 0.5000000), wk = 0.0032573 k( 167) = ( 0.0000000 0.3285714 0.5000000), wk = 0.0032573 k( 168) = ( 0.0000000 0.3428571 0.5000000), wk = 0.0032573 k( 169) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0032573 k( 170) = ( 0.0000000 0.3714286 0.5000000), wk = 0.0032573 k( 171) = ( 0.0000000 0.3857143 0.5000000), wk = 0.0032573 k( 172) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0032573 k( 173) = ( 0.0000000 0.4142857 0.5000000), wk = 0.0032573 k( 174) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0032573 k( 175) = ( 0.0000000 0.4428571 0.5000000), wk = 0.0032573 k( 176) = ( 0.0000000 0.4571429 0.5000000), wk = 0.0032573 k( 177) = ( 0.0000000 0.4714286 0.5000000), wk = 0.0032573 k( 178) = ( 0.0000000 0.4857143 0.5000000), wk = 0.0032573 k( 179) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032573 k( 180) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032573 k( 181) = ( 0.0142857 0.5000000 0.5000000), wk = 0.0032573 k( 182) = ( 0.0285714 0.5000000 0.5000000), wk = 0.0032573 k( 183) = ( 0.0428571 0.5000000 0.5000000), wk = 0.0032573 k( 184) = ( 0.0571429 0.5000000 0.5000000), wk = 0.0032573 k( 185) = ( 0.0714286 0.5000000 0.5000000), wk = 0.0032573 k( 186) = ( 0.0857143 0.5000000 0.5000000), wk = 0.0032573 k( 187) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0032573 k( 188) = ( 0.1142857 0.5000000 0.5000000), wk = 0.0032573 k( 189) = ( 0.1285714 0.5000000 0.5000000), wk = 0.0032573 k( 190) = ( 0.1428571 0.5000000 0.5000000), wk = 0.0032573 k( 191) = ( 0.1571429 0.5000000 0.5000000), wk = 0.0032573 k( 192) = ( 0.1714286 0.5000000 0.5000000), wk = 0.0032573 k( 193) = ( 0.1857143 0.5000000 0.5000000), wk = 0.0032573 k( 194) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0032573 k( 195) = ( 0.2142857 0.5000000 0.5000000), wk = 0.0032573 k( 196) = ( 0.2285714 0.5000000 0.5000000), wk = 0.0032573 k( 197) = ( 0.2428571 0.5000000 0.5000000), wk = 0.0032573 k( 198) = ( 0.2571429 0.5000000 0.5000000), wk = 0.0032573 k( 199) = ( 0.2714286 0.5000000 0.5000000), wk = 0.0032573 k( 200) = ( 0.2857143 0.5000000 0.5000000), wk = 0.0032573 k( 201) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0032573 k( 202) = ( 0.3142857 0.5000000 0.5000000), wk = 0.0032573 k( 203) = ( 0.3285714 0.5000000 0.5000000), wk = 0.0032573 k( 204) = ( 0.3428571 0.5000000 0.5000000), wk = 0.0032573 k( 205) = ( 0.3571429 0.5000000 0.5000000), wk = 0.0032573 k( 206) = ( 0.3714286 0.5000000 0.5000000), wk = 0.0032573 k( 207) = ( 0.3857143 0.5000000 0.5000000), wk = 0.0032573 k( 208) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0032573 k( 209) = ( 0.4142857 0.5000000 0.5000000), wk = 0.0032573 k( 210) = ( 0.4285714 0.5000000 0.5000000), wk = 0.0032573 k( 211) = ( 0.4428571 0.5000000 0.5000000), wk = 0.0032573 k( 212) = ( 0.4571429 0.5000000 0.5000000), wk = 0.0032573 k( 213) = ( 0.4714286 0.5000000 0.5000000), wk = 0.0032573 k( 214) = ( 0.4857143 0.5000000 0.5000000), wk = 0.0032573 k( 215) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032573 k( 216) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032573 k( 217) = ( 0.4897959 0.4897959 0.5000000), wk = 0.0032573 k( 218) = ( 0.4795918 0.4795918 0.5000000), wk = 0.0032573 k( 219) = ( 0.4693878 0.4693878 0.5000000), wk = 0.0032573 k( 220) = ( 0.4591837 0.4591837 0.5000000), wk = 0.0032573 k( 221) = ( 0.4489796 0.4489796 0.5000000), wk = 0.0032573 k( 222) = ( 0.4387755 0.4387755 0.5000000), wk = 0.0032573 k( 223) = ( 0.4285714 0.4285714 0.5000000), wk = 0.0032573 k( 224) = ( 0.4183674 0.4183674 0.5000000), wk = 0.0032573 k( 225) = ( 0.4081633 0.4081633 0.5000000), wk = 0.0032573 k( 226) = ( 0.3979592 0.3979592 0.5000000), wk = 0.0032573 k( 227) = ( 0.3877551 0.3877551 0.5000000), wk = 0.0032573 k( 228) = ( 0.3775510 0.3775510 0.5000000), wk = 0.0032573 k( 229) = ( 0.3673469 0.3673469 0.5000000), wk = 0.0032573 k( 230) = ( 0.3571429 0.3571429 0.5000000), wk = 0.0032573 k( 231) = ( 0.3469388 0.3469388 0.5000000), wk = 0.0032573 k( 232) = ( 0.3367347 0.3367347 0.5000000), wk = 0.0032573 k( 233) = ( 0.3265306 0.3265306 0.5000000), wk = 0.0032573 k( 234) = ( 0.3163265 0.3163265 0.5000000), wk = 0.0032573 k( 235) = ( 0.3061224 0.3061224 0.5000000), wk = 0.0032573 k( 236) = ( 0.2959184 0.2959184 0.5000000), wk = 0.0032573 k( 237) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0032573 k( 238) = ( 0.2755102 0.2755102 0.5000000), wk = 0.0032573 k( 239) = ( 0.2653061 0.2653061 0.5000000), wk = 0.0032573 k( 240) = ( 0.2551020 0.2551020 0.5000000), wk = 0.0032573 k( 241) = ( 0.2448980 0.2448980 0.5000000), wk = 0.0032573 k( 242) = ( 0.2346939 0.2346939 0.5000000), wk = 0.0032573 k( 243) = ( 0.2244898 0.2244898 0.5000000), wk = 0.0032573 k( 244) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0032573 k( 245) = ( 0.2040816 0.2040816 0.5000000), wk = 0.0032573 k( 246) = ( 0.1938776 0.1938776 0.5000000), wk = 0.0032573 k( 247) = ( 0.1836735 0.1836735 0.5000000), wk = 0.0032573 k( 248) = ( 0.1734694 0.1734694 0.5000000), wk = 0.0032573 k( 249) = ( 0.1632653 0.1632653 0.5000000), wk = 0.0032573 k( 250) = ( 0.1530612 0.1530612 0.5000000), wk = 0.0032573 k( 251) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0032573 k( 252) = ( 0.1326531 0.1326531 0.5000000), wk = 0.0032573 k( 253) = ( 0.1224490 0.1224490 0.5000000), wk = 0.0032573 k( 254) = ( 0.1122449 0.1122449 0.5000000), wk = 0.0032573 k( 255) = ( 0.1020408 0.1020408 0.5000000), wk = 0.0032573 k( 256) = ( 0.0918367 0.0918367 0.5000000), wk = 0.0032573 k( 257) = ( 0.0816327 0.0816327 0.5000000), wk = 0.0032573 k( 258) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0032573 k( 259) = ( 0.0612245 0.0612245 0.5000000), wk = 0.0032573 k( 260) = ( 0.0510204 0.0510204 0.5000000), wk = 0.0032573 k( 261) = ( 0.0408163 0.0408163 0.5000000), wk = 0.0032573 k( 262) = ( 0.0306122 0.0306122 0.5000000), wk = 0.0032573 k( 263) = ( 0.0204082 0.0204082 0.5000000), wk = 0.0032573 k( 264) = ( 0.0102041 0.0102041 0.5000000), wk = 0.0032573 k( 265) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032573 k( 266) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032573 k( 267) = ( 0.0000000 0.5000000 0.0250000), wk = 0.0032573 k( 268) = ( 0.0000000 0.5000000 0.0500000), wk = 0.0032573 k( 269) = ( 0.0000000 0.5000000 0.0750000), wk = 0.0032573 k( 270) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0032573 k( 271) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0032573 k( 272) = ( 0.0000000 0.5000000 0.1500000), wk = 0.0032573 k( 273) = ( 0.0000000 0.5000000 0.1750000), wk = 0.0032573 k( 274) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0032573 k( 275) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0032573 k( 276) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0032573 k( 277) = ( 0.0000000 0.5000000 0.2750000), wk = 0.0032573 k( 278) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0032573 k( 279) = ( 0.0000000 0.5000000 0.3250000), wk = 0.0032573 k( 280) = ( 0.0000000 0.5000000 0.3500000), wk = 0.0032573 k( 281) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0032573 k( 282) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0032573 k( 283) = ( 0.0000000 0.5000000 0.4250000), wk = 0.0032573 k( 284) = ( 0.0000000 0.5000000 0.4500000), wk = 0.0032573 k( 285) = ( 0.0000000 0.5000000 0.4750000), wk = 0.0032573 k( 286) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032573 k( 287) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032573 k( 288) = ( 0.5000000 0.5000000 0.0250000), wk = 0.0032573 k( 289) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0032573 k( 290) = ( 0.5000000 0.5000000 0.0750000), wk = 0.0032573 k( 291) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0032573 k( 292) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0032573 k( 293) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0032573 k( 294) = ( 0.5000000 0.5000000 0.1750000), wk = 0.0032573 k( 295) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0032573 k( 296) = ( 0.5000000 0.5000000 0.2250000), wk = 0.0032573 k( 297) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0032573 k( 298) = ( 0.5000000 0.5000000 0.2750000), wk = 0.0032573 k( 299) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0032573 k( 300) = ( 0.5000000 0.5000000 0.3250000), wk = 0.0032573 k( 301) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0032573 k( 302) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0032573 k( 303) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0032573 k( 304) = ( 0.5000000 0.5000000 0.4250000), wk = 0.0032573 k( 305) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0032573 k( 306) = ( 0.5000000 0.5000000 0.4750000), wk = 0.0032573 k( 307) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032573 Dense grid: 300897 G-vectors FFT dimensions: ( 72, 72, 125) Smooth grid: 39161 G-vectors FFT dimensions: ( 36, 36, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.26 Mb ( 278, 62) NL pseudopotentials 0.35 Mb ( 139, 164) Each V/rho on FFT grid 0.32 Mb ( 20736) Each G-vector array 0.06 Mb ( 8356) G-vector shells 0.03 Mb ( 3828) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.05 Mb ( 278, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.31 Mb ( 164, 2, 62) The potential is recalculated from file : ./KCdAs.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.6 secs Computing kpt #: 2 total cpu time spent up to now is 4.5 secs Computing kpt #: 3 total cpu time spent up to now is 5.4 secs Computing kpt #: 4 total cpu time spent up to now is 6.1 secs Computing kpt #: 5 total cpu time spent up to now is 6.9 secs Computing kpt #: 6 total cpu time spent up to now is 7.7 secs Computing kpt #: 7 total cpu time spent up to now is 8.5 secs Computing kpt #: 8 total cpu time spent up to now is 9.3 secs Computing kpt #: 9 total cpu time spent up to now is 10.1 secs Computing kpt #: 10 total cpu time spent up to now is 10.9 secs Computing kpt #: 11 total cpu time spent up to now is 11.7 secs Computing kpt #: 12 total cpu time spent up to now is 12.5 secs Computing kpt #: 13 total cpu time spent up to now is 13.3 secs Computing kpt #: 14 total cpu time spent up to now is 14.1 secs Computing kpt #: 15 total cpu time spent up to now is 14.8 secs Computing kpt #: 16 total cpu time spent up to now is 15.6 secs Computing kpt #: 17 total cpu time spent up to now is 16.3 secs Computing kpt #: 18 total cpu time spent up to now is 17.0 secs Computing kpt #: 19 total cpu time spent up to now is 17.7 secs Computing kpt #: 20 total cpu time spent up to now is 18.6 secs Computing kpt #: 21 total cpu time spent up to now is 19.5 secs Computing kpt #: 22 total cpu time spent up to now is 21.0 secs Computing kpt #: 23 total cpu time spent up to now is 22.3 secs Computing kpt #: 24 total cpu time spent up to now is 23.2 secs Computing kpt #: 25 total cpu time spent up to now is 24.1 secs Computing kpt #: 26 total cpu time spent up to now is 25.0 secs Computing kpt #: 27 total cpu time spent up to now is 26.0 secs Computing kpt #: 28 total cpu time spent up to now is 27.2 secs Computing kpt #: 29 total cpu time spent up to now is 28.3 secs Computing kpt #: 30 total cpu time spent up to now is 29.8 secs Computing kpt #: 31 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 31.7 secs Computing kpt #: 32 total cpu time spent up to now is 32.6 secs Computing kpt #: 33 total cpu time spent up to now is 33.3 secs Computing kpt #: 34 total cpu time spent up to now is 34.1 secs Computing kpt #: 35 total cpu time spent up to now is 35.0 secs Computing kpt #: 36 total cpu time spent up to now is 35.7 secs Computing kpt #: 37 total cpu time spent up to now is 36.4 secs Computing kpt #: 38 total cpu time spent up to now is 37.3 secs Computing kpt #: 39 total cpu time spent up to now is 38.2 secs Computing kpt #: 40 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 40.1 secs Computing kpt #: 41 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 42.8 secs Computing kpt #: 42 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 44.6 secs Computing kpt #: 43 total cpu time spent up to now is 45.2 secs Computing kpt #: 44 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 47.1 secs Computing kpt #: 45 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 48.9 secs Computing kpt #: 46 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 50.7 secs Computing kpt #: 47 total cpu time spent up to now is 52.0 secs Computing kpt #: 48 total cpu time spent up to now is 53.4 secs Computing kpt #: 49 total cpu time spent up to now is 54.8 secs Computing kpt #: 50 total cpu time spent up to now is 55.8 secs Computing kpt #: 51 total cpu time spent up to now is 56.6 secs Computing kpt #: 52 total cpu time spent up to now is 57.4 secs Computing kpt #: 53 total cpu time spent up to now is 58.2 secs Computing kpt #: 54 total cpu time spent up to now is 59.0 secs Computing kpt #: 55 total cpu time spent up to now is 59.8 secs Computing kpt #: 56 total cpu time spent up to now is 60.6 secs Computing kpt #: 57 total cpu time spent up to now is 61.3 secs Computing kpt #: 58 total cpu time spent up to now is 62.1 secs Computing kpt #: 59 total cpu time spent up to now is 62.9 secs Computing kpt #: 60 total cpu time spent up to now is 63.6 secs Computing kpt #: 61 total cpu time spent up to now is 64.4 secs Computing kpt #: 62 total cpu time spent up to now is 65.2 secs Computing kpt #: 63 total cpu time spent up to now is 65.9 secs Computing kpt #: 64 total cpu time spent up to now is 66.7 secs Computing kpt #: 65 total cpu time spent up to now is 67.5 secs Computing kpt #: 66 total cpu time spent up to now is 68.3 secs Computing kpt #: 67 total cpu time spent up to now is 69.1 secs Computing kpt #: 68 total cpu time spent up to now is 69.9 secs Computing kpt #: 69 total cpu time spent up to now is 70.7 secs Computing kpt #: 70 total cpu time spent up to now is 71.5 secs Computing kpt #: 71 total cpu time spent up to now is 72.3 secs Computing kpt #: 72 total cpu time spent up to now is 72.9 secs Computing kpt #: 73 total cpu time spent up to now is 73.6 secs Computing kpt #: 74 total cpu time spent up to now is 74.4 secs Computing kpt #: 75 total cpu time spent up to now is 75.2 secs Computing kpt #: 76 total cpu time spent up to now is 76.0 secs Computing kpt #: 77 total cpu time spent up to now is 76.8 secs Computing kpt #: 78 total cpu time spent up to now is 77.6 secs Computing kpt #: 79 total cpu time spent up to now is 78.4 secs Computing kpt #: 80 total cpu time spent up to now is 79.2 secs Computing kpt #: 81 total cpu time spent up to now is 80.0 secs Computing kpt #: 82 total cpu time spent up to now is 80.8 secs Computing kpt #: 83 total cpu time spent up to now is 81.5 secs Computing kpt #: 84 total cpu time spent up to now is 82.3 secs Computing kpt #: 85 total cpu time spent up to now is 83.1 secs Computing kpt #: 86 total cpu time spent up to now is 83.9 secs Computing kpt #: 87 total cpu time spent up to now is 84.7 secs Computing kpt #: 88 total cpu time spent up to now is 85.5 secs Computing kpt #: 89 total cpu time spent up to now is 86.3 secs Computing kpt #: 90 total cpu time spent up to now is 87.1 secs Computing kpt #: 91 total cpu time spent up to now is 87.9 secs Computing kpt #: 92 total cpu time spent up to now is 88.7 secs Computing kpt #: 93 total cpu time spent up to now is 89.6 secs Computing kpt #: 94 total cpu time spent up to now is 90.4 secs Computing kpt #: 95 total cpu time spent up to now is 91.2 secs Computing kpt #: 96 total cpu time spent up to now is 92.0 secs Computing kpt #: 97 total cpu time spent up to now is 92.8 secs Computing kpt #: 98 total cpu time spent up to now is 93.8 secs Computing kpt #: 99 total cpu time spent up to now is 94.7 secs Computing kpt #: 100 total cpu time spent up to now is 95.6 secs Computing kpt #: 101 total cpu time spent up to now is 96.4 secs Computing kpt #: 102 total cpu time spent up to now is 97.3 secs Computing kpt #: 103 total cpu time spent up to now is 98.1 secs Computing kpt #: 104 total cpu time spent up to now is 98.9 secs Computing kpt #: 105 total cpu time spent up to now is 99.9 secs Computing kpt #: 106 total cpu time spent up to now is 101.1 secs Computing kpt #: 107 total cpu time spent up to now is 102.1 secs Computing kpt #: 108 total cpu time spent up to now is 103.1 secs Computing kpt #: 109 total cpu time spent up to now is 104.0 secs Computing kpt #: 110 total cpu time spent up to now is 105.0 secs Computing kpt #: 111 total cpu time spent up to now is 105.8 secs Computing kpt #: 112 total cpu time spent up to now is 106.7 secs Computing kpt #: 113 total cpu time spent up to now is 107.5 secs Computing kpt #: 114 total cpu time spent up to now is 108.4 secs Computing kpt #: 115 total cpu time spent up to now is 109.3 secs Computing kpt #: 116 total cpu time spent up to now is 110.1 secs Computing kpt #: 117 total cpu time spent up to now is 110.9 secs Computing kpt #: 118 total cpu time spent up to now is 111.7 secs Computing kpt #: 119 total cpu time spent up to now is 112.6 secs Computing kpt #: 120 total cpu time spent up to now is 113.4 secs Computing kpt #: 121 total cpu time spent up to now is 114.3 secs Computing kpt #: 122 total cpu time spent up to now is 115.1 secs Computing kpt #: 123 total cpu time spent up to now is 115.9 secs Computing kpt #: 124 total cpu time spent up to now is 116.7 secs Computing kpt #: 125 total cpu time spent up to now is 117.5 secs Computing kpt #: 126 total cpu time spent up to now is 118.4 secs Computing kpt #: 127 total cpu time spent up to now is 119.3 secs Computing kpt #: 128 total cpu time spent up to now is 120.3 secs Computing kpt #: 129 total cpu time spent up to now is 121.3 secs Computing kpt #: 130 total cpu time spent up to now is 121.9 secs Computing kpt #: 131 total cpu time spent up to now is 122.6 secs Computing kpt #: 132 total cpu time spent up to now is 123.2 secs Computing kpt #: 133 total cpu time spent up to now is 123.8 secs Computing kpt #: 134 total cpu time spent up to now is 124.4 secs Computing kpt #: 135 total cpu time spent up to now is 125.0 secs Computing kpt #: 136 total cpu time spent up to now is 125.6 secs Computing kpt #: 137 total cpu time spent up to now is 126.2 secs Computing kpt #: 138 total cpu time spent up to now is 126.8 secs Computing kpt #: 139 total cpu time spent up to now is 127.4 secs Computing kpt #: 140 total cpu time spent up to now is 128.0 secs Computing kpt #: 141 total cpu time spent up to now is 128.6 secs Computing kpt #: 142 total cpu time spent up to now is 129.2 secs Computing kpt #: 143 total cpu time spent up to now is 129.7 secs Computing kpt #: 144 total cpu time spent up to now is 130.3 secs Computing kpt #: 145 total cpu time spent up to now is 130.9 secs Computing kpt #: 146 total cpu time spent up to now is 131.5 secs Computing kpt #: 147 total cpu time spent up to now is 132.1 secs Computing kpt #: 148 total cpu time spent up to now is 132.7 secs Computing kpt #: 149 total cpu time spent up to now is 133.3 secs Computing kpt #: 150 total cpu time spent up to now is 133.9 secs Computing kpt #: 151 total cpu time spent up to now is 134.5 secs Computing kpt #: 152 total cpu time spent up to now is 135.1 secs Computing kpt #: 153 total cpu time spent up to now is 135.8 secs Computing kpt #: 154 total cpu time spent up to now is 136.4 secs Computing kpt #: 155 total cpu time spent up to now is 136.9 secs Computing kpt #: 156 total cpu time spent up to now is 137.5 secs Computing kpt #: 157 total cpu time spent up to now is 138.2 secs Computing kpt #: 158 total cpu time spent up to now is 138.9 secs Computing kpt #: 159 total cpu time spent up to now is 139.7 secs Computing kpt #: 160 total cpu time spent up to now is 140.5 secs Computing kpt #: 161 total cpu time spent up to now is 141.3 secs Computing kpt #: 162 total cpu time spent up to now is 142.1 secs Computing kpt #: 163 total cpu time spent up to now is 142.9 secs Computing kpt #: 164 total cpu time spent up to now is 144.0 secs Computing kpt #: 165 total cpu time spent up to now is 145.0 secs Computing kpt #: 166 total cpu time spent up to now is 145.9 secs Computing kpt #: 167 total cpu time spent up to now is 146.8 secs Computing kpt #: 168 total cpu time spent up to now is 147.7 secs Computing kpt #: 169 total cpu time spent up to now is 148.6 secs Computing kpt #: 170 total cpu time spent up to now is 149.5 secs Computing kpt #: 171 total cpu time spent up to now is 150.4 secs Computing kpt #: 172 total cpu time spent up to now is 151.2 secs Computing kpt #: 173 total cpu time spent up to now is 152.2 secs Computing kpt #: 174 total cpu time spent up to now is 153.2 secs Computing kpt #: 175 total cpu time spent up to now is 154.2 secs Computing kpt #: 176 total cpu time spent up to now is 155.2 secs Computing kpt #: 177 total cpu time spent up to now is 156.2 secs Computing kpt #: 178 total cpu time spent up to now is 157.7 secs Computing kpt #: 179 total cpu time spent up to now is 158.5 secs Computing kpt #: 180 total cpu time spent up to now is 159.2 secs Computing kpt #: 181 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 161.4 secs Computing kpt #: 182 total cpu time spent up to now is 162.7 secs Computing kpt #: 183 total cpu time spent up to now is 164.2 secs Computing kpt #: 184 total cpu time spent up to now is 165.7 secs Computing kpt #: 185 total cpu time spent up to now is 166.9 secs Computing kpt #: 186 total cpu time spent up to now is 168.3 secs Computing kpt #: 187 total cpu time spent up to now is 169.1 secs Computing kpt #: 188 total cpu time spent up to now is 170.4 secs Computing kpt #: 189 total cpu time spent up to now is 171.2 secs Computing kpt #: 190 total cpu time spent up to now is 172.4 secs Computing kpt #: 191 total cpu time spent up to now is 173.4 secs Computing kpt #: 192 total cpu time spent up to now is 174.3 secs Computing kpt #: 193 total cpu time spent up to now is 175.3 secs Computing kpt #: 194 total cpu time spent up to now is 176.4 secs Computing kpt #: 195 total cpu time spent up to now is 177.4 secs Computing kpt #: 196 total cpu time spent up to now is 178.4 secs Computing kpt #: 197 total cpu time spent up to now is 179.4 secs Computing kpt #: 198 total cpu time spent up to now is 180.2 secs Computing kpt #: 199 total cpu time spent up to now is 181.0 secs Computing kpt #: 200 total cpu time spent up to now is 182.0 secs Computing kpt #: 201 total cpu time spent up to now is 182.8 secs Computing kpt #: 202 total cpu time spent up to now is 183.6 secs Computing kpt #: 203 total cpu time spent up to now is 184.3 secs Computing kpt #: 204 total cpu time spent up to now is 185.1 secs Computing kpt #: 205 total cpu time spent up to now is 185.9 secs Computing kpt #: 206 total cpu time spent up to now is 186.7 secs Computing kpt #: 207 total cpu time spent up to now is 187.5 secs Computing kpt #: 208 total cpu time spent up to now is 188.3 secs Computing kpt #: 209 total cpu time spent up to now is 189.1 secs Computing kpt #: 210 total cpu time spent up to now is 189.9 secs Computing kpt #: 211 total cpu time spent up to now is 190.7 secs Computing kpt #: 212 total cpu time spent up to now is 191.4 secs Computing kpt #: 213 total cpu time spent up to now is 192.2 secs Computing kpt #: 214 total cpu time spent up to now is 192.9 secs Computing kpt #: 215 total cpu time spent up to now is 193.7 secs Computing kpt #: 216 total cpu time spent up to now is 194.4 secs Computing kpt #: 217 total cpu time spent up to now is 195.2 secs Computing kpt #: 218 total cpu time spent up to now is 195.9 secs Computing kpt #: 219 total cpu time spent up to now is 196.7 secs Computing kpt #: 220 total cpu time spent up to now is 197.5 secs Computing kpt #: 221 total cpu time spent up to now is 198.3 secs Computing kpt #: 222 total cpu time spent up to now is 199.0 secs Computing kpt #: 223 total cpu time spent up to now is 199.8 secs Computing kpt #: 224 total cpu time spent up to now is 200.6 secs Computing kpt #: 225 total cpu time spent up to now is 201.4 secs Computing kpt #: 226 total cpu time spent up to now is 202.1 secs Computing kpt #: 227 total cpu time spent up to now is 202.9 secs Computing kpt #: 228 total cpu time spent up to now is 203.7 secs Computing kpt #: 229 total cpu time spent up to now is 204.5 secs Computing kpt #: 230 total cpu time spent up to now is 205.2 secs Computing kpt #: 231 total cpu time spent up to now is 206.0 secs Computing kpt #: 232 total cpu time spent up to now is 206.8 secs Computing kpt #: 233 total cpu time spent up to now is 207.5 secs Computing kpt #: 234 total cpu time spent up to now is 208.3 secs Computing kpt #: 235 total cpu time spent up to now is 209.0 secs Computing kpt #: 236 total cpu time spent up to now is 209.8 secs Computing kpt #: 237 total cpu time spent up to now is 210.6 secs Computing kpt #: 238 total cpu time spent up to now is 211.4 secs Computing kpt #: 239 total cpu time spent up to now is 212.1 secs Computing kpt #: 240 total cpu time spent up to now is 212.9 secs Computing kpt #: 241 total cpu time spent up to now is 213.7 secs Computing kpt #: 242 total cpu time spent up to now is 214.5 secs Computing kpt #: 243 total cpu time spent up to now is 215.4 secs Computing kpt #: 244 total cpu time spent up to now is 216.1 secs Computing kpt #: 245 total cpu time spent up to now is 216.8 secs Computing kpt #: 246 total cpu time spent up to now is 217.5 secs Computing kpt #: 247 total cpu time spent up to now is 218.1 secs Computing kpt #: 248 total cpu time spent up to now is 218.8 secs Computing kpt #: 249 total cpu time spent up to now is 219.4 secs Computing kpt #: 250 total cpu time spent up to now is 220.0 secs Computing kpt #: 251 total cpu time spent up to now is 220.6 secs Computing kpt #: 252 total cpu time spent up to now is 221.2 secs Computing kpt #: 253 total cpu time spent up to now is 221.8 secs Computing kpt #: 254 total cpu time spent up to now is 222.4 secs Computing kpt #: 255 total cpu time spent up to now is 223.0 secs Computing kpt #: 256 total cpu time spent up to now is 223.7 secs Computing kpt #: 257 total cpu time spent up to now is 224.3 secs Computing kpt #: 258 total cpu time spent up to now is 224.9 secs Computing kpt #: 259 total cpu time spent up to now is 225.5 secs Computing kpt #: 260 total cpu time spent up to now is 226.1 secs Computing kpt #: 261 total cpu time spent up to now is 226.7 secs Computing kpt #: 262 total cpu time spent up to now is 227.3 secs Computing kpt #: 263 total cpu time spent up to now is 227.9 secs Computing kpt #: 264 total cpu time spent up to now is 228.4 secs Computing kpt #: 265 total cpu time spent up to now is 229.0 secs Computing kpt #: 266 total cpu time spent up to now is 229.7 secs Computing kpt #: 267 total cpu time spent up to now is 230.3 secs Computing kpt #: 268 total cpu time spent up to now is 231.0 secs Computing kpt #: 269 total cpu time spent up to now is 231.7 secs Computing kpt #: 270 total cpu time spent up to now is 232.4 secs Computing kpt #: 271 total cpu time spent up to now is 233.5 secs Computing kpt #: 272 total cpu time spent up to now is 234.5 secs Computing kpt #: 273 total cpu time spent up to now is 235.2 secs Computing kpt #: 274 total cpu time spent up to now is 236.2 secs Computing kpt #: 275 total cpu time spent up to now is 237.0 secs Computing kpt #: 276 total cpu time spent up to now is 237.8 secs Computing kpt #: 277 total cpu time spent up to now is 238.6 secs Computing kpt #: 278 total cpu time spent up to now is 239.4 secs Computing kpt #: 279 total cpu time spent up to now is 240.2 secs Computing kpt #: 280 total cpu time spent up to now is 241.0 secs Computing kpt #: 281 total cpu time spent up to now is 241.7 secs Computing kpt #: 282 total cpu time spent up to now is 242.5 secs Computing kpt #: 283 total cpu time spent up to now is 243.3 secs Computing kpt #: 284 total cpu time spent up to now is 244.0 secs Computing kpt #: 285 total cpu time spent up to now is 244.8 secs Computing kpt #: 286 total cpu time spent up to now is 245.6 secs Computing kpt #: 287 total cpu time spent up to now is 246.3 secs Computing kpt #: 288 total cpu time spent up to now is 246.9 secs Computing kpt #: 289 total cpu time spent up to now is 247.5 secs Computing kpt #: 290 total cpu time spent up to now is 248.2 secs Computing kpt #: 291 total cpu time spent up to now is 248.8 secs Computing kpt #: 292 total cpu time spent up to now is 249.4 secs Computing kpt #: 293 total cpu time spent up to now is 250.0 secs Computing kpt #: 294 total cpu time spent up to now is 250.7 secs Computing kpt #: 295 total cpu time spent up to now is 251.3 secs Computing kpt #: 296 total cpu time spent up to now is 251.9 secs Computing kpt #: 297 total cpu time spent up to now is 252.5 secs Computing kpt #: 298 total cpu time spent up to now is 253.1 secs Computing kpt #: 299 total cpu time spent up to now is 253.7 secs Computing kpt #: 300 total cpu time spent up to now is 254.4 secs Computing kpt #: 301 total cpu time spent up to now is 255.0 secs Computing kpt #: 302 total cpu time spent up to now is 255.7 secs Computing kpt #: 303 total cpu time spent up to now is 256.3 secs Computing kpt #: 304 total cpu time spent up to now is 257.0 secs Computing kpt #: 305 total cpu time spent up to now is 257.7 secs Computing kpt #: 306 total cpu time spent up to now is 258.4 secs Computing kpt #: 307 total cpu time spent up to now is 259.2 secs ethr = 1.92E-08, avg # of iterations = 33.8 total cpu time spent up to now is 259.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4879 PWs) bands (ev): -24.1947 -24.1947 -24.1643 -24.1643 -7.9236 -7.9236 -7.8225 -7.8225 -7.6717 -7.6717 -7.6499 -7.6499 -7.5699 -7.5699 -7.5366 -7.5366 -4.2231 -4.2231 -3.8454 -3.8454 -2.3438 -2.3438 -2.2472 -2.2472 -2.1664 -2.1664 -1.9547 -1.9547 -1.4892 -1.4892 -1.4789 -1.4789 -1.3237 -1.3237 -1.3201 -1.3201 -1.2056 -1.2056 -0.9110 -0.9110 3.1714 3.1714 4.7518 4.7518 4.7593 4.7593 6.3434 6.3434 6.7957 6.7957 6.9389 6.9389 7.0409 7.0409 7.3989 7.3989 8.5623 8.5623 9.8068 9.8068 10.6696 10.6696 k = 0.0000 0.0143-0.0000 ( 4899 PWs) bands (ev): -24.1947 -24.1947 -24.1644 -24.1644 -7.9236 -7.9236 -7.8227 -7.8227 -7.6717 -7.6717 -7.6500 -7.6500 -7.5699 -7.5699 -7.5367 -7.5367 -4.2224 -4.2224 -3.8451 -3.8451 -2.3436 -2.3436 -2.2470 -2.2470 -2.1663 -2.1663 -1.9545 -1.9545 -1.4900 -1.4900 -1.4796 -1.4796 -1.3238 -1.3238 -1.3196 -1.3196 -1.2049 -1.2049 -0.9114 -0.9114 3.1715 3.1715 4.7433 4.7433 4.7580 4.7580 6.3439 6.3439 6.7747 6.7747 6.9089 6.9089 7.0899 7.0899 7.4081 7.4081 8.5668 8.5668 9.8123 9.8123 10.6566 10.6566 k = 0.0000 0.0286-0.0000 ( 4911 PWs) bands (ev): -24.1947 -24.1947 -24.1644 -24.1644 -7.9236 -7.9236 -7.8231 -7.8231 -7.6715 -7.6715 -7.6502 -7.6502 -7.5698 -7.5698 -7.5371 -7.5371 -4.2202 -4.2202 -3.8444 -3.8444 -2.3429 -2.3429 -2.2463 -2.2463 -2.1661 -2.1661 -1.9537 -1.9537 -1.4924 -1.4924 -1.4809 -1.4809 -1.3241 -1.3241 -1.3181 -1.3181 -1.2028 -1.2028 -0.9125 -0.9125 3.1718 3.1718 4.7111 4.7111 4.7618 4.7618 6.3452 6.3452 6.7127 6.7127 6.8817 6.8817 7.1733 7.1733 7.4349 7.4349 8.5805 8.5805 9.8286 9.8286 10.6198 10.6198 k = 0.0000 0.0429-0.0000 ( 4915 PWs) bands (ev): -24.1946 -24.1946 -24.1645 -24.1645 -7.9236 -7.9236 -7.8238 -7.8238 -7.6712 -7.6712 -7.6505 -7.6505 -7.5697 -7.5697 -7.5376 -7.5376 -4.2167 -4.2167 -3.8431 -3.8431 -2.3416 -2.3416 -2.2450 -2.2450 -2.1657 -2.1657 -1.9525 -1.9525 -1.4969 -1.4969 -1.4823 -1.4823 -1.3246 -1.3246 -1.3160 -1.3160 -1.1993 -1.1993 -0.9141 -0.9141 3.1723 3.1723 4.6586 4.6586 4.7692 4.7692 6.3458 6.3458 6.6289 6.6289 6.8687 6.8687 7.2617 7.2617 7.4774 7.4774 8.6039 8.6039 9.8552 9.8552 10.5648 10.5648 k = 0.0000 0.0571-0.0000 ( 4915 PWs) bands (ev): -24.1945 -24.1945 -24.1646 -24.1646 -7.9237 -7.9237 -7.8248 -7.8248 -7.6708 -7.6708 -7.6509 -7.6509 -7.5696 -7.5696 -7.5384 -7.5384 -4.2117 -4.2117 -3.8413 -3.8413 -2.3398 -2.3398 -2.2432 -2.2432 -2.1652 -2.1652 -1.9507 -1.9507 -1.5033 -1.5033 -1.4833 -1.4833 -1.3252 -1.3252 -1.3141 -1.3141 -1.1945 -1.1945 -0.9163 -0.9163 3.1729 3.1729 4.5890 4.5890 4.7797 4.7797 6.3424 6.3424 6.5410 6.5410 6.8601 6.8601 7.3501 7.3501 7.5325 7.5325 8.6377 8.6377 9.8916 9.8916 10.4973 10.4973 k = 0.0000 0.0714-0.0000 ( 4917 PWs) bands (ev): -24.1943 -24.1943 -24.1647 -24.1647 -7.9237 -7.9237 -7.8261 -7.8261 -7.6702 -7.6702 -7.6514 -7.6514 -7.5694 -7.5694 -7.5393 -7.5393 -4.2055 -4.2055 -3.8391 -3.8391 -2.3375 -2.3375 -2.2409 -2.2409 -2.1646 -2.1646 -1.9484 -1.9484 -1.5109 -1.5109 -1.4842 -1.4842 -1.3261 -1.3261 -1.3126 -1.3126 -1.1885 -1.1885 -0.9188 -0.9188 3.1736 3.1736 4.5056 4.5056 4.7931 4.7931 6.3252 6.3252 6.4636 6.4636 6.8521 6.8521 7.4369 7.4369 7.5964 7.5964 8.6832 8.6832 9.9367 9.9367 10.4221 10.4221 k = 0.0000 0.0857-0.0000 ( 4913 PWs) bands (ev): -24.1941 -24.1941 -24.1648 -24.1648 -7.9238 -7.9238 -7.8276 -7.8276 -7.6696 -7.6696 -7.6520 -7.6520 -7.5692 -7.5692 -7.5404 -7.5404 -4.1979 -4.1979 -3.8364 -3.8364 -2.3346 -2.3346 -2.2381 -2.2381 -2.1639 -2.1639 -1.9457 -1.9457 -1.5192 -1.5192 -1.4851 -1.4851 -1.3271 -1.3271 -1.3120 -1.3120 -1.1817 -1.1817 -0.9214 -0.9214 3.1741 3.1741 4.4115 4.4115 4.8094 4.8094 6.2742 6.2742 6.4185 6.4185 6.8437 6.8437 7.5215 7.5215 7.6650 7.6650 8.7413 8.7413 9.9888 9.9888 10.3427 10.3427 k = 0.0000 0.1000-0.0000 ( 4921 PWs) bands (ev): -24.1938 -24.1938 -24.1649 -24.1649 -7.9239 -7.9239 -7.8294 -7.8294 -7.6689 -7.6689 -7.6526 -7.6526 -7.5691 -7.5691 -7.5416 -7.5416 -4.1890 -4.1890 -3.8333 -3.8333 -2.3312 -2.3312 -2.2349 -2.2349 -2.1630 -2.1630 -1.9426 -1.9426 -1.5278 -1.5278 -1.4859 -1.4859 -1.3283 -1.3283 -1.3125 -1.3125 -1.1744 -1.1744 -0.9239 -0.9239 3.1743 3.1743 4.3094 4.3094 4.8285 4.8285 6.1932 6.1932 6.4029 6.4029 6.8344 6.8344 7.6037 7.6037 7.7344 7.7344 8.8128 8.8128 10.0460 10.0460 10.2621 10.2621 k = 0.0000 0.1143-0.0000 ( 4917 PWs) bands (ev): -24.1935 -24.1935 -24.1651 -24.1651 -7.9240 -7.9240 -7.8314 -7.8314 -7.6682 -7.6682 -7.6533 -7.6533 -7.5690 -7.5690 -7.5429 -7.5429 -4.1789 -4.1789 -3.8298 -3.8298 -2.3272 -2.3272 -2.2311 -2.2311 -2.1621 -2.1621 -1.9389 -1.9389 -1.5362 -1.5362 -1.4867 -1.4867 -1.3297 -1.3297 -1.3141 -1.3141 -1.1673 -1.1673 -0.9260 -0.9260 3.1741 3.1741 4.2016 4.2016 4.8504 4.8504 6.1022 6.1022 6.3974 6.3974 6.8240 6.8240 7.6834 7.6834 7.8016 7.8016 8.8980 8.8980 10.1042 10.1042 10.1840 10.1840 k = 0.0000 0.1286-0.0000 ( 4917 PWs) bands (ev): -24.1932 -24.1932 -24.1653 -24.1653 -7.9241 -7.9241 -7.8336 -7.8336 -7.6674 -7.6674 -7.6539 -7.6539 -7.5690 -7.5690 -7.5443 -7.5443 -4.1677 -4.1677 -3.8260 -3.8260 -2.3227 -2.3227 -2.2269 -2.2269 -2.1611 -2.1611 -1.9350 -1.9350 -1.5442 -1.5442 -1.4875 -1.4875 -1.3312 -1.3312 -1.3166 -1.3166 -1.1611 -1.1611 -0.9273 -0.9273 3.1732 3.1732 4.0902 4.0902 4.8748 4.8748 6.0097 6.0097 6.3942 6.3942 6.8123 6.8123 7.7610 7.7610 7.8640 7.8640 8.9959 8.9959 10.1011 10.1011 10.1696 10.1696 k = 0.0000 0.1429-0.0000 ( 4913 PWs) bands (ev): -24.1929 -24.1929 -24.1655 -24.1655 -7.9242 -7.9242 -7.8360 -7.8360 -7.6667 -7.6667 -7.6545 -7.6545 -7.5690 -7.5690 -7.5457 -7.5457 -4.1554 -4.1554 -3.8218 -3.8218 -2.3176 -2.3176 -2.2222 -2.2222 -2.1600 -2.1600 -1.9306 -1.9306 -1.5517 -1.5517 -1.4884 -1.4884 -1.3328 -1.3328 -1.3201 -1.3201 -1.1563 -1.1563 -0.9275 -0.9275 3.1714 3.1714 3.9768 3.9768 4.9018 4.9018 5.9185 5.9185 6.3910 6.3910 6.7995 6.7995 7.8364 7.8364 7.9207 7.9207 9.1042 9.1042 10.0329 10.0329 10.2205 10.2205 k = 0.0000 0.1571-0.0000 ( 4897 PWs) bands (ev): -24.1924 -24.1924 -24.1656 -24.1656 -7.9243 -7.9243 -7.8386 -7.8386 -7.6659 -7.6659 -7.6550 -7.6550 -7.5692 -7.5692 -7.5471 -7.5471 -4.1421 -4.1421 -3.8174 -3.8174 -2.3118 -2.3118 -2.2171 -2.2171 -2.1588 -2.1588 -1.9260 -1.9260 -1.5583 -1.5583 -1.4892 -1.4892 -1.3346 -1.3346 -1.3243 -1.3243 -1.1535 -1.1535 -0.9264 -0.9264 3.1685 3.1685 3.8628 3.8628 4.9312 4.9312 5.8300 5.8300 6.3868 6.3868 6.7853 6.7853 7.9097 7.9097 7.9714 7.9714 9.2184 9.2184 9.9729 9.9729 10.2617 10.2617 k = 0.0000 0.1714-0.0000 ( 4897 PWs) bands (ev): -24.1920 -24.1920 -24.1659 -24.1659 -7.9245 -7.9245 -7.8414 -7.8414 -7.6654 -7.6654 -7.6554 -7.6554 -7.5695 -7.5695 -7.5484 -7.5484 -4.1280 -4.1280 -3.8128 -3.8128 -2.3056 -2.3056 -2.2116 -2.2116 -2.1575 -2.1575 -1.9211 -1.9211 -1.5641 -1.5641 -1.4901 -1.4901 -1.3365 -1.3365 -1.3291 -1.3291 -1.1531 -1.1531 -0.9238 -0.9238 3.1640 3.1640 3.7495 3.7495 4.9628 4.9628 5.7454 5.7454 6.3810 6.3810 6.7697 6.7697 7.9799 7.9799 8.0178 8.0178 9.3309 9.3309 9.9290 9.9290 10.2861 10.2861 k = 0.0000 0.1857-0.0000 ( 4897 PWs) bands (ev): -24.1916 -24.1916 -24.1662 -24.1662 -7.9246 -7.9246 -7.8444 -7.8444 -7.6650 -7.6650 -7.6555 -7.6555 -7.5700 -7.5700 -7.5497 -7.5497 -4.1130 -4.1130 -3.8080 -3.8080 -2.2988 -2.2988 -2.2058 -2.2058 -2.1562 -2.1562 -1.9160 -1.9160 -1.5688 -1.5688 -1.4909 -1.4909 -1.3388 -1.3388 -1.3342 -1.3342 -1.1552 -1.1552 -0.9197 -0.9197 3.1578 3.1578 3.6377 3.6377 4.9966 4.9966 5.6653 5.6653 6.3733 6.3733 6.7529 6.7529 8.0392 8.0392 8.0681 8.0681 9.4280 9.4280 9.9130 9.9130 10.2905 10.2905 k = 0.0000 0.2000-0.0000 ( 4895 PWs) bands (ev): -24.1911 -24.1911 -24.1665 -24.1665 -7.9248 -7.9248 -7.8475 -7.8475 -7.6648 -7.6648 -7.6554 -7.6554 -7.5707 -7.5707 -7.5508 -7.5508 -4.0973 -4.0973 -3.8031 -3.8031 -2.2913 -2.2913 -2.1996 -2.1996 -2.1548 -2.1548 -1.9109 -1.9109 -1.5725 -1.5725 -1.4917 -1.4917 -1.3426 -1.3426 -1.3383 -1.3383 -1.1597 -1.1597 -0.9145 -0.9145 3.1493 3.1493 3.5284 3.5284 5.0323 5.0323 5.5906 5.5906 6.3632 6.3632 6.7346 6.7346 8.0787 8.0787 8.1322 8.1322 9.4916 9.4916 9.9409 9.9409 10.2760 10.2760 k = 0.0000 0.2143-0.0000 ( 4889 PWs) bands (ev): -24.1905 -24.1905 -24.1668 -24.1668 -7.9250 -7.9250 -7.8507 -7.8507 -7.6648 -7.6648 -7.6550 -7.6550 -7.5715 -7.5715 -7.5518 -7.5518 -4.0810 -4.0810 -3.7982 -3.7982 -2.2833 -2.2833 -2.1931 -2.1931 -2.1534 -2.1534 -1.9058 -1.9058 -1.5749 -1.5749 -1.4923 -1.4923 -1.3483 -1.3483 -1.3408 -1.3408 -1.1665 -1.1665 -0.9086 -0.9086 3.1384 3.1384 3.4225 3.4225 5.0697 5.0697 5.5218 5.5218 6.3506 6.3506 6.7150 6.7150 8.1089 8.1089 8.2002 8.2002 9.5153 9.5153 10.0149 10.0149 10.2480 10.2480 k = 0.0000 0.2286-0.0000 ( 4899 PWs) bands (ev): -24.1900 -24.1900 -24.1671 -24.1671 -7.9252 -7.9252 -7.8540 -7.8540 -7.6650 -7.6650 -7.6545 -7.6545 -7.5725 -7.5725 -7.5527 -7.5527 -4.0642 -4.0642 -3.7933 -3.7933 -2.2748 -2.2748 -2.1864 -2.1864 -2.1519 -2.1519 -1.9008 -1.9008 -1.5760 -1.5760 -1.4929 -1.4929 -1.3549 -1.3549 -1.3426 -1.3426 -1.1754 -1.1754 -0.9024 -0.9024 3.1243 3.1243 3.3208 3.3208 5.1085 5.1085 5.4598 5.4598 6.3352 6.3352 6.6939 6.6939 8.1343 8.1343 8.2683 8.2683 9.5139 9.5139 10.1051 10.1051 10.2234 10.2234 k = 0.0000 0.2429-0.0000 ( 4902 PWs) bands (ev): -24.1895 -24.1895 -24.1675 -24.1675 -7.9254 -7.9254 -7.8574 -7.8574 -7.6653 -7.6653 -7.6538 -7.6538 -7.5735 -7.5735 -7.5535 -7.5535 -4.0470 -4.0470 -3.7885 -3.7885 -2.2656 -2.2656 -2.1795 -2.1795 -2.1503 -2.1503 -1.8961 -1.8961 -1.5759 -1.5759 -1.4934 -1.4934 -1.3617 -1.3617 -1.3442 -1.3442 -1.1859 -1.1859 -0.8964 -0.8964 3.1062 3.1062 3.2247 3.2247 5.1482 5.1482 5.4054 5.4054 6.3166 6.3166 6.6714 6.6714 8.1560 8.1560 8.3357 8.3357 9.5039 9.5039 10.1204 10.1204 10.2783 10.2783 k = 0.0000 0.2571-0.0000 ( 4896 PWs) bands (ev): -24.1888 -24.1888 -24.1678 -24.1678 -7.9255 -7.9255 -7.8608 -7.8608 -7.6657 -7.6657 -7.6531 -7.6531 -7.5745 -7.5745 -7.5542 -7.5542 -4.0296 -4.0296 -3.7838 -3.7838 -2.2559 -2.2559 -2.1725 -2.1725 -2.1487 -2.1487 -1.8918 -1.8918 -1.5743 -1.5743 -1.4937 -1.4937 -1.3686 -1.3686 -1.3453 -1.3453 -1.1977 -1.1977 -0.8911 -0.8911 3.0794 3.0794 3.1391 3.1391 5.1876 5.1876 5.3601 5.3601 6.2949 6.2949 6.6474 6.6474 8.1750 8.1750 8.4020 8.4020 9.4943 9.4943 10.0758 10.0758 10.3882 10.3882 k = 0.0000 0.2714-0.0000 ( 4898 PWs) bands (ev): -24.1882 -24.1882 -24.1683 -24.1683 -7.9257 -7.9257 -7.8643 -7.8643 -7.6660 -7.6660 -7.6524 -7.6524 -7.5755 -7.5755 -7.5549 -7.5549 -4.0119 -4.0119 -3.7794 -3.7794 -2.2457 -2.2457 -2.1653 -2.1653 -2.1470 -2.1470 -1.8880 -1.8880 -1.5715 -1.5715 -1.4938 -1.4938 -1.3756 -1.3756 -1.3460 -1.3460 -1.2106 -1.2106 -0.8869 -0.8869 3.0247 3.0247 3.0838 3.0838 5.2223 5.2223 5.3281 5.3281 6.2697 6.2697 6.6219 6.6219 8.1919 8.1919 8.4667 8.4667 9.4891 9.4891 10.0222 10.0222 10.4969 10.4969 k = 0.0000 0.2857-0.0000 ( 4896 PWs) bands (ev): -24.1876 -24.1876 -24.1687 -24.1687 -7.9257 -7.9257 -7.8679 -7.8679 -7.6663 -7.6663 -7.6518 -7.6518 -7.5765 -7.5765 -7.5555 -7.5555 -3.9943 -3.9943 -3.7752 -3.7752 -2.2351 -2.2351 -2.1580 -2.1580 -2.1451 -2.1451 -1.8849 -1.8849 -1.5674 -1.5674 -1.4936 -1.4936 -1.3824 -1.3824 -1.3460 -1.3460 -1.2244 -1.2244 -0.8843 -0.8843 2.9495 2.9495 3.0516 3.0516 5.2385 5.2385 5.3236 5.3236 6.2410 6.2410 6.5949 6.5949 8.2074 8.2074 8.5291 8.5291 9.4903 9.4903 9.9677 9.9677 10.5922 10.5922 k = 0.0000 0.3000-0.0000 ( 4902 PWs) bands (ev): -24.1870 -24.1870 -24.1691 -24.1691 -7.9258 -7.9258 -7.8715 -7.8715 -7.6665 -7.6665 -7.6513 -7.6513 -7.5773 -7.5773 -7.5562 -7.5562 -3.9767 -3.9767 -3.7715 -3.7715 -2.2241 -2.2241 -2.1507 -2.1507 -2.1431 -2.1431 -1.8827 -1.8827 -1.5620 -1.5620 -1.4933 -1.4933 -1.3890 -1.3890 -1.3451 -1.3451 -1.2388 -1.2388 -0.8835 -0.8835 2.8757 2.8757 3.0213 3.0213 5.2305 5.2305 5.3521 5.3521 6.2089 6.2089 6.5664 6.5664 8.2222 8.2222 8.5884 8.5884 9.4985 9.4985 9.9153 9.9153 10.6624 10.6624 k = 0.0000 0.3143-0.0000 ( 4904 PWs) bands (ev): -24.1863 -24.1863 -24.1696 -24.1696 -7.9257 -7.9257 -7.8750 -7.8750 -7.6666 -7.6666 -7.6509 -7.6509 -7.5780 -7.5780 -7.5569 -7.5569 -3.9593 -3.9593 -3.7681 -3.7681 -2.2131 -2.2131 -2.1442 -2.1442 -2.1400 -2.1400 -1.8815 -1.8815 -1.5557 -1.5557 -1.4926 -1.4926 -1.3954 -1.3954 -1.3430 -1.3430 -1.2535 -1.2535 -0.8850 -0.8850 2.8073 2.8073 2.9892 2.9892 5.2179 5.2179 5.3937 5.3937 6.1733 6.1733 6.5365 6.5365 8.2370 8.2370 8.6435 8.6435 9.5137 9.5137 9.8673 9.8673 10.6737 10.6737 k = 0.0000 0.3286-0.0000 ( 4904 PWs) bands (ev): -24.1857 -24.1857 -24.1701 -24.1701 -7.9256 -7.9256 -7.8786 -7.8786 -7.6666 -7.6666 -7.6507 -7.6507 -7.5785 -7.5785 -7.5576 -7.5576 -3.9422 -3.9422 -3.7652 -3.7652 -2.2020 -2.2020 -2.1407 -2.1407 -2.1336 -2.1336 -1.8815 -1.8815 -1.5484 -1.5484 -1.4916 -1.4916 -1.4015 -1.4015 -1.3394 -1.3394 -1.2686 -1.2686 -0.8888 -0.8888 2.7454 2.7454 2.9551 2.9551 5.2095 5.2095 5.4393 5.4393 6.1345 6.1345 6.5051 6.5051 8.2524 8.2524 8.6929 8.6929 9.5355 9.5355 9.8259 9.8259 10.6641 10.6641 k = 0.0000 0.3429-0.0000 ( 4908 PWs) bands (ev): -24.1850 -24.1850 -24.1706 -24.1706 -7.9254 -7.9254 -7.8821 -7.8821 -7.6665 -7.6665 -7.6506 -7.6506 -7.5788 -7.5788 -7.5584 -7.5584 -3.9254 -3.9254 -3.7628 -3.7628 -2.1912 -2.1912 -2.1385 -2.1385 -2.1255 -2.1255 -1.8827 -1.8827 -1.5406 -1.5406 -1.4902 -1.4902 -1.4073 -1.4073 -1.3340 -1.3340 -1.2838 -1.2838 -0.8952 -0.8952 2.6903 2.6903 2.9190 2.9190 5.2072 5.2072 5.4867 5.4867 6.0926 6.0926 6.4723 6.4723 8.2691 8.2691 8.7348 8.7348 9.5633 9.5633 9.7933 9.7933 10.6554 10.6554 k = 0.0000 0.3571-0.0000 ( 4904 PWs) bands (ev): -24.1843 -24.1843 -24.1711 -24.1711 -7.9251 -7.9251 -7.8855 -7.8855 -7.6663 -7.6663 -7.6507 -7.6507 -7.5789 -7.5789 -7.5593 -7.5593 -3.9092 -3.9092 -3.7611 -3.7611 -2.1809 -2.1809 -2.1365 -2.1365 -2.1164 -2.1164 -1.8853 -1.8853 -1.5324 -1.5324 -1.4884 -1.4884 -1.4128 -1.4128 -1.3264 -1.3264 -1.2990 -1.2990 -0.9042 -0.9042 2.6424 2.6424 2.8815 2.8815 5.2112 5.2112 5.5350 5.5350 6.0480 6.0480 6.4381 6.4381 8.2875 8.2875 8.7675 8.7675 9.5962 9.5962 9.7717 9.7717 10.6497 10.6497 k = 0.0000 0.3714-0.0000 ( 4900 PWs) bands (ev): -24.1836 -24.1836 -24.1716 -24.1716 -7.9247 -7.9247 -7.8889 -7.8889 -7.6660 -7.6660 -7.6510 -7.6510 -7.5787 -7.5787 -7.5602 -7.5602 -3.8935 -3.8935 -3.7601 -3.7601 -2.1714 -2.1714 -2.1347 -2.1347 -2.1064 -2.1064 -1.8893 -1.8893 -1.5241 -1.5241 -1.4862 -1.4862 -1.4180 -1.4180 -1.3166 -1.3166 -1.3136 -1.3136 -0.9160 -0.9160 2.6017 2.6017 2.8428 2.8428 5.2214 5.2214 5.5838 5.5838 6.0012 6.0012 6.4025 6.4025 8.3080 8.3080 8.7893 8.7893 9.6333 9.6333 9.7630 9.7630 10.6475 10.6475 k = 0.0000 0.3857-0.0000 ( 4894 PWs) bands (ev): -24.1828 -24.1828 -24.1722 -24.1722 -7.9241 -7.9241 -7.8922 -7.8922 -7.6655 -7.6655 -7.6515 -7.6515 -7.5784 -7.5784 -7.5611 -7.5611 -3.8785 -3.8785 -3.7597 -3.7597 -2.1630 -2.1630 -2.1330 -2.1330 -2.0954 -2.0954 -1.8948 -1.8948 -1.5158 -1.5158 -1.4836 -1.4836 -1.4229 -1.4229 -1.3291 -1.3291 -1.3032 -1.3032 -0.9304 -0.9304 2.5682 2.5682 2.8037 2.8037 5.2375 5.2375 5.6324 5.6324 5.9527 5.9527 6.3657 6.3657 8.3308 8.3308 8.7993 8.7993 9.6733 9.6733 9.7684 9.7684 10.6489 10.6489 k = 0.0000 0.4000-0.0000 ( 4884 PWs) bands (ev): -24.1821 -24.1821 -24.1728 -24.1728 -7.9234 -7.9234 -7.8953 -7.8953 -7.6650 -7.6650 -7.6521 -7.6521 -7.5778 -7.5778 -7.5622 -7.5622 -3.8641 -3.8641 -3.7602 -3.7602 -2.1558 -2.1558 -2.1314 -2.1314 -2.0833 -2.0833 -1.9017 -1.9017 -1.5077 -1.5077 -1.4805 -1.4805 -1.4277 -1.4277 -1.3437 -1.3437 -1.2874 -1.2874 -0.9474 -0.9474 2.5421 2.5421 2.7646 2.7646 5.2592 5.2592 5.6803 5.6803 5.9034 5.9034 6.3276 6.3276 8.3560 8.3560 8.7976 8.7976 9.7150 9.7150 9.7878 9.7878 10.6541 10.6541 k = 0.0000 0.4143-0.0000 ( 4884 PWs) bands (ev): -24.1814 -24.1814 -24.1734 -24.1734 -7.9226 -7.9226 -7.8984 -7.8984 -7.6643 -7.6643 -7.6528 -7.6528 -7.5771 -7.5771 -7.5632 -7.5632 -3.8506 -3.8506 -3.7615 -3.7615 -2.1497 -2.1497 -2.1302 -2.1302 -2.0703 -2.0703 -1.9100 -1.9100 -1.5000 -1.5000 -1.4769 -1.4769 -1.4324 -1.4324 -1.3580 -1.3580 -1.2689 -1.2689 -0.9669 -0.9669 2.5230 2.5230 2.7263 2.7263 5.2860 5.2860 5.7250 5.7250 5.8561 5.8561 6.2883 6.2883 8.3837 8.3837 8.7853 8.7853 9.7578 9.7578 9.8189 9.8189 10.6627 10.6627 k = 0.0000 0.4286-0.0000 ( 4878 PWs) bands (ev): -24.1807 -24.1807 -24.1740 -24.1740 -7.9215 -7.9215 -7.9013 -7.9013 -7.6636 -7.6636 -7.6536 -7.6536 -7.5763 -7.5763 -7.5644 -7.5644 -3.8379 -3.8379 -3.7636 -3.7636 -2.1446 -2.1446 -2.1292 -2.1292 -2.0564 -2.0564 -1.9196 -1.9196 -1.4925 -1.4925 -1.4728 -1.4728 -1.4368 -1.4368 -1.3719 -1.3719 -1.2479 -1.2479 -0.9885 -0.9885 2.5109 2.5109 2.6891 2.6891 5.3174 5.3174 5.7517 5.7517 5.8258 5.8258 6.2477 6.2477 8.4138 8.4138 8.7642 8.7642 9.8019 9.8019 9.8575 9.8575 10.6683 10.6689 k = 0.0000 0.4429-0.0000 ( 4874 PWs) bands (ev): -24.1800 -24.1800 -24.1746 -24.1746 -7.9203 -7.9203 -7.9041 -7.9041 -7.6628 -7.6628 -7.6546 -7.6546 -7.5753 -7.5753 -7.5656 -7.5656 -3.8262 -3.8262 -3.7667 -3.7667 -2.1404 -2.1404 -2.1285 -2.1285 -2.0420 -2.0420 -1.9304 -1.9304 -1.4854 -1.4854 -1.4681 -1.4681 -1.4409 -1.4409 -1.3852 -1.3852 -1.2248 -1.2248 -1.0121 -1.0121 2.5054 2.5054 2.6539 2.6539 5.3530 5.3530 5.7256 5.7256 5.8477 5.8477 6.2061 6.2061 8.4461 8.4461 8.7363 8.7363 9.8470 9.8470 9.8984 9.8984 10.6336 10.6336 k = 0.0000 0.4571-0.0000 ( 4866 PWs) bands (ev): -24.1793 -24.1793 -24.1752 -24.1752 -7.9189 -7.9189 -7.9068 -7.9068 -7.6618 -7.6618 -7.6556 -7.6556 -7.5742 -7.5742 -7.5668 -7.5668 -3.8153 -3.8153 -3.7707 -3.7707 -2.1369 -2.1369 -2.1283 -2.1283 -2.0272 -2.0272 -1.9423 -1.9423 -1.4789 -1.4789 -1.4630 -1.4630 -1.4443 -1.4443 -1.3980 -1.3980 -1.1998 -1.1998 -1.0373 -1.0373 2.5063 2.5063 2.6211 2.6211 5.3923 5.3923 5.6782 5.6782 5.8907 5.8907 6.1633 6.1633 8.4805 8.4805 8.7036 8.7036 9.8913 9.8913 9.9364 9.9364 10.5973 10.5973 k = 0.0000 0.4714-0.0000 ( 4870 PWs) bands (ev): -24.1786 -24.1786 -24.1759 -24.1759 -7.9174 -7.9174 -7.9092 -7.9092 -7.6609 -7.6609 -7.6566 -7.6566 -7.5731 -7.5731 -7.5681 -7.5681 -3.8054 -3.8054 -3.7757 -3.7757 -2.1342 -2.1342 -2.1285 -2.1285 -2.0123 -2.0123 -1.9551 -1.9551 -1.4732 -1.4732 -1.4594 -1.4594 -1.4450 -1.4450 -1.4101 -1.4101 -1.1735 -1.1735 -1.0637 -1.0637 2.5131 2.5131 2.5913 2.5913 5.4348 5.4348 5.6276 5.6276 5.9368 5.9368 6.1196 6.1196 8.5165 8.5165 8.6679 8.6679 9.9316 9.9316 9.9663 9.9663 10.5696 10.5696 k = 0.0000 0.4857-0.0000 ( 4886 PWs) bands (ev): -24.1779 -24.1779 -24.1766 -24.1766 -7.9156 -7.9156 -7.9116 -7.9116 -7.6598 -7.6598 -7.6577 -7.6577 -7.5719 -7.5719 -7.5693 -7.5693 -3.7965 -3.7965 -3.7816 -3.7816 -2.1320 -2.1320 -2.1292 -2.1292 -1.9975 -1.9975 -1.9687 -1.9687 -1.4681 -1.4681 -1.4601 -1.4601 -1.4402 -1.4402 -1.4214 -1.4214 -1.1464 -1.1464 -1.0910 -1.0910 2.5255 2.5255 2.5651 2.5651 5.4801 5.4801 5.5772 5.5772 5.9833 5.9833 6.0749 6.0749 8.5539 8.5539 8.6303 8.6303 9.9634 9.9634 9.9826 9.9826 10.5563 10.5563 k = 0.0000 0.5000-0.0000 ( 4890 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9137 -7.9137 -7.9137 -7.9137 -7.6588 -7.6588 -7.6588 -7.6588 -7.5706 -7.5706 -7.5706 -7.5706 -3.7885 -3.7885 -3.7885 -3.7885 -2.1303 -2.1303 -2.1303 -2.1303 -1.9829 -1.9829 -1.9829 -1.9829 -1.4636 -1.4636 -1.4636 -1.4636 -1.4317 -1.4317 -1.4317 -1.4317 -1.1187 -1.1187 -1.1187 -1.1187 2.5430 2.5430 2.5430 2.5430 5.5278 5.5278 5.5278 5.5278 6.0294 6.0294 6.0294 6.0294 8.5920 8.5920 8.5920 8.5920 9.9816 9.9816 9.9816 9.9816 10.5619 10.5619 k = 0.0000 0.5000-0.0000 ( 4890 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9137 -7.9137 -7.9137 -7.9137 -7.6588 -7.6588 -7.6588 -7.6588 -7.5706 -7.5706 -7.5706 -7.5706 -3.7885 -3.7885 -3.7885 -3.7885 -2.1303 -2.1303 -2.1303 -2.1303 -1.9829 -1.9829 -1.9829 -1.9829 -1.4636 -1.4636 -1.4636 -1.4636 -1.4317 -1.4317 -1.4317 -1.4317 -1.1187 -1.1187 -1.1187 -1.1187 2.5430 2.5430 2.5430 2.5430 5.5278 5.5278 5.5278 5.5278 6.0294 6.0294 6.0294 6.0294 8.5920 8.5920 8.5920 8.5920 9.9816 9.9816 9.9816 9.9816 10.5619 10.5619 k = 0.0143 0.5000-0.0000 ( 4886 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9142 -7.9142 -7.9132 -7.9132 -7.6613 -7.6613 -7.6562 -7.6562 -7.5727 -7.5727 -7.5686 -7.5686 -3.7894 -3.7894 -3.7873 -3.7873 -2.1347 -2.1347 -2.1267 -2.1267 -1.9836 -1.9836 -1.9814 -1.9814 -1.4684 -1.4684 -1.4602 -1.4602 -1.4311 -1.4311 -1.4304 -1.4304 -1.1193 -1.1193 -1.1175 -1.1175 2.5427 2.5427 2.5446 2.5446 5.5265 5.5265 5.5280 5.5280 6.0202 6.0202 6.0218 6.0218 8.5991 8.5991 8.6027 8.6027 9.9701 9.9701 9.9846 9.9846 10.5493 10.5493 k = 0.0286 0.5000-0.0000 ( 4874 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9146 -7.9146 -7.9126 -7.9126 -7.6639 -7.6639 -7.6537 -7.6537 -7.5750 -7.5750 -7.5668 -7.5668 -3.7899 -3.7899 -3.7858 -3.7858 -2.1396 -2.1396 -2.1238 -2.1238 -1.9837 -1.9837 -1.9790 -1.9790 -1.4742 -1.4742 -1.4586 -1.4586 -1.4294 -1.4294 -1.4271 -1.4271 -1.1193 -1.1193 -1.1156 -1.1156 2.5436 2.5436 2.5473 2.5473 5.5240 5.5240 5.5272 5.5272 5.9947 5.9947 5.9976 5.9976 8.6231 8.6231 8.6306 8.6306 9.9503 9.9503 9.9786 9.9786 10.5252 10.5253 k = 0.0429 0.5000-0.0000 ( 4864 PWs) bands (ev): -24.1771 -24.1771 -24.1771 -24.1771 -7.9151 -7.9151 -7.9121 -7.9121 -7.6664 -7.6664 -7.6512 -7.6512 -7.5773 -7.5773 -7.5650 -7.5650 -3.7901 -3.7901 -3.7839 -3.7839 -2.1449 -2.1449 -2.1219 -2.1219 -1.9833 -1.9833 -1.9757 -1.9757 -1.4803 -1.4803 -1.4586 -1.4586 -1.4269 -1.4269 -1.4221 -1.4221 -1.1187 -1.1187 -1.1133 -1.1133 2.5457 2.5457 2.5513 2.5513 5.5204 5.5204 5.5252 5.5252 5.9543 5.9543 5.9584 5.9584 8.6622 8.6622 8.6741 8.6741 9.9230 9.9230 9.9637 9.9637 10.5016 10.5025 k = 0.0571 0.5000-0.0000 ( 4872 PWs) bands (ev): -24.1771 -24.1771 -24.1771 -24.1771 -7.9155 -7.9155 -7.9115 -7.9115 -7.6690 -7.6690 -7.6488 -7.6488 -7.5798 -7.5798 -7.5635 -7.5635 -3.7899 -3.7899 -3.7818 -3.7818 -2.1505 -2.1505 -2.1211 -2.1211 -1.9825 -1.9825 -1.9713 -1.9713 -1.4866 -1.4866 -1.4595 -1.4595 -1.4239 -1.4239 -1.4159 -1.4159 -1.1176 -1.1176 -1.1104 -1.1104 2.5490 2.5490 2.5564 2.5564 5.5153 5.5153 5.5219 5.5219 5.9012 5.9012 5.9059 5.9059 8.7133 8.7133 8.7304 8.7304 9.8895 9.8895 9.9406 9.9406 10.4855 10.4875 k = 0.0714 0.5000-0.0000 ( 4872 PWs) bands (ev): -24.1771 -24.1771 -24.1771 -24.1771 -7.9159 -7.9159 -7.9109 -7.9109 -7.6715 -7.6715 -7.6464 -7.6464 -7.5823 -7.5823 -7.5621 -7.5621 -3.7893 -3.7893 -3.7793 -3.7793 -2.1563 -2.1563 -2.1213 -2.1213 -1.9813 -1.9813 -1.9659 -1.9659 -1.4930 -1.4930 -1.4610 -1.4610 -1.4205 -1.4205 -1.4089 -1.4089 -1.1157 -1.1157 -1.1071 -1.1071 2.5533 2.5533 2.5626 2.5626 5.5086 5.5086 5.5171 5.5171 5.8380 5.8380 5.8427 5.8427 8.7729 8.7729 8.7959 8.7959 9.8515 9.8515 9.9108 9.9108 10.4801 10.4817 k = 0.0857 0.5000-0.0000 ( 4868 PWs) bands (ev): -24.1770 -24.1770 -24.1770 -24.1770 -7.9162 -7.9162 -7.9104 -7.9104 -7.6739 -7.6739 -7.6440 -7.6440 -7.5850 -7.5850 -7.5608 -7.5608 -3.7884 -3.7884 -3.7766 -3.7766 -2.1621 -2.1621 -2.1225 -2.1225 -1.9798 -1.9798 -1.9595 -1.9595 -1.4992 -1.4992 -1.4628 -1.4628 -1.4167 -1.4167 -1.4016 -1.4016 -1.1133 -1.1133 -1.1033 -1.1033 2.5587 2.5587 2.5698 2.5698 5.4994 5.4994 5.5102 5.5102 5.7675 5.7675 5.7715 5.7715 8.8366 8.8366 8.8664 8.8664 9.8116 9.8116 9.8770 9.8770 10.4862 10.4862 k = 0.1000 0.5000-0.0000 ( 4880 PWs) bands (ev): -24.1770 -24.1770 -24.1770 -24.1770 -7.9166 -7.9166 -7.9098 -7.9098 -7.6763 -7.6763 -7.6417 -7.6417 -7.5877 -7.5877 -7.5597 -7.5597 -3.7872 -3.7872 -3.7736 -3.7736 -2.1679 -2.1679 -2.1247 -2.1247 -1.9781 -1.9781 -1.9523 -1.9523 -1.5053 -1.5053 -1.4648 -1.4648 -1.4126 -1.4126 -1.3940 -1.3940 -1.1104 -1.1104 -1.0992 -1.0992 2.5649 2.5649 2.5779 2.5779 5.4864 5.4864 5.5001 5.5001 5.6933 5.6933 5.6957 5.6957 8.9001 8.9001 8.9368 8.9368 9.7729 9.7729 9.8423 9.8423 10.4973 10.4983 k = 0.1143 0.5000-0.0000 ( 4884 PWs) bands (ev): -24.1769 -24.1769 -24.1769 -24.1769 -7.9169 -7.9169 -7.9093 -7.9093 -7.6786 -7.6786 -7.6394 -7.6394 -7.5905 -7.5905 -7.5588 -7.5588 -3.7857 -3.7857 -3.7705 -3.7705 -2.1737 -2.1737 -2.1277 -2.1277 -1.9761 -1.9761 -1.9442 -1.9442 -1.5113 -1.5113 -1.4669 -1.4669 -1.4082 -1.4082 -1.3862 -1.3862 -1.1069 -1.1069 -1.0947 -1.0947 2.5719 2.5719 2.5869 2.5869 5.4659 5.4659 5.4833 5.4833 5.6203 5.6203 5.6210 5.6210 8.9586 8.9586 9.0018 9.0018 9.7387 9.7387 9.8096 9.8096 10.5197 10.5198 k = 0.1286 0.5000-0.0000 ( 4884 PWs) bands (ev): -24.1769 -24.1769 -24.1769 -24.1769 -7.9172 -7.9172 -7.9088 -7.9088 -7.6808 -7.6808 -7.6372 -7.6372 -7.5934 -7.5934 -7.5580 -7.5580 -3.7839 -3.7839 -3.7671 -3.7671 -2.1794 -2.1794 -2.1314 -2.1314 -1.9738 -1.9738 -1.9354 -1.9354 -1.5170 -1.5170 -1.4690 -1.4690 -1.4036 -1.4036 -1.3784 -1.3784 -1.1029 -1.1029 -1.0900 -1.0900 2.5795 2.5795 2.5964 2.5964 5.4300 5.4300 5.4499 5.4499 5.5572 5.5572 5.5601 5.5601 9.0076 9.0076 9.0553 9.0553 9.7127 9.7127 9.7819 9.7819 10.5548 10.5550 k = 0.1429 0.5000-0.0000 ( 4880 PWs) bands (ev): -24.1768 -24.1768 -24.1768 -24.1768 -7.9174 -7.9174 -7.9083 -7.9083 -7.6829 -7.6829 -7.6350 -7.6350 -7.5963 -7.5963 -7.5573 -7.5573 -3.7818 -3.7818 -3.7636 -3.7636 -2.1849 -2.1849 -2.1358 -2.1358 -1.9713 -1.9713 -1.9260 -1.9260 -1.5225 -1.5225 -1.4711 -1.4711 -1.3987 -1.3987 -1.3705 -1.3705 -1.0985 -1.0985 -1.0850 -1.0850 2.5876 2.5876 2.6065 2.6065 5.3713 5.3713 5.3887 5.3887 5.5191 5.5191 5.5194 5.5194 9.0436 9.0436 9.0924 9.0924 9.6973 9.6973 9.7609 9.7609 10.6034 10.6034 k = 0.1571 0.5000-0.0000 ( 4880 PWs) bands (ev): -24.1767 -24.1767 -24.1767 -24.1767 -7.9177 -7.9177 -7.9079 -7.9079 -7.6849 -7.6849 -7.6328 -7.6328 -7.5993 -7.5993 -7.5569 -7.5569 -3.7794 -3.7794 -3.7600 -3.7600 -2.1903 -2.1903 -2.1407 -2.1407 -1.9684 -1.9684 -1.9161 -1.9161 -1.5277 -1.5277 -1.4732 -1.4732 -1.3935 -1.3935 -1.3626 -1.3626 -1.0936 -1.0936 -1.0798 -1.0798 2.5959 2.5959 2.6168 2.6168 5.2969 5.2969 5.3100 5.3100 5.4929 5.4929 5.4966 5.4966 9.0648 9.0648 9.1105 9.1105 9.6929 9.6929 9.7471 9.7471 10.6665 10.6665 k = 0.1714 0.5000-0.0000 ( 4876 PWs) bands (ev): -24.1766 -24.1766 -24.1766 -24.1766 -7.9179 -7.9179 -7.9076 -7.9076 -7.6866 -7.6866 -7.6307 -7.6307 -7.6023 -7.6023 -7.5565 -7.5565 -3.7768 -3.7768 -3.7563 -3.7563 -2.1955 -2.1955 -2.1460 -2.1460 -1.9652 -1.9652 -1.9058 -1.9058 -1.5327 -1.5327 -1.4754 -1.4754 -1.3881 -1.3881 -1.3548 -1.3548 -1.0884 -1.0884 -1.0745 -1.0745 2.6044 2.6044 2.6273 2.6273 5.2167 5.2167 5.2262 5.2262 5.4719 5.4719 5.4785 5.4785 9.0716 9.0716 9.1109 9.1109 9.6970 9.6970 9.7393 9.7393 10.7442 10.7442 k = 0.1857 0.5000-0.0000 ( 4878 PWs) bands (ev): -24.1765 -24.1765 -24.1765 -24.1765 -7.9181 -7.9181 -7.9073 -7.9073 -7.6883 -7.6883 -7.6287 -7.6287 -7.6053 -7.6053 -7.5564 -7.5564 -3.7740 -3.7740 -3.7525 -3.7525 -2.2006 -2.2006 -2.1517 -2.1517 -1.9616 -1.9616 -1.8953 -1.8953 -1.5374 -1.5374 -1.4775 -1.4775 -1.3824 -1.3824 -1.3470 -1.3470 -1.0830 -1.0830 -1.0691 -1.0691 2.6127 2.6127 2.6375 2.6375 5.1359 5.1359 5.1422 5.1422 5.4520 5.4520 5.4609 5.4609 9.0664 9.0664 9.0977 9.0977 9.7048 9.7048 9.7351 9.7351 10.8355 10.8355 k = 0.2000 0.5000-0.0000 ( 4874 PWs) bands (ev): -24.1764 -24.1764 -24.1764 -24.1764 -7.9184 -7.9184 -7.9071 -7.9071 -7.6897 -7.6897 -7.6266 -7.6266 -7.6084 -7.6084 -7.5563 -7.5563 -3.7710 -3.7710 -3.7487 -3.7487 -2.2054 -2.2054 -2.1576 -2.1576 -1.9575 -1.9575 -1.8847 -1.8847 -1.5418 -1.5418 -1.4797 -1.4797 -1.3766 -1.3766 -1.3394 -1.3394 -1.0772 -1.0772 -1.0636 -1.0636 2.6207 2.6207 2.6474 2.6474 5.0568 5.0568 5.0602 5.0602 5.4317 5.4317 5.4423 5.4423 9.0524 9.0524 9.0758 9.0758 9.7122 9.7122 9.7319 9.7319 10.9385 10.9385 k = 0.2143 0.5000-0.0000 ( 4886 PWs) bands (ev): -24.1763 -24.1763 -24.1763 -24.1763 -7.9186 -7.9186 -7.9070 -7.9070 -7.6910 -7.6910 -7.6246 -7.6246 -7.6115 -7.6115 -7.5565 -7.5565 -3.7679 -3.7679 -3.7449 -3.7449 -2.2102 -2.2102 -2.1638 -2.1638 -1.9531 -1.9531 -1.8740 -1.8740 -1.5459 -1.5459 -1.4819 -1.4819 -1.3705 -1.3705 -1.3320 -1.3320 -1.0713 -1.0713 -1.0581 -1.0581 2.6281 2.6281 2.6567 2.6567 4.9809 4.9809 4.9813 4.9813 5.4102 5.4102 5.4223 5.4223 9.0330 9.0330 9.0491 9.0491 9.7161 9.7161 9.7274 9.7274 11.0501 11.0501 k = 0.2286 0.5000-0.0000 ( 4882 PWs) bands (ev): -24.1762 -24.1762 -24.1762 -24.1762 -7.9188 -7.9188 -7.9070 -7.9070 -7.6920 -7.6920 -7.6227 -7.6227 -7.6145 -7.6145 -7.5568 -7.5568 -3.7646 -3.7646 -3.7412 -3.7412 -2.2147 -2.2147 -2.1700 -2.1700 -1.9481 -1.9481 -1.8633 -1.8633 -1.5497 -1.5497 -1.4842 -1.4842 -1.3643 -1.3643 -1.3247 -1.3247 -1.0652 -1.0652 -1.0526 -1.0526 2.6347 2.6347 2.6650 2.6650 4.9067 4.9067 4.9092 4.9092 5.3871 5.3871 5.4004 5.4004 9.0107 9.0107 9.0208 9.0208 9.7152 9.7152 9.7202 9.7202 11.1666 11.1666 k = 0.2429 0.5000-0.0000 ( 4894 PWs) bands (ev): -24.1762 -24.1762 -24.1762 -24.1762 -7.9190 -7.9190 -7.9071 -7.9071 -7.6928 -7.6928 -7.6209 -7.6209 -7.6174 -7.6174 -7.5572 -7.5572 -3.7612 -3.7612 -3.7376 -3.7376 -2.2191 -2.2191 -2.1764 -2.1764 -1.9426 -1.9426 -1.8527 -1.8527 -1.5533 -1.5533 -1.4865 -1.4865 -1.3579 -1.3579 -1.3176 -1.3176 -1.0590 -1.0590 -1.0471 -1.0471 2.6402 2.6402 2.6721 2.6721 4.8371 4.8371 4.8425 4.8425 5.3621 5.3621 5.3766 5.3766 8.9877 8.9877 8.9929 8.9929 9.7090 9.7090 9.7095 9.7095 11.2839 11.2839 k = 0.2571 0.5000-0.0000 ( 4896 PWs) bands (ev): -24.1761 -24.1761 -24.1761 -24.1761 -7.9192 -7.9192 -7.9073 -7.9073 -7.6934 -7.6934 -7.6211 -7.6211 -7.6183 -7.6183 -7.5578 -7.5578 -3.7577 -3.7577 -3.7341 -3.7341 -2.2232 -2.2232 -2.1827 -2.1827 -1.9366 -1.9366 -1.8424 -1.8424 -1.5565 -1.5565 -1.4888 -1.4888 -1.3513 -1.3513 -1.3108 -1.3108 -1.0528 -1.0528 -1.0417 -1.0417 2.6444 2.6444 2.6778 2.6778 4.7731 4.7731 4.7815 4.7815 5.3352 5.3352 5.3508 5.3508 8.9656 8.9656 8.9668 8.9668 9.6949 9.6949 9.6976 9.6976 11.3978 11.3978 k = 0.2714 0.5000-0.0000 ( 4896 PWs) bands (ev): -24.1760 -24.1760 -24.1760 -24.1760 -7.9194 -7.9194 -7.9075 -7.9075 -7.6937 -7.6937 -7.6240 -7.6240 -7.6166 -7.6166 -7.5585 -7.5585 -3.7542 -3.7542 -3.7308 -3.7308 -2.2272 -2.2272 -2.1890 -2.1890 -1.9301 -1.9301 -1.8324 -1.8324 -1.5594 -1.5594 -1.4912 -1.4912 -1.3447 -1.3447 -1.3043 -1.3043 -1.0466 -1.0466 -1.0365 -1.0365 2.6472 2.6472 2.6818 2.6818 4.7153 4.7153 4.7266 4.7266 5.3064 5.3064 5.3228 5.3228 8.9435 8.9435 8.9455 8.9455 9.6765 9.6765 9.6812 9.6812 11.5040 11.5040 k = 0.2857 0.5000-0.0000 ( 4896 PWs) bands (ev): -24.1759 -24.1759 -24.1759 -24.1759 -7.9195 -7.9195 -7.9079 -7.9079 -7.6938 -7.6938 -7.6270 -7.6270 -7.6147 -7.6147 -7.5593 -7.5593 -3.7507 -3.7507 -3.7276 -3.7276 -2.2310 -2.2310 -2.1951 -2.1951 -1.9231 -1.9231 -1.8228 -1.8228 -1.5620 -1.5620 -1.4937 -1.4937 -1.3380 -1.3380 -1.2981 -1.2981 -1.0404 -1.0404 -1.0313 -1.0313 2.6484 2.6484 2.6839 2.6839 4.6643 4.6643 4.6783 4.6783 5.2755 5.2755 5.2928 5.2928 8.9237 8.9237 8.9282 8.9282 9.6542 9.6542 9.6604 9.6604 11.5992 11.5992 k = 0.3000 0.5000-0.0000 ( 4888 PWs) bands (ev): -24.1757 -24.1757 -24.1757 -24.1757 -7.9197 -7.9197 -7.9083 -7.9083 -7.6936 -7.6936 -7.6300 -7.6300 -7.6127 -7.6127 -7.5603 -7.5603 -3.7472 -3.7472 -3.7246 -3.7246 -2.2345 -2.2345 -2.2012 -2.2012 -1.9156 -1.9156 -1.8138 -1.8138 -1.5642 -1.5642 -1.4962 -1.4962 -1.3313 -1.3313 -1.2922 -1.2922 -1.0344 -1.0344 -1.0263 -1.0263 2.6480 2.6480 2.6840 2.6840 4.6202 4.6202 4.6369 4.6369 5.2427 5.2427 5.2609 5.2609 8.9077 8.9077 8.9142 8.9142 9.6285 9.6285 9.6356 9.6356 11.6809 11.6809 k = 0.3143 0.5000-0.0000 ( 4892 PWs) bands (ev): -24.1757 -24.1757 -24.1757 -24.1757 -7.9199 -7.9199 -7.9089 -7.9089 -7.6932 -7.6932 -7.6331 -7.6331 -7.6108 -7.6108 -7.5614 -7.5614 -3.7437 -3.7437 -3.7218 -3.7218 -2.2379 -2.2379 -2.2070 -2.2070 -1.9076 -1.9076 -1.8055 -1.8055 -1.5660 -1.5660 -1.4989 -1.4989 -1.3246 -1.3246 -1.2867 -1.2867 -1.0285 -1.0285 -1.0215 -1.0215 2.6459 2.6459 2.6821 2.6821 4.5835 4.5835 4.6025 4.6025 5.2081 5.2081 5.2270 5.2270 8.8958 8.8958 8.9039 8.9039 9.5995 9.5995 9.6072 9.6072 11.7483 11.7483 k = 0.3286 0.5000-0.0000 ( 4884 PWs) bands (ev): -24.1755 -24.1755 -24.1755 -24.1755 -7.9200 -7.9200 -7.9095 -7.9095 -7.6925 -7.6925 -7.6361 -7.6361 -7.6088 -7.6088 -7.5626 -7.5626 -3.7402 -3.7402 -3.7192 -3.7192 -2.2410 -2.2410 -2.2126 -2.2126 -1.8993 -1.8993 -1.7979 -1.7979 -1.5673 -1.5673 -1.5017 -1.5017 -1.3179 -1.3179 -1.2817 -1.2817 -1.0229 -1.0229 -1.0169 -1.0169 2.6423 2.6423 2.6782 2.6782 4.5541 4.5541 4.5752 4.5752 5.1718 5.1718 5.1914 5.1914 8.8883 8.8883 8.8975 8.8975 9.5677 9.5677 9.5757 9.5757 11.8020 11.8020 k = 0.3429 0.5000-0.0000 ( 4880 PWs) bands (ev): -24.1755 -24.1755 -24.1755 -24.1755 -7.9201 -7.9201 -7.9101 -7.9101 -7.6917 -7.6917 -7.6391 -7.6391 -7.6068 -7.6068 -7.5639 -7.5639 -3.7369 -3.7369 -3.7170 -3.7170 -2.2439 -2.2439 -2.2180 -2.2180 -1.8906 -1.8906 -1.7913 -1.7913 -1.5682 -1.5682 -1.5046 -1.5046 -1.3114 -1.3114 -1.2770 -1.2770 -1.0175 -1.0175 -1.0125 -1.0125 2.6374 2.6374 2.6724 2.6724 4.5320 4.5320 4.5550 4.5550 5.1339 5.1339 5.1541 5.1541 8.8851 8.8851 8.8952 8.8952 9.5334 9.5334 9.5417 9.5417 11.8433 11.8433 k = 0.3571 0.5000-0.0000 ( 4880 PWs) bands (ev): -24.1754 -24.1754 -24.1754 -24.1754 -7.9201 -7.9201 -7.9108 -7.9108 -7.6906 -7.6906 -7.6421 -7.6421 -7.6047 -7.6047 -7.5654 -7.5654 -3.7336 -3.7336 -3.7149 -3.7149 -2.2465 -2.2465 -2.2231 -2.2231 -1.8816 -1.8816 -1.7857 -1.7857 -1.5686 -1.5686 -1.5077 -1.5077 -1.3050 -1.3050 -1.2728 -1.2728 -1.0124 -1.0124 -1.0084 -1.0084 2.6313 2.6313 2.6650 2.6650 4.5173 4.5173 4.5418 4.5418 5.0947 5.0947 5.1155 5.1155 8.8862 8.8862 8.8970 8.8970 9.4970 9.4970 9.5055 9.5055 11.8743 11.8743 k = 0.3714 0.5000-0.0000 ( 4886 PWs) bands (ev): -24.1753 -24.1753 -24.1753 -24.1753 -7.9202 -7.9202 -7.9116 -7.9116 -7.6893 -7.6893 -7.6451 -7.6451 -7.6027 -7.6027 -7.5669 -7.5669 -3.7305 -3.7305 -3.7132 -3.7132 -2.2489 -2.2489 -2.2280 -2.2280 -1.8724 -1.8724 -1.7812 -1.7812 -1.5685 -1.5685 -1.5109 -1.5109 -1.2989 -1.2989 -1.2692 -1.2692 -1.0077 -1.0077 -1.0045 -1.0045 2.6244 2.6244 2.6563 2.6563 4.5094 4.5094 4.5351 4.5351 5.0544 5.0544 5.0758 5.0758 8.8916 8.8916 8.9029 8.9029 9.4589 9.4589 9.4675 9.4675 11.8973 11.8973 k = 0.3857 0.5000-0.0000 ( 4882 PWs) bands (ev): -24.1752 -24.1752 -24.1752 -24.1752 -7.9202 -7.9202 -7.9124 -7.9124 -7.6878 -7.6878 -7.6480 -7.6480 -7.6007 -7.6007 -7.5685 -7.5685 -3.7275 -3.7275 -3.7118 -3.7118 -2.2509 -2.2509 -2.2324 -2.2324 -1.8631 -1.8631 -1.7779 -1.7779 -1.5677 -1.5677 -1.5142 -1.5142 -1.2930 -1.2930 -1.2660 -1.2660 -1.0034 -1.0034 -1.0010 -1.0010 2.6170 2.6170 2.6467 2.6467 4.5082 4.5082 4.5348 4.5348 5.0132 5.0132 5.0352 5.0352 8.9011 8.9011 8.9127 8.9127 9.4194 9.4194 9.4282 9.4282 11.9141 11.9141 k = 0.4000 0.5000-0.0000 ( 4888 PWs) bands (ev): -24.1752 -24.1752 -24.1752 -24.1752 -7.9201 -7.9201 -7.9132 -7.9132 -7.6861 -7.6861 -7.6510 -7.6510 -7.5986 -7.5986 -7.5702 -7.5702 -3.7247 -3.7247 -3.7106 -3.7106 -2.2526 -2.2526 -2.2366 -2.2366 -1.8537 -1.8537 -1.7759 -1.7759 -1.5664 -1.5664 -1.5177 -1.5177 -1.2874 -1.2874 -1.2634 -1.2634 -0.9996 -0.9996 -0.9978 -0.9978 2.6095 2.6095 2.6365 2.6365 4.5132 4.5132 4.5403 4.5403 4.9715 4.9715 4.9940 4.9940 8.9146 8.9146 8.9263 8.9263 9.3791 9.3791 9.3880 9.3880 11.9263 11.9263 k = 0.4143 0.5000-0.0000 ( 4892 PWs) bands (ev): -24.1751 -24.1751 -24.1751 -24.1751 -7.9200 -7.9200 -7.9140 -7.9140 -7.6843 -7.6843 -7.6539 -7.6539 -7.5965 -7.5965 -7.5720 -7.5720 -3.7221 -3.7221 -3.7098 -3.7098 -2.2540 -2.2540 -2.2403 -2.2403 -1.8444 -1.8444 -1.7752 -1.7752 -1.5646 -1.5646 -1.5213 -1.5213 -1.2822 -1.2822 -1.2613 -1.2613 -0.9962 -0.9962 -0.9949 -0.9949 2.6024 2.6024 2.6263 2.6263 4.5239 4.5239 4.5513 4.5513 4.9295 4.9295 4.9525 4.9525 8.9319 8.9319 8.9436 8.9436 9.3382 9.3382 9.3473 9.3473 11.9351 11.9351 k = 0.4286 0.5000-0.0000 ( 4896 PWs) bands (ev): -24.1751 -24.1751 -24.1751 -24.1751 -7.9198 -7.9198 -7.9147 -7.9147 -7.6823 -7.6823 -7.6568 -7.6568 -7.5944 -7.5944 -7.5739 -7.5739 -3.7196 -3.7196 -3.7093 -3.7093 -2.2551 -2.2551 -2.2437 -2.2437 -1.8353 -1.8353 -1.7757 -1.7757 -1.5622 -1.5622 -1.5251 -1.5251 -1.2775 -1.2775 -1.2598 -1.2598 -0.9933 -0.9933 -0.9924 -0.9924 2.5960 2.5960 2.6164 2.6164 4.5397 4.5397 4.5671 4.5671 4.8877 4.8877 4.9111 4.9111 8.9527 8.9527 8.9644 8.9644 9.2971 9.2971 9.3064 9.3064 11.9415 11.9416 k = 0.4429 0.5000-0.0000 ( 4876 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9196 -7.9196 -7.9155 -7.9155 -7.6802 -7.6802 -7.6596 -7.6596 -7.5923 -7.5923 -7.5758 -7.5758 -3.7174 -3.7174 -3.7090 -3.7090 -2.2557 -2.2557 -2.2466 -2.2466 -1.8264 -1.8264 -1.7775 -1.7775 -1.5593 -1.5593 -1.5289 -1.5289 -1.2731 -1.2731 -1.2589 -1.2589 -0.9908 -0.9908 -0.9903 -0.9903 2.5907 2.5907 2.6073 2.6073 4.5600 4.5600 4.5872 4.5872 4.8465 4.8465 4.8703 4.8703 8.9768 8.9768 8.9884 8.9884 9.2563 9.2563 9.2658 9.2658 11.9461 11.9461 k = 0.4571 0.5000-0.0000 ( 4880 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9193 -7.9193 -7.9162 -7.9162 -7.6779 -7.6779 -7.6624 -7.6624 -7.5902 -7.5902 -7.5777 -7.5777 -3.7155 -3.7155 -3.7091 -3.7091 -2.2560 -2.2560 -2.2492 -2.2492 -1.8179 -1.8179 -1.7805 -1.7805 -1.5561 -1.5561 -1.5328 -1.5328 -1.2693 -1.2693 -1.2586 -1.2586 -0.9889 -0.9889 -0.9886 -0.9886 2.5867 2.5867 2.5994 2.5994 4.5842 4.5842 4.6106 4.6106 4.8067 4.8067 4.8305 4.8305 9.0040 9.0040 9.0153 9.0153 9.2160 9.2160 9.2258 9.2258 11.9494 11.9494 k = 0.4714 0.5000-0.0000 ( 4878 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9189 -7.9189 -7.9168 -7.9168 -7.6755 -7.6755 -7.6652 -7.6652 -7.5880 -7.5880 -7.5797 -7.5797 -3.7137 -3.7137 -3.7094 -3.7094 -2.2559 -2.2559 -2.2514 -2.2514 -1.8098 -1.8098 -1.7845 -1.7845 -1.5526 -1.5526 -1.5368 -1.5368 -1.2661 -1.2661 -1.2589 -1.2589 -0.9876 -0.9876 -0.9874 -0.9874 2.5843 2.5843 2.5928 2.5928 4.6112 4.6112 4.6361 4.6361 4.7695 4.7695 4.7925 4.7925 9.0339 9.0339 9.0450 9.0450 9.1768 9.1768 9.1868 9.1868 11.9516 11.9516 k = 0.4857 0.5000-0.0000 ( 4888 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9185 -7.9185 -7.9175 -7.9175 -7.6731 -7.6731 -7.6679 -7.6679 -7.5859 -7.5859 -7.5818 -7.5818 -3.7122 -3.7122 -3.7101 -3.7101 -2.2554 -2.2554 -2.2532 -2.2532 -1.8024 -1.8024 -1.7896 -1.7896 -1.5488 -1.5488 -1.5409 -1.5409 -1.2634 -1.2634 -1.2598 -1.2598 -0.9868 -0.9868 -0.9867 -0.9867 2.5836 2.5836 2.5879 2.5879 4.6394 4.6394 4.6589 4.6589 4.7395 4.7395 4.7580 4.7580 9.0660 9.0660 9.0766 9.0766 9.1391 9.1391 9.1492 9.1492 11.9530 11.9531 k = 0.5000 0.5000-0.0000 ( 4880 PWs) bands (ev): -24.1749 -24.1749 -24.1749 -24.1749 -7.9180 -7.9180 -7.9180 -7.9180 -7.6705 -7.6705 -7.6705 -7.6705 -7.5838 -7.5838 -7.5838 -7.5838 -3.7110 -3.7110 -3.7110 -3.7110 -2.2544 -2.2544 -2.2544 -2.2544 -1.7956 -1.7956 -1.7956 -1.7956 -1.5449 -1.5449 -1.5449 -1.5449 -1.2613 -1.2613 -1.2613 -1.2613 -0.9865 -0.9865 -0.9865 -0.9865 2.5848 2.5848 2.5848 2.5848 4.6617 4.6617 4.6617 4.6617 4.7339 4.7339 4.7339 4.7339 9.0972 9.0972 9.0972 9.0972 9.1165 9.1165 9.1165 9.1165 11.9538 11.9538 k = 0.5000 0.5000-0.0000 ( 4880 PWs) bands (ev): -24.1749 -24.1749 -24.1749 -24.1749 -7.9180 -7.9180 -7.9180 -7.9180 -7.6705 -7.6705 -7.6705 -7.6705 -7.5838 -7.5838 -7.5838 -7.5838 -3.7110 -3.7110 -3.7110 -3.7110 -2.2544 -2.2544 -2.2544 -2.2544 -1.7956 -1.7956 -1.7956 -1.7956 -1.5449 -1.5449 -1.5449 -1.5449 -1.2613 -1.2613 -1.2613 -1.2613 -0.9865 -0.9865 -0.9865 -0.9865 2.5848 2.5848 2.5848 2.5848 4.6617 4.6617 4.6617 4.6617 4.7339 4.7339 4.7339 4.7339 9.0972 9.0972 9.0972 9.0972 9.1165 9.1165 9.1165 9.1165 11.9538 11.9538 k = 0.4898 0.4898-0.0000 ( 4890 PWs) bands (ev): -24.1750 -24.1750 -24.1749 -24.1749 -7.9185 -7.9185 -7.9175 -7.9175 -7.6731 -7.6731 -7.6678 -7.6678 -7.5860 -7.5860 -7.5818 -7.5818 -3.7123 -3.7123 -3.7101 -3.7101 -2.2554 -2.2554 -2.2531 -2.2531 -1.8025 -1.8025 -1.7896 -1.7896 -1.5489 -1.5489 -1.5409 -1.5409 -1.2634 -1.2634 -1.2598 -1.2598 -0.9878 -0.9878 -0.9857 -0.9857 2.5836 2.5836 2.5880 2.5880 4.6330 4.6330 4.6687 4.6687 4.7308 4.7308 4.7633 4.7633 9.0547 9.0547 9.1012 9.1012 9.1164 9.1164 9.1587 9.1587 11.9530 11.9530 k = 0.4796 0.4796-0.0000 ( 4872 PWs) bands (ev): -24.1750 -24.1750 -24.1749 -24.1749 -7.9189 -7.9189 -7.9168 -7.9168 -7.6756 -7.6756 -7.6651 -7.6651 -7.5881 -7.5881 -7.5797 -7.5797 -3.7138 -3.7138 -3.7093 -3.7093 -2.2561 -2.2561 -2.2511 -2.2511 -1.8100 -1.8100 -1.7844 -1.7844 -1.5526 -1.5526 -1.5368 -1.5368 -1.2661 -1.2661 -1.2589 -1.2589 -0.9915 -0.9915 -0.9835 -0.9835 2.5843 2.5843 2.5930 2.5930 4.5889 4.5889 4.6760 4.6760 4.7352 4.7352 4.8094 4.8094 9.0050 9.0050 9.1027 9.1027 9.1271 9.1271 9.2079 9.2079 11.9515 11.9515 k = 0.4694 0.4694-0.0000 ( 4872 PWs) bands (ev): -24.1751 -24.1751 -24.1748 -24.1748 -7.9193 -7.9193 -7.9161 -7.9161 -7.6780 -7.6780 -7.6623 -7.6623 -7.5902 -7.5902 -7.5776 -7.5776 -3.7158 -3.7158 -3.7088 -3.7088 -2.2567 -2.2567 -2.2485 -2.2485 -1.8183 -1.8183 -1.7801 -1.7801 -1.5562 -1.5562 -1.5328 -1.5328 -1.2694 -1.2694 -1.2586 -1.2586 -0.9978 -0.9978 -0.9799 -0.9799 2.5870 2.5870 2.6000 2.6000 4.5420 4.5420 4.6876 4.6876 4.7431 4.7431 4.8597 4.8597 8.9555 8.9555 9.1051 9.1051 9.1448 9.1448 9.2566 9.2566 11.9491 11.9491 k = 0.4592 0.4592-0.0000 ( 4880 PWs) bands (ev): -24.1753 -24.1753 -24.1748 -24.1748 -7.9196 -7.9196 -7.9154 -7.9154 -7.6803 -7.6803 -7.6595 -7.6595 -7.5924 -7.5924 -7.5757 -7.5757 -3.7183 -3.7183 -3.7083 -3.7083 -2.2572 -2.2572 -2.2452 -2.2452 -1.8272 -1.8272 -1.7769 -1.7769 -1.5594 -1.5594 -1.5289 -1.5289 -1.2731 -1.2731 -1.2590 -1.2590 -1.0064 -1.0064 -0.9749 -0.9749 2.5915 2.5915 2.6089 2.6089 4.4948 4.4948 4.7032 4.7032 4.7543 4.7543 4.9117 4.9117 8.9070 8.9070 9.1084 9.1084 9.1692 9.1692 9.3041 9.3041 11.9456 11.9456 k = 0.4490 0.4490-0.0000 ( 4878 PWs) bands (ev): -24.1754 -24.1754 -24.1747 -24.1747 -7.9199 -7.9199 -7.9145 -7.9145 -7.6824 -7.6824 -7.6566 -7.6566 -7.5945 -7.5945 -7.5737 -7.5737 -3.7213 -3.7213 -3.7080 -3.7080 -2.2578 -2.2578 -2.2411 -2.2411 -1.8365 -1.8365 -1.7745 -1.7745 -1.5622 -1.5622 -1.5252 -1.5252 -1.2773 -1.2773 -1.2600 -1.2600 -1.0171 -1.0171 -0.9688 -0.9688 2.5981 2.5981 2.6196 2.6196 4.4482 4.4482 4.7227 4.7227 4.7689 4.7689 4.9648 4.9648 8.8602 8.8602 9.1127 9.1127 9.2001 9.2001 9.3502 9.3502 11.9407 11.9407 k = 0.4388 0.4388-0.0000 ( 4882 PWs) bands (ev): -24.1757 -24.1757 -24.1745 -24.1745 -7.9201 -7.9201 -7.9136 -7.9136 -7.6845 -7.6845 -7.6537 -7.6537 -7.5966 -7.5966 -7.5718 -7.5718 -3.7248 -3.7248 -3.7078 -3.7078 -2.2584 -2.2584 -2.2363 -2.2363 -1.8462 -1.8462 -1.7733 -1.7733 -1.5646 -1.5646 -1.5217 -1.5217 -1.2819 -1.2819 -1.2615 -1.2615 -1.0299 -1.0299 -0.9616 -0.9616 2.6065 2.6065 2.6323 2.6323 4.4025 4.4025 4.7454 4.7454 4.7868 4.7868 5.0186 5.0186 8.8156 8.8156 9.1180 9.1180 9.2370 9.2370 9.3944 9.3944 11.9339 11.9339 k = 0.4286 0.4286-0.0000 ( 4886 PWs) bands (ev): -24.1759 -24.1759 -24.1744 -24.1744 -7.9203 -7.9203 -7.9126 -7.9126 -7.6864 -7.6864 -7.6508 -7.6508 -7.5987 -7.5987 -7.5700 -7.5700 -3.7290 -3.7290 -3.7076 -3.7076 -2.2590 -2.2590 -2.2309 -2.2309 -1.8562 -1.8562 -1.7730 -1.7730 -1.5665 -1.5665 -1.5185 -1.5185 -1.2869 -1.2869 -1.2636 -1.2636 -1.0444 -1.0444 -0.9535 -0.9535 2.6170 2.6170 2.6470 2.6470 4.3581 4.3581 4.7709 4.7709 4.8084 4.8084 5.0732 5.0732 8.7737 8.7737 9.1243 9.1243 9.2794 9.2794 9.4366 9.4366 11.9246 11.9246 k = 0.4184 0.4184-0.0000 ( 4876 PWs) bands (ev): -24.1762 -24.1762 -24.1742 -24.1742 -7.9204 -7.9204 -7.9116 -7.9116 -7.6881 -7.6881 -7.6479 -7.6479 -7.6008 -7.6008 -7.5682 -7.5682 -3.7337 -3.7337 -3.7076 -3.7076 -2.2598 -2.2598 -2.2250 -2.2250 -1.8663 -1.8663 -1.7737 -1.7737 -1.5679 -1.5679 -1.5154 -1.5154 -1.2923 -1.2923 -1.2662 -1.2662 -1.0604 -1.0604 -0.9446 -0.9446 2.6293 2.6293 2.6636 2.6636 4.3153 4.3153 4.7984 4.7984 4.8336 4.8336 5.1283 5.1283 8.7353 8.7353 9.1317 9.1317 9.3267 9.3267 9.4766 9.4766 11.9123 11.9123 k = 0.4082 0.4082-0.0000 ( 4878 PWs) bands (ev): -24.1766 -24.1766 -24.1740 -24.1740 -7.9205 -7.9205 -7.9104 -7.9104 -7.6897 -7.6897 -7.6450 -7.6450 -7.6029 -7.6029 -7.5665 -7.5665 -3.7391 -3.7391 -3.7077 -3.7077 -2.2606 -2.2606 -2.2187 -2.2187 -1.8765 -1.8765 -1.7754 -1.7754 -1.5688 -1.5688 -1.5126 -1.5126 -1.2980 -1.2980 -1.2691 -1.2691 -1.0775 -1.0775 -0.9352 -0.9352 2.6435 2.6435 2.6821 2.6821 4.2742 4.2742 4.8275 4.8275 4.8625 4.8625 5.1841 5.1841 8.7008 8.7008 9.1401 9.1401 9.3781 9.3781 9.5142 9.5142 11.8959 11.8959 k = 0.3980 0.3980-0.0000 ( 4886 PWs) bands (ev): -24.1769 -24.1769 -24.1739 -24.1739 -7.9206 -7.9206 -7.9092 -7.9092 -7.6911 -7.6911 -7.6422 -7.6422 -7.6049 -7.6049 -7.5649 -7.5649 -3.7452 -3.7452 -3.7080 -3.7080 -2.2616 -2.2616 -2.2122 -2.2122 -1.8868 -1.8868 -1.7779 -1.7779 -1.5693 -1.5693 -1.5099 -1.5099 -1.3042 -1.3042 -1.2725 -1.2725 -1.0954 -1.0954 -0.9255 -0.9255 2.6596 2.6596 2.7026 2.7026 4.2350 4.2350 4.8580 4.8580 4.8946 4.8946 5.2405 5.2405 8.6708 8.6708 9.1497 9.1497 9.4329 9.4329 9.5491 9.5491 11.8744 11.8744 k = 0.3878 0.3878-0.0000 ( 4882 PWs) bands (ev): -24.1773 -24.1773 -24.1737 -24.1737 -7.9207 -7.9207 -7.9078 -7.9078 -7.6923 -7.6923 -7.6393 -7.6393 -7.6068 -7.6068 -7.5633 -7.5633 -3.7519 -3.7519 -3.7084 -3.7084 -2.2626 -2.2626 -2.2055 -2.2055 -1.8970 -1.8970 -1.7813 -1.7813 -1.5693 -1.5693 -1.5073 -1.5073 -1.3108 -1.3108 -1.2760 -1.2760 -1.1137 -1.1137 -0.9156 -0.9156 2.6775 2.6775 2.7251 2.7251 4.1980 4.1980 4.8898 4.8898 4.9293 4.9293 5.2974 5.2974 8.6459 8.6459 9.1604 9.1604 9.4901 9.4901 9.5812 9.5812 11.8464 11.8464 k = 0.3776 0.3776-0.0000 ( 4876 PWs) bands (ev): -24.1777 -24.1777 -24.1734 -24.1734 -7.9207 -7.9207 -7.9063 -7.9063 -7.6933 -7.6933 -7.6366 -7.6366 -7.6087 -7.6087 -7.5618 -7.5618 -3.7594 -3.7594 -3.7090 -3.7090 -2.2637 -2.2637 -2.1988 -2.1988 -1.9072 -1.9072 -1.7853 -1.7853 -1.5689 -1.5689 -1.5048 -1.5048 -1.3180 -1.3180 -1.2797 -1.2797 -1.1320 -1.1320 -0.9058 -0.9058 2.6970 2.6970 2.7497 2.7497 4.1635 4.1635 4.9232 4.9232 4.9660 4.9660 5.3548 5.3548 8.6266 8.6266 9.1722 9.1722 9.5487 9.5487 9.6103 9.6103 11.8105 11.8105 k = 0.3673 0.3673-0.0000 ( 4880 PWs) bands (ev): -24.1782 -24.1782 -24.1732 -24.1732 -7.9208 -7.9208 -7.9048 -7.9048 -7.6942 -7.6942 -7.6339 -7.6339 -7.6104 -7.6104 -7.5604 -7.5604 -3.7676 -3.7676 -3.7099 -3.7099 -2.2649 -2.2649 -2.1924 -2.1924 -1.9172 -1.9172 -1.7899 -1.7899 -1.5682 -1.5682 -1.5022 -1.5022 -1.3259 -1.3259 -1.2835 -1.2835 -1.1498 -1.1498 -0.8962 -0.8962 2.7180 2.7180 2.7764 2.7764 4.1316 4.1316 4.9579 4.9579 5.0041 5.0041 5.4127 5.4127 8.6132 8.6132 9.1854 9.1854 9.6075 9.6075 9.6364 9.6364 11.7650 11.7650 k = 0.3571 0.3571-0.0000 ( 4880 PWs) bands (ev): -24.1786 -24.1786 -24.1730 -24.1730 -7.9208 -7.9208 -7.9031 -7.9031 -7.6948 -7.6948 -7.6314 -7.6314 -7.6120 -7.6120 -7.5591 -7.5591 -3.7765 -3.7765 -3.7110 -3.7110 -2.2663 -2.2663 -2.1862 -2.1862 -1.9273 -1.9273 -1.7949 -1.7949 -1.5672 -1.5672 -1.4995 -1.4995 -1.3347 -1.3347 -1.2873 -1.2873 -1.1666 -1.1666 -0.8869 -0.8869 2.7405 2.7405 2.8052 2.8052 4.1025 4.1025 4.9937 4.9937 5.0434 5.0434 5.4709 5.4709 8.6062 8.6062 9.1997 9.1997 9.6588 9.6588 9.6659 9.6659 11.7083 11.7083 k = 0.3469 0.3469-0.0000 ( 4886 PWs) bands (ev): -24.1792 -24.1792 -24.1727 -24.1727 -7.9209 -7.9209 -7.9013 -7.9013 -7.6952 -7.6952 -7.6292 -7.6292 -7.6133 -7.6133 -7.5579 -7.5579 -3.7862 -3.7862 -3.7124 -3.7124 -2.2677 -2.2677 -2.1805 -2.1805 -1.9373 -1.9373 -1.8003 -1.8003 -1.5661 -1.5661 -1.4966 -1.4966 -1.3444 -1.3444 -1.2910 -1.2910 -1.1820 -1.1820 -0.8783 -0.8783 2.7642 2.7642 2.8362 2.8362 4.0765 4.0765 5.0302 5.0302 5.0839 5.0839 5.5295 5.5295 8.6057 8.6057 9.2154 9.2154 9.6786 9.6786 9.7214 9.7214 11.6392 11.6392 k = 0.3367 0.3367-0.0000 ( 4880 PWs) bands (ev): -24.1797 -24.1797 -24.1724 -24.1724 -7.9210 -7.9210 -7.8993 -7.8993 -7.6954 -7.6954 -7.6275 -7.6275 -7.6140 -7.6140 -7.5567 -7.5567 -3.7967 -3.7967 -3.7141 -3.7141 -2.2691 -2.2691 -2.1752 -2.1752 -1.9474 -1.9474 -1.8057 -1.8057 -1.5648 -1.5648 -1.4934 -1.4934 -1.3552 -1.3552 -1.2945 -1.2945 -1.1956 -1.1956 -0.8703 -0.8703 2.7889 2.7889 2.8694 2.8694 4.0537 4.0537 5.0667 5.0667 5.1258 5.1258 5.5881 5.5881 8.6118 8.6118 9.2325 9.2325 9.6947 9.6947 9.7739 9.7739 11.5569 11.5569 k = 0.3265 0.3265-0.0000 ( 4878 PWs) bands (ev): -24.1802 -24.1802 -24.1721 -24.1721 -7.9211 -7.9211 -7.8973 -7.8973 -7.6955 -7.6955 -7.6265 -7.6265 -7.6140 -7.6140 -7.5557 -7.5557 -3.8079 -3.8079 -3.7161 -3.7161 -2.2707 -2.2707 -2.1706 -2.1706 -1.9578 -1.9578 -1.8112 -1.8112 -1.5635 -1.5635 -1.4899 -1.4899 -1.3668 -1.3668 -1.2978 -1.2978 -1.2071 -1.2071 -0.8632 -0.8632 2.8144 2.8144 2.9050 2.9050 4.0343 4.0343 5.1025 5.1025 5.1696 5.1696 5.6468 5.6468 8.6243 8.6243 9.2510 9.2510 9.7076 9.7076 9.8220 9.8220 11.4614 11.4614 k = 0.3163 0.3163-0.0000 ( 4876 PWs) bands (ev): -24.1808 -24.1808 -24.1718 -24.1718 -7.9212 -7.9212 -7.8951 -7.8951 -7.6953 -7.6953 -7.6265 -7.6265 -7.6130 -7.6130 -7.5547 -7.5547 -3.8199 -3.8199 -3.7185 -3.7185 -2.2724 -2.2724 -2.1666 -2.1666 -1.9684 -1.9684 -1.8167 -1.8167 -1.5622 -1.5622 -1.4859 -1.4859 -1.3792 -1.3792 -1.3008 -1.3008 -1.2165 -1.2165 -0.8570 -0.8570 2.8405 2.8405 2.9429 2.9429 4.0185 4.0185 5.1371 5.1371 5.2155 5.2155 5.7054 5.7054 8.6429 8.6429 9.2710 9.2710 9.7173 9.7173 9.8649 9.8649 11.3532 11.3532 k = 0.3061 0.3061-0.0000 ( 4878 PWs) bands (ev): -24.1814 -24.1814 -24.1715 -24.1715 -7.9214 -7.9214 -7.8928 -7.8928 -7.6949 -7.6949 -7.6272 -7.6272 -7.6113 -7.6113 -7.5539 -7.5539 -3.8326 -3.8326 -3.7212 -3.7212 -2.2742 -2.2742 -2.1633 -2.1633 -1.9795 -1.9795 -1.8220 -1.8220 -1.5611 -1.5611 -1.4817 -1.4817 -1.3918 -1.3918 -1.3035 -1.3035 -1.2237 -1.2237 -0.8519 -0.8519 2.8670 2.8670 2.9832 2.9832 4.0063 4.0063 5.1703 5.1703 5.2638 5.2638 5.7635 5.7635 8.6669 8.6669 9.2924 9.2924 9.7243 9.7243 9.9021 9.9021 11.2337 11.2337 k = 0.2959 0.2959-0.0000 ( 4878 PWs) bands (ev): -24.1820 -24.1820 -24.1712 -24.1712 -7.9216 -7.9216 -7.8903 -7.8903 -7.6943 -7.6943 -7.6283 -7.6283 -7.6092 -7.6092 -7.5531 -7.5531 -3.8460 -3.8460 -3.7243 -3.7243 -2.2760 -2.2760 -2.1606 -2.1606 -1.9910 -1.9910 -1.8273 -1.8273 -1.5601 -1.5601 -1.4772 -1.4772 -1.4042 -1.4042 -1.3060 -1.3060 -1.2287 -1.2287 -0.8480 -0.8480 2.8935 2.8935 3.0260 3.0260 3.9980 3.9980 5.2019 5.2019 5.3145 5.3145 5.8211 5.8211 8.6953 8.6953 9.3155 9.3155 9.7292 9.7292 9.9333 9.9333 11.1041 11.1041 k = 0.2857 0.2857-0.0000 ( 4882 PWs) bands (ev): -24.1826 -24.1826 -24.1709 -24.1709 -7.9217 -7.9217 -7.8878 -7.8878 -7.6935 -7.6935 -7.6297 -7.6297 -7.6068 -7.6068 -7.5525 -7.5525 -3.8602 -3.8602 -3.7277 -3.7277 -2.2778 -2.2778 -2.1585 -2.1585 -2.0030 -2.0030 -1.8324 -1.8324 -1.5596 -1.5596 -1.4725 -1.4725 -1.4157 -1.4157 -1.3082 -1.3082 -1.2319 -1.2319 -0.8453 -0.8453 2.9198 2.9198 3.0713 3.0713 3.9935 3.9935 5.2323 5.2323 5.3675 5.3675 5.8777 5.8777 8.7265 8.7265 9.3402 9.3402 9.7331 9.7331 9.9591 9.9591 10.9662 10.9662 k = 0.2755 0.2755-0.0000 ( 4888 PWs) bands (ev): -24.1832 -24.1832 -24.1705 -24.1705 -7.9220 -7.9220 -7.8852 -7.8852 -7.6926 -7.6926 -7.6312 -7.6312 -7.6043 -7.6043 -7.5519 -7.5519 -3.8750 -3.8750 -3.7315 -3.7315 -2.2797 -2.2797 -2.1569 -2.1569 -2.0155 -2.0155 -1.8375 -1.8375 -1.5598 -1.5598 -1.4682 -1.4682 -1.4254 -1.4254 -1.3101 -1.3101 -1.2331 -1.2331 -0.8439 -0.8439 2.9458 2.9458 3.1192 3.1192 3.9930 3.9930 5.2617 5.2617 5.4225 5.4225 5.9333 5.9333 8.7586 8.7586 9.3665 9.3665 9.7374 9.7374 9.9799 9.9799 10.8216 10.8216 k = 0.2653 0.2653-0.0000 ( 4896 PWs) bands (ev): -24.1839 -24.1839 -24.1702 -24.1702 -7.9222 -7.9222 -7.8824 -7.8824 -7.6914 -7.6914 -7.6328 -7.6328 -7.6017 -7.6017 -7.5515 -7.5515 -3.8904 -3.8904 -3.7356 -3.7356 -2.2817 -2.2817 -2.1558 -2.1558 -2.0284 -2.0284 -1.8426 -1.8426 -1.5607 -1.5607 -1.4650 -1.4650 -1.4322 -1.4322 -1.3117 -1.3117 -1.2327 -1.2327 -0.8438 -0.8438 2.9711 2.9711 3.1695 3.1695 3.9964 3.9964 5.2907 5.2907 5.4795 5.4795 5.9874 5.9874 8.7890 8.7890 9.3945 9.3945 9.7443 9.7443 9.9968 9.9968 10.6715 10.6715 k = 0.2551 0.2551-0.0000 ( 4880 PWs) bands (ev): -24.1845 -24.1845 -24.1698 -24.1698 -7.9224 -7.9224 -7.8796 -7.8796 -7.6902 -7.6902 -7.6344 -7.6344 -7.5990 -7.5990 -7.5511 -7.5511 -3.9063 -3.9063 -3.7400 -3.7400 -2.2836 -2.2836 -2.1551 -2.1551 -2.0416 -2.0416 -1.8477 -1.8477 -1.5625 -1.5625 -1.4641 -1.4641 -1.4344 -1.4344 -1.3130 -1.3130 -1.2308 -1.2308 -0.8449 -0.8449 2.9954 2.9954 3.2224 3.2224 4.0037 4.0037 5.3198 5.3198 5.5383 5.5383 6.0397 6.0397 8.8148 8.8148 9.4244 9.4244 9.7562 9.7562 10.0108 10.0108 10.5176 10.5176 k = 0.2449 0.2449-0.0000 ( 4876 PWs) bands (ev): -24.1851 -24.1851 -24.1695 -24.1695 -7.9226 -7.9226 -7.8767 -7.8767 -7.6887 -7.6887 -7.6361 -7.6361 -7.5963 -7.5963 -7.5508 -7.5508 -3.9228 -3.9228 -3.7447 -3.7447 -2.2856 -2.2856 -2.1548 -2.1548 -2.0550 -2.0550 -1.8529 -1.8529 -1.5653 -1.5653 -1.4656 -1.4656 -1.4321 -1.4321 -1.3140 -1.3140 -1.2274 -1.2274 -0.8474 -0.8474 3.0187 3.0187 3.2778 3.2778 4.0150 4.0150 5.3495 5.3495 5.5987 5.5987 6.0900 6.0900 8.8325 8.8325 9.4560 9.4560 9.7759 9.7759 10.0224 10.0224 10.3616 10.3616 k = 0.2347 0.2347-0.0000 ( 4882 PWs) bands (ev): -24.1858 -24.1858 -24.1691 -24.1691 -7.9228 -7.9228 -7.8738 -7.8738 -7.6872 -7.6872 -7.6377 -7.6377 -7.5936 -7.5936 -7.5506 -7.5506 -3.9397 -3.9397 -3.7497 -3.7497 -2.2877 -2.2877 -2.1549 -2.1549 -2.0685 -2.0685 -1.8583 -1.8583 -1.5689 -1.5689 -1.4679 -1.4679 -1.4269 -1.4269 -1.3148 -1.3148 -1.2227 -1.2227 -0.8511 -0.8511 3.0406 3.0406 3.3357 3.3357 4.0301 4.0301 5.3802 5.3802 5.6604 5.6604 6.1379 6.1379 8.8393 8.8393 9.4895 9.4895 9.8055 9.8055 10.0298 10.0298 10.2076 10.2076 k = 0.2245 0.2245-0.0000 ( 4882 PWs) bands (ev): -24.1864 -24.1864 -24.1688 -24.1688 -7.9230 -7.9230 -7.8707 -7.8707 -7.6856 -7.6856 -7.6394 -7.6394 -7.5910 -7.5910 -7.5505 -7.5505 -3.9569 -3.9569 -3.7549 -3.7549 -2.2898 -2.2898 -2.1553 -2.1553 -2.0819 -2.0819 -1.8638 -1.8638 -1.5729 -1.5729 -1.4700 -1.4700 -1.4204 -1.4204 -1.3152 -1.3152 -1.2169 -1.2169 -0.8559 -0.8559 3.0611 3.0611 3.3961 3.3961 4.0489 4.0489 5.4125 5.4125 5.7233 5.7233 6.1831 6.1831 8.8329 8.8329 9.5249 9.5249 9.8451 9.8451 10.0004 10.0004 10.0911 10.0911 k = 0.2143 0.2143-0.0000 ( 4882 PWs) bands (ev): -24.1870 -24.1870 -24.1685 -24.1685 -7.9232 -7.9232 -7.8677 -7.8677 -7.6839 -7.6839 -7.6410 -7.6410 -7.5883 -7.5883 -7.5504 -7.5504 -3.9744 -3.9744 -3.7603 -3.7603 -2.2920 -2.2920 -2.1561 -2.1561 -2.0950 -2.0950 -1.8694 -1.8694 -1.5770 -1.5770 -1.4715 -1.4715 -1.4132 -1.4132 -1.3154 -1.3154 -1.2101 -1.2101 -0.8617 -0.8617 3.0799 3.0799 3.4588 3.4588 4.0714 4.0714 5.4469 5.4469 5.7873 5.7873 6.2253 6.2253 8.8126 8.8126 9.5622 9.5622 9.8440 9.8440 9.9187 9.9187 10.0780 10.0780 k = 0.2041 0.2041-0.0000 ( 4876 PWs) bands (ev): -24.1876 -24.1876 -24.1681 -24.1681 -7.9234 -7.9234 -7.8646 -7.8646 -7.6822 -7.6822 -7.6426 -7.6426 -7.5858 -7.5858 -7.5503 -7.5503 -3.9921 -3.9921 -3.7659 -3.7659 -2.2942 -2.2942 -2.1573 -2.1573 -2.1076 -2.1076 -1.8751 -1.8751 -1.5808 -1.5808 -1.4726 -1.4726 -1.4056 -1.4056 -1.3153 -1.3153 -1.2026 -1.2026 -0.8684 -0.8684 3.0970 3.0970 3.5239 3.5239 4.0973 4.0973 5.4838 5.4838 5.8520 5.8520 6.2643 6.2643 8.7786 8.7786 9.6006 9.6006 9.6966 9.6966 9.9710 9.9710 10.0710 10.0710 k = 0.1939 0.1939-0.0000 ( 4879 PWs) bands (ev): -24.1882 -24.1882 -24.1678 -24.1678 -7.9235 -7.9235 -7.8615 -7.8615 -7.6804 -7.6804 -7.6442 -7.6442 -7.5833 -7.5833 -7.5503 -7.5503 -4.0098 -4.0098 -3.7716 -3.7716 -2.2965 -2.2965 -2.1593 -2.1593 -2.1194 -2.1194 -1.8809 -1.8809 -1.5839 -1.5839 -1.4734 -1.4734 -1.3979 -1.3979 -1.3150 -1.3150 -1.1946 -1.1946 -0.8758 -0.8758 3.1122 3.1122 3.5913 3.5913 4.1265 4.1265 5.5235 5.5235 5.9173 5.9173 6.2999 6.2999 8.7321 8.7321 9.5339 9.5339 9.6444 9.6444 9.9718 9.9718 10.0638 10.0638 k = 0.1837 0.1837-0.0000 ( 4879 PWs) bands (ev): -24.1888 -24.1888 -24.1675 -24.1675 -7.9236 -7.9236 -7.8584 -7.8584 -7.6786 -7.6786 -7.6457 -7.6457 -7.5808 -7.5808 -7.5502 -7.5502 -4.0275 -4.0275 -3.7774 -3.7774 -2.2989 -2.2989 -2.1622 -2.1622 -2.1298 -2.1298 -1.8868 -1.8868 -1.5861 -1.5861 -1.4740 -1.4740 -1.3903 -1.3903 -1.3145 -1.3145 -1.1865 -1.1865 -0.8836 -0.8836 3.1256 3.1256 3.6607 3.6607 4.1587 4.1587 5.5664 5.5664 5.9828 5.9828 6.3321 6.3321 8.6749 8.6749 9.3737 9.3737 9.6859 9.6859 9.8608 9.8608 10.1381 10.1381 k = 0.1735 0.1735-0.0000 ( 4877 PWs) bands (ev): -24.1894 -24.1894 -24.1672 -24.1672 -7.9237 -7.9237 -7.8554 -7.8554 -7.6769 -7.6769 -7.6472 -7.6472 -7.5786 -7.5786 -7.5501 -7.5501 -4.0450 -4.0450 -3.7832 -3.7832 -2.3015 -2.3015 -2.1667 -2.1667 -2.1383 -2.1383 -1.8926 -1.8926 -1.5872 -1.5872 -1.4745 -1.4745 -1.3829 -1.3829 -1.3138 -1.3138 -1.1785 -1.1785 -0.8917 -0.8917 3.1371 3.1371 3.7321 3.7321 4.1936 4.1936 5.6127 5.6127 6.0481 6.0481 6.3607 6.3607 8.6084 8.6084 9.2137 9.2137 9.7114 9.7114 9.7600 9.7600 10.2011 10.2011 k = 0.1633 0.1633-0.0000 ( 4891 PWs) bands (ev): -24.1900 -24.1900 -24.1669 -24.1669 -7.9238 -7.9238 -7.8523 -7.8523 -7.6752 -7.6752 -7.6486 -7.6486 -7.5765 -7.5765 -7.5499 -7.5499 -4.0623 -4.0623 -3.7890 -3.7890 -2.3041 -2.3041 -2.1730 -2.1730 -2.1446 -2.1446 -1.8984 -1.8984 -1.5871 -1.5871 -1.4750 -1.4750 -1.3757 -1.3757 -1.3130 -1.3130 -1.1711 -1.1711 -0.8997 -0.8997 3.1468 3.1468 3.8053 3.8053 4.2310 4.2310 5.6625 5.6625 6.1128 6.1128 6.3861 6.3861 8.5341 8.5341 9.0552 9.0552 9.6133 9.6133 9.7868 9.7868 10.2475 10.2475 k = 0.1531 0.1531-0.0000 ( 4895 PWs) bands (ev): -24.1905 -24.1905 -24.1666 -24.1666 -7.9239 -7.9239 -7.8494 -7.8494 -7.6736 -7.6736 -7.6498 -7.6498 -7.5746 -7.5746 -7.5496 -7.5496 -4.0792 -4.0792 -3.7948 -3.7948 -2.3069 -2.3069 -2.1807 -2.1807 -2.1488 -2.1488 -1.9042 -1.9042 -1.5856 -1.5856 -1.4756 -1.4756 -1.3689 -1.3689 -1.3121 -1.3121 -1.1646 -1.1646 -0.9073 -0.9073 3.1549 3.1549 3.8801 3.8801 4.2706 4.2706 5.7160 5.7160 6.1760 6.1760 6.4086 6.4086 8.4534 8.4534 8.8990 8.8990 9.4992 9.4992 9.8354 9.8354 10.2966 10.2966 k = 0.1429 0.1429-0.0000 ( 4893 PWs) bands (ev): -24.1910 -24.1910 -24.1664 -24.1664 -7.9239 -7.9239 -7.8465 -7.8465 -7.6722 -7.6722 -7.6510 -7.6510 -7.5730 -7.5730 -7.5492 -7.5492 -4.0956 -4.0956 -3.8004 -3.8004 -2.3098 -2.3098 -2.1890 -2.1890 -2.1518 -2.1518 -1.9098 -1.9098 -1.5828 -1.5828 -1.4762 -1.4762 -1.3625 -1.3625 -1.3111 -1.3111 -1.1595 -1.1595 -0.9141 -0.9141 3.1613 3.1613 3.9561 3.9561 4.3118 4.3118 5.7732 5.7732 6.2365 6.2365 6.4294 6.4294 8.3674 8.3674 8.7457 8.7457 9.3887 9.3887 9.8874 9.8874 10.3506 10.3506 k = 0.1327 0.1327-0.0000 ( 4897 PWs) bands (ev): -24.1915 -24.1915 -24.1661 -24.1661 -7.9239 -7.9239 -7.8436 -7.8436 -7.6709 -7.6709 -7.6519 -7.6519 -7.5716 -7.5716 -7.5485 -7.5485 -4.1114 -4.1114 -3.8059 -3.8059 -2.3129 -2.3129 -2.1972 -2.1972 -2.1541 -2.1541 -1.9153 -1.9153 -1.5787 -1.5787 -1.4769 -1.4769 -1.3565 -1.3565 -1.3100 -1.3100 -1.1561 -1.1561 -0.9198 -0.9198 3.1663 3.1663 4.0330 4.0330 4.3544 4.3544 5.8340 5.8340 6.2921 6.2921 6.4505 6.4505 8.2770 8.2770 8.5958 8.5958 9.2830 9.2830 9.9417 9.9417 10.4078 10.4078 k = 0.1224 0.1224-0.0000 ( 4897 PWs) bands (ev): -24.1920 -24.1920 -24.1659 -24.1659 -7.9239 -7.9239 -7.8409 -7.8409 -7.6699 -7.6699 -7.6527 -7.6527 -7.5706 -7.5706 -7.5477 -7.5477 -4.1265 -4.1265 -3.8111 -3.8111 -2.3161 -2.3161 -2.2049 -2.2049 -2.1560 -2.1560 -1.9205 -1.9205 -1.5734 -1.5734 -1.4776 -1.4776 -1.3510 -1.3510 -1.3091 -1.3091 -1.1547 -1.1547 -0.9240 -0.9240 3.1699 3.1699 4.1104 4.1104 4.3978 4.3978 5.8983 5.8983 6.3388 6.3388 6.4756 6.4756 8.1831 8.1831 8.4501 8.4501 9.1829 9.1829 9.9983 9.9983 10.4480 10.4480 k = 0.1122 0.1122-0.0000 ( 4903 PWs) bands (ev): -24.1924 -24.1924 -24.1656 -24.1656 -7.9239 -7.9239 -7.8383 -7.8383 -7.6693 -7.6693 -7.6531 -7.6531 -7.5699 -7.5699 -7.5466 -7.5466 -4.1409 -4.1409 -3.8161 -3.8161 -2.3194 -2.3194 -2.2121 -2.2121 -2.1577 -2.1577 -1.9256 -1.9256 -1.5669 -1.5669 -1.4783 -1.4783 -1.3461 -1.3461 -1.3082 -1.3082 -1.1554 -1.1554 -0.9267 -0.9267 3.1725 3.1725 4.1877 4.1877 4.4415 4.4415 5.9658 5.9658 6.3722 6.3722 6.5094 6.5094 8.0863 8.0863 8.3093 8.3093 9.0889 9.0889 10.0568 10.0568 10.3875 10.3875 k = 0.1020 0.1020-0.0000 ( 4899 PWs) bands (ev): -24.1928 -24.1928 -24.1654 -24.1654 -7.9239 -7.9239 -7.8358 -7.8358 -7.6689 -7.6689 -7.6533 -7.6533 -7.5694 -7.5694 -7.5455 -7.5455 -4.1543 -4.1543 -3.8209 -3.8209 -2.3226 -2.3226 -2.2186 -2.2186 -2.1592 -2.1592 -1.9303 -1.9303 -1.5594 -1.5594 -1.4790 -1.4790 -1.3417 -1.3417 -1.3075 -1.3075 -1.1582 -1.1582 -0.9279 -0.9279 3.1741 3.1741 4.2644 4.2644 4.4850 4.4850 6.0362 6.0362 6.3919 6.3919 6.5520 6.5520 7.9872 7.9872 8.1742 8.1742 9.0014 9.0014 10.1168 10.1168 10.3016 10.3016 k = 0.0918 0.0918-0.0000 ( 4903 PWs) bands (ev): -24.1932 -24.1932 -24.1652 -24.1652 -7.9239 -7.9239 -7.8335 -7.8335 -7.6688 -7.6688 -7.6532 -7.6532 -7.5692 -7.5692 -7.5442 -7.5442 -4.1668 -4.1668 -3.8253 -3.8253 -2.3260 -2.3260 -2.2244 -2.2244 -2.1605 -2.1605 -1.9347 -1.9347 -1.5510 -1.5510 -1.4797 -1.4797 -1.3379 -1.3379 -1.3071 -1.3071 -1.1627 -1.1627 -0.9276 -0.9276 3.1749 3.1749 4.3396 4.3396 4.5276 4.5276 6.1089 6.1089 6.4024 6.4024 6.5996 6.5996 7.8865 7.8865 8.0457 8.0457 8.9209 8.9209 10.1724 10.1724 10.2245 10.2245 k = 0.0816 0.0816-0.0000 ( 4903 PWs) bands (ev): -24.1935 -24.1935 -24.1651 -24.1651 -7.9238 -7.9238 -7.8313 -7.8313 -7.6690 -7.6690 -7.6529 -7.6529 -7.5691 -7.5691 -7.5429 -7.5429 -4.1781 -4.1781 -3.8293 -3.8293 -2.3292 -2.3292 -2.2295 -2.2295 -2.1617 -2.1617 -1.9387 -1.9387 -1.5419 -1.5419 -1.4803 -1.4803 -1.3346 -1.3346 -1.3071 -1.3071 -1.1685 -1.1685 -0.9263 -0.9263 3.1751 3.1751 4.4125 4.4125 4.5687 4.5687 6.1822 6.1822 6.4090 6.4090 6.6480 6.6480 7.7846 7.7846 7.9248 7.9248 8.8476 8.8476 10.1325 10.1325 10.2498 10.2498 k = 0.0714 0.0714-0.0000 ( 4905 PWs) bands (ev): -24.1938 -24.1938 -24.1649 -24.1649 -7.9238 -7.9238 -7.8294 -7.8294 -7.6694 -7.6694 -7.6524 -7.6524 -7.5691 -7.5691 -7.5416 -7.5416 -4.1884 -4.1884 -3.8329 -3.8329 -2.3323 -2.3323 -2.2339 -2.2339 -2.1628 -2.1628 -1.9424 -1.9424 -1.5325 -1.5325 -1.4809 -1.4809 -1.3318 -1.3318 -1.3077 -1.3077 -1.1752 -1.1752 -0.9242 -0.9242 3.1749 3.1749 4.4819 4.4819 4.6076 4.6076 6.2526 6.2526 6.4174 6.4174 6.6947 6.6947 7.6820 7.6820 7.8128 7.8128 8.7821 8.7821 10.0621 10.0621 10.3135 10.3135 k = 0.0612 0.0612-0.0000 ( 4905 PWs) bands (ev): -24.1941 -24.1941 -24.1648 -24.1648 -7.9237 -7.9237 -7.8276 -7.8276 -7.6699 -7.6699 -7.6519 -7.6519 -7.5693 -7.5693 -7.5404 -7.5404 -4.1974 -4.1974 -3.8362 -3.8362 -2.3351 -2.3351 -2.2376 -2.2376 -2.1637 -2.1637 -1.9456 -1.9456 -1.5229 -1.5229 -1.4814 -1.4814 -1.3294 -1.3294 -1.3088 -1.3088 -1.1821 -1.1821 -0.9216 -0.9216 3.1744 3.1744 4.5467 4.5467 4.6435 4.6435 6.3095 6.3095 6.4394 6.4394 6.7381 6.7381 7.5792 7.5792 7.7110 7.7110 8.7247 8.7247 9.9979 9.9979 10.3794 10.3794 k = 0.0510 0.0510-0.0000 ( 4909 PWs) bands (ev): -24.1943 -24.1943 -24.1647 -24.1647 -7.9237 -7.9237 -7.8261 -7.8261 -7.6703 -7.6703 -7.6514 -7.6514 -7.5694 -7.5694 -7.5393 -7.5393 -4.2051 -4.2051 -3.8389 -3.8389 -2.3376 -2.3376 -2.2406 -2.2406 -2.1645 -2.1645 -1.9484 -1.9484 -1.5136 -1.5136 -1.4817 -1.4817 -1.3276 -1.3276 -1.3106 -1.3106 -1.1887 -1.1887 -0.9189 -0.9189 3.1737 3.1737 4.6053 4.6053 4.6757 4.6757 6.3385 6.3385 6.4899 6.4899 6.7774 6.7774 7.4768 7.4768 7.6208 7.6208 8.6756 8.6756 9.9416 9.9416 10.4452 10.4452 k = 0.0408 0.0408-0.0000 ( 4913 PWs) bands (ev): -24.1945 -24.1945 -24.1646 -24.1646 -7.9237 -7.9237 -7.8249 -7.8249 -7.6708 -7.6708 -7.6509 -7.6509 -7.5696 -7.5696 -7.5384 -7.5384 -4.2115 -4.2115 -3.8412 -3.8412 -2.3398 -2.3398 -2.2431 -2.2431 -2.1652 -2.1652 -1.9506 -1.9506 -1.5050 -1.5050 -1.4818 -1.4818 -1.3261 -1.3261 -1.3130 -1.3130 -1.1945 -1.1945 -0.9164 -0.9164 3.1730 3.1730 4.6563 4.6563 4.7034 4.7034 6.3467 6.3467 6.5619 6.5619 6.8120 6.8120 7.3752 7.3752 7.5439 7.5439 8.6351 8.6351 9.8942 9.8942 10.5094 10.5094 k = 0.0306 0.0306-0.0000 ( 4921 PWs) bands (ev): -24.1946 -24.1946 -24.1645 -24.1645 -7.9236 -7.9236 -7.8239 -7.8239 -7.6712 -7.6712 -7.6505 -7.6505 -7.5697 -7.5697 -7.5376 -7.5376 -4.2166 -4.2166 -3.8430 -3.8430 -2.3416 -2.3416 -2.2450 -2.2450 -2.1657 -2.1657 -1.9525 -1.9525 -1.4978 -1.4978 -1.4816 -1.4816 -1.3250 -1.3250 -1.3156 -1.3156 -1.1993 -1.1993 -0.9142 -0.9142 3.1724 3.1724 4.6981 4.6981 4.7259 4.7259 6.3471 6.3471 6.6410 6.6410 6.8423 6.8423 7.2754 7.2754 7.4818 7.4818 8.6034 8.6034 9.8565 9.8565 10.5692 10.5692 k = 0.0204 0.0204-0.0000 ( 4911 PWs) bands (ev): -24.1947 -24.1947 -24.1644 -24.1644 -7.9236 -7.9236 -7.8231 -7.8231 -7.6715 -7.6715 -7.6502 -7.6502 -7.5698 -7.5698 -7.5371 -7.5371 -4.2202 -4.2202 -3.8443 -3.8443 -2.3428 -2.3428 -2.2462 -2.2462 -2.1661 -2.1661 -1.9537 -1.9537 -1.4927 -1.4927 -1.4808 -1.4808 -1.3242 -1.3242 -1.3179 -1.3179 -1.2028 -1.2028 -0.9125 -0.9125 3.1719 3.1719 4.7288 4.7288 4.7429 4.7429 6.3455 6.3455 6.7171 6.7171 6.8713 6.8713 7.1791 7.1791 7.4362 7.4362 8.5806 8.5806 9.8290 9.8291 10.6205 10.6205 k = 0.0102 0.0102-0.0000 ( 4903 PWs) bands (ev): -24.1948 -24.1948 -24.1644 -24.1644 -7.9236 -7.9236 -7.8227 -7.8227 -7.6717 -7.6717 -7.6500 -7.6500 -7.5699 -7.5699 -7.5367 -7.5367 -4.2223 -4.2223 -3.8451 -3.8451 -2.3436 -2.3436 -2.2470 -2.2470 -2.1663 -2.1663 -1.9545 -1.9545 -1.4900 -1.4900 -1.4796 -1.4796 -1.3238 -1.3238 -1.3195 -1.3195 -1.2049 -1.2049 -0.9114 -0.9114 3.1715 3.1715 4.7466 4.7466 4.7545 4.7545 6.3440 6.3440 6.7749 6.7749 6.9072 6.9072 7.0912 7.0912 7.4083 7.4083 8.5669 8.5669 9.8124 9.8124 10.6564 10.6564 k = 0.0000 0.0000 0.0000 ( 4879 PWs) bands (ev): -24.1947 -24.1947 -24.1643 -24.1643 -7.9236 -7.9236 -7.8225 -7.8225 -7.6717 -7.6717 -7.6499 -7.6499 -7.5699 -7.5699 -7.5366 -7.5366 -4.2231 -4.2231 -3.8454 -3.8454 -2.3438 -2.3438 -2.2472 -2.2472 -2.1664 -2.1664 -1.9547 -1.9547 -1.4892 -1.4892 -1.4789 -1.4789 -1.3237 -1.3237 -1.3201 -1.3201 -1.2056 -1.2056 -0.9110 -0.9110 3.1714 3.1714 4.7518 4.7518 4.7593 4.7593 6.3434 6.3434 6.7957 6.7957 6.9389 6.9389 7.0409 7.0409 7.3989 7.3989 8.5623 8.5623 9.8068 9.8068 10.6696 10.6696 k = 0.0000 0.0000 0.0000 ( 4879 PWs) bands (ev): -24.1947 -24.1947 -24.1643 -24.1643 -7.9236 -7.9236 -7.8225 -7.8225 -7.6717 -7.6717 -7.6499 -7.6499 -7.5699 -7.5699 -7.5366 -7.5366 -4.2231 -4.2231 -3.8454 -3.8454 -2.3438 -2.3438 -2.2472 -2.2472 -2.1664 -2.1664 -1.9547 -1.9547 -1.4892 -1.4892 -1.4789 -1.4789 -1.3237 -1.3237 -1.3201 -1.3201 -1.2056 -1.2056 -0.9110 -0.9110 3.1714 3.1714 4.7518 4.7518 4.7593 4.7593 6.3434 6.3434 6.7957 6.7957 6.9389 6.9389 7.0409 7.0409 7.3989 7.3989 8.5623 8.5623 9.8068 9.8068 10.6696 10.6696 k = 0.0000 0.0000 0.0144 ( 4895 PWs) bands (ev): -24.1947 -24.1947 -24.1644 -24.1644 -7.9236 -7.9236 -7.8226 -7.8226 -7.6717 -7.6717 -7.6500 -7.6500 -7.5700 -7.5700 -7.5366 -7.5366 -4.2227 -4.2227 -3.8455 -3.8455 -2.3438 -2.3438 -2.2472 -2.2472 -2.1663 -2.1663 -1.9547 -1.9547 -1.4892 -1.4892 -1.4790 -1.4790 -1.3237 -1.3237 -1.3204 -1.3204 -1.2056 -1.2056 -0.9112 -0.9112 3.1717 3.1717 4.7517 4.7517 4.7591 4.7591 6.3313 6.3313 6.7935 6.7935 6.9391 6.9391 7.0581 7.0581 7.3995 7.3995 8.5642 8.5642 9.7957 9.7957 10.6840 10.6840 k = 0.0000 0.0000 0.0288 ( 4911 PWs) bands (ev): -24.1948 -24.1948 -24.1644 -24.1644 -7.9235 -7.9235 -7.8227 -7.8227 -7.6716 -7.6716 -7.6500 -7.6500 -7.5702 -7.5702 -7.5366 -7.5366 -4.2215 -4.2215 -3.8459 -3.8459 -2.3438 -2.3438 -2.2473 -2.2473 -2.1662 -2.1662 -1.9549 -1.9549 -1.4892 -1.4892 -1.4790 -1.4790 -1.3237 -1.3237 -1.3213 -1.3213 -1.2056 -1.2056 -0.9116 -0.9116 3.1727 3.1727 4.7512 4.7512 4.7586 4.7586 6.2977 6.2977 6.7890 6.7890 6.9396 6.9396 7.1053 7.1053 7.4015 7.4015 8.5699 8.5699 9.7646 9.7646 10.7248 10.7248 k = 0.0000 0.0000 0.0432 ( 4911 PWs) bands (ev): -24.1948 -24.1948 -24.1644 -24.1644 -7.9234 -7.9234 -7.8229 -7.8229 -7.6714 -7.6714 -7.6500 -7.6500 -7.5705 -7.5705 -7.5366 -7.5366 -4.2196 -4.2196 -3.8465 -3.8465 -2.3438 -2.3438 -2.2473 -2.2473 -2.1659 -2.1659 -1.9551 -1.9551 -1.4890 -1.4890 -1.4790 -1.4790 -1.3237 -1.3237 -1.3226 -1.3226 -1.2056 -1.2056 -0.9121 -0.9121 3.1742 3.1742 4.7504 4.7504 4.7579 4.7579 6.2487 6.2487 6.7848 6.7848 6.9404 6.9404 7.1736 7.1736 7.4049 7.4049 8.5791 8.5791 9.7182 9.7182 10.7874 10.7874 k = 0.0000 0.0000 0.0576 ( 4907 PWs) bands (ev): -24.1948 -24.1948 -24.1644 -24.1644 -7.9233 -7.9233 -7.8232 -7.8232 -7.6712 -7.6712 -7.6500 -7.6500 -7.5709 -7.5709 -7.5366 -7.5366 -4.2170 -4.2170 -3.8474 -3.8474 -2.3438 -2.3438 -2.2473 -2.2473 -2.1657 -2.1657 -1.9554 -1.9554 -1.4889 -1.4889 -1.4789 -1.4789 -1.3244 -1.3244 -1.3237 -1.3237 -1.2056 -1.2056 -0.9129 -0.9129 3.1764 3.1764 4.7494 4.7494 4.7568 4.7568 6.1902 6.1902 6.7820 6.7820 6.9416 6.9416 7.2559 7.2559 7.4094 7.4094 8.5919 8.5919 9.6619 9.6619 10.8664 10.8664 k = 0.0000 0.0000 0.0720 ( 4919 PWs) bands (ev): -24.1948 -24.1948 -24.1644 -24.1644 -7.9232 -7.9232 -7.8236 -7.8236 -7.6709 -7.6709 -7.6501 -7.6501 -7.5714 -7.5714 -7.5365 -7.5365 -4.2138 -4.2138 -3.8485 -3.8485 -2.3439 -2.3439 -2.2473 -2.2473 -2.1654 -2.1654 -1.9557 -1.9557 -1.4888 -1.4888 -1.4790 -1.4790 -1.3267 -1.3267 -1.3236 -1.3236 -1.2056 -1.2056 -0.9138 -0.9138 3.1791 3.1791 4.7481 4.7481 4.7555 4.7555 6.1268 6.1268 6.7806 6.7806 6.9431 6.9431 7.3476 7.3476 7.4152 7.4152 8.6079 8.6079 9.5998 9.5998 10.9574 10.9574 k = 0.0000 0.0000 0.0865 ( 4915 PWs) bands (ev): -24.1948 -24.1948 -24.1644 -24.1644 -7.9230 -7.9230 -7.8240 -7.8240 -7.6705 -7.6705 -7.6501 -7.6501 -7.5720 -7.5720 -7.5365 -7.5365 -4.2099 -4.2099 -3.8498 -3.8498 -2.3439 -2.3439 -2.2473 -2.2473 -2.1650 -2.1650 -1.9561 -1.9561 -1.4885 -1.4885 -1.4789 -1.4789 -1.3294 -1.3294 -1.3237 -1.3237 -1.2055 -1.2055 -0.9149 -0.9149 3.1823 3.1823 4.7466 4.7466 4.7540 4.7540 6.0618 6.0618 6.7802 6.7802 6.9448 6.9448 7.4220 7.4220 7.4456 7.4456 8.6268 8.6268 9.5350 9.5350 11.0569 11.0569 k = 0.0000 0.0000 0.1009 ( 4915 PWs) bands (ev): -24.1947 -24.1947 -24.1645 -24.1645 -7.9228 -7.9228 -7.8244 -7.8244 -7.6701 -7.6701 -7.6502 -7.6502 -7.5727 -7.5727 -7.5364 -7.5364 -4.2056 -4.2056 -3.8513 -3.8513 -2.3439 -2.3439 -2.2472 -2.2472 -2.1646 -2.1646 -1.9565 -1.9565 -1.4883 -1.4883 -1.4789 -1.4789 -1.3325 -1.3325 -1.3237 -1.3237 -1.2055 -1.2055 -0.9161 -0.9161 3.1859 3.1859 4.7449 4.7449 4.7523 4.7523 5.9971 5.9971 6.7804 6.7804 6.9467 6.9467 7.4298 7.4298 7.5480 7.5480 8.6483 8.6483 9.4697 9.4697 11.0237 11.0237 k = 0.0000 0.0000 0.1153 ( 4911 PWs) bands (ev): -24.1947 -24.1947 -24.1645 -24.1645 -7.9226 -7.9226 -7.8249 -7.8249 -7.6697 -7.6697 -7.6502 -7.6502 -7.5735 -7.5735 -7.5364 -7.5364 -4.2008 -4.2008 -3.8530 -3.8530 -2.3439 -2.3439 -2.2472 -2.2472 -2.1641 -2.1641 -1.9570 -1.9570 -1.4880 -1.4880 -1.4789 -1.4789 -1.3358 -1.3358 -1.3236 -1.3236 -1.2055 -1.2055 -0.9173 -0.9173 3.1898 3.1898 4.7430 4.7430 4.7504 4.7504 5.9342 5.9342 6.7812 6.7812 6.9487 6.9487 7.4385 7.4385 7.6533 7.6533 8.6720 8.6720 9.4053 9.4053 10.9266 10.9266 k = 0.0000 0.0000 0.1297 ( 4918 PWs) bands (ev): -24.1947 -24.1947 -24.1645 -24.1645 -7.9223 -7.9223 -7.8254 -7.8254 -7.6692 -7.6692 -7.6503 -7.6503 -7.5743 -7.5743 -7.5363 -7.5363 -4.1957 -4.1957 -3.8549 -3.8549 -2.3439 -2.3439 -2.2472 -2.2472 -2.1636 -2.1636 -1.9575 -1.9575 -1.4878 -1.4878 -1.4789 -1.4789 -1.3393 -1.3393 -1.3236 -1.3236 -1.2055 -1.2055 -0.9186 -0.9186 3.1940 3.1940 4.7411 4.7411 4.7485 4.7485 5.8740 5.8740 6.7823 6.7823 6.9509 6.9509 7.4479 7.4479 7.7603 7.7603 8.6972 8.6972 9.3431 9.3431 10.8268 10.8268 k = 0.0000 0.0000 0.1441 ( 4918 PWs) bands (ev): -24.1947 -24.1947 -24.1645 -24.1645 -7.9221 -7.9221 -7.8260 -7.8260 -7.6687 -7.6687 -7.6503 -7.6503 -7.5751 -7.5751 -7.5363 -7.5363 -4.1904 -4.1904 -3.8569 -3.8569 -2.3439 -2.3439 -2.2472 -2.2472 -2.1630 -2.1630 -1.9580 -1.9580 -1.4875 -1.4875 -1.4789 -1.4789 -1.3430 -1.3430 -1.3236 -1.3236 -1.2055 -1.2055 -0.9199 -0.9199 3.1983 3.1983 4.7391 4.7391 4.7465 4.7465 5.8174 5.8174 6.7836 6.7836 6.9531 6.9531 7.4578 7.4578 7.8681 7.8681 8.7233 8.7233 9.2837 9.2837 10.7258 10.7258 k = 0.0000 0.0000 0.1585 ( 4918 PWs) bands (ev): -24.1947 -24.1947 -24.1645 -24.1645 -7.9218 -7.9218 -7.8265 -7.8265 -7.6682 -7.6682 -7.6504 -7.6504 -7.5759 -7.5759 -7.5362 -7.5362 -4.1850 -4.1850 -3.8589 -3.8589 -2.3439 -2.3439 -2.2471 -2.2471 -2.1625 -2.1625 -1.9586 -1.9586 -1.4872 -1.4872 -1.4789 -1.4789 -1.3467 -1.3467 -1.3236 -1.3236 -1.2055 -1.2055 -0.9212 -0.9212 3.2027 3.2027 4.7372 4.7372 4.7445 4.7445 5.7647 5.7647 6.7851 6.7851 6.9552 6.9552 7.4680 7.4680 7.9757 7.9757 8.7498 8.7498 9.2279 9.2279 10.6249 10.6249 k = 0.0000 0.0000 0.1729 ( 4914 PWs) bands (ev): -24.1947 -24.1947 -24.1645 -24.1645 -7.9216 -7.9216 -7.8271 -7.8271 -7.6677 -7.6677 -7.6504 -7.6504 -7.5767 -7.5767 -7.5362 -7.5362 -4.1796 -4.1796 -3.8610 -3.8610 -2.3439 -2.3439 -2.2471 -2.2471 -2.1620 -2.1620 -1.9591 -1.9591 -1.4868 -1.4868 -1.4789 -1.4789 -1.3503 -1.3503 -1.3235 -1.3235 -1.2054 -1.2054 -0.9224 -0.9224 3.2070 3.2070 4.7352 4.7352 4.7426 4.7426 5.7166 5.7166 6.7866 6.7866 6.9574 6.9574 7.4782 7.4782 8.0820 8.0820 8.7757 8.7757 9.1763 9.1763 10.5253 10.5253 k = 0.0000 0.0000 0.1873 ( 4918 PWs) bands (ev): -24.1947 -24.1947 -24.1645 -24.1645 -7.9214 -7.9214 -7.8276 -7.8276 -7.6673 -7.6673 -7.6505 -7.6505 -7.5775 -7.5775 -7.5361 -7.5361 -4.1744 -4.1744 -3.8631 -3.8631 -2.3439 -2.3439 -2.2471 -2.2471 -2.1615 -2.1615 -1.9596 -1.9596 -1.4865 -1.4865 -1.4788 -1.4788 -1.3538 -1.3538 -1.3236 -1.3236 -1.2054 -1.2054 -0.9236 -0.9236 3.2112 3.2112 4.7334 4.7334 4.7408 4.7408 5.6733 5.6733 6.7880 6.7880 6.9594 6.9594 7.4882 7.4882 8.1859 8.1859 8.8004 8.8004 9.1293 9.1293 10.4283 10.4283 k = 0.0000 0.0000 0.2017 ( 4910 PWs) bands (ev): -24.1947 -24.1947 -24.1645 -24.1645 -7.9211 -7.9211 -7.8281 -7.8281 -7.6669 -7.6669 -7.6505 -7.6505 -7.5782 -7.5782 -7.5361 -7.5361 -4.1695 -4.1695 -3.8651 -3.8651 -2.3439 -2.3439 -2.2470 -2.2470 -2.1610 -2.1610 -1.9601 -1.9601 -1.4861 -1.4861 -1.4788 -1.4788 -1.3571 -1.3571 -1.3236 -1.3236 -1.2054 -1.2054 -0.9246 -0.9246 3.2151 3.2151 4.7318 4.7318 4.7391 4.7391 5.6352 5.6352 6.7894 6.7894 6.9612 6.9612 7.4977 7.4977 8.2859 8.2859 8.8227 8.8227 9.0875 9.0875 10.3354 10.3354 k = 0.0000 0.0000 0.2161 ( 4902 PWs) bands (ev): -24.1947 -24.1947 -24.1645 -24.1645 -7.9209 -7.9209 -7.8285 -7.8285 -7.6664 -7.6664 -7.6505 -7.6505 -7.5788 -7.5788 -7.5360 -7.5360 -4.1651 -4.1651 -3.8670 -3.8670 -2.3439 -2.3439 -2.2470 -2.2470 -2.1605 -2.1605 -1.9605 -1.9605 -1.4858 -1.4858 -1.4788 -1.4788 -1.3600 -1.3600 -1.3235 -1.3235 -1.2054 -1.2054 -0.9255 -0.9255 3.2186 3.2186 4.7303 4.7303 4.7376 4.7376 5.6026 5.6026 6.7906 6.7906 6.9628 6.9628 7.5064 7.5064 8.3802 8.3802 8.8418 8.8418 9.0512 9.0512 10.2487 10.2487 k = 0.0000 0.0000 0.2306 ( 4894 PWs) bands (ev): -24.1947 -24.1947 -24.1644 -24.1644 -7.9207 -7.9207 -7.8288 -7.8288 -7.6661 -7.6661 -7.6506 -7.6506 -7.5794 -7.5794 -7.5360 -7.5360 -4.1613 -4.1613 -3.8686 -3.8686 -2.3439 -2.3439 -2.2469 -2.2469 -2.1601 -2.1601 -1.9608 -1.9608 -1.4856 -1.4856 -1.4788 -1.4788 -1.3625 -1.3625 -1.3235 -1.3235 -1.2054 -1.2054 -0.9263 -0.9263 3.2216 3.2216 4.7290 4.7290 4.7364 4.7364 5.5755 5.5755 6.7917 6.7917 6.9642 6.9642 7.5140 7.5140 8.4666 8.4666 8.8568 8.8568 9.0210 9.0210 10.1705 10.1705 k = 0.0000 0.0000 0.2450 ( 4886 PWs) bands (ev): -24.1947 -24.1947 -24.1644 -24.1644 -7.9206 -7.9206 -7.8291 -7.8291 -7.6658 -7.6658 -7.6506 -7.6506 -7.5798 -7.5798 -7.5360 -7.5360 -4.1582 -4.1582 -3.8699 -3.8699 -2.3439 -2.3439 -2.2469 -2.2469 -2.1598 -2.1598 -1.9611 -1.9611 -1.4853 -1.4853 -1.4788 -1.4788 -1.3645 -1.3645 -1.3234 -1.3234 -1.2054 -1.2054 -0.9269 -0.9269 3.2240 3.2240 4.7280 4.7280 4.7353 4.7353 5.5543 5.5543 6.7926 6.7926 6.9654 6.9654 7.5203 7.5203 8.5420 8.5420 8.8668 8.8668 8.9970 8.9970 10.1039 10.1039 k = 0.0000 0.0000 0.2594 ( 4886 PWs) bands (ev): -24.1947 -24.1947 -24.1644 -24.1644 -7.9205 -7.9205 -7.8293 -7.8293 -7.6656 -7.6656 -7.6506 -7.6506 -7.5801 -7.5801 -7.5360 -7.5360 -4.1559 -4.1559 -3.8709 -3.8709 -2.3439 -2.3439 -2.2469 -2.2469 -2.1596 -2.1596 -1.9613 -1.9613 -1.4852 -1.4852 -1.4788 -1.4788 -1.3660 -1.3660 -1.3234 -1.3234 -1.2054 -1.2054 -0.9273 -0.9273 3.2258 3.2258 4.7272 4.7272 4.7346 4.7346 5.5390 5.5390 6.7932 6.7932 6.9662 6.9662 7.5249 7.5249 8.6024 8.6024 8.8719 8.8719 8.9797 8.9797 10.0525 10.0525 k = 0.0000 0.0000 0.2738 ( 4882 PWs) bands (ev): -24.1946 -24.1946 -24.1644 -24.1644 -7.9204 -7.9204 -7.8295 -7.8295 -7.6655 -7.6655 -7.6506 -7.6506 -7.5803 -7.5803 -7.5359 -7.5359 -4.1545 -4.1545 -3.8716 -3.8716 -2.3439 -2.3439 -2.2468 -2.2468 -2.1595 -2.1595 -1.9614 -1.9614 -1.4851 -1.4851 -1.4788 -1.4788 -1.3669 -1.3669 -1.3234 -1.3234 -1.2054 -1.2054 -0.9276 -0.9276 3.2269 3.2269 4.7268 4.7268 4.7341 4.7341 5.5299 5.5299 6.7936 6.7936 6.9667 6.9667 7.5278 7.5278 8.6425 8.6425 8.8731 8.8731 8.9692 8.9692 10.0197 10.0197 k = 0.0000 0.0000 0.2882 ( 4886 PWs) bands (ev): -24.1946 -24.1946 -24.1644 -24.1644 -7.9204 -7.9204 -7.8295 -7.8295 -7.6655 -7.6655 -7.6506 -7.6506 -7.5804 -7.5804 -7.5359 -7.5359 -4.1540 -4.1540 -3.8718 -3.8718 -2.3440 -2.3440 -2.2467 -2.2467 -2.1595 -2.1595 -1.9614 -1.9614 -1.4851 -1.4851 -1.4789 -1.4789 -1.3672 -1.3672 -1.3233 -1.3233 -1.2055 -1.2055 -0.9276 -0.9276 3.2273 3.2273 4.7266 4.7266 4.7340 4.7340 5.5268 5.5268 6.7938 6.7938 6.9669 6.9669 7.5288 7.5288 8.6568 8.6568 8.8730 8.8730 8.9657 8.9657 10.0084 10.0084 k = 0.0000 0.0000 0.2882 ( 4886 PWs) bands (ev): -24.1946 -24.1946 -24.1644 -24.1644 -7.9204 -7.9204 -7.8295 -7.8295 -7.6655 -7.6655 -7.6506 -7.6506 -7.5804 -7.5804 -7.5359 -7.5359 -4.1540 -4.1540 -3.8718 -3.8718 -2.3440 -2.3440 -2.2467 -2.2467 -2.1595 -2.1595 -1.9614 -1.9614 -1.4851 -1.4851 -1.4789 -1.4789 -1.3672 -1.3672 -1.3233 -1.3233 -1.2055 -1.2055 -0.9276 -0.9276 3.2273 3.2273 4.7266 4.7266 4.7340 4.7340 5.5268 5.5268 6.7938 6.7938 6.9669 6.9669 7.5288 7.5288 8.6568 8.6568 8.8730 8.8730 8.9657 8.9657 10.0084 10.0084 k = 0.0000 0.0143 0.2882 ( 4880 PWs) bands (ev): -24.1946 -24.1946 -24.1644 -24.1644 -7.9204 -7.9204 -7.8297 -7.8297 -7.6654 -7.6654 -7.6507 -7.6507 -7.5803 -7.5803 -7.5360 -7.5360 -4.1534 -4.1534 -3.8715 -3.8715 -2.3437 -2.3437 -2.2465 -2.2465 -2.1594 -2.1594 -1.9611 -1.9611 -1.4862 -1.4862 -1.4796 -1.4796 -1.3656 -1.3656 -1.3234 -1.3234 -1.2050 -1.2050 -0.9281 -0.9281 3.2269 3.2269 4.7152 4.7152 4.7326 4.7326 5.5331 5.5331 6.7891 6.7891 6.9617 6.9617 7.5378 7.5378 8.6631 8.6631 8.8762 8.8762 8.9718 8.9718 10.0023 10.0023 k = 0.0000 0.0286 0.2882 ( 4892 PWs) bands (ev): -24.1946 -24.1946 -24.1645 -24.1645 -7.9205 -7.9205 -7.8301 -7.8301 -7.6652 -7.6652 -7.6509 -7.6509 -7.5802 -7.5802 -7.5363 -7.5363 -4.1515 -4.1515 -3.8706 -3.8706 -2.3429 -2.3429 -2.2458 -2.2458 -2.1593 -2.1593 -1.9603 -1.9603 -1.4903 -1.4903 -1.4808 -1.4808 -1.3612 -1.3612 -1.3237 -1.3237 -1.2037 -1.2037 -0.9294 -0.9294 3.2258 3.2258 4.6746 4.6746 4.7365 4.7365 5.5505 5.5505 6.7742 6.7742 6.9479 6.9479 7.5644 7.5644 8.6806 8.6806 8.8860 8.8860 8.9910 8.9910 9.9841 9.9841 k = 0.0000 0.0429 0.2882 ( 4886 PWs) bands (ev): -24.1945 -24.1945 -24.1645 -24.1645 -7.9206 -7.9206 -7.8307 -7.8307 -7.6650 -7.6650 -7.6513 -7.6513 -7.5799 -7.5799 -7.5368 -7.5368 -4.1485 -4.1485 -3.8692 -3.8692 -2.3416 -2.3416 -2.2445 -2.2445 -2.1591 -2.1591 -1.9587 -1.9587 -1.4973 -1.4973 -1.4815 -1.4815 -1.3551 -1.3551 -1.3242 -1.3242 -1.2014 -1.2014 -0.9314 -0.9314 3.2239 3.2239 4.6110 4.6110 4.7438 4.7438 5.5758 5.5758 6.7471 6.7471 6.9294 6.9294 7.6069 7.6069 8.7051 8.7051 8.9031 8.9031 9.0249 9.0249 9.9546 9.9546 k = 0.0000 0.0571 0.2882 ( 4890 PWs) bands (ev): -24.1943 -24.1943 -24.1646 -24.1646 -7.9208 -7.9208 -7.8317 -7.8317 -7.6647 -7.6647 -7.6518 -7.6518 -7.5794 -7.5794 -7.5375 -7.5375 -4.1442 -4.1442 -3.8672 -3.8672 -2.3398 -2.3398 -2.2428 -2.2428 -2.1589 -2.1589 -1.9566 -1.9566 -1.5061 -1.5061 -1.4821 -1.4821 -1.3484 -1.3484 -1.3249 -1.3249 -1.1980 -1.1980 -0.9342 -0.9342 3.2211 3.2211 4.5298 4.5298 4.7541 4.7541 5.6057 5.6057 6.7063 6.7063 6.9104 6.9104 7.6627 7.6627 8.7316 8.7316 8.9288 8.9288 9.0754 9.0754 9.9149 9.9149 k = 0.0000 0.0714 0.2882 ( 4878 PWs) bands (ev): -24.1941 -24.1941 -24.1647 -24.1647 -7.9209 -7.9209 -7.8328 -7.8328 -7.6642 -7.6642 -7.6525 -7.6525 -7.5789 -7.5789 -7.5383 -7.5383 -4.1388 -4.1388 -3.8646 -3.8646 -2.3373 -2.3373 -2.2405 -2.2405 -2.1586 -2.1586 -1.9538 -1.9538 -1.5156 -1.5156 -1.4827 -1.4827 -1.3419 -1.3419 -1.3257 -1.3257 -1.1935 -1.1935 -0.9374 -0.9374 3.2174 3.2174 4.4357 4.4357 4.7673 4.7673 5.6375 5.6375 6.6526 6.6526 6.8931 6.8931 7.7283 7.7283 8.7561 8.7561 8.9645 8.9645 9.1428 9.1428 9.8666 9.8666 k = 0.0000 0.0857 0.2882 ( 4888 PWs) bands (ev): -24.1939 -24.1939 -24.1648 -24.1648 -7.9212 -7.9212 -7.8343 -7.8343 -7.6637 -7.6637 -7.6532 -7.6532 -7.5784 -7.5784 -7.5393 -7.5393 -4.1322 -4.1322 -3.8615 -3.8615 -2.3344 -2.3344 -2.2377 -2.2377 -2.1582 -2.1582 -1.9506 -1.9506 -1.5254 -1.5254 -1.4834 -1.4834 -1.3365 -1.3365 -1.3266 -1.3266 -1.1880 -1.1880 -0.9410 -0.9410 3.2126 3.2126 4.3322 4.3322 4.7834 4.7834 5.6698 5.6698 6.5885 6.5885 6.8777 6.8777 7.8000 7.8000 8.7769 8.7769 9.0116 9.0116 9.2257 9.2257 9.8113 9.8113 k = 0.0000 0.1000 0.2882 ( 4892 PWs) bands (ev): -24.1937 -24.1937 -24.1650 -24.1650 -7.9215 -7.9215 -7.8359 -7.8359 -7.6632 -7.6632 -7.6540 -7.6540 -7.5778 -7.5778 -7.5404 -7.5404 -4.1245 -4.1245 -3.8580 -3.8580 -2.3310 -2.3310 -2.2345 -2.2345 -2.1578 -2.1578 -1.9468 -1.9468 -1.5350 -1.5350 -1.4841 -1.4841 -1.3326 -1.3326 -1.3277 -1.3277 -1.1816 -1.1816 -0.9447 -0.9447 3.2066 3.2066 4.2222 4.2222 4.8023 4.8023 5.7017 5.7017 6.5176 6.5176 6.8632 6.8632 7.8735 7.8735 8.7941 8.7941 9.0709 9.0709 9.3213 9.3213 9.7517 9.7517 k = 0.0000 0.1143 0.2882 ( 4884 PWs) bands (ev): -24.1934 -24.1934 -24.1651 -24.1651 -7.9218 -7.9218 -7.8378 -7.8378 -7.6626 -7.6626 -7.6548 -7.6548 -7.5772 -7.5772 -7.5416 -7.5416 -4.1158 -4.1158 -3.8540 -3.8540 -2.3271 -2.3271 -2.2307 -2.2307 -2.1573 -2.1573 -1.9425 -1.9425 -1.5442 -1.5442 -1.4849 -1.4849 -1.3306 -1.3306 -1.3286 -1.3286 -1.1747 -1.1747 -0.9481 -0.9481 3.1994 3.1994 4.1080 4.1080 4.8238 4.8238 5.7331 5.7331 6.4428 6.4428 6.8490 6.8490 7.9448 7.9448 8.8086 8.8086 9.1426 9.1426 9.4262 9.4262 9.6910 9.6910 k = 0.0000 0.1286 0.2882 ( 4884 PWs) bands (ev): -24.1930 -24.1930 -24.1653 -24.1653 -7.9221 -7.9221 -7.8399 -7.8399 -7.6621 -7.6621 -7.6555 -7.6555 -7.5765 -7.5765 -7.5429 -7.5429 -4.1061 -4.1061 -3.8495 -3.8495 -2.3225 -2.3225 -2.2265 -2.2265 -2.1568 -2.1568 -1.9378 -1.9378 -1.5527 -1.5527 -1.4857 -1.4857 -1.3312 -1.3312 -1.3286 -1.3286 -1.1680 -1.1680 -0.9508 -0.9508 3.1906 3.1906 3.9913 3.9913 4.8480 4.8480 5.7637 5.7637 6.3662 6.3662 6.8344 6.8344 8.0106 8.0106 8.8208 8.8208 9.2241 9.2241 9.5353 9.5353 9.6371 9.6371 k = 0.0000 0.1429 0.2882 ( 4892 PWs) bands (ev): -24.1927 -24.1927 -24.1655 -24.1655 -7.9225 -7.9225 -7.8421 -7.8421 -7.6617 -7.6617 -7.6562 -7.6562 -7.5760 -7.5760 -7.5442 -7.5442 -4.0955 -4.0955 -3.8447 -3.8447 -2.3174 -2.3174 -2.2219 -2.2219 -2.1562 -2.1562 -1.9328 -1.9328 -1.5603 -1.5603 -1.4865 -1.4865 -1.3328 -1.3328 -1.3293 -1.3293 -1.1622 -1.1622 -0.9525 -0.9525 3.1801 3.1801 3.8736 3.8736 4.8746 4.8746 5.7937 5.7937 6.2899 6.2899 6.8191 6.8191 8.0681 8.0681 8.8311 8.8311 9.3031 9.3031 9.5851 9.5851 9.6658 9.6658 k = 0.0000 0.1571 0.2882 ( 4880 PWs) bands (ev): -24.1923 -24.1923 -24.1657 -24.1657 -7.9229 -7.9229 -7.8446 -7.8446 -7.6615 -7.6615 -7.6565 -7.6565 -7.5754 -7.5754 -7.5456 -7.5456 -4.0840 -4.0840 -3.8396 -3.8396 -2.3117 -2.3117 -2.2168 -2.2168 -2.1554 -2.1554 -1.9273 -1.9273 -1.5670 -1.5670 -1.4874 -1.4874 -1.3347 -1.3347 -1.3309 -1.3309 -1.1580 -1.1580 -0.9526 -0.9526 3.1677 3.1677 3.7560 3.7560 4.9037 4.9037 5.8228 5.8228 6.2155 6.2155 6.8029 6.8029 8.1156 8.1156 8.8397 8.8397 9.3434 9.3434 9.6067 9.6067 9.7811 9.7811 k = 0.0000 0.1714 0.2882 ( 4884 PWs) bands (ev): -24.1919 -24.1919 -24.1660 -24.1660 -7.9234 -7.9234 -7.8472 -7.8472 -7.6617 -7.6617 -7.6565 -7.6565 -7.5750 -7.5750 -7.5470 -7.5470 -4.0717 -4.0717 -3.8343 -3.8343 -2.3055 -2.3055 -2.2113 -2.2113 -2.1547 -2.1547 -1.9218 -1.9218 -1.5726 -1.5726 -1.4883 -1.4883 -1.3373 -1.3373 -1.3332 -1.3332 -1.1561 -1.1561 -0.9508 -0.9508 3.1532 3.1532 3.6396 3.6396 4.9350 4.9350 5.8509 5.8509 6.1443 6.1443 6.7855 6.7855 8.1525 8.1525 8.8464 8.8464 9.3246 9.3246 9.7018 9.7018 9.9002 9.9002 k = 0.0000 0.1857 0.2882 ( 4884 PWs) bands (ev): -24.1914 -24.1914 -24.1662 -24.1662 -7.9238 -7.9238 -7.8500 -7.8500 -7.6622 -7.6622 -7.6561 -7.6561 -7.5746 -7.5746 -7.5483 -7.5483 -4.0587 -4.0587 -3.8287 -3.8287 -2.2986 -2.2986 -2.2055 -2.2055 -2.1538 -2.1538 -1.9160 -1.9160 -1.5770 -1.5770 -1.4891 -1.4891 -1.3408 -1.3408 -1.3354 -1.3354 -1.1569 -1.1569 -0.9472 -0.9472 3.1365 3.1365 3.5251 3.5251 4.9685 4.9685 5.8770 5.8770 6.0783 6.0783 6.7670 6.7670 8.1784 8.1784 8.8512 8.8512 9.2805 9.2805 9.8399 9.8399 10.0174 10.0174 k = 0.0000 0.2000 0.2882 ( 4876 PWs) bands (ev): -24.1909 -24.1909 -24.1665 -24.1665 -7.9243 -7.9243 -7.8528 -7.8528 -7.6629 -7.6629 -7.6556 -7.6556 -7.5743 -7.5743 -7.5496 -7.5496 -4.0451 -4.0451 -3.8229 -3.8229 -2.2910 -2.2910 -2.1993 -2.1993 -2.1528 -2.1528 -1.9102 -1.9102 -1.5802 -1.5802 -1.4899 -1.4899 -1.3453 -1.3453 -1.3374 -1.3374 -1.1604 -1.1604 -0.9417 -0.9417 3.1172 3.1172 3.4136 3.4136 5.0040 5.0040 5.8981 5.8981 6.0213 6.0213 6.7472 6.7472 8.1934 8.1934 8.8536 8.8536 9.2327 9.2327 9.9995 9.9995 10.1287 10.1287 k = 0.0000 0.2143 0.2882 ( 4876 PWs) bands (ev): -24.1904 -24.1904 -24.1668 -24.1668 -7.9248 -7.9248 -7.8558 -7.8558 -7.6636 -7.6636 -7.6549 -7.6549 -7.5742 -7.5742 -7.5508 -7.5508 -4.0310 -4.0310 -3.8171 -3.8171 -2.2830 -2.2830 -2.1928 -2.1928 -2.1517 -2.1517 -1.9045 -1.9045 -1.5822 -1.5822 -1.4906 -1.4906 -1.3505 -1.3505 -1.3392 -1.3392 -1.1665 -1.1665 -0.9349 -0.9349 3.0950 3.0950 3.3057 3.3057 5.0415 5.0415 5.9008 5.9008 5.9869 5.9869 6.7261 6.7261 8.1979 8.1979 8.8534 8.8534 9.1889 9.1889 10.1719 10.1719 10.2289 10.2289 k = 0.0000 0.2286 0.2882 ( 4868 PWs) bands (ev): -24.1899 -24.1899 -24.1671 -24.1671 -7.9252 -7.9252 -7.8589 -7.8589 -7.6643 -7.6643 -7.6542 -7.6542 -7.5742 -7.5742 -7.5519 -7.5519 -4.0165 -4.0165 -3.8112 -3.8112 -2.2743 -2.2743 -2.1861 -2.1861 -2.1506 -2.1506 -1.8990 -1.8990 -1.5827 -1.5827 -1.4912 -1.4912 -1.3563 -1.3563 -1.3406 -1.3406 -1.1749 -1.1749 -0.9272 -0.9272 3.0694 3.0694 3.2027 3.2027 5.0806 5.0806 5.8712 5.8712 5.9897 5.9897 6.7036 6.7036 8.1924 8.1924 8.8502 8.8502 9.1521 9.1521 10.3036 10.3036 10.3593 10.3593 k = 0.0000 0.2429 0.2882 ( 4874 PWs) bands (ev): -24.1893 -24.1893 -24.1675 -24.1675 -7.9257 -7.9257 -7.8621 -7.8621 -7.6650 -7.6650 -7.6535 -7.6535 -7.5742 -7.5742 -7.5529 -7.5529 -4.0016 -4.0016 -3.8054 -3.8054 -2.2650 -2.2650 -2.1793 -2.1793 -2.1493 -2.1493 -1.8938 -1.8938 -1.5820 -1.5820 -1.4917 -1.4917 -1.3625 -1.3625 -1.3418 -1.3418 -1.1852 -1.1852 -0.9194 -0.9194 3.0376 3.0376 3.1076 3.1076 5.1214 5.1214 5.8303 5.8303 6.0084 6.0084 6.6798 6.6798 8.1779 8.1779 8.8436 8.8436 9.1240 9.1240 10.3529 10.3529 10.5484 10.5484 k = 0.0000 0.2571 0.2882 ( 4882 PWs) bands (ev): -24.1888 -24.1888 -24.1679 -24.1679 -7.9262 -7.9262 -7.8654 -7.8654 -7.6657 -7.6657 -7.6529 -7.6529 -7.5744 -7.5744 -7.5538 -7.5538 -3.9865 -3.9865 -3.7997 -3.7997 -2.2553 -2.2553 -2.1722 -2.1722 -2.1479 -2.1479 -1.8891 -1.8891 -1.5799 -1.5799 -1.4921 -1.4921 -1.3689 -1.3689 -1.3426 -1.3426 -1.1970 -1.1970 -0.9119 -0.9119 2.9849 2.9849 3.0359 3.0359 5.1636 5.1636 5.7913 5.7913 6.0300 6.0300 6.6547 6.6547 8.1560 8.1560 8.8332 8.8332 9.1049 9.1049 10.3650 10.3650 10.7431 10.7431 k = 0.0000 0.2714 0.2882 ( 4870 PWs) bands (ev): -24.1881 -24.1881 -24.1683 -24.1683 -7.9265 -7.9265 -7.8687 -7.8687 -7.6662 -7.6662 -7.6523 -7.6523 -7.5746 -7.5746 -7.5546 -7.5546 -3.9712 -3.9712 -3.7942 -3.7942 -2.2450 -2.2450 -2.1651 -2.1651 -2.1463 -2.1463 -1.8850 -1.8850 -1.5764 -1.5764 -1.4922 -1.4922 -1.3754 -1.3754 -1.3428 -1.3428 -1.2100 -1.2100 -0.9053 -0.9053 2.9055 2.9055 2.9938 2.9938 5.2071 5.2071 5.7573 5.7573 6.0511 6.0511 6.6282 6.6282 8.1284 8.1284 8.8189 8.8189 9.0945 9.0945 10.3459 10.3459 10.9373 10.9373 k = 0.0000 0.2857 0.2882 ( 4868 PWs) bands (ev): -24.1875 -24.1875 -24.1687 -24.1687 -7.9269 -7.9269 -7.8720 -7.8720 -7.6667 -7.6667 -7.6519 -7.6519 -7.5749 -7.5749 -7.5553 -7.5553 -3.9559 -3.9559 -3.7889 -3.7889 -2.2344 -2.2344 -2.1579 -2.1579 -2.1445 -2.1445 -1.8817 -1.8817 -1.5716 -1.5716 -1.4922 -1.4922 -1.3819 -1.3819 -1.3422 -1.3422 -1.2238 -1.2238 -0.9001 -0.9001 2.8243 2.8243 2.9570 2.9570 5.2516 5.2516 5.7293 5.7293 6.0703 6.0703 6.6004 6.6004 8.0973 8.0973 8.8002 8.8002 9.0920 9.0920 10.3063 10.3063 11.1008 11.1008 k = 0.0000 0.3000 0.2882 ( 4880 PWs) bands (ev): -24.1869 -24.1869 -24.1691 -24.1691 -7.9271 -7.9271 -7.8754 -7.8754 -7.6670 -7.6670 -7.6516 -7.6516 -7.5751 -7.5751 -7.5560 -7.5560 -3.9407 -3.9407 -3.7840 -3.7840 -2.2235 -2.2235 -2.1510 -2.1510 -2.1423 -2.1423 -1.8794 -1.8794 -1.5657 -1.5657 -1.4919 -1.4919 -1.3883 -1.3883 -1.3406 -1.3406 -1.2383 -1.2383 -0.8967 -0.8967 2.7478 2.7478 2.9196 2.9196 5.2970 5.2970 5.7077 5.7077 6.0869 6.0869 6.5713 6.5713 8.0648 8.0648 8.7771 8.7771 9.0964 9.0964 10.2554 10.2554 11.1385 11.1385 k = 0.0000 0.3143 0.2882 ( 4880 PWs) bands (ev): -24.1862 -24.1862 -24.1696 -24.1696 -7.9273 -7.9273 -7.8788 -7.8788 -7.6672 -7.6672 -7.6514 -7.6514 -7.5753 -7.5753 -7.5567 -7.5567 -3.9257 -3.9257 -3.7794 -3.7794 -2.2124 -2.2124 -2.1452 -2.1452 -2.1385 -2.1385 -1.8781 -1.8781 -1.5588 -1.5588 -1.4913 -1.4913 -1.3945 -1.3945 -1.3378 -1.3378 -1.2532 -1.2532 -0.8954 -0.8954 2.6775 2.6775 2.8807 2.8807 5.3430 5.3430 5.6925 5.6925 6.1001 6.1001 6.5410 6.5410 8.0332 8.0332 8.7495 8.7495 9.1067 9.1067 10.1988 10.1988 11.1338 11.1338 k = 0.0000 0.3286 0.2882 ( 4876 PWs) bands (ev): -24.1856 -24.1856 -24.1701 -24.1701 -7.9274 -7.9274 -7.8822 -7.8822 -7.6673 -7.6673 -7.6513 -7.6513 -7.5753 -7.5753 -7.5574 -7.5574 -3.9109 -3.9109 -3.7753 -3.7753 -2.2013 -2.2013 -2.1417 -2.1417 -2.1321 -2.1321 -1.8781 -1.8781 -1.5511 -1.5511 -1.4904 -1.4904 -1.4005 -1.4005 -1.3334 -1.3334 -1.2684 -1.2684 -0.8965 -0.8965 2.6138 2.6138 2.8405 2.8405 5.3894 5.3894 5.6838 5.6838 6.1093 6.1093 6.5093 6.5093 8.0042 8.0042 8.7174 8.7174 9.1220 9.1220 10.1398 10.1398 11.1270 11.1270 k = 0.0000 0.3429 0.2882 ( 4886 PWs) bands (ev): -24.1849 -24.1849 -24.1706 -24.1706 -7.9274 -7.9274 -7.8855 -7.8855 -7.6673 -7.6673 -7.6514 -7.6514 -7.5753 -7.5753 -7.5580 -7.5580 -3.8965 -3.8965 -3.7717 -3.7717 -2.1907 -2.1907 -2.1394 -2.1394 -2.1239 -2.1239 -1.8794 -1.8794 -1.5429 -1.5429 -1.4891 -1.4891 -1.4062 -1.4062 -1.3270 -1.3270 -1.2838 -1.2838 -0.9002 -0.9002 2.5571 2.5571 2.7993 2.7993 5.4358 5.4358 5.6816 5.6816 6.1140 6.1140 6.4765 6.4765 7.9795 7.9795 8.6811 8.6811 9.1415 9.1415 10.0804 10.0804 11.1226 11.1226 k = 0.0000 0.3571 0.2882 ( 4888 PWs) bands (ev): -24.1842 -24.1842 -24.1711 -24.1711 -7.9272 -7.9272 -7.8889 -7.8889 -7.6671 -7.6671 -7.6517 -7.6517 -7.5752 -7.5752 -7.5587 -7.5587 -3.8825 -3.8825 -3.7687 -3.7687 -2.1806 -2.1806 -2.1374 -2.1374 -2.1148 -2.1148 -1.8820 -1.8820 -1.5345 -1.5345 -1.4874 -1.4874 -1.4118 -1.4118 -1.3184 -1.3184 -1.2991 -1.2991 -0.9067 -0.9067 2.5078 2.5078 2.7572 2.7572 5.4818 5.4818 5.6858 5.6858 6.1139 6.1139 6.4424 6.4424 7.9604 7.9604 8.6409 8.6409 9.1645 9.1645 10.0215 10.0215 11.1216 11.1216 k = 0.0000 0.3714 0.2882 ( 4884 PWs) bands (ev): -24.1835 -24.1835 -24.1717 -24.1717 -7.9269 -7.9269 -7.8921 -7.8921 -7.6668 -7.6668 -7.6521 -7.6521 -7.5749 -7.5749 -7.5595 -7.5595 -3.8691 -3.8691 -3.7664 -3.7664 -2.1713 -2.1713 -2.1355 -2.1355 -2.1047 -2.1047 -1.8861 -1.8861 -1.5260 -1.5260 -1.4852 -1.4852 -1.4171 -1.4171 -1.3143 -1.3143 -1.3071 -1.3071 -0.9160 -0.9160 2.4658 2.4658 2.7149 2.7149 5.5269 5.5269 5.6966 5.6966 6.1086 6.1086 6.4070 6.4070 7.9478 7.9478 8.5971 8.5971 9.1906 9.1906 9.9638 9.9638 11.1242 11.1242 k = 0.0000 0.3857 0.2882 ( 4886 PWs) bands (ev): -24.1828 -24.1828 -24.1722 -24.1722 -7.9265 -7.9265 -7.8953 -7.8953 -7.6664 -7.6664 -7.6526 -7.6526 -7.5745 -7.5745 -7.5602 -7.5602 -3.8562 -3.8562 -3.7647 -3.7647 -2.1630 -2.1630 -2.1338 -2.1338 -2.0935 -2.0935 -1.8917 -1.8917 -1.5177 -1.5177 -1.4826 -1.4826 -1.4222 -1.4222 -1.3293 -1.3293 -1.2932 -1.2932 -0.9283 -0.9283 2.4312 2.4312 2.6728 2.6728 5.5704 5.5704 5.7139 5.7139 6.0983 6.0983 6.3705 6.3705 7.9424 7.9424 8.5502 8.5502 9.2192 9.2192 9.9076 9.9076 11.1307 11.1307 k = 0.0000 0.4000 0.2882 ( 4886 PWs) bands (ev): -24.1821 -24.1821 -24.1728 -24.1728 -7.9258 -7.9258 -7.8984 -7.8984 -7.6659 -7.6659 -7.6533 -7.6533 -7.5740 -7.5740 -7.5611 -7.5611 -3.8440 -3.8440 -3.7639 -3.7639 -2.1559 -2.1559 -2.1322 -2.1322 -2.0812 -2.0812 -1.8987 -1.8987 -1.5096 -1.5096 -1.4795 -1.4795 -1.4271 -1.4271 -1.3441 -1.3441 -1.2766 -1.2766 -0.9432 -0.9432 2.4041 2.4041 2.6313 2.6313 5.6117 5.6117 5.7378 5.7378 6.0831 6.0831 6.3327 6.3327 7.9444 7.9444 8.5009 8.5009 9.2501 9.2501 9.8531 9.8531 11.1411 11.1411 k = 0.0000 0.4143 0.2882 ( 4890 PWs) bands (ev): -24.1814 -24.1814 -24.1734 -24.1734 -7.9250 -7.9250 -7.9014 -7.9014 -7.6653 -7.6653 -7.6540 -7.6540 -7.5734 -7.5734 -7.5619 -7.5619 -3.8326 -3.8326 -3.7637 -3.7637 -2.1500 -2.1500 -2.1309 -2.1309 -2.0680 -2.0680 -1.9071 -1.9071 -1.5017 -1.5017 -1.4759 -1.4759 -1.4319 -1.4319 -1.3584 -1.3584 -1.2573 -1.2573 -0.9608 -0.9608 2.3842 2.3842 2.5910 2.5910 5.6506 5.6506 5.7677 5.7677 6.0637 6.0637 6.2937 6.2937 7.9539 7.9539 8.4497 8.4497 9.2831 9.2831 9.8002 9.8002 11.1555 11.1555 k = 0.0000 0.4286 0.2882 ( 4898 PWs) bands (ev): -24.1807 -24.1807 -24.1740 -24.1740 -7.9241 -7.9241 -7.9043 -7.9043 -7.6646 -7.6646 -7.6549 -7.6549 -7.5726 -7.5726 -7.5629 -7.5629 -3.8219 -3.8219 -3.7645 -3.7645 -2.1450 -2.1450 -2.1299 -2.1299 -2.0541 -2.0541 -1.9168 -1.9168 -1.4942 -1.4942 -1.4718 -1.4718 -1.4365 -1.4365 -1.3724 -1.3724 -1.2358 -1.2358 -0.9808 -0.9808 2.3714 2.3714 2.5524 2.5524 5.6875 5.6875 5.8024 5.8024 6.0409 6.0409 6.2535 6.2535 7.9707 7.9707 8.3974 8.3974 9.3179 9.3179 9.7489 9.7489 11.1739 11.1739 k = 0.0000 0.4429 0.2882 ( 4902 PWs) bands (ev): -24.1800 -24.1800 -24.1746 -24.1746 -7.9229 -7.9229 -7.9070 -7.9070 -7.6638 -7.6638 -7.6558 -7.6558 -7.5718 -7.5718 -7.5638 -7.5638 -3.8121 -3.8121 -3.7661 -3.7661 -2.1409 -2.1409 -2.1293 -2.1293 -2.0396 -2.0396 -1.9276 -1.9276 -1.4870 -1.4870 -1.4672 -1.4672 -1.4408 -1.4408 -1.3858 -1.3858 -1.2122 -1.2122 -1.0030 -1.0030 2.3655 2.3655 2.5160 2.5160 5.7230 5.7230 5.8395 5.8395 6.0163 6.0163 6.2122 6.2122 7.9943 7.9943 8.3446 8.3446 9.3544 9.3544 9.6993 9.6993 11.1963 11.1963 k = 0.0000 0.4571 0.2882 ( 4914 PWs) bands (ev): -24.1793 -24.1793 -24.1753 -24.1753 -7.9216 -7.9216 -7.9096 -7.9096 -7.6629 -7.6629 -7.6568 -7.6568 -7.5709 -7.5709 -7.5648 -7.5648 -3.8031 -3.8031 -3.7686 -3.7686 -2.1376 -2.1376 -2.1291 -2.1291 -2.0248 -2.0248 -1.9396 -1.9396 -1.4803 -1.4803 -1.4623 -1.4623 -1.4444 -1.4444 -1.3986 -1.3986 -1.1870 -1.1870 -1.0270 -1.0270 2.3660 2.3660 2.4822 2.4822 5.7578 5.7578 5.8746 5.8746 5.9935 5.9935 6.1700 6.1700 8.0240 8.0240 8.2921 8.2921 9.3925 9.3925 9.6511 9.6511 11.2226 11.2226 k = 0.0000 0.4714 0.2882 ( 4906 PWs) bands (ev): -24.1786 -24.1786 -24.1759 -24.1759 -7.9201 -7.9201 -7.9121 -7.9121 -7.6620 -7.6620 -7.6579 -7.6579 -7.5699 -7.5699 -7.5658 -7.5658 -3.7950 -3.7950 -3.7720 -3.7720 -2.1348 -2.1348 -2.1292 -2.1292 -2.0098 -2.0098 -1.9524 -1.9524 -1.4741 -1.4741 -1.4588 -1.4588 -1.4453 -1.4453 -1.4106 -1.4106 -1.1606 -1.1606 -1.0525 -1.0525 2.3727 2.3727 2.4518 2.4518 5.7923 5.7923 5.8952 5.8952 5.9846 5.9846 6.1272 6.1272 8.0593 8.0593 8.2406 8.2406 9.4321 9.4321 9.6045 9.6045 11.2529 11.2529 k = 0.0000 0.4857 0.2882 ( 4908 PWs) bands (ev): -24.1779 -24.1779 -24.1766 -24.1766 -7.9183 -7.9183 -7.9143 -7.9143 -7.6610 -7.6610 -7.6589 -7.6589 -7.5689 -7.5689 -7.5669 -7.5669 -3.7879 -3.7879 -3.7764 -3.7764 -2.1326 -2.1326 -2.1299 -2.1299 -1.9949 -1.9949 -1.9660 -1.9660 -1.4687 -1.4687 -1.4600 -1.4600 -1.4405 -1.4405 -1.4219 -1.4219 -1.1335 -1.1335 -1.0790 -1.0790 2.3851 2.3851 2.4251 2.4251 5.8262 5.8262 5.8854 5.8854 6.0053 6.0053 6.0843 6.0843 8.0994 8.0994 8.1908 8.1908 9.4731 9.4731 9.5593 9.5593 11.2871 11.2871 k = 0.0000 0.5000 0.2882 ( 4896 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9164 -7.9164 -7.9164 -7.9164 -7.6599 -7.6599 -7.6599 -7.6599 -7.5679 -7.5679 -7.5679 -7.5679 -3.7816 -3.7816 -3.7816 -3.7816 -2.1310 -2.1310 -2.1310 -2.1310 -1.9802 -1.9802 -1.9802 -1.9802 -1.4638 -1.4638 -1.4638 -1.4638 -1.4320 -1.4320 -1.4320 -1.4320 -1.1062 -1.1062 -1.1062 -1.1062 2.4027 2.4027 2.4027 2.4027 5.8584 5.8584 5.8584 5.8584 6.0425 6.0425 6.0425 6.0425 8.1434 8.1434 8.1434 8.1434 9.5155 9.5155 9.5155 9.5155 11.3250 11.3250 k = 0.0000 0.5000 0.2882 ( 4896 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9164 -7.9164 -7.9164 -7.9164 -7.6599 -7.6599 -7.6599 -7.6599 -7.5679 -7.5679 -7.5679 -7.5679 -3.7816 -3.7816 -3.7816 -3.7816 -2.1310 -2.1310 -2.1310 -2.1310 -1.9802 -1.9802 -1.9802 -1.9802 -1.4638 -1.4638 -1.4638 -1.4638 -1.4320 -1.4320 -1.4320 -1.4320 -1.1062 -1.1062 -1.1062 -1.1062 2.4027 2.4027 2.4027 2.4027 5.8584 5.8584 5.8584 5.8584 6.0425 6.0425 6.0425 6.0425 8.1434 8.1434 8.1434 8.1434 9.5155 9.5155 9.5155 9.5155 11.3250 11.3250 k = 0.0143 0.5000 0.2882 ( 4912 PWs) bands (ev): -24.1773 -24.1773 -24.1773 -24.1773 -7.9169 -7.9169 -7.9159 -7.9159 -7.6624 -7.6624 -7.6575 -7.6575 -7.5700 -7.5700 -7.5660 -7.5660 -3.7825 -3.7825 -3.7804 -3.7804 -2.1354 -2.1354 -2.1273 -2.1273 -1.9811 -1.9811 -1.9786 -1.9786 -1.4691 -1.4691 -1.4601 -1.4601 -1.4312 -1.4312 -1.4312 -1.4312 -1.1067 -1.1067 -1.1050 -1.1050 2.4025 2.4025 2.4044 2.4044 5.8520 5.8520 5.8587 5.8587 6.0302 6.0302 6.0401 6.0401 8.1508 8.1508 8.1521 8.1521 9.5187 9.5187 9.5210 9.5210 11.3156 11.3159 k = 0.0286 0.5000 0.2882 ( 4912 PWs) bands (ev): -24.1773 -24.1773 -24.1773 -24.1773 -7.9173 -7.9173 -7.9154 -7.9154 -7.6649 -7.6649 -7.6551 -7.6551 -7.5721 -7.5721 -7.5642 -7.5642 -3.7831 -3.7831 -3.7789 -3.7789 -2.1403 -2.1403 -2.1245 -2.1245 -1.9813 -1.9813 -1.9761 -1.9761 -1.4751 -1.4751 -1.4583 -1.4583 -1.4292 -1.4292 -1.4281 -1.4281 -1.1066 -1.1066 -1.1033 -1.1033 2.4038 2.4038 2.4076 2.4076 5.8386 5.8386 5.8525 5.8525 6.0040 6.0040 6.0244 6.0244 8.1734 8.1734 8.1763 8.1763 9.5307 9.5307 9.5353 9.5353 11.2949 11.2950 k = 0.0429 0.5000 0.2882 ( 4908 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9177 -7.9177 -7.9148 -7.9148 -7.6674 -7.6674 -7.6527 -7.6527 -7.5744 -7.5744 -7.5626 -7.5626 -3.7834 -3.7834 -3.7772 -3.7772 -2.1457 -2.1457 -2.1226 -2.1226 -1.9809 -1.9809 -1.9726 -1.9726 -1.4814 -1.4814 -1.4582 -1.4582 -1.4265 -1.4265 -1.4231 -1.4231 -1.1059 -1.1059 -1.1011 -1.1011 2.4065 2.4065 2.4123 2.4123 5.8161 5.8161 5.8378 5.8378 5.9677 5.9677 5.9986 5.9986 8.2097 8.2097 8.2143 8.2143 9.5515 9.5515 9.5581 9.5581 11.2639 11.2639 k = 0.0571 0.5000 0.2882 ( 4908 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9181 -7.9181 -7.9141 -7.9141 -7.6699 -7.6699 -7.6503 -7.6503 -7.5769 -7.5769 -7.5611 -7.5611 -3.7833 -3.7833 -3.7751 -3.7751 -2.1513 -2.1513 -2.1217 -2.1217 -1.9802 -1.9802 -1.9681 -1.9681 -1.4879 -1.4879 -1.4591 -1.4591 -1.4233 -1.4233 -1.4168 -1.4168 -1.1045 -1.1045 -1.0983 -1.0983 2.4107 2.4107 2.4185 2.4185 5.7820 5.7820 5.8099 5.8099 5.9282 5.9282 5.9677 5.9677 8.2571 8.2571 8.2637 8.2637 9.5812 9.5812 9.5894 9.5894 11.2242 11.2242 k = 0.0714 0.5000 0.2882 ( 4904 PWs) bands (ev): -24.1771 -24.1771 -24.1771 -24.1771 -7.9183 -7.9183 -7.9135 -7.9135 -7.6723 -7.6723 -7.6480 -7.6480 -7.5794 -7.5794 -7.5598 -7.5598 -3.7829 -3.7829 -3.7728 -3.7728 -2.1571 -2.1571 -2.1219 -2.1219 -1.9790 -1.9790 -1.9625 -1.9625 -1.4944 -1.4944 -1.4607 -1.4607 -1.4197 -1.4197 -1.4098 -1.4098 -1.1026 -1.1026 -1.0950 -1.0950 2.4163 2.4163 2.4260 2.4260 5.7339 5.7339 5.7628 5.7628 5.8941 5.8941 5.9364 5.9364 8.3131 8.3131 8.3220 8.3220 9.6194 9.6194 9.6288 9.6288 11.1776 11.1776 k = 0.0857 0.5000 0.2882 ( 4904 PWs) bands (ev): -24.1771 -24.1771 -24.1771 -24.1771 -7.9186 -7.9186 -7.9128 -7.9128 -7.6748 -7.6748 -7.6458 -7.6458 -7.5821 -7.5821 -7.5587 -7.5587 -3.7822 -3.7822 -3.7702 -3.7702 -2.1629 -2.1629 -2.1231 -2.1231 -1.9775 -1.9775 -1.9559 -1.9559 -1.5007 -1.5007 -1.4626 -1.4626 -1.4158 -1.4158 -1.4023 -1.4023 -1.1000 -1.1000 -1.0913 -1.0913 2.4231 2.4231 2.4348 2.4348 5.6721 5.6721 5.6974 5.6974 5.8669 5.8669 5.9068 5.9068 8.3749 8.3749 8.3863 8.3863 9.6658 9.6658 9.6757 9.6757 11.1259 11.1259 k = 0.1000 0.5000 0.2882 ( 4912 PWs) bands (ev): -24.1771 -24.1771 -24.1771 -24.1771 -7.9188 -7.9188 -7.9122 -7.9122 -7.6771 -7.6771 -7.6436 -7.6436 -7.5848 -7.5848 -7.5577 -7.5577 -3.7813 -3.7813 -3.7675 -3.7675 -2.1688 -2.1688 -2.1253 -2.1253 -1.9758 -1.9758 -1.9485 -1.9485 -1.5069 -1.5069 -1.4647 -1.4647 -1.4116 -1.4116 -1.3946 -1.3946 -1.0969 -1.0969 -1.0871 -1.0871 2.4312 2.4312 2.4449 2.4449 5.5991 5.5991 5.6197 5.6197 5.8429 5.8429 5.8790 5.8790 8.4405 8.4405 8.4543 8.4543 9.7198 9.7198 9.7293 9.7293 11.0708 11.0708 k = 0.1143 0.5000 0.2882 ( 4900 PWs) bands (ev): -24.1770 -24.1770 -24.1770 -24.1770 -7.9190 -7.9190 -7.9115 -7.9115 -7.6794 -7.6794 -7.6414 -7.6414 -7.5876 -7.5876 -7.5569 -7.5569 -3.7800 -3.7800 -3.7646 -3.7646 -2.1745 -2.1745 -2.1282 -2.1282 -1.9737 -1.9737 -1.9401 -1.9401 -1.5129 -1.5129 -1.4668 -1.4668 -1.4071 -1.4071 -1.3867 -1.3867 -1.0932 -1.0932 -1.0827 -1.0827 2.4404 2.4404 2.4561 2.4561 5.5180 5.5180 5.5348 5.5348 5.8190 5.8190 5.8517 5.8517 8.5079 8.5079 8.5240 8.5240 9.7802 9.7802 9.7883 9.7883 11.0139 11.0139 k = 0.1286 0.5000 0.2882 ( 4904 PWs) bands (ev): -24.1769 -24.1769 -24.1769 -24.1769 -7.9191 -7.9191 -7.9109 -7.9109 -7.6816 -7.6816 -7.6393 -7.6393 -7.5905 -7.5905 -7.5562 -7.5562 -3.7785 -3.7785 -3.7615 -3.7615 -2.1802 -2.1802 -2.1320 -2.1320 -1.9714 -1.9714 -1.9311 -1.9311 -1.5186 -1.5186 -1.4690 -1.4690 -1.4024 -1.4024 -1.3787 -1.3787 -1.0890 -1.0890 -1.0779 -1.0779 2.4505 2.4505 2.4683 2.4683 5.4318 5.4318 5.4458 5.4458 5.7940 5.7940 5.8238 5.8238 8.5758 8.5758 8.5940 8.5940 9.8453 9.8453 9.8510 9.8510 10.9564 10.9565 k = 0.1429 0.5000 0.2882 ( 4904 PWs) bands (ev): -24.1768 -24.1768 -24.1768 -24.1768 -7.9192 -7.9192 -7.9103 -7.9103 -7.6837 -7.6837 -7.6372 -7.6372 -7.5934 -7.5934 -7.5558 -7.5558 -3.7767 -3.7767 -3.7583 -3.7583 -2.1858 -2.1858 -2.1364 -2.1364 -1.9688 -1.9688 -1.9215 -1.9215 -1.5241 -1.5241 -1.4712 -1.4712 -1.3974 -1.3974 -1.3707 -1.3707 -1.0843 -1.0843 -1.0728 -1.0728 2.4615 2.4615 2.4813 2.4813 5.3425 5.3425 5.3549 5.3549 5.7670 5.7670 5.7947 5.7947 8.6433 8.6433 8.6634 8.6634 9.9129 9.9129 9.9152 9.9152 10.8997 10.8997 k = 0.1571 0.5000 0.2882 ( 4872 PWs) bands (ev): -24.1767 -24.1767 -24.1767 -24.1767 -7.9193 -7.9193 -7.9097 -7.9097 -7.6856 -7.6856 -7.6352 -7.6352 -7.5964 -7.5964 -7.5554 -7.5554 -3.7747 -3.7747 -3.7550 -3.7550 -2.1911 -2.1911 -2.1412 -2.1412 -1.9658 -1.9658 -1.9114 -1.9114 -1.5293 -1.5293 -1.4734 -1.4734 -1.3921 -1.3921 -1.3627 -1.3627 -1.0791 -1.0791 -1.0675 -1.0675 2.4731 2.4731 2.4950 2.4950 5.2521 5.2521 5.2637 5.2637 5.7379 5.7379 5.7640 5.7640 8.7100 8.7100 8.7316 8.7316 9.9783 9.9783 9.9804 9.9804 10.8447 10.8447 k = 0.1714 0.5000 0.2882 ( 4864 PWs) bands (ev): -24.1766 -24.1766 -24.1766 -24.1766 -7.9194 -7.9194 -7.9092 -7.9092 -7.6874 -7.6874 -7.6332 -7.6332 -7.5994 -7.5994 -7.5552 -7.5552 -3.7724 -3.7724 -3.7517 -3.7517 -2.1963 -2.1963 -2.1465 -2.1465 -1.9625 -1.9625 -1.9009 -1.9009 -1.5342 -1.5342 -1.4756 -1.4756 -1.3867 -1.3867 -1.3548 -1.3548 -1.0736 -1.0736 -1.0620 -1.0620 2.4852 2.4852 2.5092 2.5092 5.1620 5.1620 5.1735 5.1735 5.7064 5.7064 5.7313 5.7313 8.7756 8.7756 8.7984 8.7984 10.0378 10.0378 10.0448 10.0448 10.7922 10.7922 k = 0.1857 0.5000 0.2882 ( 4888 PWs) bands (ev): -24.1765 -24.1765 -24.1765 -24.1765 -7.9194 -7.9194 -7.9087 -7.9087 -7.6890 -7.6890 -7.6313 -7.6313 -7.6025 -7.6025 -7.5552 -7.5552 -3.7700 -3.7700 -3.7483 -3.7483 -2.2013 -2.2013 -2.1522 -2.1522 -1.9588 -1.9588 -1.8903 -1.8903 -1.5389 -1.5389 -1.4778 -1.4778 -1.3810 -1.3810 -1.3471 -1.3471 -1.0678 -1.0678 -1.0565 -1.0565 2.4976 2.4976 2.5237 2.5237 5.0732 5.0732 5.0852 5.0852 5.6726 5.6726 5.6965 5.6965 8.8402 8.8402 8.8639 8.8639 10.0911 10.0911 10.1029 10.1029 10.7428 10.7428 k = 0.2000 0.5000 0.2882 ( 4892 PWs) bands (ev): -24.1765 -24.1765 -24.1765 -24.1765 -7.9195 -7.9195 -7.9083 -7.9083 -7.6905 -7.6905 -7.6294 -7.6294 -7.6056 -7.6056 -7.5554 -7.5554 -3.7675 -3.7675 -3.7449 -3.7449 -2.2062 -2.2062 -2.1582 -2.1582 -1.9547 -1.9547 -1.8795 -1.8795 -1.5433 -1.5433 -1.4801 -1.4801 -1.3752 -1.3752 -1.3394 -1.3394 -1.0618 -1.0618 -1.0508 -1.0508 2.5100 2.5100 2.5382 2.5382 4.9868 4.9868 4.9998 4.9998 5.6365 5.6365 5.6597 5.6597 8.9038 8.9038 8.9282 8.9282 10.1361 10.1361 10.1521 10.1521 10.6971 10.6971 k = 0.2143 0.5000 0.2882 ( 4888 PWs) bands (ev): -24.1763 -24.1763 -24.1763 -24.1763 -7.9195 -7.9195 -7.9080 -7.9080 -7.6917 -7.6917 -7.6275 -7.6275 -7.6087 -7.6087 -7.5557 -7.5557 -3.7648 -3.7648 -3.7416 -3.7416 -2.2108 -2.2108 -2.1643 -2.1643 -1.9501 -1.9501 -1.8686 -1.8686 -1.5474 -1.5474 -1.4823 -1.4823 -1.3691 -1.3691 -1.3319 -1.3319 -1.0554 -1.0554 -1.0450 -1.0450 2.5223 2.5223 2.5524 2.5524 4.9037 4.9037 4.9181 4.9181 5.5982 5.5982 5.6208 5.6208 8.9667 8.9667 8.9916 8.9916 10.1716 10.1716 10.1905 10.1905 10.6552 10.6552 k = 0.2286 0.5000 0.2882 ( 4900 PWs) bands (ev): -24.1763 -24.1763 -24.1763 -24.1763 -7.9196 -7.9196 -7.9078 -7.9078 -7.6928 -7.6928 -7.6257 -7.6257 -7.6117 -7.6117 -7.5561 -7.5561 -3.7619 -3.7619 -3.7384 -3.7384 -2.2154 -2.2154 -2.1705 -2.1705 -1.9450 -1.9450 -1.8578 -1.8578 -1.5511 -1.5511 -1.4846 -1.4846 -1.3628 -1.3628 -1.3246 -1.3246 -1.0490 -1.0490 -1.0393 -1.0393 2.5341 2.5341 2.5662 2.5662 4.8247 4.8247 4.8408 4.8408 5.5576 5.5576 5.5799 5.5799 9.0289 9.0289 9.0542 9.0542 10.1976 10.1976 10.2176 10.2176 10.6168 10.6168 k = 0.2429 0.5000 0.2882 ( 4900 PWs) bands (ev): -24.1762 -24.1762 -24.1762 -24.1762 -7.9196 -7.9196 -7.9077 -7.9077 -7.6936 -7.6936 -7.6240 -7.6240 -7.6147 -7.6147 -7.5567 -7.5567 -3.7590 -3.7590 -3.7353 -3.7353 -2.2197 -2.2197 -2.1768 -2.1768 -1.9395 -1.9395 -1.8472 -1.8472 -1.5546 -1.5546 -1.4869 -1.4869 -1.3564 -1.3564 -1.3176 -1.3176 -1.0423 -1.0423 -1.0335 -1.0335 2.5453 2.5453 2.5791 2.5791 4.7505 4.7505 4.7685 4.7685 5.5150 5.5150 5.5370 5.5370 9.0905 9.0905 9.1163 9.1163 10.2147 10.2147 10.2340 10.2340 10.5815 10.5815 k = 0.2571 0.5000 0.2882 ( 4900 PWs) bands (ev): -24.1761 -24.1761 -24.1761 -24.1761 -7.9197 -7.9197 -7.9077 -7.9077 -7.6941 -7.6941 -7.6226 -7.6226 -7.6173 -7.6173 -7.5575 -7.5575 -3.7560 -3.7560 -3.7322 -3.7322 -2.2238 -2.2238 -2.1831 -2.1831 -1.9334 -1.9334 -1.8368 -1.8368 -1.5577 -1.5577 -1.4893 -1.4893 -1.3499 -1.3499 -1.3108 -1.3108 -1.0357 -1.0357 -1.0278 -1.0278 2.5555 2.5555 2.5910 2.5910 4.6818 4.6818 4.7019 4.7019 5.4706 5.4706 5.4923 5.4923 9.1517 9.1517 9.1778 9.1778 10.2248 10.2248 10.2416 10.2416 10.5485 10.5485 k = 0.2714 0.5000 0.2882 ( 4904 PWs) bands (ev): -24.1760 -24.1760 -24.1760 -24.1760 -7.9197 -7.9197 -7.9078 -7.9078 -7.6944 -7.6944 -7.6229 -7.6229 -7.6182 -7.6182 -7.5583 -7.5583 -3.7530 -3.7530 -3.7294 -3.7294 -2.2277 -2.2277 -2.1893 -2.1893 -1.9268 -1.9268 -1.8268 -1.8268 -1.5605 -1.5605 -1.4917 -1.4917 -1.3433 -1.3433 -1.3043 -1.3043 -1.0290 -1.0290 -1.0221 -1.0221 2.5646 2.5646 2.6015 2.6015 4.6190 4.6190 4.6413 4.6413 5.4243 5.4243 5.4460 5.4460 9.2123 9.2123 9.2388 9.2388 10.2296 10.2296 10.2428 10.2428 10.5169 10.5169 k = 0.2857 0.5000 0.2882 ( 4892 PWs) bands (ev): -24.1758 -24.1758 -24.1758 -24.1758 -7.9197 -7.9197 -7.9080 -7.9080 -7.6945 -7.6945 -7.6253 -7.6253 -7.6170 -7.6170 -7.5593 -7.5593 -3.7499 -3.7499 -3.7267 -3.7267 -2.2314 -2.2314 -2.1954 -2.1954 -1.9196 -1.9196 -1.8172 -1.8172 -1.5629 -1.5629 -1.4941 -1.4941 -1.3366 -1.3366 -1.2981 -1.2981 -1.0224 -1.0224 -1.0165 -1.0165 2.5723 2.5723 2.6103 2.6103 4.5628 4.5628 4.5872 4.5872 5.3766 5.3766 5.3982 5.3982 9.2723 9.2723 9.2993 9.2993 10.2313 10.2313 10.2401 10.2401 10.4861 10.4861 k = 0.3000 0.5000 0.2882 ( 4904 PWs) bands (ev): -24.1758 -24.1758 -24.1758 -24.1758 -7.9198 -7.9198 -7.9083 -7.9083 -7.6943 -7.6943 -7.6283 -7.6283 -7.6153 -7.6153 -7.5605 -7.5605 -3.7469 -3.7469 -3.7242 -3.7242 -2.2349 -2.2349 -2.2014 -2.2014 -1.9120 -1.9120 -1.8083 -1.8083 -1.5649 -1.5649 -1.4967 -1.4967 -1.3299 -1.3299 -1.2924 -1.2924 -1.0159 -1.0159 -1.0111 -1.0111 2.5786 2.5786 2.6173 2.6173 4.5135 4.5135 4.5400 4.5400 5.3275 5.3275 5.3491 5.3491 9.3315 9.3315 9.3589 9.3589 10.2316 10.2316 10.2357 10.2357 10.4555 10.4555 k = 0.3143 0.5000 0.2882 ( 4904 PWs) bands (ev): -24.1757 -24.1757 -24.1757 -24.1757 -7.9198 -7.9198 -7.9087 -7.9087 -7.6939 -7.6939 -7.6313 -7.6313 -7.6135 -7.6135 -7.5617 -7.5617 -3.7439 -3.7439 -3.7219 -3.7219 -2.2382 -2.2382 -2.2073 -2.2073 -1.9040 -1.9040 -1.8001 -1.8001 -1.5666 -1.5666 -1.4994 -1.4994 -1.3233 -1.3233 -1.2869 -1.2869 -1.0096 -1.0096 -1.0058 -1.0058 2.5832 2.5832 2.6222 2.6222 4.4715 4.4715 4.5000 4.5000 5.2772 5.2772 5.2990 5.2990 9.3894 9.3894 9.4174 9.4174 10.2313 10.2313 10.2322 10.2322 10.4252 10.4252 k = 0.3286 0.5000 0.2882 ( 4904 PWs) bands (ev): -24.1756 -24.1756 -24.1756 -24.1756 -7.9198 -7.9198 -7.9092 -7.9092 -7.6932 -7.6932 -7.6344 -7.6344 -7.6115 -7.6115 -7.5631 -7.5631 -3.7409 -3.7409 -3.7198 -3.7198 -2.2413 -2.2413 -2.2129 -2.2129 -1.8956 -1.8956 -1.7926 -1.7926 -1.5677 -1.5677 -1.5021 -1.5021 -1.3167 -1.3167 -1.2819 -1.2819 -1.0035 -1.0035 -1.0007 -1.0007 2.5862 2.5862 2.6251 2.6251 4.4370 4.4370 4.4672 4.4672 5.2262 5.2262 5.2480 5.2480 9.4458 9.4458 9.4744 9.4744 10.2281 10.2281 10.2343 10.2343 10.3954 10.3954 k = 0.3429 0.5000 0.2882 ( 4908 PWs) bands (ev): -24.1755 -24.1755 -24.1755 -24.1755 -7.9198 -7.9198 -7.9098 -7.9098 -7.6922 -7.6922 -7.6375 -7.6375 -7.6095 -7.6095 -7.5645 -7.5645 -3.7380 -3.7380 -3.7180 -3.7180 -2.2442 -2.2442 -2.2183 -2.2183 -1.8868 -1.8868 -1.7862 -1.7862 -1.5685 -1.5685 -1.5050 -1.5050 -1.3102 -1.3102 -1.2773 -1.2773 -0.9976 -0.9976 -0.9958 -0.9958 2.5876 2.5876 2.6258 2.6258 4.4101 4.4101 4.4416 4.4416 5.1746 5.1746 5.1966 5.1966 9.5002 9.5002 9.5294 9.5294 10.2267 10.2267 10.2388 10.2388 10.3667 10.3667 k = 0.3571 0.5000 0.2882 ( 4900 PWs) bands (ev): -24.1754 -24.1754 -24.1754 -24.1754 -7.9197 -7.9197 -7.9104 -7.9104 -7.6911 -7.6911 -7.6405 -7.6405 -7.6075 -7.6075 -7.5661 -7.5661 -3.7351 -3.7351 -3.7164 -3.7164 -2.2467 -2.2467 -2.2233 -2.2233 -1.8777 -1.8777 -1.7807 -1.7807 -1.5686 -1.5686 -1.5080 -1.5080 -1.3039 -1.3039 -1.2732 -1.2732 -0.9921 -0.9921 -0.9911 -0.9911 2.5875 2.5875 2.6245 2.6245 4.3907 4.3907 4.4232 4.4232 5.1227 5.1227 5.1449 5.1449 9.5519 9.5519 9.5817 9.5817 10.2269 10.2269 10.2463 10.2463 10.3405 10.3405 k = 0.3714 0.5000 0.2882 ( 4892 PWs) bands (ev): -24.1753 -24.1753 -24.1753 -24.1753 -7.9197 -7.9197 -7.9110 -7.9110 -7.6897 -7.6897 -7.6436 -7.6436 -7.6054 -7.6054 -7.5678 -7.5678 -3.7324 -3.7324 -3.7151 -3.7151 -2.2490 -2.2490 -2.2281 -2.2281 -1.8685 -1.8685 -1.7764 -1.7764 -1.5683 -1.5683 -1.5111 -1.5111 -1.2978 -1.2978 -1.2696 -1.2696 -0.9870 -0.9870 -0.9866 -0.9866 2.5862 2.5862 2.6214 2.6214 4.3787 4.3787 4.4117 4.4117 5.0710 5.0710 5.0933 5.0933 9.6004 9.6004 9.6305 9.6305 10.2267 10.2267 10.2562 10.2562 10.3195 10.3196 k = 0.3857 0.5000 0.2882 ( 4888 PWs) bands (ev): -24.1752 -24.1752 -24.1752 -24.1752 -7.9196 -7.9196 -7.9117 -7.9117 -7.6881 -7.6881 -7.6467 -7.6467 -7.6033 -7.6033 -7.5695 -7.5695 -3.7298 -3.7298 -3.7140 -3.7140 -2.2510 -2.2510 -2.2326 -2.2326 -1.8591 -1.8591 -1.7733 -1.7733 -1.5674 -1.5674 -1.5144 -1.5144 -1.2920 -1.2920 -1.2664 -1.2664 -0.9825 -0.9825 -0.9823 -0.9823 2.5840 2.5840 2.6169 2.6169 4.3736 4.3736 4.4067 4.4067 5.0197 5.0197 5.0422 5.0422 9.6453 9.6453 9.6754 9.6754 10.2219 10.2219 10.2633 10.2633 10.2997 10.2997 k = 0.4000 0.5000 0.2882 ( 4892 PWs) bands (ev): -24.1752 -24.1752 -24.1752 -24.1752 -7.9194 -7.9194 -7.9124 -7.9124 -7.6864 -7.6864 -7.6497 -7.6497 -7.6012 -7.6012 -7.5714 -7.5714 -3.7273 -3.7273 -3.7132 -3.7132 -2.2527 -2.2527 -2.2367 -2.2367 -1.8498 -1.8498 -1.7714 -1.7714 -1.5660 -1.5660 -1.5178 -1.5178 -1.2866 -1.2866 -1.2638 -1.2638 -0.9787 -0.9787 -0.9781 -0.9781 2.5812 2.5812 2.6111 2.6111 4.3749 4.3749 4.4076 4.4076 4.9695 4.9695 4.9920 4.9920 9.6861 9.6861 9.7158 9.7158 10.2091 10.2091 10.2495 10.2495 10.3031 10.3032 k = 0.4143 0.5000 0.2882 ( 4896 PWs) bands (ev): -24.1751 -24.1751 -24.1751 -24.1751 -7.9193 -7.9193 -7.9132 -7.9132 -7.6844 -7.6844 -7.6527 -7.6527 -7.5990 -7.5990 -7.5733 -7.5733 -3.7250 -3.7250 -3.7127 -3.7127 -2.2541 -2.2541 -2.2404 -2.2404 -1.8405 -1.8405 -1.7708 -1.7708 -1.5640 -1.5640 -1.5213 -1.5213 -1.2815 -1.2815 -1.2617 -1.2617 -0.9753 -0.9753 -0.9744 -0.9744 2.5781 2.5781 2.6047 2.6047 4.3820 4.3820 4.4138 4.4138 4.9210 4.9210 4.9433 4.9433 9.7225 9.7225 9.7511 9.7511 10.1909 10.1909 10.2248 10.2248 10.3218 10.3218 k = 0.4286 0.5000 0.2882 ( 4900 PWs) bands (ev): -24.1751 -24.1751 -24.1751 -24.1751 -7.9190 -7.9190 -7.9139 -7.9139 -7.6824 -7.6824 -7.6557 -7.6557 -7.5968 -7.5968 -7.5752 -7.5752 -3.7228 -3.7228 -3.7124 -3.7124 -2.2551 -2.2551 -2.2438 -2.2438 -1.8314 -1.8314 -1.7715 -1.7715 -1.5616 -1.5616 -1.5250 -1.5250 -1.2769 -1.2769 -1.2602 -1.2602 -0.9723 -0.9723 -0.9713 -0.9713 2.5752 2.5752 2.5980 2.5980 4.3940 4.3940 4.4242 4.4242 4.8749 4.8749 4.8967 4.8967 9.7546 9.7546 9.7812 9.7812 10.1713 10.1713 10.2000 10.2000 10.3430 10.3433 k = 0.4429 0.5000 0.2882 ( 4904 PWs) bands (ev): -24.1751 -24.1751 -24.1751 -24.1751 -7.9188 -7.9188 -7.9146 -7.9146 -7.6801 -7.6801 -7.6587 -7.6587 -7.5946 -7.5946 -7.5773 -7.5773 -3.7208 -3.7208 -3.7124 -3.7124 -2.2558 -2.2558 -2.2468 -2.2468 -1.8225 -1.8225 -1.7734 -1.7734 -1.5587 -1.5587 -1.5288 -1.5288 -1.2727 -1.2727 -1.2593 -1.2593 -0.9697 -0.9697 -0.9688 -0.9688 2.5727 2.5727 2.5913 2.5913 4.4098 4.4098 4.4375 4.4375 4.8325 4.8325 4.8532 4.8532 9.7822 9.7822 9.8059 9.8059 10.1531 10.1531 10.1770 10.1770 10.3639 10.3639 k = 0.4571 0.5000 0.2882 ( 4912 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9184 -7.9184 -7.9153 -7.9153 -7.6778 -7.6778 -7.6616 -7.6616 -7.5925 -7.5925 -7.5794 -7.5794 -3.7190 -3.7190 -3.7126 -3.7126 -2.2561 -2.2561 -2.2493 -2.2493 -1.8140 -1.8140 -1.7765 -1.7765 -1.5555 -1.5555 -1.5326 -1.5326 -1.2691 -1.2691 -1.2590 -1.2590 -0.9677 -0.9677 -0.9668 -0.9668 2.5710 2.5710 2.5852 2.5852 4.4279 4.4279 4.4518 4.4518 4.7955 4.7955 4.8139 4.8139 9.8053 9.8053 9.8248 9.8248 10.1378 10.1378 10.1568 10.1568 10.3841 10.3841 k = 0.4714 0.5000 0.2882 ( 4912 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9180 -7.9180 -7.9159 -7.9159 -7.6753 -7.6753 -7.6645 -7.6645 -7.5902 -7.5902 -7.5815 -7.5815 -3.7174 -3.7174 -3.7131 -3.7131 -2.2560 -2.2560 -2.2515 -2.2515 -1.8060 -1.8060 -1.7806 -1.7806 -1.5520 -1.5520 -1.5366 -1.5366 -1.2660 -1.2660 -1.2592 -1.2592 -0.9661 -0.9661 -0.9655 -0.9655 2.5703 2.5703 2.5799 2.5799 4.4462 4.4462 4.4644 4.4644 4.7665 4.7665 4.7810 4.7810 9.8236 9.8236 9.8376 9.8376 10.1268 10.1268 10.1402 10.1402 10.4010 10.4010 k = 0.4857 0.5000 0.2882 ( 4932 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9176 -7.9176 -7.9166 -7.9166 -7.6727 -7.6727 -7.6673 -7.6673 -7.5881 -7.5881 -7.5837 -7.5837 -3.7160 -3.7160 -3.7139 -3.7139 -2.2555 -2.2555 -2.2533 -2.2533 -1.7985 -1.7985 -1.7857 -1.7857 -1.5483 -1.5483 -1.5405 -1.5405 -1.2634 -1.2634 -1.2600 -1.2600 -0.9651 -0.9651 -0.9647 -0.9647 2.5707 2.5707 2.5756 2.5756 4.4618 4.4618 4.4719 4.4719 4.7488 4.7488 4.7570 4.7570 9.8365 9.8365 9.8439 9.8439 10.1212 10.1212 10.1282 10.1282 10.4124 10.4124 k = 0.5000 0.5000 0.2882 ( 4944 PWs) bands (ev): -24.1751 -24.1751 -24.1751 -24.1751 -7.9171 -7.9171 -7.9171 -7.9171 -7.6700 -7.6700 -7.6700 -7.6700 -7.5859 -7.5859 -7.5859 -7.5859 -3.7148 -3.7148 -3.7148 -3.7148 -2.2546 -2.2546 -2.2546 -2.2546 -1.7918 -1.7918 -1.7918 -1.7918 -1.5445 -1.5445 -1.5445 -1.5445 -1.2615 -1.2615 -1.2615 -1.2615 -0.9646 -0.9646 -0.9646 -0.9646 2.5725 2.5725 2.5725 2.5725 4.4712 4.4712 4.4712 4.4712 4.7455 4.7455 4.7455 4.7455 9.8435 9.8435 9.8435 9.8435 10.1217 10.1217 10.1217 10.1217 10.4168 10.4168 k = 0.5000 0.5000 0.2882 ( 4944 PWs) bands (ev): -24.1751 -24.1751 -24.1751 -24.1751 -7.9171 -7.9171 -7.9171 -7.9171 -7.6700 -7.6700 -7.6700 -7.6700 -7.5859 -7.5859 -7.5859 -7.5859 -3.7148 -3.7148 -3.7148 -3.7148 -2.2546 -2.2546 -2.2546 -2.2546 -1.7918 -1.7918 -1.7918 -1.7918 -1.5445 -1.5445 -1.5445 -1.5445 -1.2615 -1.2615 -1.2615 -1.2615 -0.9646 -0.9646 -0.9646 -0.9646 2.5725 2.5725 2.5725 2.5725 4.4712 4.4712 4.4712 4.4712 4.7455 4.7455 4.7455 4.7455 9.8435 9.8435 9.8435 9.8435 10.1217 10.1217 10.1217 10.1217 10.4168 10.4168 k = 0.4898 0.4898 0.2882 ( 4932 PWs) bands (ev): -24.1751 -24.1751 -24.1750 -24.1750 -7.9176 -7.9176 -7.9165 -7.9165 -7.6727 -7.6727 -7.6673 -7.6673 -7.5881 -7.5881 -7.5836 -7.5836 -3.7160 -3.7160 -3.7139 -3.7139 -2.2556 -2.2556 -2.2532 -2.2532 -1.7986 -1.7986 -1.7857 -1.7857 -1.5484 -1.5484 -1.5405 -1.5405 -1.2635 -1.2635 -1.2600 -1.2600 -0.9659 -0.9659 -0.9639 -0.9639 2.5707 2.5707 2.5757 2.5757 4.4574 4.4574 4.4763 4.4763 4.7457 4.7457 4.7602 4.7602 9.8348 9.8348 9.8457 9.8457 10.1205 10.1205 10.1290 10.1290 10.4089 10.4089 k = 0.4796 0.4796 0.2882 ( 4918 PWs) bands (ev): -24.1751 -24.1751 -24.1750 -24.1750 -7.9181 -7.9181 -7.9159 -7.9159 -7.6753 -7.6753 -7.6644 -7.6644 -7.5903 -7.5903 -7.5815 -7.5815 -3.7175 -3.7175 -3.7131 -3.7131 -2.2562 -2.2562 -2.2513 -2.2513 -1.8062 -1.8062 -1.7804 -1.7804 -1.5521 -1.5521 -1.5365 -1.5365 -1.2660 -1.2660 -1.2592 -1.2592 -0.9698 -0.9698 -0.9618 -0.9618 2.5701 2.5701 2.5803 2.5803 4.4261 4.4261 4.4873 4.4873 4.7501 4.7501 4.7950 4.7950 9.8142 9.8142 9.8478 9.8478 10.1222 10.1222 10.1445 10.1445 10.3864 10.3864 k = 0.4694 0.4694 0.2882 ( 4908 PWs) bands (ev): -24.1752 -24.1752 -24.1749 -24.1749 -7.9185 -7.9185 -7.9152 -7.9152 -7.6778 -7.6778 -7.6615 -7.6615 -7.5925 -7.5925 -7.5793 -7.5793 -3.7193 -3.7193 -3.7125 -3.7125 -2.2568 -2.2568 -2.2486 -2.2486 -1.8144 -1.8144 -1.7761 -1.7761 -1.5556 -1.5556 -1.5326 -1.5326 -1.2691 -1.2691 -1.2590 -1.2590 -0.9762 -0.9762 -0.9584 -0.9584 2.5706 2.5706 2.5866 2.5866 4.3845 4.3845 4.5051 4.5051 4.7577 4.7577 4.8423 4.8423 9.7833 9.7833 9.8510 9.8510 10.1256 10.1256 10.1665 10.1665 10.3520 10.3520 k = 0.4592 0.4592 0.2882 ( 4908 PWs) bands (ev): -24.1753 -24.1753 -24.1748 -24.1748 -7.9188 -7.9188 -7.9145 -7.9145 -7.6802 -7.6802 -7.6586 -7.6586 -7.5947 -7.5947 -7.5772 -7.5772 -3.7214 -3.7214 -3.7121 -3.7121 -2.2573 -2.2573 -2.2453 -2.2453 -1.8233 -1.8233 -1.7727 -1.7727 -1.5587 -1.5587 -1.5288 -1.5288 -1.2727 -1.2727 -1.2594 -1.2594 -0.9851 -0.9851 -0.9537 -0.9537 2.5722 2.5722 2.5947 2.5947 4.3383 4.3383 4.5296 4.5296 4.7682 4.7682 4.8965 4.8965 9.7447 9.7447 9.8554 9.8554 10.1303 10.1303 10.1926 10.1926 10.3097 10.3097 k = 0.4490 0.4490 0.2882 ( 4904 PWs) bands (ev): -24.1755 -24.1755 -24.1747 -24.1747 -7.9191 -7.9191 -7.9137 -7.9137 -7.6825 -7.6825 -7.6556 -7.6556 -7.5970 -7.5970 -7.5751 -7.5751 -3.7238 -3.7238 -3.7118 -3.7118 -2.2579 -2.2579 -2.2412 -2.2412 -1.8326 -1.8326 -1.7703 -1.7703 -1.5616 -1.5616 -1.5252 -1.5252 -1.2768 -1.2768 -1.2604 -1.2604 -0.9961 -0.9961 -0.9480 -0.9480 2.5750 2.5750 2.6046 2.6046 4.2904 4.2904 4.5604 4.5604 4.7818 4.7818 4.9548 4.9548 9.7003 9.7003 9.8611 9.8611 10.1357 10.1357 10.2158 10.2158 10.2691 10.2691 k = 0.4388 0.4388 0.2882 ( 4900 PWs) bands (ev): -24.1757 -24.1757 -24.1746 -24.1746 -7.9194 -7.9194 -7.9129 -7.9129 -7.6847 -7.6847 -7.6525 -7.6525 -7.5992 -7.5992 -7.5731 -7.5731 -3.7267 -3.7267 -3.7117 -3.7117 -2.2585 -2.2585 -2.2364 -2.2364 -1.8423 -1.8423 -1.7689 -1.7689 -1.5640 -1.5640 -1.5218 -1.5218 -1.2812 -1.2812 -1.2620 -1.2620 -1.0093 -1.0093 -0.9413 -0.9413 2.5789 2.5789 2.6166 2.6166 4.2423 4.2423 4.5970 4.5970 4.7984 4.7984 5.0157 5.0157 9.6515 9.6515 9.8680 9.8680 10.1393 10.1393 10.1987 10.1987 10.2721 10.2721 k = 0.4286 0.4286 0.2882 ( 4892 PWs) bands (ev): -24.1760 -24.1760 -24.1744 -24.1744 -7.9196 -7.9196 -7.9119 -7.9119 -7.6867 -7.6867 -7.6495 -7.6495 -7.6013 -7.6013 -7.5712 -7.5712 -3.7300 -3.7300 -3.7117 -3.7117 -2.2591 -2.2591 -2.2311 -2.2311 -1.8523 -1.8523 -1.7684 -1.7684 -1.5659 -1.5659 -1.5187 -1.5187 -1.2861 -1.2861 -1.2640 -1.2640 -1.0243 -1.0243 -0.9338 -0.9338 2.5843 2.5843 2.6305 2.6305 4.1949 4.1949 4.6389 4.6389 4.8180 4.8180 5.0783 5.0783 9.5993 9.5993 9.8762 9.8762 10.1242 10.1242 10.1735 10.1735 10.3056 10.3056 k = 0.4184 0.4184 0.2882 ( 4900 PWs) bands (ev): -24.1762 -24.1762 -24.1743 -24.1743 -7.9198 -7.9198 -7.9110 -7.9110 -7.6885 -7.6885 -7.6465 -7.6465 -7.6035 -7.6035 -7.5693 -7.5693 -3.7338 -3.7338 -3.7120 -3.7120 -2.2599 -2.2599 -2.2252 -2.2252 -1.8624 -1.8624 -1.7688 -1.7688 -1.5674 -1.5674 -1.5158 -1.5158 -1.2913 -1.2913 -1.2665 -1.2665 -1.0408 -1.0408 -0.9257 -0.9257 2.5910 2.5910 2.6466 2.6466 4.1488 4.1488 4.6853 4.6853 4.8405 4.8405 5.1421 5.1421 9.5444 9.5444 9.8855 9.8855 10.0805 10.0805 10.1766 10.1766 10.3449 10.3449 k = 0.4082 0.4082 0.2882 ( 4908 PWs) bands (ev): -24.1766 -24.1766 -24.1741 -24.1741 -7.9199 -7.9199 -7.9099 -7.9099 -7.6902 -7.6902 -7.6434 -7.6434 -7.6055 -7.6055 -7.5675 -7.5675 -3.7380 -3.7380 -3.7124 -3.7124 -2.2608 -2.2608 -2.2190 -2.2190 -1.8728 -1.8728 -1.7703 -1.7703 -1.5684 -1.5684 -1.5130 -1.5130 -1.2968 -1.2968 -1.2694 -1.2694 -1.0587 -1.0587 -0.9172 -0.9172 2.5994 2.5994 2.6647 2.6647 4.1044 4.1044 4.7356 4.7356 4.8662 4.8662 5.2067 5.2067 9.4878 9.4878 9.8961 9.8961 10.0322 10.0322 10.1878 10.1878 10.3874 10.3874 k = 0.3980 0.3980 0.2882 ( 4902 PWs) bands (ev): -24.1769 -24.1769 -24.1739 -24.1739 -7.9201 -7.9201 -7.9088 -7.9088 -7.6918 -7.6918 -7.6404 -7.6404 -7.6075 -7.6075 -7.5657 -7.5657 -3.7429 -3.7429 -3.7130 -3.7130 -2.2617 -2.2617 -2.2125 -2.2125 -1.8831 -1.8831 -1.7725 -1.7725 -1.5689 -1.5689 -1.5104 -1.5104 -1.3028 -1.3028 -1.2727 -1.2727 -1.0774 -1.0774 -0.9085 -0.9085 2.6094 2.6094 2.6850 2.6850 4.0619 4.0619 4.7890 4.7890 4.8950 4.8950 5.2719 5.2719 9.4300 9.4300 9.9077 9.9077 9.9862 9.9862 10.2020 10.2020 10.4262 10.4262 k = 0.3878 0.3878 0.2882 ( 4892 PWs) bands (ev): -24.1773 -24.1773 -24.1737 -24.1737 -7.9202 -7.9202 -7.9075 -7.9075 -7.6931 -7.6931 -7.6375 -7.6375 -7.6095 -7.6095 -7.5641 -7.5641 -3.7483 -3.7483 -3.7138 -3.7138 -2.2628 -2.2628 -2.2059 -2.2059 -1.8933 -1.8933 -1.7755 -1.7755 -1.5689 -1.5689 -1.5079 -1.5079 -1.3091 -1.3091 -1.2761 -1.2761 -1.0967 -1.0967 -0.8997 -0.8997 2.6212 2.6212 2.7075 2.7075 4.0218 4.0218 4.8443 4.8443 4.9273 4.9273 5.3373 5.3373 9.3715 9.3715 9.9193 9.9193 9.9455 9.9455 10.2184 10.2184 10.4301 10.4301 k = 0.3776 0.3776 0.2882 ( 4892 PWs) bands (ev): -24.1777 -24.1777 -24.1735 -24.1735 -7.9203 -7.9203 -7.9062 -7.9062 -7.6943 -7.6943 -7.6346 -7.6346 -7.6113 -7.6113 -7.5625 -7.5625 -3.7543 -3.7543 -3.7149 -3.7149 -2.2639 -2.2639 -2.1993 -2.1993 -1.9035 -1.9035 -1.7793 -1.7793 -1.5686 -1.5686 -1.5055 -1.5055 -1.3160 -1.3160 -1.2797 -1.2797 -1.1161 -1.1161 -0.8911 -0.8911 2.6347 2.6347 2.7322 2.7322 3.9842 3.9842 4.9002 4.9002 4.9640 4.9640 5.4027 5.4027 9.3131 9.3131 9.9041 9.9041 9.9377 9.9377 10.2368 10.2368 10.4321 10.4321 k = 0.3673 0.3673 0.2882 ( 4900 PWs) bands (ev): -24.1782 -24.1782 -24.1733 -24.1733 -7.9204 -7.9204 -7.9048 -7.9048 -7.6952 -7.6952 -7.6318 -7.6318 -7.6130 -7.6130 -7.5610 -7.5610 -3.7609 -3.7609 -3.7162 -3.7162 -2.2652 -2.2652 -2.1929 -2.1929 -1.9136 -1.9136 -1.7836 -1.7836 -1.5680 -1.5680 -1.5030 -1.5030 -1.3236 -1.3236 -1.2834 -1.2834 -1.1351 -1.1351 -0.8828 -0.8828 2.6499 2.6499 2.7591 2.7591 3.9493 3.9493 4.9542 4.9542 5.0067 5.0067 5.4679 5.4679 9.2553 9.2553 9.8735 9.8735 9.9521 9.9521 10.2572 10.2572 10.4338 10.4338 k = 0.3571 0.3571 0.2882 ( 4896 PWs) bands (ev): -24.1787 -24.1787 -24.1730 -24.1730 -7.9206 -7.9206 -7.9033 -7.9033 -7.6960 -7.6960 -7.6292 -7.6292 -7.6144 -7.6144 -7.5596 -7.5596 -3.7682 -3.7682 -3.7178 -3.7178 -2.2665 -2.2665 -2.1868 -2.1868 -1.9236 -1.9236 -1.7884 -1.7884 -1.5672 -1.5672 -1.5003 -1.5003 -1.3319 -1.3319 -1.2870 -1.2870 -1.1532 -1.1532 -0.8750 -0.8750 2.6669 2.6669 2.7883 2.7883 3.9173 3.9173 5.0043 5.0043 5.0569 5.0569 5.5325 5.5325 9.1985 9.1985 9.8481 9.8481 9.9683 9.9683 10.2797 10.2797 10.4351 10.4351 k = 0.3469 0.3469 0.2882 ( 4888 PWs) bands (ev): -24.1791 -24.1791 -24.1727 -24.1727 -7.9207 -7.9207 -7.9016 -7.9016 -7.6965 -7.6965 -7.6271 -7.6271 -7.6153 -7.6153 -7.5584 -7.5584 -3.7761 -3.7761 -3.7197 -3.7197 -2.2680 -2.2680 -2.1812 -2.1812 -1.9336 -1.9336 -1.7935 -1.7935 -1.5661 -1.5661 -1.4974 -1.4974 -1.3412 -1.3412 -1.2905 -1.2905 -1.1701 -1.1701 -0.8678 -0.8678 2.6855 2.6855 2.8198 2.8198 3.8885 3.8885 5.0510 5.0510 5.1134 5.1134 5.5964 5.5964 9.1435 9.1435 9.8287 9.8287 9.9857 9.9857 10.3043 10.3043 10.4357 10.4357 k = 0.3367 0.3367 0.2882 ( 4896 PWs) bands (ev): -24.1797 -24.1797 -24.1725 -24.1725 -7.9209 -7.9209 -7.8999 -7.8999 -7.6969 -7.6969 -7.6259 -7.6259 -7.6153 -7.6153 -7.5572 -7.5572 -3.7848 -3.7848 -3.7220 -3.7220 -2.2695 -2.2695 -2.1761 -2.1761 -1.9437 -1.9437 -1.7988 -1.7988 -1.5649 -1.5649 -1.4942 -1.4942 -1.3516 -1.3516 -1.2938 -1.2938 -1.1852 -1.1852 -0.8615 -0.8615 2.7056 2.7056 2.8535 2.8535 3.8630 3.8630 5.0967 5.0967 5.1733 5.1733 5.6591 5.6591 9.0906 9.0906 9.8156 9.8156 10.0040 10.0040 10.3310 10.3310 10.4355 10.4355 k = 0.3265 0.3265 0.2882 ( 4892 PWs) bands (ev): -24.1802 -24.1802 -24.1722 -24.1722 -7.9211 -7.9211 -7.8980 -7.8980 -7.6970 -7.6970 -7.6257 -7.6257 -7.6143 -7.6143 -7.5561 -7.5561 -3.7941 -3.7941 -3.7245 -3.7245 -2.2711 -2.2711 -2.1716 -2.1716 -1.9540 -1.9540 -1.8042 -1.8042 -1.5637 -1.5637 -1.4906 -1.4906 -1.3629 -1.3629 -1.2969 -1.2969 -1.1982 -1.1982 -0.8562 -0.8562 2.7272 2.7272 2.8897 2.8897 3.8410 3.8410 5.1431 5.1431 5.2345 5.2345 5.7203 5.7203 9.0404 9.0404 9.8084 9.8084 10.0231 10.0231 10.3595 10.3595 10.4346 10.4346 k = 0.3163 0.3163 0.2882 ( 4892 PWs) bands (ev): -24.1808 -24.1808 -24.1718 -24.1718 -7.9213 -7.9213 -7.8961 -7.8961 -7.6969 -7.6969 -7.6263 -7.6263 -7.6124 -7.6124 -7.5552 -7.5552 -3.8042 -3.8042 -3.7275 -3.7275 -2.2727 -2.2727 -2.1677 -2.1677 -1.9645 -1.9645 -1.8097 -1.8097 -1.5625 -1.5625 -1.4867 -1.4867 -1.3751 -1.3751 -1.2998 -1.2998 -1.2090 -1.2090 -0.8519 -0.8519 2.7500 2.7500 2.9282 2.9282 3.8226 3.8226 5.1909 5.1909 5.2958 5.2958 5.7797 5.7797 8.9936 8.9936 9.8067 9.8067 10.0427 10.0427 10.3870 10.3870 10.4354 10.4354 k = 0.3061 0.3061 0.2882 ( 4872 PWs) bands (ev): -24.1813 -24.1813 -24.1715 -24.1715 -7.9215 -7.9215 -7.8940 -7.8940 -7.6966 -7.6966 -7.6274 -7.6274 -7.6100 -7.6100 -7.5543 -7.5543 -3.8149 -3.8149 -3.7307 -3.7307 -2.2745 -2.2745 -2.1645 -2.1645 -1.9754 -1.9754 -1.8150 -1.8150 -1.5615 -1.5615 -1.4823 -1.4823 -1.3876 -1.3876 -1.3023 -1.3023 -1.2174 -1.2174 -0.8487 -0.8487 2.7738 2.7738 2.9691 2.9691 3.8080 3.8080 5.2401 5.2401 5.3568 5.3568 5.8367 5.8367 8.9506 8.9506 9.8098 9.8098 10.0626 10.0626 10.4003 10.4003 10.4507 10.4507 k = 0.2959 0.2959 0.2882 ( 4880 PWs) bands (ev): -24.1819 -24.1819 -24.1712 -24.1712 -7.9217 -7.9217 -7.8918 -7.8918 -7.6961 -7.6961 -7.6288 -7.6288 -7.6074 -7.6074 -7.5536 -7.5536 -3.8263 -3.8263 -3.7344 -3.7344 -2.2763 -2.2763 -2.1620 -2.1620 -1.9868 -1.9868 -1.8203 -1.8203 -1.5607 -1.5607 -1.4777 -1.4777 -1.4001 -1.4001 -1.3046 -1.3046 -1.2236 -1.2236 -0.8469 -0.8469 2.7985 2.7985 3.0124 3.0124 3.7972 3.7972 5.2910 5.2910 5.4170 5.4170 5.8909 5.8909 8.9120 8.9120 9.8167 9.8167 10.0824 10.0824 10.3930 10.3930 10.4861 10.4861 k = 0.2857 0.2857 0.2882 ( 4888 PWs) bands (ev): -24.1826 -24.1826 -24.1709 -24.1709 -7.9219 -7.9219 -7.8895 -7.8895 -7.6954 -7.6954 -7.6302 -7.6302 -7.6048 -7.6048 -7.5530 -7.5530 -3.8384 -3.8384 -3.7385 -3.7385 -2.2781 -2.2781 -2.1600 -2.1600 -1.9987 -1.9987 -1.8256 -1.8256 -1.5604 -1.5604 -1.4729 -1.4729 -1.4118 -1.4118 -1.3066 -1.3066 -1.2277 -1.2277 -0.8463 -0.8463 2.8239 2.8239 3.0582 3.0582 3.7905 3.7905 5.3434 5.3434 5.4764 5.4764 5.9418 5.9418 8.8786 8.8786 9.8261 9.8261 10.1016 10.1016 10.3743 10.3743 10.5313 10.5313 k = 0.2755 0.2755 0.2882 ( 4872 PWs) bands (ev): -24.1832 -24.1832 -24.1705 -24.1705 -7.9222 -7.9222 -7.8871 -7.8871 -7.6945 -7.6945 -7.6316 -7.6316 -7.6020 -7.6020 -7.5524 -7.5524 -3.8511 -3.8511 -3.7428 -3.7428 -2.2800 -2.2800 -2.1585 -2.1585 -2.0111 -2.0111 -1.8309 -1.8309 -1.5607 -1.5607 -1.4683 -1.4683 -1.4219 -1.4219 -1.3083 -1.3083 -1.2297 -1.2297 -0.8471 -0.8471 2.8497 2.8497 3.1064 3.1064 3.7877 3.7877 5.3974 5.3974 5.5350 5.5350 5.9889 5.9889 8.8507 8.8507 9.8364 9.8364 10.1197 10.1197 10.3455 10.3455 10.5838 10.5838 k = 0.2653 0.2653 0.2882 ( 4868 PWs) bands (ev): -24.1838 -24.1838 -24.1702 -24.1702 -7.9224 -7.9224 -7.8846 -7.8846 -7.6934 -7.6934 -7.6331 -7.6331 -7.5993 -7.5993 -7.5520 -7.5520 -3.8643 -3.8643 -3.7476 -3.7476 -2.2819 -2.2819 -2.1575 -2.1575 -2.0239 -2.0239 -1.8362 -1.8362 -1.5619 -1.5619 -1.4645 -1.4645 -1.4292 -1.4292 -1.3098 -1.3098 -1.2300 -1.2300 -0.8492 -0.8492 2.8757 2.8757 3.1572 3.1572 3.7891 3.7891 5.4526 5.4526 5.5927 5.5927 6.0315 6.0315 8.8290 8.8290 9.8459 9.8459 10.1359 10.1359 10.3049 10.3049 10.6432 10.6432 k = 0.2551 0.2551 0.2882 ( 4880 PWs) bands (ev): -24.1844 -24.1844 -24.1699 -24.1699 -7.9226 -7.9226 -7.8821 -7.8821 -7.6921 -7.6921 -7.6345 -7.6345 -7.5967 -7.5967 -7.5517 -7.5517 -3.8782 -3.8782 -3.7526 -3.7526 -2.2839 -2.2839 -2.1569 -2.1569 -2.0371 -2.0371 -1.8416 -1.8416 -1.5642 -1.5642 -1.4629 -1.4629 -1.4324 -1.4324 -1.3110 -1.3110 -1.2285 -1.2285 -0.8527 -0.8527 2.9017 2.9017 3.2103 3.2103 3.7947 3.7947 5.5091 5.5091 5.6497 5.6497 6.0693 6.0693 8.8141 8.8141 9.8526 9.8526 10.1492 10.1492 10.2503 10.2503 10.7078 10.7078 k = 0.2449 0.2449 0.2882 ( 4880 PWs) bands (ev): -24.1851 -24.1851 -24.1695 -24.1695 -7.9228 -7.9228 -7.8795 -7.8795 -7.6907 -7.6907 -7.6360 -7.6360 -7.5940 -7.5940 -7.5515 -7.5515 -3.8924 -3.8924 -3.7580 -3.7580 -2.2859 -2.2859 -2.1567 -2.1567 -2.0505 -2.0505 -1.8471 -1.8471 -1.5674 -1.5674 -1.4638 -1.4638 -1.4309 -1.4309 -1.3120 -1.3120 -1.2255 -1.2255 -0.8575 -0.8575 2.9275 2.9275 3.2660 3.2660 3.8044 3.8044 5.5667 5.5667 5.7064 5.7064 6.1016 6.1016 8.8063 8.8063 9.8548 9.8548 10.1580 10.1580 10.1803 10.1803 10.7313 10.7313 k = 0.2347 0.2347 0.2882 ( 4880 PWs) bands (ev): -24.1857 -24.1857 -24.1692 -24.1692 -7.9230 -7.9230 -7.8768 -7.8768 -7.6892 -7.6892 -7.6374 -7.6374 -7.5915 -7.5915 -7.5514 -7.5514 -3.9071 -3.9071 -3.7637 -3.7637 -2.2880 -2.2880 -2.1568 -2.1568 -2.0640 -2.0640 -1.8528 -1.8528 -1.5715 -1.5715 -1.4659 -1.4659 -1.4262 -1.4262 -1.3128 -1.3128 -1.2211 -1.2211 -0.8635 -0.8635 2.9529 2.9529 3.3241 3.3241 3.8182 3.8182 5.6251 5.6251 5.7629 5.7629 6.1281 6.1281 8.8061 8.8061 9.8505 9.8505 10.0933 10.0933 10.1618 10.1618 10.6361 10.6361 k = 0.2245 0.2245 0.2882 ( 4888 PWs) bands (ev): -24.1864 -24.1864 -24.1689 -24.1689 -7.9232 -7.9232 -7.8740 -7.8740 -7.6875 -7.6875 -7.6389 -7.6389 -7.5890 -7.5890 -7.5513 -7.5513 -3.9221 -3.9221 -3.7696 -3.7696 -2.2901 -2.2901 -2.1573 -2.1573 -2.0774 -2.0774 -1.8586 -1.8586 -1.5760 -1.5760 -1.4679 -1.4679 -1.4199 -1.4199 -1.3134 -1.3134 -1.2155 -1.2155 -0.8706 -0.8706 2.9777 2.9777 3.3846 3.3846 3.8361 3.8361 5.6840 5.6840 5.8196 5.8196 6.1485 6.1485 8.8136 8.8136 9.8376 9.8376 9.9922 9.9922 10.1577 10.1577 10.5246 10.5246 k = 0.2143 0.2143 0.2882 ( 4894 PWs) bands (ev): -24.1870 -24.1870 -24.1685 -24.1685 -7.9233 -7.9233 -7.8713 -7.8713 -7.6857 -7.6857 -7.6403 -7.6403 -7.5866 -7.5866 -7.5512 -7.5512 -3.9374 -3.9374 -3.7757 -3.7757 -2.2922 -2.2922 -2.1581 -2.1581 -2.0906 -2.0906 -1.8646 -1.8646 -1.5807 -1.5807 -1.4696 -1.4696 -1.4128 -1.4128 -1.3137 -1.3137 -1.2089 -1.2089 -0.8788 -0.8788 3.0017 3.0017 3.4474 3.4474 3.8580 3.8580 5.7433 5.7433 5.8767 5.8767 6.1627 6.1627 8.8289 8.8289 9.8098 9.8098 9.8836 9.8836 10.1442 10.1442 10.4103 10.4103 k = 0.2041 0.2041 0.2882 ( 4890 PWs) bands (ev): -24.1876 -24.1876 -24.1682 -24.1682 -7.9234 -7.9234 -7.8684 -7.8684 -7.6839 -7.6839 -7.6417 -7.6417 -7.5844 -7.5844 -7.5512 -7.5512 -3.9528 -3.9528 -3.7820 -3.7820 -2.2944 -2.2944 -2.1594 -2.1594 -2.1032 -2.1032 -1.8708 -1.8708 -1.5850 -1.5850 -1.4707 -1.4707 -1.4053 -1.4053 -1.3138 -1.3138 -1.2015 -1.2015 -0.8877 -0.8877 3.0247 3.0247 3.5125 3.5125 3.8839 3.8839 5.8024 5.8024 5.9346 5.9346 6.1708 6.1708 8.8519 8.8519 9.7276 9.7276 9.8092 9.8092 10.1194 10.1194 10.2967 10.2967 k = 0.1939 0.1939 0.2882 ( 4890 PWs) bands (ev): -24.1882 -24.1882 -24.1679 -24.1679 -7.9234 -7.9234 -7.8656 -7.8656 -7.6819 -7.6819 -7.6430 -7.6430 -7.5823 -7.5823 -7.5511 -7.5511 -3.9683 -3.9683 -3.7884 -3.7884 -2.2967 -2.2967 -2.1613 -2.1613 -2.1150 -2.1150 -1.8770 -1.8770 -1.5886 -1.5886 -1.4715 -1.4715 -1.3978 -1.3978 -1.3137 -1.3137 -1.1936 -1.1936 -0.8972 -0.8972 3.0467 3.0467 3.5799 3.5799 3.9135 3.9135 5.8610 5.8610 5.9936 5.9936 6.1730 6.1730 8.8822 8.8822 9.5975 9.5975 9.7653 9.7653 10.0814 10.0814 10.1868 10.1868 k = 0.1837 0.1837 0.2882 ( 4892 PWs) bands (ev): -24.1888 -24.1888 -24.1676 -24.1676 -7.9234 -7.9234 -7.8628 -7.8628 -7.6800 -7.6800 -7.6444 -7.6444 -7.5805 -7.5805 -7.5509 -7.5509 -3.9837 -3.9837 -3.7949 -3.7949 -2.2991 -2.2991 -2.1641 -2.1641 -2.1256 -2.1256 -1.8834 -1.8834 -1.5914 -1.5914 -1.4722 -1.4722 -1.3904 -1.3904 -1.3135 -1.3135 -1.1856 -1.1856 -0.9071 -0.9071 3.0675 3.0675 3.6492 3.6492 3.9468 3.9468 5.9179 5.9179 6.0536 6.0536 6.1705 6.1705 8.9190 8.9190 9.4564 9.4564 9.7181 9.7181 10.0253 10.0253 10.0865 10.0865 k = 0.1735 0.1735 0.2882 ( 4896 PWs) bands (ev): -24.1893 -24.1893 -24.1673 -24.1673 -7.9234 -7.9234 -7.8600 -7.8600 -7.6780 -7.6780 -7.6457 -7.6457 -7.5789 -7.5789 -7.5507 -7.5507 -3.9990 -3.9990 -3.8015 -3.8015 -2.3016 -2.3016 -2.1683 -2.1683 -2.1344 -2.1344 -1.8898 -1.8898 -1.5930 -1.5930 -1.4728 -1.4728 -1.3831 -1.3831 -1.3132 -1.3132 -1.1779 -1.1779 -0.9169 -0.9169 3.0869 3.0869 3.7205 3.7205 3.9837 3.9837 5.9712 5.9712 6.1144 6.1144 6.1660 6.1660 8.9612 8.9612 9.3109 9.3109 9.6641 9.6641 9.9442 9.9442 10.0051 10.0051 k = 0.1633 0.1633 0.2882 ( 4906 PWs) bands (ev): -24.1899 -24.1899 -24.1670 -24.1670 -7.9233 -7.9233 -7.8572 -7.8572 -7.6760 -7.6760 -7.6470 -7.6470 -7.5776 -7.5776 -7.5503 -7.5503 -4.0141 -4.0141 -3.8080 -3.8080 -2.3043 -2.3043 -2.1741 -2.1741 -2.1410 -2.1410 -1.8962 -1.8962 -1.5934 -1.5934 -1.4734 -1.4734 -1.3763 -1.3763 -1.3129 -1.3129 -1.1708 -1.1708 -0.9263 -0.9263 3.1051 3.1051 3.7935 3.7935 4.0238 4.0238 6.0151 6.0151 6.1601 6.1601 6.1811 6.1811 9.0055 9.0055 9.1654 9.1654 9.6036 9.6036 9.8511 9.8511 9.9324 9.9324 k = 0.1531 0.1531 0.2882 ( 4904 PWs) bands (ev): -24.1904 -24.1904 -24.1668 -24.1668 -7.9232 -7.9232 -7.8545 -7.8545 -7.6740 -7.6740 -7.6483 -7.6483 -7.5766 -7.5766 -7.5497 -7.5497 -4.0289 -4.0289 -3.8145 -3.8145 -2.3071 -2.3071 -2.1813 -2.1813 -2.1456 -2.1456 -1.9026 -1.9026 -1.5924 -1.5924 -1.4739 -1.4739 -1.3697 -1.3697 -1.3126 -1.3126 -1.1649 -1.1649 -0.9349 -0.9349 3.1218 3.1218 3.8680 3.8680 4.0670 4.0670 6.0373 6.0373 6.1766 6.1766 6.2426 6.2426 8.9959 8.9959 9.0757 9.0757 9.5375 9.5375 9.7607 9.7607 9.8575 9.8575 k = 0.1429 0.1429 0.2882 ( 4898 PWs) bands (ev): -24.1909 -24.1909 -24.1665 -24.1665 -7.9230 -7.9230 -7.8518 -7.8518 -7.6721 -7.6721 -7.6495 -7.6495 -7.5760 -7.5760 -7.5489 -7.5489 -4.0432 -4.0432 -3.8208 -3.8208 -2.3100 -2.3100 -2.1891 -2.1891 -2.1487 -2.1487 -1.9089 -1.9089 -1.5901 -1.5901 -1.4745 -1.4745 -1.3637 -1.3637 -1.3123 -1.3123 -1.1606 -1.1606 -0.9422 -0.9422 3.1371 3.1371 3.9436 3.9436 4.1131 4.1131 6.0317 6.0317 6.2138 6.2138 6.3067 6.3067 8.8578 8.8578 9.1143 9.1143 9.4670 9.4670 9.6794 9.6794 9.7790 9.7790 k = 0.1327 0.1327 0.2882 ( 4886 PWs) bands (ev): -24.1914 -24.1914 -24.1662 -24.1662 -7.9228 -7.9228 -7.8492 -7.8492 -7.6703 -7.6703 -7.6506 -7.6506 -7.5756 -7.5756 -7.5479 -7.5479 -4.0570 -4.0570 -3.8270 -3.8270 -2.3130 -2.3130 -2.1970 -2.1970 -2.1510 -2.1510 -1.9150 -1.9150 -1.5863 -1.5863 -1.4752 -1.4752 -1.3580 -1.3580 -1.3122 -1.3122 -1.1582 -1.1582 -0.9478 -0.9478 3.1511 3.1511 4.0200 4.0200 4.1616 4.1616 6.0082 6.0082 6.2639 6.2639 6.3716 6.3716 8.7128 8.7128 9.1549 9.1549 9.3934 9.3934 9.6132 9.6132 9.6980 9.6980 k = 0.1224 0.1224 0.2882 ( 4882 PWs) bands (ev): -24.1918 -24.1918 -24.1659 -24.1659 -7.9226 -7.9226 -7.8466 -7.8466 -7.6686 -7.6686 -7.6516 -7.6516 -7.5755 -7.5755 -7.5468 -7.5468 -4.0702 -4.0702 -3.8329 -3.8329 -2.3161 -2.3161 -2.2047 -2.2047 -2.1527 -2.1527 -1.9210 -1.9210 -1.5813 -1.5813 -1.4758 -1.4758 -1.3530 -1.3530 -1.3123 -1.3123 -1.1582 -1.1582 -0.9515 -0.9515 3.1636 3.1636 4.0968 4.0968 4.2124 4.2124 5.9754 5.9754 6.3190 6.3190 6.4365 6.4365 8.5700 8.5700 9.1796 9.1796 9.3185 9.3185 9.5714 9.5714 9.6157 9.6157 k = 0.1122 0.1122 0.2882 ( 4886 PWs) bands (ev): -24.1923 -24.1923 -24.1657 -24.1657 -7.9224 -7.9224 -7.8442 -7.8442 -7.6671 -7.6671 -7.6525 -7.6525 -7.5757 -7.5757 -7.5456 -7.5456 -4.0827 -4.0827 -3.8386 -3.8386 -2.3194 -2.3194 -2.2118 -2.2118 -2.1541 -2.1541 -1.9268 -1.9268 -1.5750 -1.5750 -1.4765 -1.4765 -1.3485 -1.3485 -1.3129 -1.3129 -1.1603 -1.1603 -0.9532 -0.9532 3.1749 3.1749 4.1735 4.1735 4.2651 4.2651 5.9367 5.9367 6.3757 6.3757 6.5010 6.5010 8.4311 8.4311 9.1757 9.1757 9.2452 9.2452 9.5335 9.5335 9.5637 9.5637 k = 0.1020 0.1020 0.2882 ( 4884 PWs) bands (ev): -24.1927 -24.1927 -24.1655 -24.1655 -7.9221 -7.9221 -7.8419 -7.8419 -7.6659 -7.6659 -7.6531 -7.6531 -7.5761 -7.5761 -7.5443 -7.5443 -4.0944 -4.0944 -3.8439 -3.8439 -2.3227 -2.3227 -2.2183 -2.2183 -2.1552 -2.1552 -1.9323 -1.9323 -1.5676 -1.5676 -1.4772 -1.4772 -1.3446 -1.3446 -1.3140 -1.3140 -1.1643 -1.1643 -0.9530 -0.9530 3.1848 3.1848 4.2493 4.2493 4.3191 4.3191 5.8941 5.8941 6.4326 6.4326 6.5646 6.5646 8.2973 8.2973 9.1367 9.1367 9.1812 9.1812 9.4528 9.4528 9.5887 9.5887 k = 0.0918 0.0918 0.2882 ( 4892 PWs) bands (ev): -24.1931 -24.1931 -24.1653 -24.1653 -7.9219 -7.9219 -7.8398 -7.8398 -7.6649 -7.6649 -7.6535 -7.6535 -7.5766 -7.5766 -7.5430 -7.5430 -4.1052 -4.1052 -3.8489 -3.8489 -2.3260 -2.3260 -2.2241 -2.2241 -2.1561 -2.1561 -1.9375 -1.9375 -1.5591 -1.5591 -1.4779 -1.4779 -1.3414 -1.3414 -1.3158 -1.3158 -1.1698 -1.1698 -0.9513 -0.9513 3.1935 3.1935 4.3236 4.3236 4.3740 4.3740 5.8486 5.8486 6.4885 6.4885 6.6267 6.6267 8.1698 8.1698 9.0718 9.0718 9.1292 9.1292 9.3745 9.3745 9.6350 9.6350 k = 0.0816 0.0816 0.2882 ( 4894 PWs) bands (ev): -24.1934 -24.1934 -24.1651 -24.1651 -7.9216 -7.9216 -7.8378 -7.8378 -7.6644 -7.6644 -7.6535 -7.6535 -7.5772 -7.5772 -7.5417 -7.5417 -4.1151 -4.1151 -3.8535 -3.8535 -2.3292 -2.3292 -2.2291 -2.2291 -2.1569 -2.1569 -1.9422 -1.9422 -1.5497 -1.5497 -1.4786 -1.4786 -1.3391 -1.3391 -1.3182 -1.3182 -1.1760 -1.1760 -0.9484 -0.9484 3.2011 3.2011 4.3954 4.3954 4.4292 4.4292 5.8014 5.8014 6.5427 6.5427 6.6866 6.6866 8.0497 8.0497 9.0010 9.0010 9.0805 9.0805 9.2999 9.2999 9.6916 9.6916 k = 0.0714 0.0714 0.2882 ( 4894 PWs) bands (ev): -24.1937 -24.1937 -24.1650 -24.1650 -7.9214 -7.9214 -7.8359 -7.8359 -7.6642 -7.6642 -7.6533 -7.6533 -7.5778 -7.5778 -7.5405 -7.5405 -4.1240 -4.1240 -3.8576 -3.8576 -2.3323 -2.3323 -2.2335 -2.2335 -2.1576 -2.1576 -1.9466 -1.9466 -1.5396 -1.5396 -1.4792 -1.4792 -1.3380 -1.3380 -1.3210 -1.3210 -1.1824 -1.1824 -0.9450 -0.9450 3.2076 3.2076 4.4636 4.4636 4.4838 4.4838 5.7534 5.7534 6.5942 6.5942 6.7434 6.7434 7.9384 7.9384 8.9317 8.9317 9.0344 9.0344 9.2300 9.2300 9.7515 9.7515 k = 0.0612 0.0612 0.2882 ( 4886 PWs) bands (ev): -24.1939 -24.1939 -24.1648 -24.1648 -7.9211 -7.9211 -7.8343 -7.8343 -7.6642 -7.6642 -7.6529 -7.6529 -7.5784 -7.5784 -7.5393 -7.5393 -4.1318 -4.1318 -3.8613 -3.8613 -2.3351 -2.3351 -2.2371 -2.2371 -2.1581 -2.1581 -1.9504 -1.9504 -1.5290 -1.5290 -1.4797 -1.4797 -1.3389 -1.3389 -1.3234 -1.3234 -1.1884 -1.1884 -0.9413 -0.9413 3.2130 3.2130 4.5269 4.5269 4.5371 4.5371 5.7059 5.7059 6.6420 6.6420 6.7964 6.7964 7.8373 7.8373 8.8667 8.8667 8.9925 8.9925 9.1659 9.1659 9.8104 9.8104 k = 0.0510 0.0510 0.2882 ( 4884 PWs) bands (ev): -24.1941 -24.1941 -24.1647 -24.1647 -7.9209 -7.9209 -7.8329 -7.8329 -7.6644 -7.6644 -7.6524 -7.6524 -7.5789 -7.5789 -7.5383 -7.5383 -4.1385 -4.1385 -3.8645 -3.8645 -2.3376 -2.3376 -2.2402 -2.2402 -2.1585 -2.1585 -1.9537 -1.9537 -1.5183 -1.5183 -1.4801 -1.4801 -1.3426 -1.3426 -1.3244 -1.3244 -1.1937 -1.1937 -0.9376 -0.9376 3.2175 3.2175 4.5834 4.5834 4.5883 4.5883 5.6601 5.6601 6.6851 6.6851 6.8443 6.8443 7.7479 7.7479 8.8076 8.8076 8.9562 8.9562 9.1088 9.1088 9.8653 9.8653 k = 0.0408 0.0408 0.2882 ( 4880 PWs) bands (ev): -24.1943 -24.1943 -24.1646 -24.1646 -7.9207 -7.9207 -7.8317 -7.8317 -7.6647 -7.6647 -7.6518 -7.6518 -7.5794 -7.5794 -7.5375 -7.5375 -4.1440 -4.1440 -3.8671 -3.8671 -2.3398 -2.3398 -2.2426 -2.2426 -2.1588 -2.1588 -1.9565 -1.9565 -1.5078 -1.5078 -1.4805 -1.4805 -1.3484 -1.3484 -1.3245 -1.3245 -1.1980 -1.1980 -0.9343 -0.9343 3.2211 3.2211 4.6311 4.6311 4.6363 4.6363 5.6177 5.6177 6.7223 6.7223 6.8859 6.8859 7.6718 7.6718 8.7562 8.7562 8.9261 8.9261 9.0597 9.0597 9.9137 9.9137 k = 0.0306 0.0306 0.2882 ( 4884 PWs) bands (ev): -24.1944 -24.1944 -24.1645 -24.1645 -7.9206 -7.9206 -7.8307 -7.8307 -7.6650 -7.6650 -7.6513 -7.6513 -7.5798 -7.5798 -7.5368 -7.5368 -4.1484 -4.1484 -3.8691 -3.8691 -2.3415 -2.3415 -2.2445 -2.2445 -2.1591 -2.1591 -1.9587 -1.9587 -1.4983 -1.4983 -1.4806 -1.4806 -1.3550 -1.3550 -1.3241 -1.3241 -1.2013 -1.2013 -0.9315 -0.9315 3.2238 3.2238 4.6707 4.6707 4.6771 4.6771 5.5809 5.5809 6.7527 6.7527 6.9202 6.9202 7.6105 7.6105 8.7141 8.7141 8.9027 8.9027 9.0198 9.0198 9.9538 9.9538 k = 0.0204 0.0204 0.2882 ( 4886 PWs) bands (ev): -24.1946 -24.1946 -24.1645 -24.1645 -7.9205 -7.9205 -7.8301 -7.8301 -7.6653 -7.6653 -7.6510 -7.6510 -7.5802 -7.5802 -7.5363 -7.5363 -4.1515 -4.1515 -3.8706 -3.8706 -2.3429 -2.3429 -2.2458 -2.2458 -2.1593 -2.1593 -1.9602 -1.9602 -1.4907 -1.4907 -1.4804 -1.4804 -1.3612 -1.3612 -1.3237 -1.3237 -1.2036 -1.2036 -0.9294 -0.9294 3.2258 3.2258 4.7010 4.7010 4.7079 4.7079 5.5519 5.5519 6.7752 6.7752 6.9457 6.9457 7.5656 7.5656 8.6828 8.6828 8.8861 8.8861 8.9902 8.9902 9.9837 9.9837 k = 0.0102 0.0102 0.2882 ( 4882 PWs) bands (ev): -24.1946 -24.1946 -24.1644 -24.1644 -7.9204 -7.9204 -7.8297 -7.8297 -7.6654 -7.6654 -7.6507 -7.6507 -7.5803 -7.5803 -7.5360 -7.5360 -4.1534 -4.1534 -3.8715 -3.8715 -2.3437 -2.3437 -2.2465 -2.2465 -2.1594 -2.1594 -1.9611 -1.9611 -1.4863 -1.4863 -1.4796 -1.4796 -1.3656 -1.3656 -1.3234 -1.3234 -1.2050 -1.2050 -0.9281 -0.9281 3.2269 3.2269 4.7201 4.7201 4.7273 4.7273 5.5333 5.5333 6.7891 6.7891 6.9615 6.9615 7.5380 7.5380 8.6634 8.6634 8.8762 8.8762 8.9719 8.9719 10.0021 10.0021 k = 0.0000 0.0000 0.2882 ( 4886 PWs) bands (ev): -24.1946 -24.1946 -24.1644 -24.1644 -7.9204 -7.9204 -7.8295 -7.8295 -7.6655 -7.6655 -7.6506 -7.6506 -7.5804 -7.5804 -7.5359 -7.5359 -4.1540 -4.1540 -3.8718 -3.8718 -2.3440 -2.3440 -2.2467 -2.2467 -2.1595 -2.1595 -1.9614 -1.9614 -1.4851 -1.4851 -1.4789 -1.4789 -1.3672 -1.3672 -1.3233 -1.3233 -1.2055 -1.2055 -0.9276 -0.9276 3.2273 3.2273 4.7266 4.7266 4.7340 4.7340 5.5268 5.5268 6.7938 6.7938 6.9669 6.9669 7.5288 7.5288 8.6568 8.6568 8.8730 8.8730 8.9657 8.9657 10.0084 10.0084 k = 0.0000 0.5000-0.0000 ( 4890 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9137 -7.9137 -7.9137 -7.9137 -7.6588 -7.6588 -7.6588 -7.6588 -7.5706 -7.5706 -7.5706 -7.5706 -3.7885 -3.7885 -3.7885 -3.7885 -2.1303 -2.1303 -2.1303 -2.1303 -1.9829 -1.9829 -1.9829 -1.9829 -1.4636 -1.4636 -1.4636 -1.4636 -1.4317 -1.4317 -1.4317 -1.4317 -1.1187 -1.1187 -1.1187 -1.1187 2.5430 2.5430 2.5430 2.5430 5.5278 5.5278 5.5278 5.5278 6.0294 6.0294 6.0294 6.0294 8.5920 8.5920 8.5920 8.5920 9.9816 9.9816 9.9816 9.9816 10.5619 10.5619 k = 0.0000 0.5000 0.0144 ( 4892 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9137 -7.9137 -7.9137 -7.9137 -7.6588 -7.6588 -7.6588 -7.6588 -7.5706 -7.5706 -7.5706 -7.5706 -3.7885 -3.7885 -3.7885 -3.7885 -2.1303 -2.1303 -2.1303 -2.1303 -1.9829 -1.9829 -1.9829 -1.9829 -1.4636 -1.4636 -1.4636 -1.4636 -1.4317 -1.4317 -1.4317 -1.4317 -1.1186 -1.1186 -1.1186 -1.1186 2.5421 2.5421 2.5421 2.5421 5.5298 5.5298 5.5298 5.5298 6.0293 6.0293 6.0293 6.0293 8.5896 8.5896 8.5896 8.5896 9.9711 9.9711 9.9711 9.9711 10.5777 10.5777 k = 0.0000 0.5000 0.0288 ( 4878 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9137 -7.9137 -7.9137 -7.9137 -7.6588 -7.6588 -7.6588 -7.6588 -7.5705 -7.5705 -7.5705 -7.5705 -3.7884 -3.7884 -3.7884 -3.7884 -2.1303 -2.1303 -2.1303 -2.1303 -1.9828 -1.9828 -1.9828 -1.9828 -1.4636 -1.4636 -1.4636 -1.4636 -1.4317 -1.4317 -1.4317 -1.4317 -1.1184 -1.1184 -1.1184 -1.1184 2.5394 2.5394 2.5394 2.5394 5.5358 5.5358 5.5358 5.5358 6.0291 6.0291 6.0291 6.0291 8.5823 8.5823 8.5823 8.5823 9.9428 9.9428 9.9428 9.9428 10.6216 10.6216 k = 0.0000 0.5000 0.0432 ( 4876 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9138 -7.9138 -7.9138 -7.9138 -7.6588 -7.6588 -7.6588 -7.6588 -7.5705 -7.5705 -7.5705 -7.5705 -3.7882 -3.7882 -3.7882 -3.7882 -2.1303 -2.1303 -2.1303 -2.1303 -1.9827 -1.9827 -1.9827 -1.9827 -1.4636 -1.4636 -1.4636 -1.4636 -1.4317 -1.4317 -1.4317 -1.4317 -1.1180 -1.1180 -1.1180 -1.1180 2.5349 2.5349 2.5349 2.5349 5.5458 5.5458 5.5458 5.5458 6.0288 6.0288 6.0288 6.0288 8.5702 8.5702 8.5702 8.5702 9.9034 9.9034 9.9034 9.9034 10.6868 10.6869 k = 0.0000 0.5000 0.0576 ( 4872 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9139 -7.9139 -7.9139 -7.9139 -7.6589 -7.6589 -7.6589 -7.6589 -7.5703 -7.5703 -7.5703 -7.5703 -3.7879 -3.7879 -3.7879 -3.7879 -2.1304 -2.1304 -2.1304 -2.1304 -1.9826 -1.9826 -1.9826 -1.9826 -1.4636 -1.4636 -1.4636 -1.4636 -1.4317 -1.4317 -1.4317 -1.4317 -1.1175 -1.1175 -1.1175 -1.1175 2.5289 2.5289 2.5289 2.5289 5.5593 5.5593 5.5593 5.5593 6.0283 6.0283 6.0283 6.0283 8.5536 8.5536 8.5536 8.5536 9.8590 9.8590 9.8590 9.8590 10.7663 10.7663 k = 0.0000 0.5000 0.0720 ( 4876 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9141 -7.9141 -7.9141 -7.9141 -7.6590 -7.6590 -7.6590 -7.6590 -7.5702 -7.5702 -7.5702 -7.5702 -3.7875 -3.7875 -3.7875 -3.7875 -2.1304 -2.1304 -2.1304 -2.1304 -1.9825 -1.9825 -1.9825 -1.9825 -1.4636 -1.4636 -1.4636 -1.4636 -1.4317 -1.4317 -1.4317 -1.4317 -1.1169 -1.1169 -1.1169 -1.1169 2.5214 2.5214 2.5214 2.5214 5.5762 5.5762 5.5762 5.5762 6.0278 6.0278 6.0278 6.0278 8.5326 8.5326 8.5326 8.5326 9.8138 9.8138 9.8138 9.8138 10.8450 10.8451 k = 0.0000 0.5000 0.0865 ( 4878 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9142 -7.9142 -7.9142 -7.9142 -7.6590 -7.6590 -7.6590 -7.6590 -7.5700 -7.5700 -7.5700 -7.5700 -3.7871 -3.7871 -3.7871 -3.7871 -2.1304 -2.1304 -2.1304 -2.1304 -1.9823 -1.9823 -1.9823 -1.9823 -1.4636 -1.4636 -1.4636 -1.4636 -1.4317 -1.4317 -1.4317 -1.4317 -1.1161 -1.1161 -1.1161 -1.1161 2.5127 2.5127 2.5127 2.5127 5.5961 5.5961 5.5961 5.5961 6.0273 6.0273 6.0273 6.0273 8.5076 8.5076 8.5076 8.5076 9.7701 9.7701 9.7701 9.7701 10.8811 10.8811 k = 0.0000 0.5000 0.1009 ( 4884 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9144 -7.9144 -7.9144 -7.9144 -7.6591 -7.6591 -7.6591 -7.6591 -7.5699 -7.5699 -7.5699 -7.5699 -3.7867 -3.7867 -3.7867 -3.7867 -2.1305 -2.1305 -2.1305 -2.1305 -1.9822 -1.9822 -1.9822 -1.9822 -1.4636 -1.4636 -1.4636 -1.4636 -1.4318 -1.4318 -1.4318 -1.4318 -1.1153 -1.1153 -1.1153 -1.1153 2.5030 2.5030 2.5030 2.5030 5.6185 5.6185 5.6185 5.6185 6.0268 6.0268 6.0268 6.0268 8.4791 8.4791 8.4791 8.4791 9.7295 9.7295 9.7295 9.7295 10.9093 10.9093 k = 0.0000 0.5000 0.1153 ( 4880 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9146 -7.9146 -7.9146 -7.9146 -7.6592 -7.6592 -7.6592 -7.6592 -7.5697 -7.5697 -7.5697 -7.5697 -3.7862 -3.7862 -3.7862 -3.7862 -2.1305 -2.1305 -2.1305 -2.1305 -1.9820 -1.9820 -1.9820 -1.9820 -1.4637 -1.4637 -1.4637 -1.4637 -1.4318 -1.4318 -1.4318 -1.4318 -1.1144 -1.1144 -1.1144 -1.1144 2.4927 2.4927 2.4927 2.4927 5.6428 5.6428 5.6428 5.6428 6.0264 6.0264 6.0264 6.0264 8.4477 8.4477 8.4477 8.4477 9.6927 9.6927 9.6927 9.6927 10.9398 10.9398 k = 0.0000 0.5000 0.1297 ( 4880 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9148 -7.9148 -7.9148 -7.9148 -7.6593 -7.6593 -7.6593 -7.6593 -7.5694 -7.5694 -7.5694 -7.5694 -3.7856 -3.7856 -3.7856 -3.7856 -2.1306 -2.1306 -2.1306 -2.1306 -1.9818 -1.9818 -1.9818 -1.9818 -1.4637 -1.4637 -1.4637 -1.4637 -1.4318 -1.4318 -1.4318 -1.4318 -1.1134 -1.1134 -1.1134 -1.1134 2.4818 2.4818 2.4818 2.4818 5.6685 5.6685 5.6685 5.6685 6.0262 6.0262 6.0262 6.0262 8.4141 8.4141 8.4141 8.4141 9.6599 9.6599 9.6599 9.6599 10.9732 10.9732 k = 0.0000 0.5000 0.1441 ( 4896 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9151 -7.9151 -7.9151 -7.9151 -7.6594 -7.6594 -7.6594 -7.6594 -7.5692 -7.5692 -7.5692 -7.5692 -3.7851 -3.7851 -3.7851 -3.7851 -2.1307 -2.1307 -2.1307 -2.1307 -1.9816 -1.9816 -1.9816 -1.9816 -1.4637 -1.4637 -1.4637 -1.4637 -1.4319 -1.4319 -1.4319 -1.4319 -1.1125 -1.1125 -1.1125 -1.1125 2.4708 2.4708 2.4708 2.4708 5.6949 5.6949 5.6949 5.6949 6.0262 6.0262 6.0262 6.0262 8.3792 8.3792 8.3792 8.3792 9.6311 9.6311 9.6311 9.6311 11.0093 11.0093 k = 0.0000 0.5000 0.1585 ( 4876 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9152 -7.9152 -7.9152 -7.9152 -7.6595 -7.6595 -7.6595 -7.6595 -7.5690 -7.5690 -7.5690 -7.5690 -3.7845 -3.7845 -3.7845 -3.7845 -2.1307 -2.1307 -2.1307 -2.1307 -1.9813 -1.9813 -1.9813 -1.9813 -1.4637 -1.4637 -1.4637 -1.4637 -1.4318 -1.4318 -1.4318 -1.4318 -1.1115 -1.1115 -1.1115 -1.1115 2.4599 2.4599 2.4599 2.4599 5.7213 5.7213 5.7213 5.7213 6.0267 6.0267 6.0267 6.0267 8.3437 8.3437 8.3437 8.3437 9.6063 9.6063 9.6063 9.6063 11.0476 11.0476 k = 0.0000 0.5000 0.1729 ( 4884 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9155 -7.9155 -7.9155 -7.9155 -7.6595 -7.6595 -7.6595 -7.6595 -7.5688 -7.5688 -7.5688 -7.5688 -3.7840 -3.7840 -3.7840 -3.7840 -2.1307 -2.1307 -2.1307 -2.1307 -1.9811 -1.9811 -1.9811 -1.9811 -1.4637 -1.4637 -1.4637 -1.4637 -1.4319 -1.4319 -1.4319 -1.4319 -1.1105 -1.1105 -1.1105 -1.1105 2.4494 2.4494 2.4494 2.4494 5.7471 5.7471 5.7471 5.7471 6.0275 6.0275 6.0275 6.0275 8.3086 8.3086 8.3086 8.3086 9.5852 9.5852 9.5852 9.5852 11.0876 11.0876 k = 0.0000 0.5000 0.1873 ( 4886 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9157 -7.9157 -7.9157 -7.9157 -7.6596 -7.6596 -7.6596 -7.6596 -7.5686 -7.5686 -7.5686 -7.5686 -3.7835 -3.7835 -3.7835 -3.7835 -2.1308 -2.1308 -2.1308 -2.1308 -1.9810 -1.9810 -1.9810 -1.9810 -1.4637 -1.4637 -1.4637 -1.4637 -1.4319 -1.4319 -1.4319 -1.4319 -1.1096 -1.1096 -1.1096 -1.1096 2.4394 2.4394 2.4394 2.4394 5.7714 5.7714 5.7714 5.7714 6.0288 6.0288 6.0288 6.0288 8.2748 8.2748 8.2748 8.2748 9.5674 9.5674 9.5674 9.5674 11.1285 11.1285 k = 0.0000 0.5000 0.2017 ( 4890 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9159 -7.9159 -7.9159 -7.9159 -7.6597 -7.6597 -7.6597 -7.6597 -7.5684 -7.5684 -7.5684 -7.5684 -3.7831 -3.7831 -3.7831 -3.7831 -2.1308 -2.1308 -2.1308 -2.1308 -1.9808 -1.9808 -1.9808 -1.9808 -1.4638 -1.4638 -1.4638 -1.4638 -1.4319 -1.4319 -1.4319 -1.4319 -1.1088 -1.1088 -1.1088 -1.1088 2.4303 2.4303 2.4303 2.4303 5.7936 5.7936 5.7936 5.7936 6.0307 6.0307 6.0307 6.0307 8.2432 8.2432 8.2432 8.2432 9.5527 9.5527 9.5527 9.5527 11.1694 11.1694 k = 0.0000 0.5000 0.2161 ( 4898 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9160 -7.9160 -7.9160 -7.9160 -7.6598 -7.6598 -7.6598 -7.6598 -7.5683 -7.5683 -7.5683 -7.5683 -3.7826 -3.7826 -3.7826 -3.7826 -2.1309 -2.1309 -2.1309 -2.1309 -1.9806 -1.9806 -1.9806 -1.9806 -1.4638 -1.4638 -1.4638 -1.4638 -1.4320 -1.4320 -1.4320 -1.4320 -1.1080 -1.1080 -1.1080 -1.1080 2.4223 2.4223 2.4223 2.4223 5.8131 5.8131 5.8131 5.8131 6.0330 6.0330 6.0330 6.0330 8.2147 8.2147 8.2147 8.2147 9.5408 9.5408 9.5408 9.5408 11.2091 11.2091 k = 0.0000 0.5000 0.2306 ( 4902 PWs) bands (ev): -24.1773 -24.1773 -24.1773 -24.1773 -7.9162 -7.9162 -7.9162 -7.9162 -7.6598 -7.6598 -7.6598 -7.6598 -7.5681 -7.5681 -7.5681 -7.5681 -3.7823 -3.7823 -3.7823 -3.7823 -2.1309 -2.1309 -2.1309 -2.1309 -1.9805 -1.9805 -1.9805 -1.9805 -1.4638 -1.4638 -1.4638 -1.4638 -1.4320 -1.4320 -1.4320 -1.4320 -1.1074 -1.1074 -1.1074 -1.1074 2.4154 2.4154 2.4154 2.4154 5.8293 5.8293 5.8293 5.8293 6.0356 6.0356 6.0356 6.0356 8.1901 8.1901 8.1901 8.1901 9.5314 9.5314 9.5314 9.5314 11.2459 11.2459 k = 0.0000 0.5000 0.2450 ( 4910 PWs) bands (ev): -24.1773 -24.1773 -24.1773 -24.1773 -7.9163 -7.9163 -7.9163 -7.9163 -7.6599 -7.6599 -7.6599 -7.6599 -7.5680 -7.5680 -7.5680 -7.5680 -3.7820 -3.7820 -3.7820 -3.7820 -2.1310 -2.1310 -2.1310 -2.1310 -1.9804 -1.9804 -1.9804 -1.9804 -1.4638 -1.4638 -1.4638 -1.4638 -1.4320 -1.4320 -1.4320 -1.4320 -1.1069 -1.1069 -1.1069 -1.1069 2.4099 2.4099 2.4099 2.4099 5.8421 5.8421 5.8421 5.8421 6.0382 6.0382 6.0382 6.0382 8.1702 8.1702 8.1702 8.1702 9.5243 9.5243 9.5243 9.5243 11.2780 11.2780 k = 0.0000 0.5000 0.2594 ( 4916 PWs) bands (ev): -24.1773 -24.1773 -24.1773 -24.1773 -7.9164 -7.9164 -7.9164 -7.9164 -7.6599 -7.6599 -7.6599 -7.6599 -7.5680 -7.5680 -7.5680 -7.5680 -3.7818 -3.7818 -3.7818 -3.7818 -2.1310 -2.1310 -2.1310 -2.1310 -1.9803 -1.9803 -1.9803 -1.9803 -1.4639 -1.4639 -1.4639 -1.4639 -1.4320 -1.4320 -1.4320 -1.4320 -1.1065 -1.1065 -1.1065 -1.1065 2.4059 2.4059 2.4059 2.4059 5.8512 5.8512 5.8512 5.8512 6.0404 6.0404 6.0404 6.0404 8.1555 8.1555 8.1555 8.1555 9.5194 9.5194 9.5194 9.5194 11.3031 11.3032 k = 0.0000 0.5000 0.2738 ( 4904 PWs) bands (ev): -24.1773 -24.1773 -24.1773 -24.1773 -7.9164 -7.9164 -7.9164 -7.9164 -7.6599 -7.6599 -7.6599 -7.6599 -7.5679 -7.5679 -7.5679 -7.5679 -3.7817 -3.7817 -3.7817 -3.7817 -2.1310 -2.1310 -2.1310 -2.1310 -1.9803 -1.9803 -1.9803 -1.9803 -1.4638 -1.4638 -1.4638 -1.4638 -1.4320 -1.4320 -1.4320 -1.4320 -1.1062 -1.1062 -1.1062 -1.1062 2.4035 2.4035 2.4035 2.4035 5.8566 5.8566 5.8566 5.8566 6.0420 6.0420 6.0420 6.0420 8.1465 8.1465 8.1465 8.1465 9.5165 9.5165 9.5165 9.5165 11.3194 11.3194 k = 0.0000 0.5000 0.2882 ( 4896 PWs) bands (ev): -24.1772 -24.1772 -24.1772 -24.1772 -7.9164 -7.9164 -7.9164 -7.9164 -7.6599 -7.6599 -7.6599 -7.6599 -7.5679 -7.5679 -7.5679 -7.5679 -3.7816 -3.7816 -3.7816 -3.7816 -2.1310 -2.1310 -2.1310 -2.1310 -1.9802 -1.9802 -1.9802 -1.9802 -1.4638 -1.4638 -1.4638 -1.4638 -1.4320 -1.4320 -1.4320 -1.4320 -1.1062 -1.1062 -1.1062 -1.1062 2.4027 2.4027 2.4027 2.4027 5.8584 5.8584 5.8584 5.8584 6.0425 6.0425 6.0425 6.0425 8.1434 8.1434 8.1434 8.1434 9.5155 9.5155 9.5155 9.5155 11.3250 11.3250 k = 0.5000 0.5000-0.0000 ( 4880 PWs) bands (ev): -24.1749 -24.1749 -24.1749 -24.1749 -7.9180 -7.9180 -7.9180 -7.9180 -7.6705 -7.6705 -7.6705 -7.6705 -7.5838 -7.5838 -7.5838 -7.5838 -3.7110 -3.7110 -3.7110 -3.7110 -2.2544 -2.2544 -2.2544 -2.2544 -1.7956 -1.7956 -1.7956 -1.7956 -1.5449 -1.5449 -1.5449 -1.5449 -1.2613 -1.2613 -1.2613 -1.2613 -0.9865 -0.9865 -0.9865 -0.9865 2.5848 2.5848 2.5848 2.5848 4.6617 4.6617 4.6617 4.6617 4.7339 4.7339 4.7339 4.7339 9.0972 9.0972 9.0972 9.0972 9.1165 9.1165 9.1165 9.1165 11.9538 11.9538 k = 0.5000 0.5000 0.0144 ( 4868 PWs) bands (ev): -24.1749 -24.1749 -24.1749 -24.1749 -7.9180 -7.9180 -7.9180 -7.9180 -7.6705 -7.6705 -7.6705 -7.6705 -7.5838 -7.5838 -7.5838 -7.5838 -3.7110 -3.7110 -3.7110 -3.7110 -2.2544 -2.2544 -2.2544 -2.2544 -1.7956 -1.7956 -1.7956 -1.7956 -1.5449 -1.5449 -1.5449 -1.5449 -1.2613 -1.2613 -1.2613 -1.2613 -0.9863 -0.9863 -0.9863 -0.9863 2.5848 2.5848 2.5848 2.5848 4.6605 4.6605 4.6605 4.6605 4.7339 4.7339 4.7339 4.7339 9.1000 9.1000 9.1000 9.1000 9.1207 9.1207 9.1207 9.1207 11.9438 11.9438 k = 0.5000 0.5000 0.0288 ( 4876 PWs) bands (ev): -24.1749 -24.1749 -24.1749 -24.1749 -7.9180 -7.9180 -7.9180 -7.9180 -7.6705 -7.6705 -7.6705 -7.6705 -7.5839 -7.5839 -7.5839 -7.5839 -3.7111 -3.7111 -3.7111 -3.7111 -2.2544 -2.2544 -2.2544 -2.2544 -1.7955 -1.7955 -1.7955 -1.7955 -1.5449 -1.5449 -1.5449 -1.5449 -1.2613 -1.2613 -1.2613 -1.2613 -0.9859 -0.9859 -0.9859 -0.9859 2.5845 2.5845 2.5845 2.5845 4.6570 4.6570 4.6570 4.6570 4.7340 4.7340 4.7340 4.7340 9.1083 9.1083 9.1083 9.1083 9.1337 9.1337 9.1337 9.1337 11.9145 11.9145 k = 0.5000 0.5000 0.0432 ( 4876 PWs) bands (ev): -24.1749 -24.1749 -24.1749 -24.1749 -7.9180 -7.9180 -7.9180 -7.9180 -7.6705 -7.6705 -7.6705 -7.6705 -7.5839 -7.5839 -7.5839 -7.5839 -3.7112 -3.7112 -3.7112 -3.7112 -2.2544 -2.2544 -2.2544 -2.2544 -1.7954 -1.7954 -1.7954 -1.7954 -1.5448 -1.5448 -1.5448 -1.5448 -1.2613 -1.2613 -1.2613 -1.2613 -0.9853 -0.9853 -0.9853 -0.9853 2.5842 2.5842 2.5842 2.5842 4.6511 4.6511 4.6511 4.6511 4.7341 4.7341 4.7341 4.7341 9.1215 9.1215 9.1215 9.1215 9.1556 9.1556 9.1556 9.1556 11.8673 11.8673 k = 0.5000 0.5000 0.0576 ( 4896 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9179 -7.9179 -7.9179 -7.9179 -7.6705 -7.6705 -7.6705 -7.6705 -7.5840 -7.5840 -7.5840 -7.5840 -3.7114 -3.7114 -3.7114 -3.7114 -2.2545 -2.2545 -2.2545 -2.2545 -1.7953 -1.7953 -1.7953 -1.7953 -1.5449 -1.5449 -1.5449 -1.5449 -1.2613 -1.2613 -1.2613 -1.2613 -0.9844 -0.9844 -0.9844 -0.9844 2.5837 2.5837 2.5837 2.5837 4.6430 4.6430 4.6430 4.6430 4.7344 4.7344 4.7344 4.7344 9.1394 9.1394 9.1394 9.1394 9.1864 9.1864 9.1864 9.1864 11.8046 11.8046 k = 0.5000 0.5000 0.0720 ( 4904 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9179 -7.9179 -7.9179 -7.9179 -7.6704 -7.6704 -7.6704 -7.6704 -7.5841 -7.5841 -7.5841 -7.5841 -3.7116 -3.7116 -3.7116 -3.7116 -2.2545 -2.2545 -2.2545 -2.2545 -1.7951 -1.7951 -1.7951 -1.7951 -1.5449 -1.5449 -1.5449 -1.5449 -1.2614 -1.2614 -1.2614 -1.2614 -0.9833 -0.9833 -0.9833 -0.9833 2.5830 2.5830 2.5830 2.5830 4.6329 4.6329 4.6329 4.6329 4.7348 4.7348 4.7348 4.7348 9.1621 9.1621 9.1621 9.1621 9.2257 9.2257 9.2257 9.2257 11.7290 11.7290 k = 0.5000 0.5000 0.0865 ( 4912 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9178 -7.9178 -7.9178 -7.9178 -7.6704 -7.6704 -7.6704 -7.6704 -7.5843 -7.5843 -7.5843 -7.5843 -3.7118 -3.7118 -3.7118 -3.7118 -2.2545 -2.2545 -2.2545 -2.2545 -1.7948 -1.7948 -1.7948 -1.7948 -1.5448 -1.5448 -1.5448 -1.5448 -1.2614 -1.2614 -1.2614 -1.2614 -0.9821 -0.9821 -0.9821 -0.9821 2.5823 2.5823 2.5823 2.5823 4.6212 4.6212 4.6212 4.6212 4.7354 4.7354 4.7354 4.7354 9.1896 9.1896 9.1896 9.1896 9.2728 9.2728 9.2728 9.2728 11.6431 11.6431 k = 0.5000 0.5000 0.1009 ( 4892 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9178 -7.9178 -7.9178 -7.9178 -7.6704 -7.6704 -7.6704 -7.6704 -7.5844 -7.5844 -7.5844 -7.5844 -3.7121 -3.7121 -3.7121 -3.7121 -2.2545 -2.2545 -2.2545 -2.2545 -1.7945 -1.7945 -1.7945 -1.7945 -1.5448 -1.5448 -1.5448 -1.5448 -1.2613 -1.2613 -1.2613 -1.2613 -0.9805 -0.9805 -0.9805 -0.9805 2.5815 2.5815 2.5815 2.5815 4.6080 4.6080 4.6080 4.6080 4.7361 4.7361 4.7361 4.7361 9.2217 9.2217 9.2217 9.2217 9.3273 9.3273 9.3273 9.3273 11.5493 11.5493 k = 0.5000 0.5000 0.1153 ( 4900 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9177 -7.9177 -7.9177 -7.9177 -7.6703 -7.6703 -7.6703 -7.6703 -7.5845 -7.5845 -7.5845 -7.5845 -3.7123 -3.7123 -3.7123 -3.7123 -2.2545 -2.2545 -2.2545 -2.2545 -1.7943 -1.7943 -1.7943 -1.7943 -1.5448 -1.5448 -1.5448 -1.5448 -1.2614 -1.2614 -1.2614 -1.2614 -0.9790 -0.9790 -0.9790 -0.9790 2.5806 2.5806 2.5806 2.5806 4.5939 4.5939 4.5939 4.5939 4.7369 4.7369 4.7369 4.7369 9.2585 9.2585 9.2585 9.2585 9.3882 9.3882 9.3882 9.3882 11.4497 11.4497 k = 0.5000 0.5000 0.1297 ( 4908 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9176 -7.9176 -7.9176 -7.9176 -7.6703 -7.6703 -7.6703 -7.6703 -7.5847 -7.5847 -7.5847 -7.5847 -3.7126 -3.7126 -3.7126 -3.7126 -2.2545 -2.2545 -2.2545 -2.2545 -1.7940 -1.7940 -1.7940 -1.7940 -1.5447 -1.5447 -1.5447 -1.5447 -1.2614 -1.2614 -1.2614 -1.2614 -0.9773 -0.9773 -0.9773 -0.9773 2.5796 2.5796 2.5796 2.5796 4.5791 4.5791 4.5791 4.5791 4.7379 4.7379 4.7379 4.7379 9.2997 9.2997 9.2997 9.2997 9.4550 9.4550 9.4550 9.4550 11.3461 11.3461 k = 0.5000 0.5000 0.1441 ( 4896 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9176 -7.9176 -7.9176 -7.9176 -7.6703 -7.6703 -7.6703 -7.6703 -7.5848 -7.5848 -7.5848 -7.5848 -3.7129 -3.7129 -3.7129 -3.7129 -2.2545 -2.2545 -2.2545 -2.2545 -1.7936 -1.7936 -1.7936 -1.7936 -1.5447 -1.5447 -1.5447 -1.5447 -1.2614 -1.2614 -1.2614 -1.2614 -0.9756 -0.9756 -0.9756 -0.9756 2.5787 2.5787 2.5787 2.5787 4.5641 4.5641 4.5641 4.5641 4.7388 4.7388 4.7388 4.7388 9.3452 9.3452 9.3452 9.3452 9.5265 9.5265 9.5265 9.5265 11.2403 11.2403 k = 0.5000 0.5000 0.1585 ( 4896 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9175 -7.9175 -7.9175 -7.9175 -7.6702 -7.6702 -7.6702 -7.6702 -7.5850 -7.5850 -7.5850 -7.5850 -3.7132 -3.7132 -3.7132 -3.7132 -2.2545 -2.2545 -2.2545 -2.2545 -1.7933 -1.7933 -1.7933 -1.7933 -1.5446 -1.5446 -1.5446 -1.5446 -1.2614 -1.2614 -1.2614 -1.2614 -0.9739 -0.9739 -0.9739 -0.9739 2.5777 2.5777 2.5777 2.5777 4.5492 4.5492 4.5492 4.5492 4.7399 4.7399 4.7399 4.7399 9.3948 9.3948 9.3948 9.3948 9.6016 9.6016 9.6016 9.6016 11.1335 11.1335 k = 0.5000 0.5000 0.1729 ( 4896 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9174 -7.9174 -7.9174 -7.9174 -7.6702 -7.6702 -7.6702 -7.6702 -7.5851 -7.5851 -7.5851 -7.5851 -3.7135 -3.7135 -3.7135 -3.7135 -2.2545 -2.2545 -2.2545 -2.2545 -1.7930 -1.7930 -1.7930 -1.7930 -1.5446 -1.5446 -1.5446 -1.5446 -1.2614 -1.2614 -1.2614 -1.2614 -0.9722 -0.9722 -0.9722 -0.9722 2.5768 2.5768 2.5768 2.5768 4.5348 4.5348 4.5348 4.5348 4.7409 4.7409 4.7409 4.7409 9.4482 9.4482 9.4482 9.4482 9.6793 9.6793 9.6793 9.6793 11.0270 11.0270 k = 0.5000 0.5000 0.1873 ( 4896 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9173 -7.9173 -7.9173 -7.9173 -7.6701 -7.6701 -7.6701 -7.6701 -7.5853 -7.5853 -7.5853 -7.5853 -3.7138 -3.7138 -3.7138 -3.7138 -2.2545 -2.2545 -2.2545 -2.2545 -1.7928 -1.7928 -1.7928 -1.7928 -1.5445 -1.5445 -1.5445 -1.5445 -1.2614 -1.2614 -1.2614 -1.2614 -0.9706 -0.9706 -0.9706 -0.9706 2.5759 2.5759 2.5759 2.5759 4.5212 4.5212 4.5212 4.5212 4.7418 4.7418 4.7418 4.7418 9.5048 9.5048 9.5048 9.5048 9.7577 9.7577 9.7577 9.7577 10.9220 10.9220 k = 0.5000 0.5000 0.2017 ( 4888 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9173 -7.9173 -7.9173 -7.9173 -7.6701 -7.6701 -7.6701 -7.6701 -7.5854 -7.5854 -7.5854 -7.5854 -3.7140 -3.7140 -3.7140 -3.7140 -2.2545 -2.2545 -2.2545 -2.2545 -1.7925 -1.7925 -1.7925 -1.7925 -1.5445 -1.5445 -1.5445 -1.5445 -1.2613 -1.2613 -1.2613 -1.2613 -0.9691 -0.9691 -0.9691 -0.9691 2.5750 2.5750 2.5750 2.5750 4.5088 4.5088 4.5088 4.5088 4.7427 4.7427 4.7427 4.7427 9.5640 9.5640 9.5640 9.5640 9.8352 9.8352 9.8352 9.8352 10.8199 10.8199 k = 0.5000 0.5000 0.2161 ( 4888 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9172 -7.9172 -7.9172 -7.9172 -7.6701 -7.6701 -7.6701 -7.6701 -7.5855 -7.5855 -7.5855 -7.5855 -3.7143 -3.7143 -3.7143 -3.7143 -2.2545 -2.2545 -2.2545 -2.2545 -1.7922 -1.7922 -1.7922 -1.7922 -1.5445 -1.5445 -1.5445 -1.5445 -1.2613 -1.2613 -1.2613 -1.2613 -0.9678 -0.9678 -0.9678 -0.9678 2.5743 2.5743 2.5743 2.5743 4.4978 4.4978 4.4978 4.4978 4.7435 4.7435 4.7435 4.7435 9.6248 9.6248 9.6248 9.6248 9.9094 9.9094 9.9094 9.9094 10.7221 10.7221 k = 0.5000 0.5000 0.2306 ( 4896 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9172 -7.9172 -7.9172 -7.9172 -7.6701 -7.6701 -7.6701 -7.6701 -7.5856 -7.5856 -7.5856 -7.5856 -3.7144 -3.7144 -3.7144 -3.7144 -2.2545 -2.2545 -2.2545 -2.2545 -1.7921 -1.7921 -1.7921 -1.7921 -1.5445 -1.5445 -1.5445 -1.5445 -1.2614 -1.2614 -1.2614 -1.2614 -0.9667 -0.9667 -0.9667 -0.9667 2.5737 2.5737 2.5737 2.5737 4.4885 4.4885 4.4885 4.4885 4.7442 4.7442 4.7442 4.7442 9.6855 9.6855 9.6855 9.6855 9.9776 9.9776 9.9776 9.9776 10.6306 10.6306 k = 0.5000 0.5000 0.2450 ( 4904 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9171 -7.9171 -7.9171 -7.9171 -7.6700 -7.6700 -7.6700 -7.6700 -7.5857 -7.5857 -7.5857 -7.5857 -3.7146 -3.7146 -3.7146 -3.7146 -2.2546 -2.2546 -2.2546 -2.2546 -1.7919 -1.7919 -1.7919 -1.7919 -1.5445 -1.5445 -1.5445 -1.5445 -1.2614 -1.2614 -1.2614 -1.2614 -0.9657 -0.9657 -0.9657 -0.9657 2.5732 2.5732 2.5732 2.5732 4.4810 4.4810 4.4810 4.4810 4.7448 4.7448 4.7448 4.7448 9.7434 9.7434 9.7434 9.7434 10.0364 10.0364 10.0364 10.0364 10.5485 10.5485 k = 0.5000 0.5000 0.2594 ( 4916 PWs) bands (ev): -24.1750 -24.1750 -24.1750 -24.1750 -7.9171 -7.9171 -7.9171 -7.9171 -7.6700 -7.6700 -7.6700 -7.6700 -7.5858 -7.5858 -7.5858 -7.5858 -3.7147 -3.7147 -3.7147 -3.7147 -2.2546 -2.2546 -2.2546 -2.2546 -1.7918 -1.7918 -1.7918 -1.7918 -1.5445 -1.5445 -1.5445 -1.5445 -1.2614 -1.2614 -1.2614 -1.2614 -0.9651 -0.9651 -0.9651 -0.9651 2.5728 2.5728 2.5728 2.5728 4.4756 4.4756 4.4756 4.4756 4.7452 4.7452 4.7452 4.7452 9.7940 9.7940 9.7940 9.7940 10.0822 10.0822 10.0822 10.0822 10.4805 10.4805 k = 0.5000 0.5000 0.2738 ( 4944 PWs) bands (ev): -24.1751 -24.1751 -24.1751 -24.1751 -7.9171 -7.9171 -7.9171 -7.9171 -7.6700 -7.6700 -7.6700 -7.6700 -7.5859 -7.5859 -7.5859 -7.5859 -3.7148 -3.7148 -3.7148 -3.7148 -2.2546 -2.2546 -2.2546 -2.2546 -1.7918 -1.7918 -1.7918 -1.7918 -1.5445 -1.5445 -1.5445 -1.5445 -1.2615 -1.2615 -1.2615 -1.2615 -0.9648 -0.9648 -0.9648 -0.9648 2.5726 2.5726 2.5726 2.5726 4.4723 4.4723 4.4723 4.4723 4.7454 4.7454 4.7454 4.7454 9.8301 9.8301 9.8301 9.8301 10.1116 10.1116 10.1116 10.1116 10.4338 10.4338 k = 0.5000 0.5000 0.2882 ( 4944 PWs) bands (ev): -24.1751 -24.1751 -24.1751 -24.1751 -7.9171 -7.9171 -7.9171 -7.9171 -7.6700 -7.6700 -7.6700 -7.6700 -7.5859 -7.5859 -7.5859 -7.5859 -3.7148 -3.7148 -3.7148 -3.7148 -2.2546 -2.2546 -2.2546 -2.2546 -1.7918 -1.7918 -1.7918 -1.7918 -1.5445 -1.5445 -1.5445 -1.5445 -1.2615 -1.2615 -1.2615 -1.2615 -0.9646 -0.9646 -0.9646 -0.9646 2.5725 2.5725 2.5725 2.5725 4.4712 4.4712 4.4712 4.4712 4.7455 4.7455 4.7455 4.7455 9.8435 9.8435 9.8435 9.8435 10.1217 10.1217 10.1217 10.1217 10.4168 10.4168 Writing output data file KCdAs.save init_run : 0.77s CPU 1.04s WALL ( 1 calls) electrons : 252.79s CPU 256.36s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.06s CPU 0.10s WALL ( 1 calls) Called by electrons: c_bands : 252.79s CPU 256.35s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.23s CPU 0.37s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.07s WALL ( 307 calls) cegterg : 236.36s CPU 239.37s WALL ( 653 calls) Called by sum_band: Called by *egterg: h_psi : 111.55s CPU 113.82s WALL ( 11329 calls) s_psi : 8.65s CPU 8.64s WALL ( 11329 calls) g_psi : 0.32s CPU 0.36s WALL ( 10369 calls) cdiaghg : 97.04s CPU 98.39s WALL ( 10676 calls) cegterg:over : 10.77s CPU 10.86s WALL ( 10369 calls) cegterg:upda : 11.48s CPU 11.29s WALL ( 10369 calls) cegterg:last : 4.73s CPU 4.66s WALL ( 1498 calls) cdiaghg:chol : 5.63s CPU 5.70s WALL ( 10676 calls) cdiaghg:inve : 4.02s CPU 3.94s WALL ( 10676 calls) cdiaghg:para : 6.67s CPU 6.58s WALL ( 21352 calls) Called by h_psi: h_psi:vloc : 91.66s CPU 93.58s WALL ( 11329 calls) h_psi:vnl : 19.40s CPU 19.80s WALL ( 11329 calls) add_vuspsi : 9.97s CPU 10.33s WALL ( 11329 calls) General routines calbec : 9.39s CPU 9.43s WALL ( 11329 calls) fft : 0.02s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 77.16s CPU 78.62s WALL ( 1077568 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.20s CPU 0.26s WALL ( 614 calls) Parallel routines fft_scatter : 32.92s CPU 32.80s WALL ( 1077591 calls) PWSCF : 4m32.56s CPU 4m48.06s WALL This run was terminated on: 20:39:19 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=