Program PWSCF v.5.3.0 (svn rev. 11974) starts on 1Feb2017 at 8:18: 8 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./NbTe4.save/ file Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P renormalized file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P 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: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 44 32 9 1978 1194 181 Max 45 33 10 1982 1216 185 Sum 3181 2305 657 142599 86857 13087 bravais-lattice index = 14 lattice parameter (alat) = 12.2520 a.u. unit-cell volume = 1935.1211 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 2 number of electrons = 74.00 number of Kohn-Sham states= 88 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 267.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.252038 celldm(2)= 1.000000 celldm(3)= 1.052163 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 1.052163 ) 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 0.950423 ) PseudoPot. # 1 for Nb read from file: /users/gautes/Pseudo/Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: c1e153ab096482f446ae869583c6ae55 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1227 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 Te read from file: /users/gautes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 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 Nb 13.00 92.90640 Nb( 1.00) Te 6.00 127.60000 Te( 1.00) 16 Sym. Ops., with inversion, found ( 8 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5260816 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5260816 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) f =( 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5260816 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.5260816 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(10) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.5260816 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.5260816 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) f =( 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.5260816 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) f =( 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.5260816 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) 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= 251 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039841 k( 2) = ( 0.0000000 0.0200000 -0.0000000), wk = 0.0039841 k( 3) = ( 0.0000000 0.0400000 -0.0000000), wk = 0.0039841 k( 4) = ( 0.0000000 0.0600000 -0.0000000), wk = 0.0039841 k( 5) = ( 0.0000000 0.0800000 -0.0000000), wk = 0.0039841 k( 6) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0039841 k( 7) = ( 0.0000000 0.1200000 -0.0000000), wk = 0.0039841 k( 8) = ( 0.0000000 0.1400000 -0.0000000), wk = 0.0039841 k( 9) = ( 0.0000000 0.1600000 -0.0000000), wk = 0.0039841 k( 10) = ( 0.0000000 0.1800000 -0.0000000), wk = 0.0039841 k( 11) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0039841 k( 12) = ( 0.0000000 0.2200000 -0.0000000), wk = 0.0039841 k( 13) = ( 0.0000000 0.2400000 -0.0000000), wk = 0.0039841 k( 14) = ( 0.0000000 0.2600000 -0.0000000), wk = 0.0039841 k( 15) = ( 0.0000000 0.2800000 -0.0000000), wk = 0.0039841 k( 16) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0039841 k( 17) = ( 0.0000000 0.3200000 -0.0000000), wk = 0.0039841 k( 18) = ( 0.0000000 0.3400000 -0.0000000), wk = 0.0039841 k( 19) = ( 0.0000000 0.3600000 -0.0000000), wk = 0.0039841 k( 20) = ( 0.0000000 0.3800000 -0.0000000), wk = 0.0039841 k( 21) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0039841 k( 22) = ( 0.0000000 0.4200000 -0.0000000), wk = 0.0039841 k( 23) = ( 0.0000000 0.4400000 -0.0000000), wk = 0.0039841 k( 24) = ( 0.0000000 0.4600000 -0.0000000), wk = 0.0039841 k( 25) = ( 0.0000000 0.4800000 -0.0000000), wk = 0.0039841 k( 26) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0039841 k( 27) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0039841 k( 28) = ( 0.0200000 0.5000000 -0.0000000), wk = 0.0039841 k( 29) = ( 0.0400000 0.5000000 -0.0000000), wk = 0.0039841 k( 30) = ( 0.0600000 0.5000000 -0.0000000), wk = 0.0039841 k( 31) = ( 0.0800000 0.5000000 -0.0000000), wk = 0.0039841 k( 32) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0039841 k( 33) = ( 0.1200000 0.5000000 -0.0000000), wk = 0.0039841 k( 34) = ( 0.1400000 0.5000000 -0.0000000), wk = 0.0039841 k( 35) = ( 0.1600000 0.5000000 -0.0000000), wk = 0.0039841 k( 36) = ( 0.1800000 0.5000000 -0.0000000), wk = 0.0039841 k( 37) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0039841 k( 38) = ( 0.2200000 0.5000000 -0.0000000), wk = 0.0039841 k( 39) = ( 0.2400000 0.5000000 -0.0000000), wk = 0.0039841 k( 40) = ( 0.2600000 0.5000000 -0.0000000), wk = 0.0039841 k( 41) = ( 0.2800000 0.5000000 -0.0000000), wk = 0.0039841 k( 42) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0039841 k( 43) = ( 0.3200000 0.5000000 -0.0000000), wk = 0.0039841 k( 44) = ( 0.3400000 0.5000000 -0.0000000), wk = 0.0039841 k( 45) = ( 0.3600000 0.5000000 -0.0000000), wk = 0.0039841 k( 46) = ( 0.3800000 0.5000000 -0.0000000), wk = 0.0039841 k( 47) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0039841 k( 48) = ( 0.4200000 0.5000000 -0.0000000), wk = 0.0039841 k( 49) = ( 0.4400000 0.5000000 -0.0000000), wk = 0.0039841 k( 50) = ( 0.4600000 0.5000000 -0.0000000), wk = 0.0039841 k( 51) = ( 0.4800000 0.5000000 -0.0000000), wk = 0.0039841 k( 52) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0039841 k( 53) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0039841 k( 54) = ( 0.4857143 0.4857143 -0.0000000), wk = 0.0039841 k( 55) = ( 0.4714286 0.4714286 -0.0000000), wk = 0.0039841 k( 56) = ( 0.4571429 0.4571429 -0.0000000), wk = 0.0039841 k( 57) = ( 0.4428571 0.4428571 -0.0000000), wk = 0.0039841 k( 58) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0039841 k( 59) = ( 0.4142857 0.4142857 -0.0000000), wk = 0.0039841 k( 60) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0039841 k( 61) = ( 0.3857143 0.3857143 -0.0000000), wk = 0.0039841 k( 62) = ( 0.3714286 0.3714286 -0.0000000), wk = 0.0039841 k( 63) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0039841 k( 64) = ( 0.3428571 0.3428571 -0.0000000), wk = 0.0039841 k( 65) = ( 0.3285714 0.3285714 -0.0000000), wk = 0.0039841 k( 66) = ( 0.3142857 0.3142857 -0.0000000), wk = 0.0039841 k( 67) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0039841 k( 68) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0039841 k( 69) = ( 0.2714286 0.2714286 -0.0000000), wk = 0.0039841 k( 70) = ( 0.2571429 0.2571429 -0.0000000), wk = 0.0039841 k( 71) = ( 0.2428571 0.2428571 -0.0000000), wk = 0.0039841 k( 72) = ( 0.2285714 0.2285714 -0.0000000), wk = 0.0039841 k( 73) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0039841 k( 74) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0039841 k( 75) = ( 0.1857143 0.1857143 -0.0000000), wk = 0.0039841 k( 76) = ( 0.1714286 0.1714286 -0.0000000), wk = 0.0039841 k( 77) = ( 0.1571429 0.1571429 -0.0000000), wk = 0.0039841 k( 78) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0039841 k( 79) = ( 0.1285714 0.1285714 -0.0000000), wk = 0.0039841 k( 80) = ( 0.1142857 0.1142857 -0.0000000), wk = 0.0039841 k( 81) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0039841 k( 82) = ( 0.0857143 0.0857143 -0.0000000), wk = 0.0039841 k( 83) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0039841 k( 84) = ( 0.0571429 0.0571429 -0.0000000), wk = 0.0039841 k( 85) = ( 0.0428571 0.0428571 -0.0000000), wk = 0.0039841 k( 86) = ( 0.0285714 0.0285714 -0.0000000), wk = 0.0039841 k( 87) = ( 0.0142857 0.0142857 -0.0000000), wk = 0.0039841 k( 88) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039841 k( 89) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039841 k( 90) = ( 0.0000000 0.0000000 0.0198005), wk = 0.0039841 k( 91) = ( 0.0000000 0.0000000 0.0396010), wk = 0.0039841 k( 92) = ( 0.0000000 0.0000000 0.0594014), wk = 0.0039841 k( 93) = ( 0.0000000 0.0000000 0.0792019), wk = 0.0039841 k( 94) = ( 0.0000000 0.0000000 0.0990024), wk = 0.0039841 k( 95) = ( 0.0000000 0.0000000 0.1188029), wk = 0.0039841 k( 96) = ( 0.0000000 0.0000000 0.1386033), wk = 0.0039841 k( 97) = ( 0.0000000 0.0000000 0.1584038), wk = 0.0039841 k( 98) = ( 0.0000000 0.0000000 0.1782043), wk = 0.0039841 k( 99) = ( 0.0000000 0.0000000 0.1980048), wk = 0.0039841 k( 100) = ( 0.0000000 0.0000000 0.2178053), wk = 0.0039841 k( 101) = ( 0.0000000 0.0000000 0.2376057), wk = 0.0039841 k( 102) = ( 0.0000000 0.0000000 0.2574062), wk = 0.0039841 k( 103) = ( 0.0000000 0.0000000 0.2772067), wk = 0.0039841 k( 104) = ( 0.0000000 0.0000000 0.2970072), wk = 0.0039841 k( 105) = ( 0.0000000 0.0000000 0.3168076), wk = 0.0039841 k( 106) = ( 0.0000000 0.0000000 0.3366081), wk = 0.0039841 k( 107) = ( 0.0000000 0.0000000 0.3564086), wk = 0.0039841 k( 108) = ( 0.0000000 0.0000000 0.3762091), wk = 0.0039841 k( 109) = ( 0.0000000 0.0000000 0.3960096), wk = 0.0039841 k( 110) = ( 0.0000000 0.0000000 0.4158100), wk = 0.0039841 k( 111) = ( 0.0000000 0.0000000 0.4356105), wk = 0.0039841 k( 112) = ( 0.0000000 0.0000000 0.4554110), wk = 0.0039841 k( 113) = ( 0.0000000 0.0000000 0.4752115), wk = 0.0039841 k( 114) = ( 0.0000000 0.0000000 0.4752115), wk = 0.0039841 k( 115) = ( 0.0000000 0.0200000 0.4752115), wk = 0.0039841 k( 116) = ( 0.0000000 0.0400000 0.4752115), wk = 0.0039841 k( 117) = ( 0.0000000 0.0600000 0.4752115), wk = 0.0039841 k( 118) = ( 0.0000000 0.0800000 0.4752115), wk = 0.0039841 k( 119) = ( 0.0000000 0.1000000 0.4752115), wk = 0.0039841 k( 120) = ( 0.0000000 0.1200000 0.4752115), wk = 0.0039841 k( 121) = ( 0.0000000 0.1400000 0.4752115), wk = 0.0039841 k( 122) = ( 0.0000000 0.1600000 0.4752115), wk = 0.0039841 k( 123) = ( 0.0000000 0.1800000 0.4752115), wk = 0.0039841 k( 124) = ( 0.0000000 0.2000000 0.4752115), wk = 0.0039841 k( 125) = ( 0.0000000 0.2200000 0.4752115), wk = 0.0039841 k( 126) = ( 0.0000000 0.2400000 0.4752115), wk = 0.0039841 k( 127) = ( 0.0000000 0.2600000 0.4752115), wk = 0.0039841 k( 128) = ( 0.0000000 0.2800000 0.4752115), wk = 0.0039841 k( 129) = ( 0.0000000 0.3000000 0.4752115), wk = 0.0039841 k( 130) = ( 0.0000000 0.3200000 0.4752115), wk = 0.0039841 k( 131) = ( 0.0000000 0.3400000 0.4752115), wk = 0.0039841 k( 132) = ( 0.0000000 0.3600000 0.4752115), wk = 0.0039841 k( 133) = ( 0.0000000 0.3800000 0.4752115), wk = 0.0039841 k( 134) = ( 0.0000000 0.4000000 0.4752115), wk = 0.0039841 k( 135) = ( 0.0000000 0.4200000 0.4752115), wk = 0.0039841 k( 136) = ( 0.0000000 0.4400000 0.4752115), wk = 0.0039841 k( 137) = ( 0.0000000 0.4600000 0.4752115), wk = 0.0039841 k( 138) = ( 0.0000000 0.4800000 0.4752115), wk = 0.0039841 k( 139) = ( 0.0000000 0.5000000 0.4752115), wk = 0.0039841 k( 140) = ( 0.0000000 0.5000000 0.4752115), wk = 0.0039841 k( 141) = ( 0.0200000 0.5000000 0.4752115), wk = 0.0039841 k( 142) = ( 0.0400000 0.5000000 0.4752115), wk = 0.0039841 k( 143) = ( 0.0600000 0.5000000 0.4752115), wk = 0.0039841 k( 144) = ( 0.0800000 0.5000000 0.4752115), wk = 0.0039841 k( 145) = ( 0.1000000 0.5000000 0.4752115), wk = 0.0039841 k( 146) = ( 0.1200000 0.5000000 0.4752115), wk = 0.0039841 k( 147) = ( 0.1400000 0.5000000 0.4752115), wk = 0.0039841 k( 148) = ( 0.1600000 0.5000000 0.4752115), wk = 0.0039841 k( 149) = ( 0.1800000 0.5000000 0.4752115), wk = 0.0039841 k( 150) = ( 0.2000000 0.5000000 0.4752115), wk = 0.0039841 k( 151) = ( 0.2200000 0.5000000 0.4752115), wk = 0.0039841 k( 152) = ( 0.2400000 0.5000000 0.4752115), wk = 0.0039841 k( 153) = ( 0.2600000 0.5000000 0.4752115), wk = 0.0039841 k( 154) = ( 0.2800000 0.5000000 0.4752115), wk = 0.0039841 k( 155) = ( 0.3000000 0.5000000 0.4752115), wk = 0.0039841 k( 156) = ( 0.3200000 0.5000000 0.4752115), wk = 0.0039841 k( 157) = ( 0.3400000 0.5000000 0.4752115), wk = 0.0039841 k( 158) = ( 0.3600000 0.5000000 0.4752115), wk = 0.0039841 k( 159) = ( 0.3800000 0.5000000 0.4752115), wk = 0.0039841 k( 160) = ( 0.4000000 0.5000000 0.4752115), wk = 0.0039841 k( 161) = ( 0.4200000 0.5000000 0.4752115), wk = 0.0039841 k( 162) = ( 0.4400000 0.5000000 0.4752115), wk = 0.0039841 k( 163) = ( 0.4600000 0.5000000 0.4752115), wk = 0.0039841 k( 164) = ( 0.4800000 0.5000000 0.4752115), wk = 0.0039841 k( 165) = ( 0.5000000 0.5000000 0.4752115), wk = 0.0039841 k( 166) = ( 0.5000000 0.5000000 0.4752115), wk = 0.0039841 k( 167) = ( 0.4857143 0.4857143 0.4752115), wk = 0.0039841 k( 168) = ( 0.4714286 0.4714286 0.4752115), wk = 0.0039841 k( 169) = ( 0.4571429 0.4571429 0.4752115), wk = 0.0039841 k( 170) = ( 0.4428571 0.4428571 0.4752115), wk = 0.0039841 k( 171) = ( 0.4285714 0.4285714 0.4752115), wk = 0.0039841 k( 172) = ( 0.4142857 0.4142857 0.4752115), wk = 0.0039841 k( 173) = ( 0.4000000 0.4000000 0.4752115), wk = 0.0039841 k( 174) = ( 0.3857143 0.3857143 0.4752115), wk = 0.0039841 k( 175) = ( 0.3714286 0.3714286 0.4752115), wk = 0.0039841 k( 176) = ( 0.3571429 0.3571429 0.4752115), wk = 0.0039841 k( 177) = ( 0.3428571 0.3428571 0.4752115), wk = 0.0039841 k( 178) = ( 0.3285714 0.3285714 0.4752115), wk = 0.0039841 k( 179) = ( 0.3142857 0.3142857 0.4752115), wk = 0.0039841 k( 180) = ( 0.3000000 0.3000000 0.4752115), wk = 0.0039841 k( 181) = ( 0.2857143 0.2857143 0.4752115), wk = 0.0039841 k( 182) = ( 0.2714286 0.2714286 0.4752115), wk = 0.0039841 k( 183) = ( 0.2571429 0.2571429 0.4752115), wk = 0.0039841 k( 184) = ( 0.2428571 0.2428571 0.4752115), wk = 0.0039841 k( 185) = ( 0.2285714 0.2285714 0.4752115), wk = 0.0039841 k( 186) = ( 0.2142857 0.2142857 0.4752115), wk = 0.0039841 k( 187) = ( 0.2000000 0.2000000 0.4752115), wk = 0.0039841 k( 188) = ( 0.1857143 0.1857143 0.4752115), wk = 0.0039841 k( 189) = ( 0.1714286 0.1714286 0.4752115), wk = 0.0039841 k( 190) = ( 0.1571429 0.1571429 0.4752115), wk = 0.0039841 k( 191) = ( 0.1428571 0.1428571 0.4752115), wk = 0.0039841 k( 192) = ( 0.1285714 0.1285714 0.4752115), wk = 0.0039841 k( 193) = ( 0.1142857 0.1142857 0.4752115), wk = 0.0039841 k( 194) = ( 0.1000000 0.1000000 0.4752115), wk = 0.0039841 k( 195) = ( 0.0857143 0.0857143 0.4752115), wk = 0.0039841 k( 196) = ( 0.0714286 0.0714286 0.4752115), wk = 0.0039841 k( 197) = ( 0.0571429 0.0571429 0.4752115), wk = 0.0039841 k( 198) = ( 0.0428571 0.0428571 0.4752115), wk = 0.0039841 k( 199) = ( 0.0285714 0.0285714 0.4752115), wk = 0.0039841 k( 200) = ( 0.0142857 0.0142857 0.4752115), wk = 0.0039841 k( 201) = ( 0.0000000 0.0000000 0.4752115), wk = 0.0039841 k( 202) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0039841 k( 203) = ( 0.0000000 0.5000000 0.0198005), wk = 0.0039841 k( 204) = ( 0.0000000 0.5000000 0.0396010), wk = 0.0039841 k( 205) = ( 0.0000000 0.5000000 0.0594014), wk = 0.0039841 k( 206) = ( 0.0000000 0.5000000 0.0792019), wk = 0.0039841 k( 207) = ( 0.0000000 0.5000000 0.0990024), wk = 0.0039841 k( 208) = ( 0.0000000 0.5000000 0.1188029), wk = 0.0039841 k( 209) = ( 0.0000000 0.5000000 0.1386033), wk = 0.0039841 k( 210) = ( 0.0000000 0.5000000 0.1584038), wk = 0.0039841 k( 211) = ( 0.0000000 0.5000000 0.1782043), wk = 0.0039841 k( 212) = ( 0.0000000 0.5000000 0.1980048), wk = 0.0039841 k( 213) = ( 0.0000000 0.5000000 0.2178053), wk = 0.0039841 k( 214) = ( 0.0000000 0.5000000 0.2376057), wk = 0.0039841 k( 215) = ( 0.0000000 0.5000000 0.2574062), wk = 0.0039841 k( 216) = ( 0.0000000 0.5000000 0.2772067), wk = 0.0039841 k( 217) = ( 0.0000000 0.5000000 0.2970072), wk = 0.0039841 k( 218) = ( 0.0000000 0.5000000 0.3168076), wk = 0.0039841 k( 219) = ( 0.0000000 0.5000000 0.3366081), wk = 0.0039841 k( 220) = ( 0.0000000 0.5000000 0.3564086), wk = 0.0039841 k( 221) = ( 0.0000000 0.5000000 0.3762091), wk = 0.0039841 k( 222) = ( 0.0000000 0.5000000 0.3960096), wk = 0.0039841 k( 223) = ( 0.0000000 0.5000000 0.4158100), wk = 0.0039841 k( 224) = ( 0.0000000 0.5000000 0.4356105), wk = 0.0039841 k( 225) = ( 0.0000000 0.5000000 0.4554110), wk = 0.0039841 k( 226) = ( 0.0000000 0.5000000 0.4752115), wk = 0.0039841 k( 227) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0039841 k( 228) = ( 0.5000000 0.5000000 0.0198005), wk = 0.0039841 k( 229) = ( 0.5000000 0.5000000 0.0396010), wk = 0.0039841 k( 230) = ( 0.5000000 0.5000000 0.0594014), wk = 0.0039841 k( 231) = ( 0.5000000 0.5000000 0.0792019), wk = 0.0039841 k( 232) = ( 0.5000000 0.5000000 0.0990024), wk = 0.0039841 k( 233) = ( 0.5000000 0.5000000 0.1188029), wk = 0.0039841 k( 234) = ( 0.5000000 0.5000000 0.1386033), wk = 0.0039841 k( 235) = ( 0.5000000 0.5000000 0.1584038), wk = 0.0039841 k( 236) = ( 0.5000000 0.5000000 0.1782043), wk = 0.0039841 k( 237) = ( 0.5000000 0.5000000 0.1980048), wk = 0.0039841 k( 238) = ( 0.5000000 0.5000000 0.2178053), wk = 0.0039841 k( 239) = ( 0.5000000 0.5000000 0.2376057), wk = 0.0039841 k( 240) = ( 0.5000000 0.5000000 0.2574062), wk = 0.0039841 k( 241) = ( 0.5000000 0.5000000 0.2772067), wk = 0.0039841 k( 242) = ( 0.5000000 0.5000000 0.2970072), wk = 0.0039841 k( 243) = ( 0.5000000 0.5000000 0.3168076), wk = 0.0039841 k( 244) = ( 0.5000000 0.5000000 0.3366081), wk = 0.0039841 k( 245) = ( 0.5000000 0.5000000 0.3564086), wk = 0.0039841 k( 246) = ( 0.5000000 0.5000000 0.3762091), wk = 0.0039841 k( 247) = ( 0.5000000 0.5000000 0.3960096), wk = 0.0039841 k( 248) = ( 0.5000000 0.5000000 0.4158100), wk = 0.0039841 k( 249) = ( 0.5000000 0.5000000 0.4356105), wk = 0.0039841 k( 250) = ( 0.5000000 0.5000000 0.4554110), wk = 0.0039841 k( 251) = ( 0.5000000 0.5000000 0.4752115), wk = 0.0039841 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039841 k( 2) = ( 0.0000000 0.0200000 0.0000000), wk = 0.0039841 k( 3) = ( 0.0000000 0.0400000 0.0000000), wk = 0.0039841 k( 4) = ( 0.0000000 0.0600000 0.0000000), wk = 0.0039841 k( 5) = ( 0.0000000 0.0800000 0.0000000), wk = 0.0039841 k( 6) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0039841 k( 7) = ( 0.0000000 0.1200000 0.0000000), wk = 0.0039841 k( 8) = ( 0.0000000 0.1400000 -0.0000000), wk = 0.0039841 k( 9) = ( 0.0000000 0.1600000 0.0000000), wk = 0.0039841 k( 10) = ( 0.0000000 0.1800000 0.0000000), wk = 0.0039841 k( 11) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0039841 k( 12) = ( 0.0000000 0.2200000 -0.0000000), wk = 0.0039841 k( 13) = ( 0.0000000 0.2400000 0.0000000), wk = 0.0039841 k( 14) = ( 0.0000000 0.2600000 0.0000000), wk = 0.0039841 k( 15) = ( 0.0000000 0.2800000 -0.0000000), wk = 0.0039841 k( 16) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0039841 k( 17) = ( 0.0000000 0.3200000 0.0000000), wk = 0.0039841 k( 18) = ( 0.0000000 0.3400000 0.0000000), wk = 0.0039841 k( 19) = ( 0.0000000 0.3600000 0.0000000), wk = 0.0039841 k( 20) = ( 0.0000000 0.3800000 0.0000000), wk = 0.0039841 k( 21) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0039841 k( 22) = ( 0.0000000 0.4200000 -0.0000000), wk = 0.0039841 k( 23) = ( 0.0000000 0.4400000 -0.0000000), wk = 0.0039841 k( 24) = ( 0.0000000 0.4600000 -0.0000000), wk = 0.0039841 k( 25) = ( 0.0000000 0.4800000 0.0000000), wk = 0.0039841 k( 26) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0039841 k( 27) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0039841 k( 28) = ( 0.0200000 0.5000000 0.0000000), wk = 0.0039841 k( 29) = ( 0.0400000 0.5000000 0.0000000), wk = 0.0039841 k( 30) = ( 0.0600000 0.5000000 0.0000000), wk = 0.0039841 k( 31) = ( 0.0800000 0.5000000 0.0000000), wk = 0.0039841 k( 32) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0039841 k( 33) = ( 0.1200000 0.5000000 0.0000000), wk = 0.0039841 k( 34) = ( 0.1400000 0.5000000 0.0000000), wk = 0.0039841 k( 35) = ( 0.1600000 0.5000000 0.0000000), wk = 0.0039841 k( 36) = ( 0.1800000 0.5000000 0.0000000), wk = 0.0039841 k( 37) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0039841 k( 38) = ( 0.2200000 0.5000000 0.0000000), wk = 0.0039841 k( 39) = ( 0.2400000 0.5000000 0.0000000), wk = 0.0039841 k( 40) = ( 0.2600000 0.5000000 0.0000000), wk = 0.0039841 k( 41) = ( 0.2800000 0.5000000 0.0000000), wk = 0.0039841 k( 42) = ( 0.3000000 0.5000000 0.0000000), wk = 0.0039841 k( 43) = ( 0.3200000 0.5000000 0.0000000), wk = 0.0039841 k( 44) = ( 0.3400000 0.5000000 -0.0000000), wk = 0.0039841 k( 45) = ( 0.3600000 0.5000000 0.0000000), wk = 0.0039841 k( 46) = ( 0.3800000 0.5000000 -0.0000000), wk = 0.0039841 k( 47) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0039841 k( 48) = ( 0.4200000 0.5000000 0.0000000), wk = 0.0039841 k( 49) = ( 0.4400000 0.5000000 -0.0000000), wk = 0.0039841 k( 50) = ( 0.4600000 0.5000000 0.0000000), wk = 0.0039841 k( 51) = ( 0.4800000 0.5000000 0.0000000), wk = 0.0039841 k( 52) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0039841 k( 53) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0039841 k( 54) = ( 0.4857143 0.4857143 0.0000000), wk = 0.0039841 k( 55) = ( 0.4714286 0.4714286 0.0000000), wk = 0.0039841 k( 56) = ( 0.4571429 0.4571429 0.0000000), wk = 0.0039841 k( 57) = ( 0.4428571 0.4428571 0.0000000), wk = 0.0039841 k( 58) = ( 0.4285714 0.4285714 0.0000000), wk = 0.0039841 k( 59) = ( 0.4142857 0.4142857 -0.0000000), wk = 0.0039841 k( 60) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0039841 k( 61) = ( 0.3857143 0.3857143 0.0000000), wk = 0.0039841 k( 62) = ( 0.3714286 0.3714286 0.0000000), wk = 0.0039841 k( 63) = ( 0.3571429 0.3571429 0.0000000), wk = 0.0039841 k( 64) = ( 0.3428571 0.3428571 0.0000000), wk = 0.0039841 k( 65) = ( 0.3285714 0.3285714 -0.0000000), wk = 0.0039841 k( 66) = ( 0.3142857 0.3142857 -0.0000000), wk = 0.0039841 k( 67) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0039841 k( 68) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0039841 k( 69) = ( 0.2714286 0.2714286 0.0000000), wk = 0.0039841 k( 70) = ( 0.2571429 0.2571429 -0.0000000), wk = 0.0039841 k( 71) = ( 0.2428571 0.2428571 -0.0000000), wk = 0.0039841 k( 72) = ( 0.2285714 0.2285714 0.0000000), wk = 0.0039841 k( 73) = ( 0.2142857 0.2142857 0.0000000), wk = 0.0039841 k( 74) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0039841 k( 75) = ( 0.1857143 0.1857143 0.0000000), wk = 0.0039841 k( 76) = ( 0.1714286 0.1714286 0.0000000), wk = 0.0039841 k( 77) = ( 0.1571429 0.1571429 -0.0000000), wk = 0.0039841 k( 78) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0039841 k( 79) = ( 0.1285714 0.1285714 -0.0000000), wk = 0.0039841 k( 80) = ( 0.1142857 0.1142857 -0.0000000), wk = 0.0039841 k( 81) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0039841 k( 82) = ( 0.0857143 0.0857143 -0.0000000), wk = 0.0039841 k( 83) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0039841 k( 84) = ( 0.0571429 0.0571429 -0.0000000), wk = 0.0039841 k( 85) = ( 0.0428571 0.0428571 -0.0000000), wk = 0.0039841 k( 86) = ( 0.0285714 0.0285714 -0.0000000), wk = 0.0039841 k( 87) = ( 0.0142857 0.0142857 -0.0000000), wk = 0.0039841 k( 88) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039841 k( 89) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039841 k( 90) = ( 0.0000000 0.0000000 0.0208333), wk = 0.0039841 k( 91) = ( 0.0000000 0.0000000 0.0416667), wk = 0.0039841 k( 92) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0039841 k( 93) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0039841 k( 94) = ( 0.0000000 0.0000000 0.1041667), wk = 0.0039841 k( 95) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0039841 k( 96) = ( 0.0000000 0.0000000 0.1458333), wk = 0.0039841 k( 97) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0039841 k( 98) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0039841 k( 99) = ( 0.0000000 0.0000000 0.2083333), wk = 0.0039841 k( 100) = ( 0.0000000 0.0000000 0.2291667), wk = 0.0039841 k( 101) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0039841 k( 102) = ( 0.0000000 0.0000000 0.2708333), wk = 0.0039841 k( 103) = ( 0.0000000 0.0000000 0.2916667), wk = 0.0039841 k( 104) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0039841 k( 105) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0039841 k( 106) = ( 0.0000000 0.0000000 0.3541667), wk = 0.0039841 k( 107) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0039841 k( 108) = ( 0.0000000 0.0000000 0.3958333), wk = 0.0039841 k( 109) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0039841 k( 110) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0039841 k( 111) = ( 0.0000000 0.0000000 0.4583333), wk = 0.0039841 k( 112) = ( 0.0000000 0.0000000 0.4791667), wk = 0.0039841 k( 113) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0039841 k( 114) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0039841 k( 115) = ( 0.0000000 0.0200000 0.5000000), wk = 0.0039841 k( 116) = ( 0.0000000 0.0400000 0.5000000), wk = 0.0039841 k( 117) = ( 0.0000000 0.0600000 0.5000000), wk = 0.0039841 k( 118) = ( 0.0000000 0.0800000 0.5000000), wk = 0.0039841 k( 119) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0039841 k( 120) = ( 0.0000000 0.1200000 0.5000000), wk = 0.0039841 k( 121) = ( 0.0000000 0.1400000 0.5000000), wk = 0.0039841 k( 122) = ( 0.0000000 0.1600000 0.5000000), wk = 0.0039841 k( 123) = ( 0.0000000 0.1800000 0.5000000), wk = 0.0039841 k( 124) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0039841 k( 125) = ( 0.0000000 0.2200000 0.5000000), wk = 0.0039841 k( 126) = ( 0.0000000 0.2400000 0.5000000), wk = 0.0039841 k( 127) = ( 0.0000000 0.2600000 0.5000000), wk = 0.0039841 k( 128) = ( 0.0000000 0.2800000 0.5000000), wk = 0.0039841 k( 129) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0039841 k( 130) = ( 0.0000000 0.3200000 0.5000000), wk = 0.0039841 k( 131) = ( 0.0000000 0.3400000 0.5000000), wk = 0.0039841 k( 132) = ( 0.0000000 0.3600000 0.5000000), wk = 0.0039841 k( 133) = ( 0.0000000 0.3800000 0.5000000), wk = 0.0039841 k( 134) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0039841 k( 135) = ( 0.0000000 0.4200000 0.5000000), wk = 0.0039841 k( 136) = ( 0.0000000 0.4400000 0.5000000), wk = 0.0039841 k( 137) = ( 0.0000000 0.4600000 0.5000000), wk = 0.0039841 k( 138) = ( 0.0000000 0.4800000 0.5000000), wk = 0.0039841 k( 139) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0039841 k( 140) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0039841 k( 141) = ( 0.0200000 0.5000000 0.5000000), wk = 0.0039841 k( 142) = ( 0.0400000 0.5000000 0.5000000), wk = 0.0039841 k( 143) = ( 0.0600000 0.5000000 0.5000000), wk = 0.0039841 k( 144) = ( 0.0800000 0.5000000 0.5000000), wk = 0.0039841 k( 145) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0039841 k( 146) = ( 0.1200000 0.5000000 0.5000000), wk = 0.0039841 k( 147) = ( 0.1400000 0.5000000 0.5000000), wk = 0.0039841 k( 148) = ( 0.1600000 0.5000000 0.5000000), wk = 0.0039841 k( 149) = ( 0.1800000 0.5000000 0.5000000), wk = 0.0039841 k( 150) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0039841 k( 151) = ( 0.2200000 0.5000000 0.5000000), wk = 0.0039841 k( 152) = ( 0.2400000 0.5000000 0.5000000), wk = 0.0039841 k( 153) = ( 0.2600000 0.5000000 0.5000000), wk = 0.0039841 k( 154) = ( 0.2800000 0.5000000 0.5000000), wk = 0.0039841 k( 155) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0039841 k( 156) = ( 0.3200000 0.5000000 0.5000000), wk = 0.0039841 k( 157) = ( 0.3400000 0.5000000 0.5000000), wk = 0.0039841 k( 158) = ( 0.3600000 0.5000000 0.5000000), wk = 0.0039841 k( 159) = ( 0.3800000 0.5000000 0.5000000), wk = 0.0039841 k( 160) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0039841 k( 161) = ( 0.4200000 0.5000000 0.5000000), wk = 0.0039841 k( 162) = ( 0.4400000 0.5000000 0.5000000), wk = 0.0039841 k( 163) = ( 0.4600000 0.5000000 0.5000000), wk = 0.0039841 k( 164) = ( 0.4800000 0.5000000 0.5000000), wk = 0.0039841 k( 165) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0039841 k( 166) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0039841 k( 167) = ( 0.4857143 0.4857143 0.5000000), wk = 0.0039841 k( 168) = ( 0.4714286 0.4714286 0.5000000), wk = 0.0039841 k( 169) = ( 0.4571429 0.4571429 0.5000000), wk = 0.0039841 k( 170) = ( 0.4428571 0.4428571 0.5000000), wk = 0.0039841 k( 171) = ( 0.4285714 0.4285714 0.5000000), wk = 0.0039841 k( 172) = ( 0.4142857 0.4142857 0.5000000), wk = 0.0039841 k( 173) = ( 0.4000000 0.4000000 0.5000000), wk = 0.0039841 k( 174) = ( 0.3857143 0.3857143 0.5000000), wk = 0.0039841 k( 175) = ( 0.3714286 0.3714286 0.5000000), wk = 0.0039841 k( 176) = ( 0.3571429 0.3571429 0.5000000), wk = 0.0039841 k( 177) = ( 0.3428571 0.3428571 0.5000000), wk = 0.0039841 k( 178) = ( 0.3285714 0.3285714 0.5000000), wk = 0.0039841 k( 179) = ( 0.3142857 0.3142857 0.5000000), wk = 0.0039841 k( 180) = ( 0.3000000 0.3000000 0.5000000), wk = 0.0039841 k( 181) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0039841 k( 182) = ( 0.2714286 0.2714286 0.5000000), wk = 0.0039841 k( 183) = ( 0.2571429 0.2571429 0.5000000), wk = 0.0039841 k( 184) = ( 0.2428571 0.2428571 0.5000000), wk = 0.0039841 k( 185) = ( 0.2285714 0.2285714 0.5000000), wk = 0.0039841 k( 186) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0039841 k( 187) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0039841 k( 188) = ( 0.1857143 0.1857143 0.5000000), wk = 0.0039841 k( 189) = ( 0.1714286 0.1714286 0.5000000), wk = 0.0039841 k( 190) = ( 0.1571429 0.1571429 0.5000000), wk = 0.0039841 k( 191) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0039841 k( 192) = ( 0.1285714 0.1285714 0.5000000), wk = 0.0039841 k( 193) = ( 0.1142857 0.1142857 0.5000000), wk = 0.0039841 k( 194) = ( 0.1000000 0.1000000 0.5000000), wk = 0.0039841 k( 195) = ( 0.0857143 0.0857143 0.5000000), wk = 0.0039841 k( 196) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0039841 k( 197) = ( 0.0571429 0.0571429 0.5000000), wk = 0.0039841 k( 198) = ( 0.0428571 0.0428571 0.5000000), wk = 0.0039841 k( 199) = ( 0.0285714 0.0285714 0.5000000), wk = 0.0039841 k( 200) = ( 0.0142857 0.0142857 0.5000000), wk = 0.0039841 k( 201) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0039841 k( 202) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0039841 k( 203) = ( 0.0000000 0.5000000 0.0208333), wk = 0.0039841 k( 204) = ( 0.0000000 0.5000000 0.0416667), wk = 0.0039841 k( 205) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0039841 k( 206) = ( 0.0000000 0.5000000 0.0833333), wk = 0.0039841 k( 207) = ( 0.0000000 0.5000000 0.1041667), wk = 0.0039841 k( 208) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0039841 k( 209) = ( 0.0000000 0.5000000 0.1458333), wk = 0.0039841 k( 210) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0039841 k( 211) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0039841 k( 212) = ( 0.0000000 0.5000000 0.2083333), wk = 0.0039841 k( 213) = ( 0.0000000 0.5000000 0.2291667), wk = 0.0039841 k( 214) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0039841 k( 215) = ( 0.0000000 0.5000000 0.2708333), wk = 0.0039841 k( 216) = ( 0.0000000 0.5000000 0.2916667), wk = 0.0039841 k( 217) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0039841 k( 218) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0039841 k( 219) = ( 0.0000000 0.5000000 0.3541667), wk = 0.0039841 k( 220) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0039841 k( 221) = ( 0.0000000 0.5000000 0.3958333), wk = 0.0039841 k( 222) = ( 0.0000000 0.5000000 0.4166667), wk = 0.0039841 k( 223) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0039841 k( 224) = ( 0.0000000 0.5000000 0.4583333), wk = 0.0039841 k( 225) = ( 0.0000000 0.5000000 0.4791667), wk = 0.0039841 k( 226) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0039841 k( 227) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0039841 k( 228) = ( 0.5000000 0.5000000 0.0208333), wk = 0.0039841 k( 229) = ( 0.5000000 0.5000000 0.0416667), wk = 0.0039841 k( 230) = ( 0.5000000 0.5000000 0.0625000), wk = 0.0039841 k( 231) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0039841 k( 232) = ( 0.5000000 0.5000000 0.1041667), wk = 0.0039841 k( 233) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0039841 k( 234) = ( 0.5000000 0.5000000 0.1458333), wk = 0.0039841 k( 235) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0039841 k( 236) = ( 0.5000000 0.5000000 0.1875000), wk = 0.0039841 k( 237) = ( 0.5000000 0.5000000 0.2083333), wk = 0.0039841 k( 238) = ( 0.5000000 0.5000000 0.2291667), wk = 0.0039841 k( 239) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0039841 k( 240) = ( 0.5000000 0.5000000 0.2708333), wk = 0.0039841 k( 241) = ( 0.5000000 0.5000000 0.2916667), wk = 0.0039841 k( 242) = ( 0.5000000 0.5000000 0.3125000), wk = 0.0039841 k( 243) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0039841 k( 244) = ( 0.5000000 0.5000000 0.3541667), wk = 0.0039841 k( 245) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0039841 k( 246) = ( 0.5000000 0.5000000 0.3958333), wk = 0.0039841 k( 247) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0039841 k( 248) = ( 0.5000000 0.5000000 0.4375000), wk = 0.0039841 k( 249) = ( 0.5000000 0.5000000 0.4583333), wk = 0.0039841 k( 250) = ( 0.5000000 0.5000000 0.4791667), wk = 0.0039841 k( 251) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0039841 Dense grid: 142599 G-vectors FFT dimensions: ( 64, 64, 72) Smooth grid: 86857 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.44 Mb ( 324, 88) NL pseudopotentials 0.84 Mb ( 162, 340) Each V/rho on FFT grid 0.06 Mb ( 4096) Each G-vector array 0.02 Mb ( 1981) G-vector shells 0.01 Mb ( 970) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.74 Mb ( 324, 352) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.91 Mb ( 340, 2, 88) The potential is recalculated from file : ./NbTe4.save/charge-density.dat Starting wfc are 116 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 6.1 secs Computing kpt #: 2 total cpu time spent up to now is 11.0 secs Computing kpt #: 3 total cpu time spent up to now is 15.6 secs Computing kpt #: 4 total cpu time spent up to now is 20.0 secs Computing kpt #: 5 total cpu time spent up to now is 25.7 secs Computing kpt #: 6 total cpu time spent up to now is 31.7 secs Computing kpt #: 7 total cpu time spent up to now is 37.9 secs Computing kpt #: 8 total cpu time spent up to now is 43.0 secs Computing kpt #: 9 total cpu time spent up to now is 47.8 secs Computing kpt #: 10 total cpu time spent up to now is 53.2 secs Computing kpt #: 11 total cpu time spent up to now is 58.8 secs Computing kpt #: 12 total cpu time spent up to now is 63.8 secs Computing kpt #: 13 total cpu time spent up to now is 68.6 secs Computing kpt #: 14 total cpu time spent up to now is 73.5 secs Computing kpt #: 15 total cpu time spent up to now is 78.4 secs Computing kpt #: 16 total cpu time spent up to now is 83.4 secs Computing kpt #: 17 total cpu time spent up to now is 88.5 secs Computing kpt #: 18 total cpu time spent up to now is 93.6 secs Computing kpt #: 19 total cpu time spent up to now is 98.2 secs Computing kpt #: 20 total cpu time spent up to now is 102.8 secs Computing kpt #: 21 total cpu time spent up to now is 107.0 secs Computing kpt #: 22 total cpu time spent up to now is 111.5 secs Computing kpt #: 23 total cpu time spent up to now is 115.6 secs Computing kpt #: 24 total cpu time spent up to now is 119.8 secs Computing kpt #: 25 total cpu time spent up to now is 124.4 secs Computing kpt #: 26 total cpu time spent up to now is 128.8 secs Computing kpt #: 27 total cpu time spent up to now is 133.0 secs Computing kpt #: 28 total cpu time spent up to now is 136.9 secs Computing kpt #: 29 total cpu time spent up to now is 141.3 secs Computing kpt #: 30 total cpu time spent up to now is 145.9 secs Computing kpt #: 31 total cpu time spent up to now is 150.5 secs Computing kpt #: 32 total cpu time spent up to now is 155.2 secs Computing kpt #: 33 total cpu time spent up to now is 160.1 secs Computing kpt #: 34 total cpu time spent up to now is 164.7 secs Computing kpt #: 35 total cpu time spent up to now is 169.0 secs Computing kpt #: 36 total cpu time spent up to now is 173.2 secs Computing kpt #: 37 total cpu time spent up to now is 178.0 secs Computing kpt #: 38 total cpu time spent up to now is 182.8 secs Computing kpt #: 39 total cpu time spent up to now is 187.6 secs Computing kpt #: 40 total cpu time spent up to now is 192.3 secs Computing kpt #: 41 total cpu time spent up to now is 197.3 secs Computing kpt #: 42 total cpu time spent up to now is 202.6 secs Computing kpt #: 43 total cpu time spent up to now is 208.3 secs Computing kpt #: 44 total cpu time spent up to now is 214.5 secs Computing kpt #: 45 total cpu time spent up to now is 219.6 secs Computing kpt #: 46 total cpu time spent up to now is 224.2 secs Computing kpt #: 47 total cpu time spent up to now is 229.0 secs Computing kpt #: 48 total cpu time spent up to now is 233.6 secs Computing kpt #: 49 total cpu time spent up to now is 238.8 secs Computing kpt #: 50 total cpu time spent up to now is 243.9 secs Computing kpt #: 51 total cpu time spent up to now is 248.7 secs Computing kpt #: 52 total cpu time spent up to now is 253.4 secs Computing kpt #: 53 total cpu time spent up to now is 258.6 secs Computing kpt #: 54 total cpu time spent up to now is 263.9 secs Computing kpt #: 55 total cpu time spent up to now is 269.1 secs Computing kpt #: 56 total cpu time spent up to now is 274.0 secs Computing kpt #: 57 total cpu time spent up to now is 278.6 secs Computing kpt #: 58 total cpu time spent up to now is 284.3 secs Computing kpt #: 59 total cpu time spent up to now is 289.0 secs Computing kpt #: 60 total cpu time spent up to now is 294.8 secs Computing kpt #: 61 total cpu time spent up to now is 300.6 secs Computing kpt #: 62 total cpu time spent up to now is 307.9 secs Computing kpt #: 63 total cpu time spent up to now is 312.9 secs Computing kpt #: 64 total cpu time spent up to now is 317.7 secs Computing kpt #: 65 total cpu time spent up to now is 322.8 secs Computing kpt #: 66 total cpu time spent up to now is 327.5 secs Computing kpt #: 67 total cpu time spent up to now is 332.0 secs Computing kpt #: 68 total cpu time spent up to now is 336.6 secs Computing kpt #: 69 total cpu time spent up to now is 341.1 secs Computing kpt #: 70 total cpu time spent up to now is 345.4 secs Computing kpt #: 71 total cpu time spent up to now is 349.9 secs Computing kpt #: 72 total cpu time spent up to now is 354.3 secs Computing kpt #: 73 total cpu time spent up to now is 358.9 secs Computing kpt #: 74 total cpu time spent up to now is 363.5 secs Computing kpt #: 75 total cpu time spent up to now is 367.5 secs Computing kpt #: 76 total cpu time spent up to now is 371.5 secs Computing kpt #: 77 total cpu time spent up to now is 376.2 secs Computing kpt #: 78 total cpu time spent up to now is 381.7 secs Computing kpt #: 79 total cpu time spent up to now is 386.2 secs Computing kpt #: 80 total cpu time spent up to now is 391.1 secs Computing kpt #: 81 total cpu time spent up to now is 395.9 secs Computing kpt #: 82 total cpu time spent up to now is 400.5 secs Computing kpt #: 83 total cpu time spent up to now is 405.7 secs Computing kpt #: 84 total cpu time spent up to now is 409.7 secs Computing kpt #: 85 total cpu time spent up to now is 413.5 secs Computing kpt #: 86 total cpu time spent up to now is 417.3 secs Computing kpt #: 87 total cpu time spent up to now is 421.8 secs Computing kpt #: 88 total cpu time spent up to now is 425.6 secs Computing kpt #: 89 total cpu time spent up to now is 429.2 secs Computing kpt #: 90 total cpu time spent up to now is 433.5 secs Computing kpt #: 91 total cpu time spent up to now is 437.2 secs Computing kpt #: 92 total cpu time spent up to now is 440.9 secs Computing kpt #: 93 total cpu time spent up to now is 444.4 secs Computing kpt #: 94 total cpu time spent up to now is 448.1 secs Computing kpt #: 95 total cpu time spent up to now is 452.1 secs Computing kpt #: 96 total cpu time spent up to now is 455.3 secs Computing kpt #: 97 total cpu time spent up to now is 459.3 secs Computing kpt #: 98 total cpu time spent up to now is 462.6 secs Computing kpt #: 99 total cpu time spent up to now is 465.9 secs Computing kpt #: 100 total cpu time spent up to now is 469.0 secs Computing kpt #: 101 total cpu time spent up to now is 472.2 secs Computing kpt #: 102 total cpu time spent up to now is 475.4 secs Computing kpt #: 103 total cpu time spent up to now is 478.6 secs Computing kpt #: 104 total cpu time spent up to now is 482.0 secs Computing kpt #: 105 total cpu time spent up to now is 485.2 secs Computing kpt #: 106 total cpu time spent up to now is 488.6 secs Computing kpt #: 107 total cpu time spent up to now is 491.8 secs Computing kpt #: 108 total cpu time spent up to now is 495.1 secs Computing kpt #: 109 total cpu time spent up to now is 498.0 secs Computing kpt #: 110 total cpu time spent up to now is 501.2 secs Computing kpt #: 111 total cpu time spent up to now is 503.9 secs Computing kpt #: 112 total cpu time spent up to now is 506.8 secs Computing kpt #: 113 total cpu time spent up to now is 509.5 secs Computing kpt #: 114 total cpu time spent up to now is 512.6 secs Computing kpt #: 115 total cpu time spent up to now is 515.4 secs Computing kpt #: 116 total cpu time spent up to now is 518.7 secs Computing kpt #: 117 total cpu time spent up to now is 521.9 secs Computing kpt #: 118 total cpu time spent up to now is 525.4 secs Computing kpt #: 119 total cpu time spent up to now is 528.9 secs Computing kpt #: 120 total cpu time spent up to now is 534.0 secs Computing kpt #: 121 total cpu time spent up to now is 537.8 secs Computing kpt #: 122 total cpu time spent up to now is 542.1 secs Computing kpt #: 123 total cpu time spent up to now is 546.0 secs Computing kpt #: 124 total cpu time spent up to now is 550.1 secs Computing kpt #: 125 total cpu time spent up to now is 554.5 secs Computing kpt #: 126 total cpu time spent up to now is 559.0 secs Computing kpt #: 127 total cpu time spent up to now is 563.3 secs Computing kpt #: 128 total cpu time spent up to now is 568.9 secs Computing kpt #: 129 total cpu time spent up to now is 574.8 secs Computing kpt #: 130 total cpu time spent up to now is 580.9 secs Computing kpt #: 131 total cpu time spent up to now is 585.9 secs Computing kpt #: 132 total cpu time spent up to now is 590.0 secs Computing kpt #: 133 total cpu time spent up to now is 594.1 secs Computing kpt #: 134 total cpu time spent up to now is 598.0 secs Computing kpt #: 135 total cpu time spent up to now is 602.1 secs Computing kpt #: 136 total cpu time spent up to now is 606.3 secs Computing kpt #: 137 total cpu time spent up to now is 610.1 secs Computing kpt #: 138 total cpu time spent up to now is 614.2 secs Computing kpt #: 139 total cpu time spent up to now is 618.3 secs Computing kpt #: 140 total cpu time spent up to now is 622.4 secs Computing kpt #: 141 total cpu time spent up to now is 626.7 secs Computing kpt #: 142 total cpu time spent up to now is 631.0 secs Computing kpt #: 143 total cpu time spent up to now is 635.0 secs Computing kpt #: 144 total cpu time spent up to now is 639.8 secs Computing kpt #: 145 total cpu time spent up to now is 644.0 secs Computing kpt #: 146 total cpu time spent up to now is 648.4 secs Computing kpt #: 147 total cpu time spent up to now is 653.3 secs Computing kpt #: 148 total cpu time spent up to now is 658.9 secs Computing kpt #: 149 total cpu time spent up to now is 664.4 secs Computing kpt #: 150 total cpu time spent up to now is 669.9 secs Computing kpt #: 151 total cpu time spent up to now is 675.1 secs Computing kpt #: 152 total cpu time spent up to now is 680.1 secs Computing kpt #: 153 total cpu time spent up to now is 685.9 secs Computing kpt #: 154 total cpu time spent up to now is 690.9 secs Computing kpt #: 155 total cpu time spent up to now is 696.0 secs Computing kpt #: 156 total cpu time spent up to now is 701.3 secs Computing kpt #: 157 total cpu time spent up to now is 706.6 secs Computing kpt #: 158 total cpu time spent up to now is 711.9 secs Computing kpt #: 159 total cpu time spent up to now is 719.2 secs Computing kpt #: 160 total cpu time spent up to now is 724.0 secs Computing kpt #: 161 total cpu time spent up to now is 728.9 secs Computing kpt #: 162 total cpu time spent up to now is 733.7 secs Computing kpt #: 163 total cpu time spent up to now is 738.3 secs Computing kpt #: 164 total cpu time spent up to now is 743.2 secs Computing kpt #: 165 total cpu time spent up to now is 747.8 secs Computing kpt #: 166 total cpu time spent up to now is 752.2 secs Computing kpt #: 167 total cpu time spent up to now is 756.8 secs Computing kpt #: 168 total cpu time spent up to now is 761.6 secs Computing kpt #: 169 total cpu time spent up to now is 768.7 secs Computing kpt #: 170 total cpu time spent up to now is 772.9 secs Computing kpt #: 171 total cpu time spent up to now is 777.4 secs Computing kpt #: 172 total cpu time spent up to now is 781.9 secs Computing kpt #: 173 total cpu time spent up to now is 786.6 secs Computing kpt #: 174 total cpu time spent up to now is 791.1 secs Computing kpt #: 175 total cpu time spent up to now is 795.5 secs Computing kpt #: 176 total cpu time spent up to now is 799.8 secs Computing kpt #: 177 total cpu time spent up to now is 803.9 secs Computing kpt #: 178 total cpu time spent up to now is 808.2 secs Computing kpt #: 179 total cpu time spent up to now is 812.5 secs Computing kpt #: 180 total cpu time spent up to now is 816.7 secs Computing kpt #: 181 total cpu time spent up to now is 820.8 secs Computing kpt #: 182 total cpu time spent up to now is 825.6 secs Computing kpt #: 183 total cpu time spent up to now is 830.2 secs Computing kpt #: 184 total cpu time spent up to now is 834.9 secs Computing kpt #: 185 total cpu time spent up to now is 841.1 secs Computing kpt #: 186 total cpu time spent up to now is 848.7 secs Computing kpt #: 187 total cpu time spent up to now is 854.5 secs Computing kpt #: 188 total cpu time spent up to now is 859.3 secs Computing kpt #: 189 total cpu time spent up to now is 863.3 secs Computing kpt #: 190 total cpu time spent up to now is 867.0 secs Computing kpt #: 191 total cpu time spent up to now is 871.0 secs Computing kpt #: 192 total cpu time spent up to now is 874.7 secs Computing kpt #: 193 total cpu time spent up to now is 878.1 secs Computing kpt #: 194 total cpu time spent up to now is 881.6 secs Computing kpt #: 195 total cpu time spent up to now is 884.9 secs Computing kpt #: 196 total cpu time spent up to now is 888.3 secs Computing kpt #: 197 total cpu time spent up to now is 891.6 secs Computing kpt #: 198 total cpu time spent up to now is 894.7 secs Computing kpt #: 199 total cpu time spent up to now is 898.0 secs Computing kpt #: 200 total cpu time spent up to now is 900.8 secs Computing kpt #: 201 total cpu time spent up to now is 903.8 secs Computing kpt #: 202 total cpu time spent up to now is 908.3 secs Computing kpt #: 203 total cpu time spent up to now is 912.7 secs Computing kpt #: 204 total cpu time spent up to now is 920.2 secs Computing kpt #: 205 total cpu time spent up to now is 924.7 secs Computing kpt #: 206 total cpu time spent up to now is 929.2 secs Computing kpt #: 207 total cpu time spent up to now is 934.1 secs Computing kpt #: 208 total cpu time spent up to now is 939.2 secs Computing kpt #: 209 total cpu time spent up to now is 946.6 secs Computing kpt #: 210 total cpu time spent up to now is 953.6 secs Computing kpt #: 211 total cpu time spent up to now is 959.1 secs Computing kpt #: 212 total cpu time spent up to now is 964.9 secs Computing kpt #: 213 total cpu time spent up to now is 971.1 secs Computing kpt #: 214 total cpu time spent up to now is 978.6 secs Computing kpt #: 215 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 987.4 secs Computing kpt #: 216 total cpu time spent up to now is 993.9 secs Computing kpt #: 217 total cpu time spent up to now is 999.3 secs Computing kpt #: 218 total cpu time spent up to now is 1004.4 secs Computing kpt #: 219 total cpu time spent up to now is 1009.2 secs Computing kpt #: 220 total cpu time spent up to now is 1013.4 secs Computing kpt #: 221 total cpu time spent up to now is 1017.6 secs Computing kpt #: 222 total cpu time spent up to now is 1021.6 secs Computing kpt #: 223 total cpu time spent up to now is 1025.9 secs Computing kpt #: 224 total cpu time spent up to now is 1030.1 secs Computing kpt #: 225 total cpu time spent up to now is 1034.1 secs Computing kpt #: 226 total cpu time spent up to now is 1038.1 secs Computing kpt #: 227 total cpu time spent up to now is 1042.8 secs Computing kpt #: 228 total cpu time spent up to now is 1048.0 secs Computing kpt #: 229 total cpu time spent up to now is 1052.8 secs Computing kpt #: 230 total cpu time spent up to now is 1058.1 secs Computing kpt #: 231 total cpu time spent up to now is 1062.7 secs Computing kpt #: 232 total cpu time spent up to now is 1068.0 secs Computing kpt #: 233 total cpu time spent up to now is 1072.7 secs Computing kpt #: 234 total cpu time spent up to now is 1080.1 secs Computing kpt #: 235 total cpu time spent up to now is 1084.9 secs Computing kpt #: 236 total cpu time spent up to now is 1089.5 secs Computing kpt #: 237 total cpu time spent up to now is 1093.7 secs Computing kpt #: 238 total cpu time spent up to now is 1097.9 secs Computing kpt #: 239 total cpu time spent up to now is 1101.9 secs Computing kpt #: 240 total cpu time spent up to now is 1105.7 secs Computing kpt #: 241 total cpu time spent up to now is 1109.6 secs Computing kpt #: 242 total cpu time spent up to now is 1113.8 secs Computing kpt #: 243 total cpu time spent up to now is 1117.8 secs Computing kpt #: 244 total cpu time spent up to now is 1121.8 secs Computing kpt #: 245 total cpu time spent up to now is 1125.6 secs Computing kpt #: 246 total cpu time spent up to now is 1129.2 secs Computing kpt #: 247 total cpu time spent up to now is 1132.7 secs Computing kpt #: 248 total cpu time spent up to now is 1136.3 secs Computing kpt #: 249 total cpu time spent up to now is 1140.4 secs Computing kpt #: 250 total cpu time spent up to now is 1144.9 secs Computing kpt #: 251 total cpu time spent up to now is 1150.0 secs ethr = 1.35E-08, avg # of iterations = 41.0 total cpu time spent up to now is 1150.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 10917 PWs) bands (ev): -45.3584 -45.3584 -45.2986 -45.2986 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5072 -21.5072 -21.3129 -21.3129 -10.0655 -10.0655 -7.4299 -7.4299 -6.0446 -6.0446 -5.9023 -5.9023 -4.9403 -4.9403 -4.9111 -4.9111 -1.5261 -1.5261 -0.9315 -0.9315 -0.2176 -0.2176 0.6229 0.6229 0.6589 0.6589 1.2803 1.2803 2.4907 2.4907 3.3531 3.3531 3.3777 3.3777 3.9442 3.9442 4.2738 4.2738 4.2885 4.2885 4.4408 4.4408 4.5322 4.5322 4.6849 4.6849 5.1632 5.1632 5.5105 5.5105 6.1350 6.1350 7.3814 7.3814 7.5945 7.5945 7.6862 7.6862 7.8292 7.8292 7.9445 7.9445 8.9542 8.9542 9.6623 9.6623 9.9635 9.9635 10.0628 10.0628 11.4950 11.4950 11.6607 11.6607 11.9216 11.9216 k = 0.0000 0.0200-0.0000 ( 10925 PWs) bands (ev): -45.3585 -45.3585 -45.2987 -45.2987 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5072 -21.5072 -21.3129 -21.3129 -10.0654 -10.0654 -7.4297 -7.4297 -6.0449 -6.0449 -5.9025 -5.9025 -4.9409 -4.9409 -4.9117 -4.9117 -1.5246 -1.5246 -0.9314 -0.9314 -0.2160 -0.2160 0.6237 0.6237 0.6593 0.6593 1.2798 1.2798 2.4919 2.4919 3.3530 3.3530 3.3777 3.3777 3.9437 3.9437 4.2687 4.2687 4.2925 4.2925 4.4403 4.4403 4.5315 4.5315 4.6848 4.6848 5.1620 5.1620 5.5089 5.5089 6.1353 6.1353 7.3787 7.3787 7.5831 7.5831 7.6937 7.6937 7.8319 7.8319 7.9448 7.9448 8.9531 8.9531 9.6612 9.6612 9.9605 9.9605 10.0697 10.0697 11.5002 11.5002 11.6620 11.6620 11.9243 11.9243 k = 0.0000 0.0400-0.0000 ( 10915 PWs) bands (ev): -45.3585 -45.3585 -45.2986 -45.2986 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5072 -21.5072 -21.3129 -21.3129 -10.0650 -10.0650 -7.4292 -7.4292 -6.0456 -6.0456 -5.9033 -5.9033 -4.9429 -4.9429 -4.9131 -4.9131 -1.5199 -1.5199 -0.9311 -0.9311 -0.2113 -0.2113 0.6264 0.6264 0.6607 0.6607 1.2782 1.2782 2.4955 2.4955 3.3527 3.3527 3.3774 3.3774 3.9420 3.9420 4.2587 4.2587 4.2991 4.2991 4.4387 4.4387 4.5294 4.5294 4.6842 4.6842 5.1584 5.1584 5.5044 5.5044 6.1362 6.1362 7.3704 7.3704 7.5596 7.5596 7.7045 7.7045 7.8417 7.8417 7.9458 7.9458 8.9497 8.9497 9.6579 9.6579 9.9524 9.9524 10.0895 10.0895 11.5155 11.5155 11.6657 11.6657 11.9325 11.9325 k = 0.0000 0.0600-0.0000 ( 10907 PWs) bands (ev): -45.3585 -45.3585 -45.2985 -45.2985 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5072 -21.5072 -21.3129 -21.3129 -10.0644 -10.0644 -7.4283 -7.4283 -6.0468 -6.0468 -5.9046 -5.9046 -4.9467 -4.9467 -4.9150 -4.9150 -1.5123 -1.5123 -0.9306 -0.9306 -0.2033 -0.2033 0.6307 0.6307 0.6629 0.6629 1.2756 1.2756 2.5015 2.5015 3.3523 3.3523 3.3770 3.3770 3.9392 3.9392 4.2468 4.2468 4.3054 4.3054 4.4362 4.4362 4.5257 4.5257 4.6833 4.6833 5.1521 5.1521 5.4970 5.4970 6.1376 6.1376 7.3557 7.3557 7.5362 7.5362 7.7058 7.7058 7.8599 7.8599 7.9486 7.9486 8.9441 8.9441 9.6528 9.6528 9.9409 9.9409 10.1203 10.1203 11.5400 11.5400 11.6718 11.6718 11.9463 11.9463 k = 0.0000 0.0800-0.0000 ( 10909 PWs) bands (ev): -45.3585 -45.3585 -45.2985 -45.2985 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5072 -21.5072 -21.3129 -21.3129 -10.0636 -10.0636 -7.4270 -7.4270 -6.0486 -6.0486 -5.9063 -5.9063 -4.9527 -4.9527 -4.9168 -4.9168 -1.5019 -1.5019 -0.9300 -0.9300 -0.1921 -0.1921 0.6367 0.6367 0.6660 0.6660 1.2720 1.2720 2.5100 2.5100 3.3517 3.3517 3.3764 3.3764 3.9352 3.9352 4.2332 4.2332 4.3110 4.3110 4.4328 4.4328 4.5204 4.5204 4.6820 4.6820 5.1431 5.1431 5.4869 5.4869 6.1395 6.1395 7.3344 7.3344 7.5178 7.5178 7.6953 7.6953 7.8828 7.8828 7.9553 7.9553 8.9364 8.9364 9.6460 9.6460 9.9272 9.9272 10.1607 10.1607 11.5720 11.5720 11.6800 11.6800 11.9659 11.9659 k = 0.0000 0.1000-0.0000 ( 10913 PWs) bands (ev): -45.3586 -45.3586 -45.2985 -45.2985 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0625 -10.0625 -7.4255 -7.4255 -6.0508 -6.0508 -5.9084 -5.9084 -4.9611 -4.9611 -4.9180 -4.9180 -1.4890 -1.4890 -0.9293 -0.9293 -0.1778 -0.1778 0.6444 0.6444 0.6700 0.6700 1.2675 1.2675 2.5211 2.5211 3.3510 3.3510 3.3757 3.3757 3.9298 3.9298 4.2181 4.2181 4.3157 4.3157 4.4285 4.4285 4.5133 4.5133 4.6802 4.6802 5.1310 5.1310 5.4745 5.4745 6.1418 6.1418 7.3082 7.3082 7.5054 7.5054 7.6763 7.6763 7.9027 7.9027 7.9702 7.9702 8.9266 8.9266 9.6376 9.6376 9.9119 9.9119 10.2097 10.2097 11.6092 11.6092 11.6907 11.6907 11.9913 11.9913 k = 0.0000 0.1200-0.0000 ( 10913 PWs) bands (ev): -45.3586 -45.3586 -45.2985 -45.2985 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0612 -10.0612 -7.4236 -7.4236 -6.0536 -6.0536 -5.9108 -5.9108 -4.9719 -4.9719 -4.9186 -4.9186 -1.4740 -1.4740 -0.9285 -0.9285 -0.1603 -0.1603 0.6535 0.6535 0.6748 0.6748 1.2623 1.2623 2.5347 2.5347 3.3501 3.3501 3.3750 3.3750 3.9231 3.9231 4.2015 4.2015 4.3194 4.3194 4.4236 4.4236 4.5042 4.5042 4.6779 4.6779 5.1158 5.1158 5.4601 5.4601 6.1446 6.1446 7.2795 7.2795 7.4976 7.4976 7.6521 7.6521 7.9145 7.9145 7.9956 7.9956 8.9148 8.9148 9.6279 9.6279 9.8954 9.8954 10.2666 10.2666 11.6469 11.6469 11.7065 11.7065 12.0223 12.0223 k = 0.0000 0.1400-0.0000 ( 10909 PWs) bands (ev): -45.3586 -45.3586 -45.2985 -45.2985 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0598 -10.0598 -7.4214 -7.4214 -6.0570 -6.0570 -5.9134 -5.9134 -4.9847 -4.9847 -4.9187 -4.9187 -1.4573 -1.4573 -0.9278 -0.9278 -0.1396 -0.1396 0.6640 0.6640 0.6806 0.6806 1.2565 1.2565 2.5510 2.5510 3.3490 3.3490 3.3742 3.3742 3.9149 3.9149 4.1834 4.1834 4.3220 4.3220 4.4180 4.4180 4.4930 4.4930 4.6751 4.6751 5.0973 5.0973 5.4442 5.4442 6.1477 6.1477 7.2509 7.2509 7.4924 7.4924 7.6255 7.6255 7.9207 7.9207 8.0281 8.0281 8.9011 8.9011 9.6168 9.6168 9.8782 9.8782 10.3304 10.3304 11.6766 11.6766 11.7342 11.7342 12.0581 12.0581 k = 0.0000 0.1600-0.0000 ( 10911 PWs) bands (ev): -45.3586 -45.3586 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0582 -10.0582 -7.4190 -7.4190 -6.0609 -6.0609 -5.9161 -5.9161 -4.9991 -4.9991 -4.9185 -4.9185 -1.4392 -1.4392 -0.9271 -0.9271 -0.1158 -0.1158 0.6752 0.6752 0.6875 0.6875 1.2501 1.2501 2.5700 2.5700 3.3477 3.3477 3.3733 3.3733 3.9050 3.9050 4.1637 4.1637 4.3231 4.3231 4.4118 4.4118 4.4795 4.4795 4.6718 4.6718 5.0754 5.0754 5.4273 5.4273 6.1512 6.1512 7.2241 7.2241 7.4880 7.4880 7.5995 7.5995 7.9242 7.9242 8.0641 8.0641 8.8855 8.8855 9.6044 9.6044 9.8602 9.8602 10.4004 10.4004 11.6945 11.6945 11.7758 11.7758 12.0972 12.0972 k = 0.0000 0.1800-0.0000 ( 10899 PWs) bands (ev): -45.3586 -45.3586 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0564 -10.0564 -7.4163 -7.4163 -6.0653 -6.0653 -5.9188 -5.9188 -5.0147 -5.0147 -4.9179 -4.9179 -1.4202 -1.4202 -0.9266 -0.9266 -0.0891 -0.0891 0.6861 0.6861 0.6967 0.6967 1.2434 1.2434 2.5919 2.5919 3.3462 3.3462 3.3724 3.3724 3.8934 3.8934 4.1424 4.1424 4.3222 4.3222 4.4049 4.4049 4.4640 4.4640 4.6681 4.6681 5.0506 5.0506 5.4100 5.4100 6.1548 6.1548 7.2003 7.2003 7.4822 7.4822 7.5768 7.5768 7.9266 7.9266 8.1021 8.1021 8.8681 8.8681 9.5906 9.5906 9.8414 9.8414 10.4757 10.4757 11.7067 11.7067 11.8236 11.8236 12.1366 12.1366 k = 0.0000 0.2000-0.0000 ( 10883 PWs) bands (ev): -45.3585 -45.3585 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0546 -10.0546 -7.4135 -7.4135 -6.0703 -6.0703 -5.9215 -5.9215 -5.0313 -5.0313 -4.9172 -4.9172 -1.4008 -1.4008 -0.9262 -0.9262 -0.0596 -0.0596 0.6952 0.6952 0.7090 0.7090 1.2365 1.2365 2.6166 2.6166 3.3446 3.3446 3.3716 3.3716 3.8800 3.8800 4.1197 4.1197 4.3183 4.3183 4.3970 4.3970 4.4475 4.4475 4.6639 4.6639 5.0234 5.0234 5.3925 5.3925 6.1586 6.1586 7.1801 7.1801 7.4732 7.4732 7.5604 7.5604 7.9286 7.9286 8.1416 8.1416 8.8489 8.8489 9.5757 9.5757 9.8216 9.8216 10.5554 10.5554 11.7171 11.7171 11.8730 11.8730 12.1716 12.1716 k = 0.0000 0.2200-0.0000 ( 10875 PWs) bands (ev): -45.3585 -45.3585 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0526 -10.0526 -7.4105 -7.4105 -6.0756 -6.0756 -5.9240 -5.9240 -5.0484 -5.0484 -4.9164 -4.9164 -1.3812 -1.3812 -0.9260 -0.9260 -0.0276 -0.0276 0.7034 0.7034 0.7236 0.7236 1.2296 1.2296 2.6444 2.6444 3.3429 3.3429 3.3708 3.3708 3.8646 3.8646 4.0955 4.0955 4.3098 4.3098 4.3876 4.3876 4.4319 4.4319 4.6594 4.6594 4.9944 4.9944 5.3752 5.3752 6.1625 6.1625 7.1636 7.1636 7.4608 7.4608 7.5513 7.5513 7.9303 7.9303 8.1827 8.1827 8.8281 8.8281 9.5595 9.5595 9.8006 9.8006 10.6389 10.6389 11.7266 11.7266 11.9214 11.9214 12.1968 12.1968 k = 0.0000 0.2400-0.0000 ( 10871 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0506 -10.0506 -7.4074 -7.4074 -6.0814 -6.0814 -5.9263 -5.9263 -5.0658 -5.0658 -4.9155 -4.9155 -1.3620 -1.3620 -0.9260 -0.9260 0.0065 0.0065 0.7113 0.7113 0.7393 0.7393 1.2229 1.2229 2.6752 2.6752 3.3410 3.3410 3.3700 3.3700 3.8472 3.8472 4.0700 4.0700 4.2943 4.2943 4.3763 4.3763 4.4196 4.4196 4.6547 4.6547 4.9648 4.9648 5.3582 5.3582 6.1665 6.1665 7.1508 7.1508 7.4472 7.4472 7.5478 7.5478 7.9318 7.9318 8.2256 8.2256 8.8058 8.8058 9.5421 9.5421 9.7779 9.7779 10.7252 10.7252 11.7360 11.7360 11.9671 11.9671 12.2094 12.2094 k = 0.0000 0.2600-0.0000 ( 10873 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0486 -10.0486 -7.4042 -7.4042 -6.0874 -6.0874 -5.9285 -5.9285 -5.0831 -5.0831 -4.9145 -4.9145 -1.3434 -1.3434 -0.9262 -0.9262 0.0425 0.0425 0.7191 0.7191 0.7556 0.7556 1.2164 1.2164 2.7091 2.7091 3.3391 3.3391 3.3692 3.3692 3.8275 3.8275 4.0434 4.0434 4.2697 4.2697 4.3646 4.3646 4.4116 4.4116 4.6499 4.6499 4.9353 4.9353 5.3417 5.3417 6.1705 6.1705 7.1417 7.1417 7.4350 7.4350 7.5478 7.5478 7.9333 7.9333 8.2705 8.2705 8.7821 8.7821 9.5236 9.5236 9.7535 9.7535 10.8136 10.8136 11.7453 11.7453 12.0079 12.0079 12.2124 12.2124 k = 0.0000 0.2800-0.0000 ( 10877 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0466 -10.0466 -7.4011 -7.4011 -6.0935 -6.0935 -5.9304 -5.9304 -5.1002 -5.1002 -4.9135 -4.9135 -1.3256 -1.3256 -0.9266 -0.9266 0.0796 0.0796 0.7268 0.7268 0.7721 0.7721 1.2105 1.2105 2.7462 2.7462 3.3372 3.3372 3.3685 3.3685 3.8055 3.8055 4.0161 4.0161 4.2362 4.2362 4.3537 4.3537 4.4070 4.4070 4.6452 4.6452 4.9068 4.9068 5.3258 5.3258 6.1744 6.1744 7.1359 7.1359 7.4258 7.4258 7.5497 7.5497 7.9347 7.9347 8.3174 8.3174 8.7575 8.7575 9.5038 9.5038 9.7272 9.7272 10.9032 10.9032 11.7549 11.7549 12.0408 12.0408 12.2126 12.2126 k = 0.0000 0.3000-0.0000 ( 10885 PWs) bands (ev): -45.3585 -45.3585 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5074 -21.5074 -21.3129 -21.3129 -10.0447 -10.0447 -7.3980 -7.3980 -6.0998 -6.0998 -5.9321 -5.9321 -5.1166 -5.1166 -4.9125 -4.9125 -1.3090 -1.3090 -0.9272 -0.9272 0.1174 0.1174 0.7343 0.7343 0.7884 0.7884 1.2051 1.2051 2.7863 2.7863 3.3354 3.3354 3.3679 3.3679 3.7810 3.7810 3.9883 3.9883 4.1957 4.1957 4.3437 4.3437 4.4046 4.4046 4.6405 4.6405 4.8801 4.8801 5.3106 5.3106 6.1783 6.1783 7.1331 7.1331 7.4205 7.4205 7.5525 7.5525 7.9360 7.9360 8.3662 8.3662 8.7325 8.7325 9.4823 9.4823 9.6993 9.6993 10.9930 10.9930 11.7647 11.7647 12.0617 12.0617 12.2168 12.2168 k = 0.0000 0.3200-0.0000 ( 10869 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5074 -21.5074 -21.3129 -21.3129 -10.0428 -10.0428 -7.3950 -7.3950 -6.1059 -6.1059 -5.9336 -5.9336 -5.1322 -5.1322 -4.9115 -4.9115 -1.2937 -1.2937 -0.9279 -0.9279 0.1550 0.1550 0.7416 0.7416 0.8043 0.8043 1.2005 1.2005 2.8295 2.8295 3.3336 3.3336 3.3673 3.3673 3.7538 3.7538 3.9607 3.9607 4.1502 4.1502 4.3344 4.3344 4.4036 4.4036 4.6361 4.6361 4.8554 4.8554 5.2962 5.2962 6.1820 6.1820 7.1329 7.1329 7.4191 7.4191 7.5557 7.5557 7.9372 7.9372 8.4161 8.4161 8.7084 8.7084 9.4585 9.4585 9.6704 9.6704 11.0819 11.0819 11.7751 11.7751 12.0680 12.0680 12.2284 12.2284 k = 0.0000 0.3400-0.0000 ( 10857 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5074 -21.5074 -21.3129 -21.3129 -10.0410 -10.0410 -7.3921 -7.3921 -6.1118 -6.1118 -5.9348 -5.9348 -5.1468 -5.1468 -4.9105 -4.9105 -1.2798 -1.2798 -0.9287 -0.9287 0.1918 0.1918 0.7485 0.7485 0.8193 0.8193 1.1966 1.1966 2.8754 2.8754 3.3319 3.3319 3.3668 3.3668 3.7240 3.7240 3.9335 3.9335 4.1020 4.1020 4.3256 4.3256 4.4036 4.4036 4.6320 4.6320 4.8333 4.8333 5.2829 5.2829 6.1855 6.1855 7.1347 7.1347 7.4214 7.4214 7.5589 7.5589 7.9384 7.9384 8.4651 8.4651 8.6875 8.6875 9.4316 9.4316 9.6414 9.6414 11.1688 11.1688 11.7859 11.7859 12.0623 12.0623 12.2439 12.2439 k = 0.0000 0.3600-0.0000 ( 10859 PWs) bands (ev): -45.3583 -45.3583 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5074 -21.5074 -21.3130 -21.3130 -10.0394 -10.0394 -7.3895 -7.3895 -6.1174 -6.1174 -5.9359 -5.9359 -5.1601 -5.1601 -4.9096 -4.9096 -1.2674 -1.2674 -0.9296 -0.9296 0.2269 0.2269 0.7549 0.7549 0.8333 0.8333 1.1935 1.1935 2.9239 2.9239 3.3304 3.3304 3.3664 3.3664 3.6917 3.6917 3.9071 3.9071 4.0532 4.0532 4.3174 4.3174 4.4040 4.4040 4.6282 4.6282 4.8137 4.8137 5.2708 5.2708 6.1888 6.1888 7.1381 7.1381 7.4270 7.4270 7.5620 7.5620 7.9394 7.9394 8.5078 8.5078 8.6759 8.6759 9.4005 9.4005 9.6135 9.6135 11.2523 11.2523 11.7972 11.7972 12.0492 12.0492 12.2543 12.2543 k = 0.0000 0.3800-0.0000 ( 10851 PWs) bands (ev): -45.3583 -45.3583 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5074 -21.5074 -21.3130 -21.3130 -10.0379 -10.0379 -7.3870 -7.3870 -6.1225 -6.1225 -5.9368 -5.9368 -5.1720 -5.1720 -4.9088 -4.9088 -1.2567 -1.2567 -0.9304 -0.9304 0.2595 0.2595 0.7607 0.7607 0.8459 0.8459 1.1913 1.1913 2.9743 2.9743 3.3290 3.3290 3.3662 3.3662 3.6572 3.6572 3.8811 3.8811 4.0064 4.0064 4.3099 4.3099 4.4048 4.4048 4.6248 4.6248 4.7968 4.7968 5.2600 5.2600 6.1918 6.1918 7.1423 7.1423 7.4350 7.4350 7.5647 7.5647 7.9404 7.9404 8.5327 8.5327 8.6854 8.6854 9.3641 9.3641 9.5883 9.5883 11.3309 11.3309 11.8091 11.8091 12.0325 12.0325 12.2578 12.2578 k = 0.0000 0.4000-0.0000 ( 10865 PWs) bands (ev): -45.3583 -45.3583 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5074 -21.5074 -21.3130 -21.3130 -10.0366 -10.0366 -7.3849 -7.3849 -6.1270 -6.1270 -5.9375 -5.9375 -5.1824 -5.1824 -4.9081 -4.9081 -1.2475 -1.2475 -0.9313 -0.9313 0.2887 0.2887 0.7658 0.7658 0.8571 0.8571 1.1898 1.1898 3.0261 3.0261 3.3280 3.3280 3.3660 3.3660 3.6210 3.6210 3.8545 3.8545 3.9647 3.9647 4.3033 4.3033 4.4057 4.4057 4.6219 4.6219 4.7827 4.7827 5.2507 5.2507 6.1945 6.1945 7.1469 7.1469 7.4447 7.4447 7.5670 7.5670 7.9412 7.9412 8.5342 8.5342 8.7221 8.7221 9.3216 9.3216 9.5667 9.5667 11.4026 11.4026 11.8214 11.8214 12.0142 12.0142 12.2590 12.2590 k = 0.0000 0.4200-0.0000 ( 10865 PWs) bands (ev): -45.3583 -45.3583 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5074 -21.5074 -21.3130 -21.3130 -10.0355 -10.0355 -7.3831 -7.3831 -6.1309 -6.1309 -5.9380 -5.9380 -5.1910 -5.1910 -4.9075 -4.9075 -1.2401 -1.2401 -0.9320 -0.9320 0.3137 0.3137 0.7701 0.7701 0.8664 0.8664 1.1888 1.1888 3.0779 3.0779 3.3272 3.3272 3.3662 3.3662 3.5838 3.5838 3.8269 3.8269 3.9312 3.9312 4.2977 4.2977 4.4065 4.4065 4.6195 4.6195 4.7712 4.7712 5.2429 5.2429 6.1968 6.1968 7.1514 7.1514 7.4549 7.4549 7.5688 7.5688 7.9419 7.9419 8.5230 8.5230 8.7758 8.7758 9.2731 9.2731 9.5493 9.5493 11.4656 11.4656 11.8341 11.8341 11.9957 11.9957 12.2595 12.2595 k = 0.0000 0.4400-0.0000 ( 10881 PWs) bands (ev): -45.3583 -45.3583 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0346 -10.0346 -7.3817 -7.3817 -6.1340 -6.1340 -5.9385 -5.9385 -5.1979 -5.1979 -4.9071 -4.9071 -1.2342 -1.2342 -0.9326 -0.9326 0.3340 0.3340 0.7735 0.7735 0.8739 0.8739 1.1884 1.1884 3.1278 3.1278 3.3268 3.3268 3.3668 3.3668 3.5464 3.5464 3.7996 3.7996 3.9071 3.9071 4.2932 4.2932 4.4073 4.4073 4.6175 4.6175 4.7623 4.7623 5.2369 5.2369 6.1986 6.1986 7.1552 7.1552 7.4645 7.4645 7.5702 7.5702 7.9425 7.9425 8.5090 8.5090 8.8373 8.8373 9.2191 9.2191 9.5362 9.5362 11.5177 11.5177 11.8468 11.8468 11.9780 11.9780 12.2597 12.2597 k = 0.0000 0.4600-0.0000 ( 10885 PWs) bands (ev): -45.3583 -45.3583 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0340 -10.0340 -7.3806 -7.3806 -6.1362 -6.1362 -5.9387 -5.9387 -5.2028 -5.2028 -4.9067 -4.9067 -1.2301 -1.2301 -0.9331 -0.9331 0.3489 0.3489 0.7760 0.7760 0.8793 0.8793 1.1882 1.1882 3.1722 3.1722 3.3269 3.3269 3.3681 3.3681 3.5107 3.5107 3.7761 3.7761 3.8915 3.8915 4.2899 4.2899 4.4079 4.4079 4.6161 4.6161 4.7560 4.7560 5.2325 5.2325 6.1999 6.1999 7.1582 7.1582 7.4725 7.4725 7.5712 7.5712 7.9429 7.9429 8.4969 8.4969 8.9021 8.9021 9.1606 9.1606 9.5271 9.5271 11.5568 11.5568 11.8586 11.8586 11.9623 11.9623 12.2598 12.2598 k = 0.0000 0.4800-0.0000 ( 10883 PWs) bands (ev): -45.3583 -45.3583 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0336 -10.0336 -7.3800 -7.3800 -6.1376 -6.1376 -5.9389 -5.9389 -5.2058 -5.2058 -4.9065 -4.9065 -1.2276 -1.2276 -0.9334 -0.9334 0.3580 0.3580 0.7776 0.7776 0.8826 0.8826 1.1881 1.1881 3.2049 3.2049 3.3275 3.3275 3.3702 3.3702 3.4819 3.4819 3.7604 3.7604 3.8829 3.8829 4.2880 4.2880 4.4083 4.4083 4.6153 4.6153 4.7523 4.7523 5.2298 5.2298 6.2007 6.2007 7.1600 7.1600 7.4777 7.4777 7.5717 7.5717 7.9432 7.9432 8.4888 8.4888 8.9681 8.9681 9.0985 9.0985 9.5217 9.5217 11.5811 11.5811 11.8680 11.8680 11.9506 11.9506 12.2598 12.2598 k = 0.0000 0.5000-0.0000 ( 10884 PWs) bands (ev): -45.3583 -45.3583 -45.2986 -45.2986 -24.0753 -24.0753 -23.6593 -23.6593 -22.1280 -22.1280 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0335 -10.0335 -7.3798 -7.3798 -6.1381 -6.1381 -5.9390 -5.9390 -5.2068 -5.2068 -4.9064 -4.9064 -1.2268 -1.2268 -0.9335 -0.9335 0.3611 0.3611 0.7781 0.7781 0.8837 0.8837 1.1881 1.1881 3.2174 3.2174 3.3279 3.3279 3.3717 3.3717 3.4700 3.4700 3.7548 3.7548 3.8801 3.8801 4.2873 4.2873 4.4084 4.4084 4.6150 4.6150 4.7510 4.7510 5.2290 5.2290 6.2010 6.2010 7.1607 7.1607 7.4795 7.4795 7.5719 7.5719 7.9433 7.9433 8.4861 8.4861 9.0321 9.0321 9.0358 9.0358 9.5200 9.5200 11.5894 11.5894 11.8718 11.8718 11.9460 11.9460 12.2598 12.2598 k = 0.0000 0.5000-0.0000 ( 10884 PWs) bands (ev): -45.3583 -45.3583 -45.2986 -45.2986 -24.0753 -24.0753 -23.6593 -23.6593 -22.1280 -22.1280 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0335 -10.0335 -7.3798 -7.3798 -6.1381 -6.1381 -5.9390 -5.9390 -5.2068 -5.2068 -4.9064 -4.9064 -1.2268 -1.2268 -0.9335 -0.9335 0.3611 0.3611 0.7781 0.7781 0.8837 0.8837 1.1881 1.1881 3.2174 3.2174 3.3279 3.3279 3.3717 3.3717 3.4700 3.4700 3.7548 3.7548 3.8801 3.8801 4.2873 4.2873 4.4084 4.4084 4.6150 4.6150 4.7510 4.7510 5.2290 5.2290 6.2010 6.2010 7.1607 7.1607 7.4795 7.4795 7.5719 7.5719 7.9433 7.9433 8.4861 8.4861 9.0321 9.0321 9.0358 9.0358 9.5200 9.5200 11.5894 11.5894 11.8718 11.8718 11.9460 11.9460 12.2598 12.2598 k = 0.0200 0.5000-0.0000 ( 10888 PWs) bands (ev): -45.3584 -45.3584 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0334 -10.0334 -7.3796 -7.3796 -6.1381 -6.1381 -5.9394 -5.9394 -5.2067 -5.2067 -4.9077 -4.9077 -1.2245 -1.2245 -0.9336 -0.9336 0.3619 0.3619 0.7785 0.7785 0.8853 0.8853 1.1877 1.1877 3.2175 3.2175 3.3279 3.3279 3.3715 3.3715 3.4701 3.4701 3.7549 3.7549 3.8802 3.8802 4.2857 4.2857 4.4079 4.4079 4.6155 4.6155 4.7510 4.7510 5.2264 5.2264 6.2013 6.2013 7.1574 7.1574 7.4637 7.4637 7.5878 7.5878 7.9433 7.9433 8.4830 8.4830 9.0243 9.0243 9.0429 9.0429 9.5204 9.5204 11.5938 11.5938 11.8742 11.8742 11.9457 11.9457 12.2598 12.2598 k = 0.0400 0.5000-0.0000 ( 10884 PWs) bands (ev): -45.3584 -45.3584 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0330 -10.0330 -7.3790 -7.3790 -6.1382 -6.1382 -5.9408 -5.9408 -5.2065 -5.2065 -4.9113 -4.9113 -1.2176 -1.2176 -0.9338 -0.9338 0.3642 0.3642 0.7799 0.7799 0.8900 0.8900 1.1865 1.1865 3.2181 3.2181 3.3278 3.3278 3.3711 3.3711 3.4705 3.4705 3.7551 3.7551 3.8805 3.8805 4.2811 4.2811 4.4063 4.4063 4.6168 4.6168 4.7509 4.7509 5.2188 5.2188 6.2023 6.2023 7.1478 7.1478 7.4316 7.4316 7.6202 7.6202 7.9435 7.9435 8.4742 8.4742 9.0146 9.0146 9.0504 9.0504 9.5215 9.5215 11.6072 11.6072 11.8814 11.8814 11.9447 11.9447 12.2604 12.2604 k = 0.0600 0.5000-0.0000 ( 10886 PWs) bands (ev): -45.3584 -45.3584 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0324 -10.0324 -7.3781 -7.3781 -6.1384 -6.1384 -5.9431 -5.9431 -5.2062 -5.2062 -4.9173 -4.9173 -1.2063 -1.2063 -0.9343 -0.9343 0.3680 0.3680 0.7821 0.7821 0.8977 0.8977 1.1846 1.1846 3.2190 3.2190 3.3276 3.3276 3.3703 3.3703 3.4711 3.4711 3.7553 3.7553 3.8809 3.8809 4.2733 4.2733 4.4038 4.4038 4.6187 4.6187 4.7508 4.7508 5.2061 5.2061 6.2039 6.2039 7.1325 7.1325 7.3960 7.3960 7.6566 7.6566 7.9437 7.9437 8.4600 8.4600 9.0047 9.0047 9.0564 9.0564 9.5233 9.5233 11.6292 11.6292 11.8931 11.8931 11.9431 11.9431 12.2624 12.2624 k = 0.0800 0.5000-0.0000 ( 10878 PWs) bands (ev): -45.3584 -45.3584 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0315 -10.0315 -7.3768 -7.3768 -6.1387 -6.1387 -5.9463 -5.9463 -5.2058 -5.2058 -4.9254 -4.9254 -1.1909 -1.1909 -0.9348 -0.9348 0.3735 0.3735 0.7853 0.7853 0.9083 0.9083 1.1822 1.1822 3.2202 3.2202 3.3274 3.3274 3.3694 3.3694 3.4720 3.4720 3.7556 3.7556 3.8815 3.8815 4.2626 4.2626 4.4005 4.4005 4.6210 4.6210 4.7504 4.7504 5.1881 5.1881 6.2060 6.2060 7.1125 7.1125 7.3604 7.3604 7.6935 7.6935 7.9440 7.9440 8.4410 8.4410 8.9947 8.9947 9.0605 9.0605 9.5257 9.5257 11.6596 11.6596 11.9077 11.9077 11.9419 11.9419 12.2663 12.2663 k = 0.1000 0.5000-0.0000 ( 10868 PWs) bands (ev): -45.3583 -45.3583 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0304 -10.0304 -7.3752 -7.3752 -6.1391 -6.1391 -5.9502 -5.9502 -5.2052 -5.2052 -4.9356 -4.9356 -1.1717 -1.1717 -0.9355 -0.9355 0.3805 0.3805 0.7892 0.7892 0.9216 0.9216 1.1794 1.1794 3.2219 3.2219 3.3271 3.3271 3.3682 3.3682 3.4730 3.4730 3.7560 3.7560 3.8821 3.8821 4.2489 4.2489 4.3964 4.3964 4.6233 4.6233 4.7499 4.7499 5.1649 5.1649 6.2087 6.2087 7.0892 7.0892 7.3261 7.3261 7.7299 7.7299 7.9445 7.9445 8.4182 8.4182 8.9845 8.9845 9.0627 9.0627 9.5284 9.5284 11.6978 11.6978 11.9190 11.9190 11.9473 11.9473 12.2722 12.2722 k = 0.1200 0.5000-0.0000 ( 10868 PWs) bands (ev): -45.3583 -45.3583 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0292 -10.0292 -7.3733 -7.3733 -6.1396 -6.1396 -5.9549 -5.9549 -5.2046 -5.2046 -4.9477 -4.9477 -1.1491 -1.1491 -0.9362 -0.9362 0.3893 0.3893 0.7940 0.7940 0.9373 0.9373 1.1766 1.1766 3.2239 3.2239 3.3267 3.3267 3.3667 3.3667 3.4742 3.4742 3.7564 3.7564 3.8829 3.8829 4.2328 4.2328 4.3913 4.3913 4.6253 4.6253 4.7490 4.7490 5.1365 5.1365 6.2119 6.2119 7.0641 7.0641 7.2934 7.2934 7.7655 7.7655 7.9450 7.9450 8.3924 8.3924 8.9737 8.9737 9.0630 9.0630 9.5310 9.5310 11.7434 11.7434 11.9186 11.9186 11.9672 11.9672 12.2798 12.2798 k = 0.1400 0.5000-0.0000 ( 10874 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0277 -10.0277 -7.3711 -7.3711 -6.1402 -6.1402 -5.9602 -5.9602 -5.2038 -5.2038 -4.9613 -4.9613 -1.1239 -1.1239 -0.9368 -0.9368 0.3997 0.3997 0.7994 0.7994 0.9549 0.9549 1.1742 1.1742 3.2263 3.2263 3.3262 3.3262 3.3651 3.3651 3.4754 3.4754 3.7567 3.7567 3.8837 3.8837 4.2144 4.2144 4.3849 4.3849 4.6268 4.6268 4.7476 4.7476 5.1030 5.1030 6.2154 6.2154 7.0387 7.0387 7.2626 7.2626 7.8005 7.8005 7.9457 7.9457 8.3646 8.3646 8.9618 8.9618 9.0617 9.0617 9.5329 9.5329 11.7954 11.7954 11.9126 11.9126 11.9955 11.9955 12.2890 12.2890 k = 0.1600 0.5000-0.0000 ( 10868 PWs) bands (ev): -45.3583 -45.3583 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0261 -10.0261 -7.3686 -7.3686 -6.1410 -6.1410 -5.9659 -5.9659 -5.2030 -5.2030 -4.9762 -4.9762 -1.0967 -1.0967 -0.9370 -0.9370 0.4120 0.4120 0.8056 0.8056 0.9737 0.9737 1.1729 1.1729 3.2291 3.2291 3.3257 3.3257 3.3633 3.3633 3.4767 3.4767 3.7571 3.7571 3.8845 3.8845 4.1944 4.1944 4.3766 4.3766 4.6276 4.6276 4.7453 4.7453 5.0651 5.0651 6.2193 6.2193 7.0144 7.0144 7.2340 7.2340 7.8352 7.8352 7.9465 7.9465 8.3355 8.3355 8.9483 8.9483 9.0595 9.0595 9.5336 9.5336 11.8523 11.8523 11.9052 11.9052 12.0284 12.0284 12.2994 12.2994 k = 0.1800 0.5000-0.0000 ( 10872 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0243 -10.0243 -7.3659 -7.3659 -6.1419 -6.1419 -5.9721 -5.9721 -5.2022 -5.2022 -4.9922 -4.9922 -1.0687 -1.0687 -0.9362 -0.9362 0.4260 0.4260 0.8123 0.8123 0.9927 0.9927 1.1737 1.1737 3.2323 3.2323 3.3250 3.3250 3.3614 3.3614 3.4781 3.4781 3.7573 3.7573 3.8852 3.8852 4.1730 4.1730 4.3658 4.3658 4.6277 4.6277 4.7419 4.7419 5.0233 5.0233 6.2235 6.2235 6.9922 6.9922 7.2079 7.2079 7.8698 7.8698 7.9478 7.9478 8.3059 8.3059 8.9329 8.9329 9.0566 9.0566 9.5324 9.5324 11.8901 11.8901 11.9201 11.9201 12.0647 12.0647 12.3106 12.3106 k = 0.2000 0.5000-0.0000 ( 10860 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0224 -10.0224 -7.3630 -7.3630 -6.1430 -6.1430 -5.9785 -5.9785 -5.2013 -5.2013 -5.0088 -5.0088 -1.0415 -1.0415 -0.9333 -0.9333 0.4418 0.4418 0.8195 0.8195 1.0104 1.0104 1.1779 1.1779 3.2358 3.2358 3.3243 3.3243 3.3594 3.3594 3.4795 3.4795 3.7574 3.7574 3.8857 3.8857 4.1509 4.1509 4.3520 4.3520 4.6271 4.6271 4.7370 4.7370 4.9789 4.9789 6.2278 6.2278 6.9728 6.9728 7.1848 7.1848 7.9040 7.9040 7.9502 7.9502 8.2764 8.2764 8.9152 8.9152 9.0535 9.0535 9.5288 9.5288 11.8823 11.8823 11.9824 11.9824 12.1043 12.1043 12.3225 12.3225 k = 0.2200 0.5000-0.0000 ( 10868 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0205 -10.0205 -7.3599 -7.3599 -6.1443 -6.1443 -5.9851 -5.9851 -5.2005 -5.2005 -5.0260 -5.0260 -1.0179 -1.0179 -0.9263 -0.9263 0.4593 0.4593 0.8270 0.8270 1.0251 1.0251 1.1871 1.1871 3.2397 3.2397 3.3235 3.3235 3.3573 3.3573 3.4810 3.4810 3.7573 3.7573 3.8858 3.8858 4.1284 4.1284 4.3345 4.3345 4.6259 4.6259 4.7298 4.7298 4.9333 4.9333 6.2322 6.2322 6.9569 6.9569 7.1650 7.1650 7.9327 7.9327 7.9596 7.9596 8.2472 8.2472 8.8952 8.8952 9.0504 9.0504 9.5220 9.5220 11.8718 11.8718 12.0468 12.0468 12.1470 12.1470 12.3346 12.3346 k = 0.2400 0.5000-0.0000 ( 10850 PWs) bands (ev): -45.3583 -45.3583 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0185 -10.0185 -7.3568 -7.3568 -6.1458 -6.1458 -5.9916 -5.9916 -5.1996 -5.1996 -5.0433 -5.0433 -1.0011 -1.0011 -0.9124 -0.9124 0.4786 0.4786 0.8349 0.8349 1.0355 1.0355 1.2023 1.2023 3.2437 3.2437 3.3226 3.3226 3.3552 3.3552 3.4826 3.4826 3.7569 3.7569 3.8855 3.8855 4.1061 4.1061 4.3129 4.3129 4.6238 4.6238 4.7196 4.7196 4.8886 4.8886 6.2367 6.2367 6.9447 6.9447 7.1486 7.1486 7.9426 7.9426 7.9894 7.9894 8.2189 8.2189 8.8731 8.8731 9.0474 9.0474 9.5117 9.5117 11.8609 11.8609 12.1070 12.1070 12.1932 12.1932 12.3466 12.3466 k = 0.2600 0.5000-0.0000 ( 10842 PWs) bands (ev): -45.3583 -45.3583 -45.2983 -45.2983 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0164 -10.0164 -7.3536 -7.3536 -6.1475 -6.1475 -5.9980 -5.9980 -5.1988 -5.1988 -5.0604 -5.0604 -0.9920 -0.9920 -0.8912 -0.8912 0.4994 0.4994 0.8428 0.8428 1.0414 1.0414 1.2234 1.2234 3.2480 3.2480 3.3216 3.3216 3.3530 3.3530 3.4846 3.4846 3.7562 3.7562 3.8844 3.8844 4.0844 4.0844 4.2870 4.2870 4.6208 4.6208 4.7049 4.7049 4.8477 4.8477 6.2411 6.2411 6.9366 6.9366 7.1357 7.1357 7.9452 7.9452 8.0285 8.0285 8.1918 8.1918 8.8491 8.8491 9.0445 9.0445 9.4975 9.4975 11.8499 11.8499 12.1578 12.1578 12.2381 12.2381 12.3596 12.3596 k = 0.2800 0.5000-0.0000 ( 10846 PWs) bands (ev): -45.3584 -45.3584 -45.2983 -45.2983 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0144 -10.0144 -7.3503 -7.3503 -6.1494 -6.1494 -6.0042 -6.0042 -5.1982 -5.1982 -5.0770 -5.0770 -0.9886 -0.9886 -0.8654 -0.8654 0.5216 0.5216 0.8508 0.8508 1.0436 1.0436 1.2493 1.2493 3.2522 3.2522 3.3206 3.3206 3.3509 3.3509 3.4871 3.4871 3.7550 3.7550 3.8823 3.8823 4.0639 4.0639 4.2568 4.2568 4.6158 4.6158 4.6847 4.6847 4.8138 4.8138 6.2454 6.2454 6.9327 6.9327 7.1260 7.1260 7.9465 7.9465 8.0701 8.0701 8.1671 8.1671 8.8237 8.8237 9.0414 9.0414 9.4792 9.4792 11.8392 11.8392 12.1940 12.1940 12.2651 12.2651 12.3826 12.3826 k = 0.3000 0.5000-0.0000 ( 10838 PWs) bands (ev): -45.3583 -45.3583 -45.2983 -45.2983 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0125 -10.0125 -7.3472 -7.3472 -6.1515 -6.1515 -6.0100 -6.0100 -5.1977 -5.1977 -5.0929 -5.0929 -0.9881 -0.9881 -0.8380 -0.8380 0.5448 0.5448 0.8587 0.8587 1.0432 1.0432 1.2785 1.2785 3.2562 3.2562 3.3195 3.3195 3.3487 3.3487 3.4903 3.4903 3.7534 3.7534 3.8788 3.8788 4.0452 4.0452 4.2230 4.2230 4.6058 4.6058 4.6617 4.6617 4.7885 4.7885 6.2496 6.2496 6.9330 6.9330 7.1193 7.1193 7.9473 7.9473 8.1052 8.1052 8.1528 8.1528 8.7975 8.7975 9.0379 9.0379 9.4569 9.4569 11.8288 11.8288 12.2025 12.2025 12.2791 12.2791 12.3944 12.3944 k = 0.3200 0.5000-0.0000 ( 10838 PWs) bands (ev): -45.3584 -45.3584 -45.2982 -45.2982 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0106 -10.0106 -7.3441 -7.3441 -6.1537 -6.1537 -6.0153 -6.0153 -5.1974 -5.1974 -5.1078 -5.1078 -0.9893 -0.9893 -0.8109 -0.8109 0.5687 0.5687 0.8664 0.8664 1.0414 1.0414 1.3093 1.3093 3.2598 3.2598 3.3183 3.3183 3.3467 3.3467 3.4947 3.4947 3.7511 3.7511 3.8736 3.8736 4.0286 4.0286 4.1866 4.1866 4.5845 4.5845 4.6439 4.6439 4.7709 4.7709 6.2536 6.2536 6.9371 6.9371 7.1151 7.1151 7.9480 7.9480 8.1019 8.1019 8.1808 8.1808 8.7711 8.7711 9.0338 9.0338 9.4306 9.4306 11.8190 11.8190 12.1803 12.1803 12.3024 12.3024 12.4032 12.4032 k = 0.3400 0.5000-0.0000 ( 10836 PWs) bands (ev): -45.3583 -45.3583 -45.2983 -45.2983 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0088 -10.0088 -7.3412 -7.3412 -6.1561 -6.1561 -6.0202 -6.0202 -5.1975 -5.1975 -5.1214 -5.1214 -0.9912 -0.9912 -0.7851 -0.7851 0.5927 0.5927 0.8737 0.8737 1.0388 1.0388 1.3405 1.3405 3.2626 3.2626 3.3172 3.3172 3.3447 3.3447 3.5007 3.5007 3.7479 3.7479 3.8663 3.8663 4.0146 4.0146 4.1490 4.1490 4.5519 4.5519 4.6350 4.6350 4.7584 4.7584 6.2575 6.2575 6.9447 6.9447 7.1131 7.1131 7.9486 7.9486 8.0812 8.0812 8.2297 8.2297 8.7453 8.7453 9.0285 9.0285 9.4010 9.4010 11.8098 11.8098 12.1457 12.1457 12.3283 12.3283 12.4111 12.4111 k = 0.3600 0.5000-0.0000 ( 10828 PWs) bands (ev): -45.3583 -45.3583 -45.2982 -45.2982 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0071 -10.0071 -7.3384 -7.3384 -6.1584 -6.1584 -6.0244 -6.0244 -5.1979 -5.1979 -5.1334 -5.1334 -0.9934 -0.9934 -0.7614 -0.7614 0.6162 0.6162 0.8804 0.8804 1.0360 1.0360 1.3710 1.3710 3.2644 3.2644 3.3160 3.3160 3.3430 3.3430 3.5087 3.5087 3.7437 3.7437 3.8568 3.8568 4.0034 4.0034 4.1119 4.1119 4.5149 4.5149 4.6305 4.6305 4.7492 4.7492 6.2611 6.2611 6.9548 6.9548 7.1130 7.1130 7.9490 7.9490 8.0591 8.0591 8.2831 8.2831 8.7209 8.7209 9.0215 9.0215 9.3687 9.3687 11.8015 11.8015 12.1077 12.1077 12.3515 12.3515 12.4170 12.4170 k = 0.3800 0.5000-0.0000 ( 10820 PWs) bands (ev): -45.3583 -45.3583 -45.2982 -45.2982 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0056 -10.0056 -7.3359 -7.3359 -6.1607 -6.1607 -6.0281 -6.0281 -5.1989 -5.1989 -5.1435 -5.1435 -0.9958 -0.9958 -0.7403 -0.7403 0.6385 0.6385 0.8866 0.8866 1.0333 1.0333 1.3996 1.3996 3.2650 3.2650 3.3149 3.3149 3.3415 3.3415 3.5191 3.5191 3.7381 3.7381 3.8452 3.8452 3.9949 3.9949 4.0770 4.0770 4.4782 4.4782 4.6279 4.6279 4.7422 4.7422 6.2644 6.2644 6.9666 6.9666 7.1144 7.1144 7.9495 7.9495 8.0377 8.0377 8.3381 8.3381 8.6991 8.6991 9.0120 9.0120 9.3352 9.3352 11.7941 11.7941 12.0703 12.0703 12.3697 12.3697 12.4208 12.4208 k = 0.4000 0.5000-0.0000 ( 10802 PWs) bands (ev): -45.3583 -45.3583 -45.2981 -45.2981 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0043 -10.0043 -7.3338 -7.3338 -6.1628 -6.1628 -6.0312 -6.0312 -5.2004 -5.2004 -5.1517 -5.1517 -0.9980 -0.9980 -0.7221 -0.7221 0.6590 0.6590 0.8921 0.8921 1.0310 1.0310 1.4256 1.4256 3.2645 3.2645 3.3139 3.3139 3.3403 3.3403 3.5321 3.5321 3.7303 3.7303 3.8322 3.8322 3.9888 3.9888 4.0460 4.0460 4.4440 4.4440 4.6262 4.6262 4.7368 4.7368 6.2673 6.2673 6.9788 6.9788 7.1171 7.1171 7.9499 7.9499 8.0176 8.0176 8.3926 8.3926 8.6811 8.6811 8.9991 8.9991 9.3021 9.3021 11.7877 11.7877 12.0355 12.0355 12.3804 12.3804 12.4243 12.4243 k = 0.4200 0.5000-0.0000 ( 10802 PWs) bands (ev): -45.3583 -45.3583 -45.2981 -45.2981 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0032 -10.0032 -7.3319 -7.3319 -6.1647 -6.1647 -6.0337 -6.0337 -5.2024 -5.2024 -5.1577 -5.1577 -0.9999 -0.9999 -0.7070 -0.7070 0.6769 0.6769 0.8967 0.8967 1.0291 1.0291 1.4481 1.4481 3.2630 3.2630 3.3129 3.3129 3.3395 3.3395 3.5479 3.5479 3.7196 3.7196 3.8192 3.8192 3.9846 3.9846 4.0202 4.0202 4.4141 4.4141 4.6250 4.6250 4.7327 4.7327 6.2698 6.2698 6.9902 6.9902 7.1207 7.1207 7.9504 7.9504 7.9996 7.9996 8.4439 8.4439 8.6689 8.6689 8.9819 8.9819 9.2717 9.2717 11.7824 11.7824 12.0052 12.0052 12.3826 12.3826 12.4299 12.4299 k = 0.4400 0.5000-0.0000 ( 10796 PWs) bands (ev): -45.3583 -45.3583 -45.2981 -45.2981 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0023 -10.0023 -7.3304 -7.3304 -6.1662 -6.1662 -6.0357 -6.0357 -5.2045 -5.2045 -5.1620 -5.1620 -1.0015 -1.0015 -0.6951 -0.6951 0.6916 0.6916 0.9004 0.9004 1.0277 1.0277 1.4665 1.4665 3.2610 3.2610 3.3121 3.3121 3.3390 3.3390 3.5662 3.5662 3.7052 3.7052 3.8077 3.8077 3.9817 3.9817 4.0003 4.0003 4.3895 4.3895 4.6242 4.6242 4.7296 4.7296 6.2718 6.2718 7.0000 7.0000 7.1248 7.1248 7.9509 7.9509 7.9843 7.9843 8.4877 8.4877 8.6651 8.6651 8.9602 8.9602 9.2463 9.2463 11.7782 11.7782 11.9805 11.9805 12.3794 12.3794 12.4367 12.4367 k = 0.4600 0.5000-0.0000 ( 10792 PWs) bands (ev): -45.3583 -45.3583 -45.2980 -45.2980 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0017 -10.0017 -7.3294 -7.3294 -6.1674 -6.1674 -6.0370 -6.0370 -5.2064 -5.2064 -5.1647 -5.1647 -1.0027 -1.0027 -0.6866 -0.6866 0.7024 0.7024 0.9030 0.9030 1.0268 1.0268 1.4800 1.4800 3.2590 3.2590 3.3115 3.3115 3.3387 3.3387 3.5863 3.5863 3.6875 3.6875 3.7992 3.7992 3.9792 3.9792 3.9871 3.9871 4.3712 4.3712 4.6236 4.6236 4.7275 4.7275 6.2732 6.2732 7.0073 7.0073 7.1286 7.1286 7.9517 7.9517 7.9723 7.9723 8.5185 8.5185 8.6720 8.6720 8.9359 8.9359 9.2275 9.2275 11.7751 11.7751 11.9623 11.9623 12.3751 12.3751 12.4425 12.4425 k = 0.4800 0.5000-0.0000 ( 10784 PWs) bands (ev): -45.3583 -45.3583 -45.2980 -45.2980 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0013 -10.0013 -7.3287 -7.3287 -6.1681 -6.1681 -6.0378 -6.0378 -5.2077 -5.2077 -5.1661 -5.1661 -1.0034 -1.0034 -0.6814 -0.6814 0.7091 0.7091 0.9047 0.9047 1.0263 1.0263 1.4883 1.4883 3.2575 3.2575 3.3112 3.3112 3.3385 3.3385 3.6064 3.6064 3.6684 3.6684 3.7940 3.7940 3.9754 3.9754 3.9817 3.9817 4.3600 4.3600 4.6232 4.6232 4.7262 4.7262 6.2741 6.2741 7.0117 7.0117 7.1314 7.1314 7.9529 7.9529 7.9641 7.9641 8.5344 8.5344 8.6853 8.6853 8.9147 8.9147 9.2162 9.2162 11.7733 11.7733 11.9511 11.9511 12.3719 12.3719 12.4462 12.4462 k = 0.5000 0.5000-0.0000 ( 10768 PWs) bands (ev): -45.3582 -45.3582 -45.2979 -45.2979 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0012 -10.0012 -7.3285 -7.3285 -6.1684 -6.1684 -6.0381 -6.0381 -5.2082 -5.2082 -5.1666 -5.1666 -1.0037 -1.0037 -0.6797 -0.6797 0.7114 0.7114 0.9052 0.9052 1.0261 1.0261 1.4911 1.4911 3.2570 3.2570 3.3111 3.3111 3.3385 3.3385 3.6178 3.6178 3.6573 3.6573 3.7923 3.7923 3.9732 3.9732 3.9808 3.9808 4.3562 4.3562 4.6231 4.6231 4.7258 4.7258 6.2744 6.2744 7.0132 7.0132 7.1324 7.1324 7.9538 7.9538 7.9607 7.9607 8.5389 8.5389 8.6924 8.6924 8.9057 8.9057 9.2124 9.2124 11.7727 11.7727 11.9474 11.9474 12.3707 12.3707 12.4475 12.4475 k = 0.5000 0.5000-0.0000 ( 10768 PWs) bands (ev): -45.3582 -45.3582 -45.2979 -45.2979 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0012 -10.0012 -7.3285 -7.3285 -6.1684 -6.1684 -6.0381 -6.0381 -5.2082 -5.2082 -5.1666 -5.1666 -1.0037 -1.0037 -0.6797 -0.6797 0.7114 0.7114 0.9052 0.9052 1.0261 1.0261 1.4911 1.4911 3.2570 3.2570 3.3111 3.3111 3.3385 3.3385 3.6178 3.6178 3.6573 3.6573 3.7923 3.7923 3.9732 3.9732 3.9808 3.9808 4.3562 4.3562 4.6231 4.6231 4.7258 4.7258 6.2744 6.2744 7.0132 7.0132 7.1324 7.1324 7.9538 7.9538 7.9607 7.9607 8.5389 8.5389 8.6924 8.6924 8.9057 8.9057 9.2124 9.2124 11.7727 11.7727 11.9474 11.9474 12.3707 12.3707 12.4475 12.4475 k = 0.4857 0.4857-0.0000 ( 10784 PWs) bands (ev): -45.3582 -45.3582 -45.2980 -45.2980 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0013 -10.0013 -7.3287 -7.3287 -6.1681 -6.1681 -6.0378 -6.0378 -5.2077 -5.2077 -5.1661 -5.1661 -1.0034 -1.0034 -0.6815 -0.6815 0.7091 0.7091 0.9047 0.9047 1.0263 1.0263 1.4882 1.4882 3.2575 3.2575 3.3112 3.3112 3.3385 3.3385 3.6061 3.6061 3.6688 3.6688 3.7940 3.7940 3.9755 3.9755 3.9816 3.9816 4.3600 4.3600 4.6232 4.6232 4.7262 4.7262 6.2741 6.2741 7.0117 7.0117 7.1314 7.1314 7.9528 7.9528 7.9641 7.9641 8.5346 8.5346 8.6846 8.6846 8.9152 8.9152 9.2162 9.2162 11.7733 11.7733 11.9512 11.9512 12.3719 12.3719 12.4462 12.4462 k = 0.4714 0.4714-0.0000 ( 10800 PWs) bands (ev): -45.3583 -45.3583 -45.2980 -45.2980 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0017 -10.0017 -7.3294 -7.3294 -6.1674 -6.1674 -6.0370 -6.0370 -5.2062 -5.2062 -5.1647 -5.1647 -1.0027 -1.0027 -0.6867 -0.6867 0.7022 0.7022 0.9030 0.9030 1.0268 1.0268 1.4798 1.4798 3.2587 3.2587 3.3116 3.3116 3.3387 3.3387 3.5850 3.5850 3.6899 3.6899 3.7989 3.7989 3.9813 3.9813 3.9849 3.9849 4.3715 4.3715 4.6236 4.6236 4.7275 4.7275 6.2732 6.2732 7.0071 7.0071 7.1285 7.1285 7.9517 7.9517 7.9723 7.9723 8.5223 8.5223 8.6647 8.6647 8.9400 8.9400 9.2272 9.2272 11.7752 11.7752 11.9627 11.9627 12.3751 12.3751 12.4421 12.4421 k = 0.4571 0.4571-0.0000 ( 10808 PWs) bands (ev): -45.3584 -45.3584 -45.2981 -45.2981 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0023 -10.0023 -7.3305 -7.3305 -6.1661 -6.1661 -6.0357 -6.0357 -5.2038 -5.2038 -5.1624 -5.1624 -1.0015 -1.0015 -0.6954 -0.6954 0.6908 0.6908 0.9002 0.9002 1.0276 1.0276 1.4659 1.4659 3.2595 3.2595 3.3122 3.3122 3.3389 3.3389 3.5636 3.5636 3.7132 3.7132 3.8067 3.8067 3.9857 3.9857 3.9954 3.9954 4.3901 4.3901 4.6241 4.6241 4.7296 4.7296 6.2717 6.2717 6.9996 6.9996 7.1243 7.1243 7.9508 7.9508 7.9837 7.9837 8.5038 8.5038 8.6382 8.6382 8.9743 8.9743 9.2445 9.2445 11.7784 11.7784 11.9816 11.9816 12.3790 12.3790 12.4352 12.4352 k = 0.4429 0.4429-0.0000 ( 10803 PWs) bands (ev): -45.3583 -45.3583 -45.2981 -45.2981 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0033 -10.0033 -7.3320 -7.3320 -6.1644 -6.1644 -6.0338 -6.0338 -5.2005 -5.2005 -5.1592 -5.1592 -0.9998 -0.9998 -0.7073 -0.7073 0.6752 0.6752 0.8964 0.8964 1.0287 1.0287 1.4472 1.4472 3.2581 3.2581 3.3130 3.3130 3.3391 3.3391 3.5453 3.5453 3.7376 3.7376 3.8169 3.8169 3.9905 3.9905 4.0110 4.0110 4.4151 4.4151 4.6249 4.6249 4.7327 4.7327 6.2696 6.2696 6.9893 6.9893 7.1196 7.1196 7.9501 7.9501 7.9970 7.9970 8.4815 8.4815 8.6094 8.6094 9.0136 9.0136 9.2666 9.2666 11.7828 11.7828 12.0076 12.0076 12.3813 12.3813 12.4263 12.4263 k = 0.4286 0.4286-0.0000 ( 10817 PWs) bands (ev): -45.3583 -45.3583 -45.2982 -45.2982 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0044 -10.0044 -7.3340 -7.3340 -6.1622 -6.1622 -6.0314 -6.0314 -5.1962 -5.1962 -5.1551 -5.1551 -0.9978 -0.9978 -0.7225 -0.7225 0.6555 0.6555 0.8915 0.8915 1.0302 1.0302 1.4241 1.4241 3.2523 3.2523 3.3139 3.3139 3.3393 3.3393 3.5327 3.5327 3.7626 3.7626 3.8299 3.8299 3.9966 3.9966 4.0304 4.0304 4.4457 4.4457 4.6259 4.6259 4.7366 4.7366 6.2670 6.2670 6.9768 6.9768 7.1150 7.1150 7.9495 7.9495 8.0101 8.0101 8.4577 8.4577 8.5806 8.5806 9.0555 9.0555 9.2923 9.2923 11.7887 11.7887 12.0403 12.0403 12.3774 12.3774 12.4179 12.4179 k = 0.4143 0.4143-0.0000 ( 10827 PWs) bands (ev): -45.3583 -45.3583 -45.2982 -45.2982 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0058 -10.0058 -7.3363 -7.3363 -6.1595 -6.1595 -6.0285 -6.0285 -5.1910 -5.1910 -5.1502 -5.1502 -0.9954 -0.9954 -0.7406 -0.7406 0.6320 0.6320 0.8857 0.8857 1.0318 1.0318 1.3973 1.3973 3.2400 3.2400 3.3148 3.3148 3.3396 3.3396 3.5280 3.5280 3.7870 3.7870 3.8467 3.8467 4.0041 4.0041 4.0528 4.0528 4.4811 4.4811 4.6271 4.6271 4.7416 4.7416 6.2638 6.2638 6.9626 6.9626 7.1109 7.1109 7.9489 7.9489 8.0207 8.0207 8.4345 8.4345 8.5540 8.5540 9.0984 9.0984 9.3201 9.3201 11.7959 11.7959 12.0786 12.0786 12.3643 12.3643 12.4114 12.4114 k = 0.4000 0.4000-0.0000 ( 10835 PWs) bands (ev): -45.3583 -45.3583 -45.2983 -45.2983 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0074 -10.0074 -7.3390 -7.3390 -6.1564 -6.1564 -6.0251 -6.0251 -5.1850 -5.1850 -5.1444 -5.1444 -0.9929 -0.9929 -0.7615 -0.7615 0.6051 0.6051 0.8790 0.8790 1.0337 1.0337 1.3675 1.3675 3.2204 3.2204 3.3158 3.3158 3.3400 3.3400 3.5321 3.5321 3.8091 3.8091 3.8686 3.8686 4.0131 4.0131 4.0777 4.0777 4.5203 4.5203 4.6286 4.6286 4.7476 4.7476 6.2602 6.2602 6.9476 6.9476 7.1077 7.1077 7.9481 7.9481 8.0265 8.0265 8.4128 8.4128 8.5321 8.5321 9.1415 9.1415 9.3492 9.3492 11.8047 11.8047 12.1208 12.1208 12.3443 12.3443 12.4020 12.4020 k = 0.3857 0.3857-0.0000 ( 10839 PWs) bands (ev): -45.3583 -45.3583 -45.2983 -45.2983 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0093 -10.0093 -7.3421 -7.3421 -6.1530 -6.1530 -6.0213 -6.0213 -5.1781 -5.1781 -5.1378 -5.1378 -0.9904 -0.9904 -0.7848 -0.7848 0.5751 0.5751 0.8715 0.8715 1.0355 1.0355 1.3356 1.3356 3.1941 3.1941 3.3169 3.3169 3.3407 3.3407 3.5440 3.5440 3.8282 3.8282 3.8962 3.8962 4.0237 4.0237 4.1043 4.1043 4.5622 4.5622 4.6309 4.6309 4.7548 4.7548 6.2562 6.2562 6.9327 6.9327 7.1056 7.1056 7.9473 7.9473 8.0258 8.0258 8.3920 8.3920 8.5176 8.5176 9.1841 9.1841 9.3787 9.3787 11.8149 11.8149 12.1622 12.1622 12.3213 12.3213 12.3833 12.3833 k = 0.3714 0.3714-0.0000 ( 10847 PWs) bands (ev): -45.3583 -45.3583 -45.2983 -45.2983 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0113 -10.0113 -7.3454 -7.3454 -6.1491 -6.1491 -6.0171 -6.0171 -5.1704 -5.1704 -5.1305 -5.1305 -0.9882 -0.9882 -0.8100 -0.8100 0.5424 0.5424 0.8632 0.8632 1.0370 1.0370 1.3026 1.3026 3.1625 3.1625 3.3181 3.3181 3.3417 3.3417 3.5619 3.5619 3.8450 3.8450 3.9281 3.9281 4.0361 4.0361 4.1322 4.1322 4.6035 4.6035 4.6364 4.6364 4.7631 4.7631 6.2517 6.2517 6.9188 6.9188 7.1047 7.1047 7.9463 7.9463 8.0179 8.0179 8.3708 8.3708 8.5130 8.5130 9.2257 9.2257 9.4080 9.4080 11.8267 11.8267 12.1886 12.1886 12.2945 12.2945 12.3604 12.3604 k = 0.3571 0.3571-0.0000 ( 10859 PWs) bands (ev): -45.3583 -45.3583 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0135 -10.0135 -7.3491 -7.3491 -6.1449 -6.1449 -6.0125 -6.0125 -5.1620 -5.1620 -5.1224 -5.1224 -0.9867 -0.9867 -0.8367 -0.8367 0.5073 0.5073 0.8542 0.8542 1.0376 1.0376 1.2696 1.2696 3.1273 3.1273 3.3195 3.3195 3.3429 3.3429 3.5840 3.5840 3.8609 3.8609 3.9625 3.9625 4.0503 4.0503 4.1606 4.1606 4.6252 4.6252 4.6638 4.6638 4.7728 4.7728 6.2470 6.2470 6.9065 6.9065 7.1053 7.1053 7.9450 7.9450 8.0036 8.0036 8.3484 8.3484 8.5187 8.5187 9.2658 9.2658 9.4367 9.4367 11.8400 11.8400 12.1721 12.1721 12.2531 12.2531 12.3721 12.3721 k = 0.3429 0.3429-0.0000 ( 10841 PWs) bands (ev): -45.3583 -45.3583 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0159 -10.0159 -7.3529 -7.3529 -6.1404 -6.1404 -6.0075 -6.0075 -5.1529 -5.1529 -5.1137 -5.1137 -0.9868 -0.9868 -0.8637 -0.8637 0.4703 0.4703 0.8447 0.8447 1.0364 1.0364 1.2380 1.2380 3.0898 3.0898 3.3210 3.3210 3.3443 3.3443 3.6087 3.6087 3.8767 3.8767 3.9975 3.9975 4.0669 4.0669 4.1891 4.1891 4.6299 4.6299 4.7096 4.7096 4.7841 4.7841 6.2419 6.2419 6.8965 6.8965 7.1074 7.1074 7.9433 7.9433 7.9846 7.9846 8.3250 8.3250 8.5329 8.5329 9.3042 9.3042 9.4648 9.4648 11.8549 11.8549 12.1047 12.1047 12.2123 12.2123 12.4169 12.4169 k = 0.3286 0.3286-0.0000 ( 10843 PWs) bands (ev): -45.3582 -45.3582 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0184 -10.0184 -7.3570 -7.3570 -6.1356 -6.1356 -6.0023 -6.0023 -5.1432 -5.1432 -5.1044 -5.1044 -0.9900 -0.9900 -0.8891 -0.8891 0.4317 0.4317 0.8346 0.8346 1.0320 1.0320 1.2098 1.2098 3.0511 3.0511 3.3226 3.3226 3.3458 3.3458 3.6349 3.6349 3.8929 3.8929 4.0312 4.0312 4.0869 4.0869 4.2172 4.2172 4.6324 4.6324 4.7580 4.7580 4.7976 4.7976 6.2367 6.2367 6.8893 6.8893 7.1112 7.1112 7.9395 7.9395 7.9639 7.9639 8.3015 8.3015 8.5531 8.5531 9.3404 9.3404 9.4920 9.4920 11.8712 11.8712 12.0100 12.0100 12.1764 12.1764 12.4350 12.4350 k = 0.3143 0.3143-0.0000 ( 10853 PWs) bands (ev): -45.3583 -45.3583 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0210 -10.0210 -7.3613 -7.3613 -6.1306 -6.1306 -5.9968 -5.9968 -5.1329 -5.1329 -5.0946 -5.0946 -0.9993 -0.9993 -0.9100 -0.9100 0.3919 0.3919 0.8242 0.8242 1.0225 1.0225 1.1872 1.1872 3.0117 3.0117 3.3243 3.3243 3.3475 3.3475 3.6615 3.6615 3.9097 3.9097 4.0613 4.0613 4.1117 4.1117 4.2444 4.2444 4.6345 4.6345 4.7995 4.7995 4.8206 4.8206 6.2312 6.2312 6.8854 6.8854 7.1168 7.1168 7.9271 7.9271 7.9499 7.9499 8.2785 8.2785 8.5772 8.5772 9.3742 9.3742 9.5185 9.5185 11.8860 11.8860 11.9068 11.9068 12.1412 12.1412 12.4268 12.4268 k = 0.3000 0.3000-0.0000 ( 10865 PWs) bands (ev): -45.3583 -45.3583 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0237 -10.0237 -7.3657 -7.3657 -6.1254 -6.1254 -5.9911 -5.9911 -5.1222 -5.1222 -5.0843 -5.0843 -1.0175 -1.0175 -0.9233 -0.9233 0.3513 0.3513 0.8134 0.8134 1.0066 1.0066 1.1720 1.1720 2.9722 2.9722 3.3260 3.3260 3.3492 3.3492 3.6878 3.6878 3.9273 3.9273 4.0868 4.0868 4.1415 4.1415 4.2703 4.2703 4.6367 4.6367 4.8206 4.8206 4.8660 4.8660 6.2255 6.2255 6.8851 6.8851 7.1245 7.1245 7.9044 7.9044 7.9453 7.9453 8.2564 8.2564 8.6033 8.6033 9.4054 9.4054 9.5444 9.5444 11.7904 11.7904 11.9096 11.9096 12.1060 12.1060 12.4162 12.4162 k = 0.2857 0.2857-0.0000 ( 10865 PWs) bands (ev): -45.3583 -45.3583 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5075 -21.5075 -21.3130 -21.3130 -10.0265 -10.0265 -7.3701 -7.3701 -6.1200 -6.1200 -5.9852 -5.9852 -5.1110 -5.1110 -5.0736 -5.0736 -1.0438 -1.0438 -0.9295 -0.9295 0.3102 0.3102 0.8025 0.8025 0.9845 0.9845 1.1643 1.1643 2.9331 2.9331 3.3279 3.3279 3.3510 3.3510 3.7133 3.7133 3.9457 3.9457 4.1091 4.1091 4.1744 4.1744 4.2946 4.2946 4.6389 4.6389 4.8381 4.8381 4.9164 4.9164 6.2198 6.2198 6.8885 6.8885 7.1343 7.1343 7.8795 7.8795 7.9430 7.9430 8.2356 8.2356 8.6302 8.6302 9.4336 9.4336 9.5700 9.5700 11.6751 11.6751 11.9298 11.9298 12.0713 12.0713 12.4039 12.4039 k = 0.2714 0.2714-0.0000 ( 10863 PWs) bands (ev): -45.3583 -45.3583 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0294 -10.0294 -7.3747 -7.3747 -6.1146 -6.1146 -5.9792 -5.9792 -5.0995 -5.0995 -5.0626 -5.0626 -1.0751 -1.0751 -0.9315 -0.9315 0.2689 0.2689 0.7914 0.7914 0.9578 0.9578 1.1627 1.1627 2.8946 2.8946 3.3297 3.3297 3.3529 3.3529 3.7376 3.7376 3.9649 3.9649 4.1297 4.1297 4.2080 4.2080 4.3169 4.3169 4.6412 4.6412 4.8563 4.8563 4.9672 4.9672 6.2139 6.2139 6.8959 6.8959 7.1464 7.1464 7.8549 7.8549 7.9413 7.9413 8.2159 8.2159 8.6572 8.6572 9.4589 9.4589 9.5953 9.5953 11.5581 11.5581 11.9505 11.9505 12.0380 12.0380 12.3895 12.3895 k = 0.2571 0.2571-0.0000 ( 10855 PWs) bands (ev): -45.3583 -45.3583 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0322 -10.0322 -7.3792 -7.3792 -6.1090 -6.1090 -5.9732 -5.9732 -5.0877 -5.0877 -5.0513 -5.0513 -1.1090 -1.1090 -0.9315 -0.9315 0.2277 0.2277 0.7802 0.7802 0.9286 0.9286 1.1653 1.1653 2.8571 2.8571 3.3316 3.3316 3.3548 3.3548 3.7604 3.7604 3.9846 3.9846 4.1496 4.1496 4.2411 4.2411 4.3373 4.3373 4.6438 4.6438 4.8756 4.8756 5.0174 5.0174 6.2079 6.2079 6.9073 6.9073 7.1607 7.1607 7.8314 7.8314 7.9397 7.9397 8.1974 8.1974 8.6835 8.6835 9.4812 9.4812 9.6206 9.6206 11.4407 11.4407 11.9665 11.9665 12.0111 12.0111 12.3726 12.3726 k = 0.2429 0.2429-0.0000 ( 10875 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0351 -10.0351 -7.3838 -7.3838 -6.1035 -6.1035 -5.9671 -5.9671 -5.0757 -5.0757 -5.0399 -5.0399 -1.1440 -1.1440 -0.9306 -0.9306 0.1870 0.1870 0.7692 0.7692 0.8985 0.8985 1.1705 1.1705 2.8207 2.8207 3.3335 3.3335 3.3567 3.3567 3.7816 3.7816 4.0049 4.0049 4.1691 4.1691 4.2726 4.2726 4.3555 4.3555 4.6465 4.6465 4.8960 4.8960 5.0665 5.0665 6.2019 6.2019 6.9225 6.9225 7.1774 7.1774 7.8096 7.8096 7.9381 7.9381 8.1798 8.1798 8.7089 8.7089 9.5009 9.5009 9.6457 9.6457 11.3238 11.3238 11.9561 11.9561 12.0124 12.0124 12.3521 12.3521 k = 0.2286 0.2286-0.0000 ( 10871 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0380 -10.0380 -7.3882 -7.3882 -6.0980 -6.0980 -5.9610 -5.9610 -5.0637 -5.0637 -5.0285 -5.0285 -1.1795 -1.1795 -0.9294 -0.9294 0.1470 0.1470 0.7582 0.7582 0.8686 0.8686 1.1776 1.1776 2.7856 2.7856 3.3353 3.3353 3.3587 3.3587 3.8011 3.8011 4.0253 4.0253 4.1881 4.1881 4.3021 4.3021 4.3718 4.3718 4.6494 4.6494 4.9173 4.9173 5.1141 5.1141 6.1959 6.1959 6.9417 6.9417 7.1963 7.1963 7.7898 7.7898 7.9365 7.9365 8.1629 8.1629 8.7332 8.7332 9.5182 9.5182 9.6705 9.6705 11.2084 11.2084 11.9276 11.9276 12.0333 12.0333 12.3269 12.3269 k = 0.2143 0.2143-0.0000 ( 10881 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5074 -21.5074 -21.3130 -21.3130 -10.0408 -10.0408 -7.3926 -7.3926 -6.0925 -6.0925 -5.9551 -5.9551 -5.0517 -5.0517 -5.0170 -5.0170 -1.2148 -1.2148 -0.9282 -0.9282 0.1080 0.1080 0.7475 0.7475 0.8396 0.8396 1.1857 1.1857 2.7520 2.7520 3.3371 3.3371 3.3606 3.3606 3.8192 3.8192 4.0458 4.0458 4.2066 4.2066 4.3289 4.3289 4.3865 4.3865 4.6525 4.6525 4.9394 4.9394 5.1600 5.1600 6.1899 6.1899 6.9645 6.9645 7.2173 7.2173 7.7722 7.7722 7.9348 7.9348 8.1463 8.1463 8.7563 8.7563 9.5336 9.5336 9.6951 9.6951 11.0950 11.0950 11.8973 11.8973 12.0572 12.0572 12.2950 12.2950 k = 0.2000 0.2000-0.0000 ( 10877 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5074 -21.5074 -21.3129 -21.3129 -10.0436 -10.0436 -7.3969 -7.3969 -6.0872 -6.0872 -5.9492 -5.9492 -5.0398 -5.0398 -5.0057 -5.0057 -1.2495 -1.2495 -0.9272 -0.9272 0.0703 0.0703 0.7371 0.7371 0.8119 0.8119 1.1945 1.1945 2.7200 2.7200 3.3389 3.3389 3.3625 3.3625 3.8358 3.8358 4.0661 4.0661 4.2245 4.2245 4.3525 4.3525 4.4001 4.4001 4.6557 4.6557 4.9619 4.9619 5.2038 5.2038 6.1839 6.1839 6.9907 6.9907 7.2402 7.2402 7.7569 7.7569 7.9332 7.9332 8.1297 8.1297 8.7782 8.7782 9.5474 9.5474 9.7192 9.7192 10.9845 10.9845 11.8676 11.8676 12.0803 12.0803 12.2543 12.2543 k = 0.1857 0.1857-0.0000 ( 10881 PWs) bands (ev): -45.3585 -45.3585 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5074 -21.5074 -21.3129 -21.3129 -10.0463 -10.0463 -7.4010 -7.4010 -6.0820 -6.0820 -5.9435 -5.9435 -5.0282 -5.0282 -4.9946 -4.9946 -1.2832 -1.2832 -0.9264 -0.9264 0.0341 0.0341 0.7270 0.7270 0.7859 0.7859 1.2037 1.2037 2.6898 2.6898 3.3407 3.3407 3.3643 3.3643 3.8510 3.8510 4.0860 4.0860 4.2413 4.2413 4.3721 4.3721 4.4137 4.4137 4.6589 4.6589 4.9845 4.9845 5.2452 5.2452 6.1781 6.1781 7.0201 7.0201 7.2646 7.2646 7.7442 7.7442 7.9315 7.9315 8.1126 8.1126 8.7990 8.7990 9.5600 9.5600 9.7429 9.7429 10.8775 10.8775 11.8391 11.8391 12.0969 12.0969 12.2073 12.2073 k = 0.1714 0.1714-0.0000 ( 10881 PWs) bands (ev): -45.3585 -45.3585 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0489 -10.0489 -7.4049 -7.4049 -6.0770 -6.0770 -5.9380 -5.9380 -5.0169 -5.0169 -4.9839 -4.9839 -1.3156 -1.3156 -0.9260 -0.9260 -0.0004 -0.0004 0.7173 0.7173 0.7618 0.7618 1.2130 1.2130 2.6614 2.6614 3.3423 3.3423 3.3661 3.3661 3.8649 3.8649 4.1054 4.1054 4.2571 4.2571 4.3871 4.3871 4.4280 4.4280 4.6622 4.6622 5.0070 5.0070 5.2840 5.2840 6.1725 6.1725 7.0524 7.0524 7.2901 7.2901 7.7340 7.7340 7.9297 7.9297 8.0948 8.0948 8.8187 8.8187 9.5717 9.5717 9.7660 9.7660 10.7744 10.7744 11.8120 11.8120 12.0842 12.0842 12.1782 12.1782 k = 0.1571 0.1571-0.0000 ( 10871 PWs) bands (ev): -45.3584 -45.3584 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0513 -10.0513 -7.4087 -7.4087 -6.0723 -6.0723 -5.9328 -5.9328 -5.0060 -5.0060 -4.9735 -4.9735 -1.3465 -1.3465 -0.9258 -0.9258 -0.0330 -0.0330 0.7080 0.7080 0.7397 0.7397 1.2221 1.2221 2.6349 2.6349 3.3439 3.3439 3.3678 3.3678 3.8776 3.8776 4.1242 4.1242 4.2713 4.2713 4.3978 4.3978 4.4431 4.4431 4.6654 4.6654 5.0289 5.0289 5.3200 5.3200 6.1671 6.1671 7.0871 7.0871 7.3162 7.3162 7.7264 7.7264 7.9279 7.9279 8.0759 8.0759 8.8374 8.8374 9.5827 9.5827 9.7885 9.7885 10.6760 10.6760 11.7865 11.7865 12.0281 12.0281 12.1862 12.1862 k = 0.1429 0.1429-0.0000 ( 10887 PWs) bands (ev): -45.3585 -45.3585 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0536 -10.0536 -7.4122 -7.4122 -6.0678 -6.0678 -5.9279 -5.9279 -4.9956 -4.9956 -4.9637 -4.9637 -1.3756 -1.3756 -0.9260 -0.9260 -0.0634 -0.0634 0.6989 0.6989 0.7200 0.7200 1.2311 1.2311 2.6105 2.6105 3.3454 3.3454 3.3694 3.3694 3.8891 3.8891 4.1422 4.1422 4.2838 4.2838 4.4055 4.4055 4.4581 4.4581 4.6684 4.6684 5.0499 5.0499 5.3531 5.3531 6.1620 6.1620 7.1238 7.1238 7.3424 7.3424 7.7215 7.7215 7.9258 7.9258 8.0559 8.0559 8.8551 8.8551 9.5932 9.5932 9.8105 9.8105 10.5827 10.5827 11.7624 11.7624 11.9583 11.9583 12.1710 12.1710 k = 0.1286 0.1286-0.0000 ( 10897 PWs) bands (ev): -45.3585 -45.3585 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0558 -10.0558 -7.4154 -7.4154 -6.0636 -6.0636 -5.9233 -5.9233 -4.9859 -4.9859 -4.9544 -4.9544 -1.4027 -1.4027 -0.9263 -0.9263 -0.0915 -0.0915 0.6895 0.6895 0.7032 0.7032 1.2395 1.2395 2.5881 2.5881 3.3468 3.3468 3.3709 3.3709 3.8995 3.8995 4.1596 4.1596 4.2941 4.2941 4.4114 4.4114 4.4721 4.4721 4.6714 4.6714 5.0698 5.0698 5.3831 5.3831 6.1572 6.1572 7.1618 7.1618 7.3683 7.3683 7.7190 7.7190 7.9233 7.9233 8.0348 8.0348 8.8718 8.8718 9.6032 9.6032 9.8319 9.8319 10.4952 10.4952 11.7395 11.7395 11.8878 11.8878 12.1280 12.1280 k = 0.1143 0.1143-0.0000 ( 10911 PWs) bands (ev): -45.3586 -45.3586 -45.2985 -45.2985 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0577 -10.0577 -7.4183 -7.4183 -6.0598 -6.0598 -5.9191 -5.9191 -4.9769 -4.9769 -4.9459 -4.9459 -1.4275 -1.4275 -0.9269 -0.9269 -0.1171 -0.1171 0.6787 0.6787 0.6906 0.6906 1.2475 1.2475 2.5680 2.5680 3.3480 3.3480 3.3723 3.3723 3.9088 3.9088 4.1762 4.1762 4.3021 4.3021 4.4163 4.4163 4.4849 4.4849 4.6741 4.6741 5.0883 5.0883 5.4100 5.4100 6.1528 6.1528 7.2004 7.2004 7.3937 7.3937 7.7187 7.7187 7.9199 7.9199 8.0130 8.0130 8.8875 8.8875 9.6129 9.6129 9.8526 9.8526 10.4139 10.4139 11.7170 11.7170 11.8212 11.8212 12.0876 12.0876 k = 0.1000 0.1000-0.0000 ( 10909 PWs) bands (ev): -45.3586 -45.3586 -45.2984 -45.2984 -24.0753 -24.0753 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0595 -10.0595 -7.4210 -7.4210 -6.0564 -6.0564 -5.9153 -5.9153 -4.9687 -4.9687 -4.9381 -4.9381 -1.4499 -1.4499 -0.9276 -0.9276 -0.1401 -0.1401 0.6666 0.6666 0.6821 0.6821 1.2548 1.2548 2.5501 2.5501 3.3492 3.3492 3.3735 3.3735 3.9171 3.9171 4.1920 4.1920 4.3076 4.3076 4.4208 4.4208 4.4962 4.4962 4.6765 4.6765 5.1051 5.1051 5.4337 5.4337 6.1488 6.1488 7.2385 7.2385 7.4186 7.4186 7.7201 7.7201 7.9147 7.9147 7.9916 7.9916 8.9019 8.9019 9.6221 9.6221 9.8727 9.8727 10.3395 10.3395 11.6922 11.6922 11.7634 11.7634 12.0507 12.0507 k = 0.0857 0.0857-0.0000 ( 10917 PWs) bands (ev): -45.3586 -45.3586 -45.2985 -45.2985 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0611 -10.0611 -7.4233 -7.4233 -6.0533 -6.0533 -5.9119 -5.9119 -4.9614 -4.9614 -4.9312 -4.9312 -1.4696 -1.4696 -0.9284 -0.9284 -0.1603 -0.1603 0.6552 0.6552 0.6756 0.6756 1.2613 1.2613 2.5344 2.5344 3.3502 3.3502 3.3746 3.3746 3.9242 3.9242 4.2070 4.2070 4.3103 4.3103 4.4251 4.4251 4.5059 4.5059 4.6787 4.6787 5.1201 5.1201 5.4541 5.4541 6.1452 6.1452 7.2748 7.2748 7.4434 7.4434 7.7225 7.7225 7.9059 7.9059 7.9729 7.9729 8.9150 8.9150 9.6309 9.6309 9.8918 9.8918 10.2724 10.2724 11.6588 11.6588 11.7219 11.7219 12.0176 12.0176 k = 0.0714 0.0714-0.0000 ( 10915 PWs) bands (ev): -45.3586 -45.3586 -45.2985 -45.2985 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0624 -10.0624 -7.4253 -7.4253 -6.0507 -6.0507 -5.9090 -5.9090 -4.9551 -4.9551 -4.9252 -4.9252 -1.4866 -1.4866 -0.9292 -0.9292 -0.1776 -0.1776 0.6454 0.6454 0.6704 0.6704 1.2669 1.2669 2.5211 2.5211 3.3510 3.3510 3.3755 3.3755 3.9303 3.9303 4.2213 4.2213 4.3106 4.3106 4.4292 4.4292 4.5141 4.5141 4.6806 4.6806 5.1330 5.1330 5.4714 5.4714 6.1422 6.1422 7.3075 7.3075 7.4691 7.4691 7.7244 7.7244 7.8917 7.8917 7.9595 7.9595 8.9265 8.9265 9.6391 9.6391 9.9097 9.9097 10.2133 10.2133 11.6170 11.6170 11.6979 11.6979 11.9890 11.9890 k = 0.0571 0.0571-0.0000 ( 10921 PWs) bands (ev): -45.3586 -45.3586 -45.2985 -45.2985 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5073 -21.5073 -21.3129 -21.3129 -10.0635 -10.0635 -7.4270 -7.4270 -6.0485 -6.0485 -5.9066 -5.9066 -4.9499 -4.9499 -4.9202 -4.9202 -1.5007 -1.5007 -0.9300 -0.9300 -0.1919 -0.1919 0.6372 0.6372 0.6663 0.6663 1.2717 1.2717 2.5102 2.5102 3.3518 3.3518 3.3763 3.3763 3.9353 3.9353 4.2347 4.2347 4.3085 4.3085 4.4330 4.4330 4.5207 4.5207 4.6821 4.6821 5.1438 5.1438 5.4855 5.4855 6.1396 6.1396 7.3350 7.3350 7.4967 7.4967 7.7242 7.7242 7.8733 7.8733 7.9517 7.9517 8.9362 8.9362 9.6465 9.6465 9.9260 9.9260 10.1628 10.1628 11.5762 11.5762 11.6830 11.6830 11.9650 11.9650 k = 0.0429 0.0429-0.0000 ( 10923 PWs) bands (ev): -45.3586 -45.3586 -45.2986 -45.2986 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5072 -21.5072 -21.3129 -21.3129 -10.0644 -10.0644 -7.4282 -7.4282 -6.0468 -6.0468 -5.9047 -5.9047 -4.9457 -4.9457 -4.9163 -4.9163 -1.5118 -1.5118 -0.9306 -0.9306 -0.2031 -0.2031 0.6309 0.6309 0.6630 0.6630 1.2754 1.2754 2.5017 2.5017 3.3523 3.3523 3.3769 3.3769 3.9392 3.9392 4.2473 4.2473 4.3045 4.3045 4.4362 4.4362 4.5258 4.5258 4.6833 4.6833 5.1522 5.1522 5.4965 5.4965 6.1376 6.1376 7.3560 7.3560 7.5263 7.5263 7.7194 7.7194 7.8548 7.8548 7.9476 7.9476 8.9440 8.9440 9.6529 9.6529 9.9403 9.9403 10.1214 10.1214 11.5418 11.5418 11.6728 11.6728 11.9462 11.9462 k = 0.0286 0.0286-0.0000 ( 10913 PWs) bands (ev): -45.3585 -45.3585 -45.2986 -45.2986 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5072 -21.5072 -21.3129 -21.3129 -10.0650 -10.0650 -7.4292 -7.4292 -6.0456 -6.0456 -5.9034 -5.9034 -4.9427 -4.9427 -4.9134 -4.9134 -1.5197 -1.5197 -0.9311 -0.9311 -0.2111 -0.2111 0.6264 0.6264 0.6607 0.6607 1.2781 1.2781 2.4956 2.4956 3.3527 3.3527 3.3774 3.3774 3.9420 3.9420 4.2587 4.2587 4.2989 4.2989 4.4387 4.4387 4.5294 4.5294 4.6842 4.6842 5.1583 5.1583 5.5042 5.5042 6.1362 6.1362 7.3704 7.3704 7.5564 7.5564 7.7087 7.7087 7.8403 7.8403 7.9457 7.9457 8.9496 8.9496 9.6579 9.6579 9.9521 9.9521 10.0900 10.0900 11.5161 11.5161 11.6660 11.6660 11.9326 11.9326 k = 0.0143 0.0143-0.0000 ( 10925 PWs) bands (ev): -45.3585 -45.3585 -45.2987 -45.2987 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5072 -21.5072 -21.3129 -21.3129 -10.0654 -10.0654 -7.4297 -7.4297 -6.0449 -6.0449 -5.9026 -5.9026 -4.9409 -4.9409 -4.9117 -4.9117 -1.5245 -1.5245 -0.9314 -0.9314 -0.2160 -0.2160 0.6237 0.6237 0.6593 0.6593 1.2798 1.2798 2.4919 2.4919 3.3530 3.3530 3.3777 3.3777 3.9436 3.9436 4.2686 4.2686 4.2925 4.2925 4.4403 4.4403 4.5315 4.5315 4.6848 4.6848 5.1620 5.1620 5.5089 5.5089 6.1353 6.1353 7.3787 7.3787 7.5827 7.5827 7.6942 7.6942 7.8319 7.8319 7.9448 7.9448 8.9530 8.9530 9.6612 9.6612 9.9604 9.9604 10.0699 10.0699 11.5003 11.5003 11.6620 11.6620 11.9243 11.9243 k = 0.0000 0.0000 0.0000 ( 10917 PWs) bands (ev): -45.3584 -45.3584 -45.2986 -45.2986 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5072 -21.5072 -21.3129 -21.3129 -10.0655 -10.0655 -7.4299 -7.4299 -6.0446 -6.0446 -5.9023 -5.9023 -4.9403 -4.9403 -4.9111 -4.9111 -1.5261 -1.5261 -0.9315 -0.9315 -0.2176 -0.2176 0.6229 0.6229 0.6589 0.6589 1.2803 1.2803 2.4907 2.4907 3.3531 3.3531 3.3777 3.3777 3.9442 3.9442 4.2738 4.2738 4.2885 4.2885 4.4408 4.4408 4.5322 4.5322 4.6849 4.6849 5.1632 5.1632 5.5105 5.5105 6.1350 6.1350 7.3814 7.3814 7.5945 7.5945 7.6862 7.6862 7.8292 7.8292 7.9445 7.9445 8.9542 8.9542 9.6623 9.6623 9.9635 9.9635 10.0628 10.0628 11.4950 11.4950 11.6607 11.6607 11.9216 11.9216 k = 0.0000 0.0000 0.0000 ( 10917 PWs) bands (ev): -45.3584 -45.3584 -45.2986 -45.2986 -24.0754 -24.0754 -23.6593 -23.6593 -22.1279 -22.1279 -21.8542 -21.8542 -21.5072 -21.5072 -21.3129 -21.3129 -10.0655 -10.0655 -7.4299 -7.4299 -6.0446 -6.0446 -5.9023 -5.9023 -4.9403 -4.9403 -4.9111 -4.9111 -1.5261 -1.5261 -0.9315 -0.9315 -0.2176 -0.2176 0.6229 0.6229 0.6589 0.6589 1.2803 1.2803 2.4907 2.4907 3.3531 3.3531 3.3777 3.3777 3.9442 3.9442 4.2738 4.2738 4.2885 4.2885 4.4408 4.4408 4.5322 4.5322 4.6849 4.6849 5.1632 5.1632 5.5105 5.5105 6.1350 6.1350 7.3814 7.3814 7.5945 7.5945 7.6862 7.6862 7.8292 7.8292 7.9445 7.9445 8.9542 8.9542 9.6623 9.6623 9.9635 9.9635 10.0628 10.0628 11.4950 11.4950 11.6607 11.6607 11.9216 11.9216 k = 0.0000 0.0000 0.0198 ( 10917 PWs) bands (ev): -45.3584 -45.3584 -45.2987 -45.2987 -24.0749 -24.0749 -23.6596 -23.6596 -22.1278 -22.1278 -21.8547 -21.8547 -21.5070 -21.5070 -21.3131 -21.3131 -10.0630 -10.0630 -7.4334 -7.4334 -6.0435 -6.0435 -5.9013 -5.9013 -4.9414 -4.9414 -4.9124 -4.9124 -1.5252 -1.5252 -0.9313 -0.9313 -0.2158 -0.2158 0.6208 0.6208 0.6633 0.6633 1.2773 1.2773 2.4862 2.4862 3.3516 3.3516 3.3759 3.3759 3.9443 3.9443 4.2581 4.2581 4.2824 4.2824 4.4487 4.4487 4.5477 4.5477 4.6908 4.6908 5.1668 5.1668 5.5119 5.5119 6.1236 6.1236 7.3874 7.3874 7.5976 7.5976 7.6849 7.6849 7.8330 7.8330 7.9482 7.9482 8.9499 8.9499 9.6628 9.6628 9.9645 9.9645 10.0639 10.0639 11.4925 11.4925 11.6588 11.6588 11.9193 11.9193 k = 0.0000 0.0000 0.0396 ( 10917 PWs) bands (ev): -45.3582 -45.3582 -45.2989 -45.2989 -24.0733 -24.0733 -23.6606 -23.6606 -22.1274 -22.1274 -21.8562 -21.8562 -21.5064 -21.5064 -21.3138 -21.3138 -10.0556 -10.0556 -7.4438 -7.4438 -6.0400 -6.0400 -5.8982 -5.8982 -4.9445 -4.9445 -4.9161 -4.9161 -1.5224 -1.5224 -0.9305 -0.9305 -0.2103 -0.2103 0.6148 0.6148 0.6766 0.6766 1.2685 1.2685 2.4729 2.4729 3.3474 3.3474 3.3704 3.3704 3.9437 3.9437 4.2190 4.2190 4.2686 4.2686 4.4689 4.4689 4.5861 4.5861 4.7080 4.7080 5.1774 5.1774 5.5160 5.5160 6.0901 6.0901 7.4049 7.4049 7.6069 7.6069 7.6810 7.6810 7.8443 7.8443 7.9592 7.9592 8.9369 8.9369 9.6642 9.6642 9.9674 9.9674 10.0674 10.0674 11.4852 11.4852 11.6532 11.6532 11.9130 11.9130 k = 0.0000 0.0000 0.0594 ( 10909 PWs) bands (ev): -45.3579 -45.3579 -45.2992 -45.2992 -24.0707 -24.0707 -23.6623 -23.6623 -22.1268 -22.1268 -21.8587 -21.8587 -21.5054 -21.5054 -21.3148 -21.3148 -10.0432 -10.0432 -7.4610 -7.4610 -6.0342 -6.0342 -5.8932 -5.8932 -4.9497 -4.9497 -4.9224 -4.9224 -1.5177 -1.5177 -0.9293 -0.9293 -0.2013 -0.2013 0.6051 0.6051 0.6986 0.6986 1.2539 1.2539 2.4510 2.4510 3.3406 3.3406 3.3617 3.3617 3.9399 3.9399 4.1681 4.1681 4.2555 4.2555 4.4968 4.4968 4.6359 4.6359 4.7349 4.7349 5.1947 5.1947 5.5220 5.5220 6.0373 6.0373 7.4321 7.4321 7.6223 7.6223 7.6747 7.6747 7.8630 7.8630 7.9770 7.9770 8.9155 8.9155 9.6666 9.6666 9.9722 9.9722 10.0731 10.0731 11.4730 11.4730 11.6438 11.6438 11.9035 11.9035 k = 0.0000 0.0000 0.0792 ( 10909 PWs) bands (ev): -45.3575 -45.3575 -45.2996 -45.2996 -24.0670 -24.0670 -23.6647 -23.6647 -22.1259 -22.1259 -21.8621 -21.8621 -21.5040 -21.5040 -21.3163 -21.3163 -10.0259 -10.0259 -7.4848 -7.4848 -6.0261 -6.0261 -5.8861 -5.8861 -4.9569 -4.9569 -4.9312 -4.9312 -1.5111 -1.5111 -0.9277 -0.9277 -0.1886 -0.1886 0.5918 0.5918 0.7291 0.7291 1.2340 1.2340 2.4211 2.4211 3.3314 3.3314 3.3500 3.3500 3.9294 3.9294 4.1119 4.1119 4.2505 4.2505 4.5297 4.5297 4.6907 4.6907 4.7696 4.7696 5.2182 5.2182 5.5281 5.5281 5.9689 5.9689 7.4666 7.4666 7.6438 7.6438 7.6660 7.6660 7.8887 7.8887 8.0010 8.0010 8.8858 8.8858 9.6700 9.6700 9.9790 9.9790 10.0811 10.0811 11.4562 11.4562 11.6306 11.6306 11.8925 11.8925 k = 0.0000 0.0000 0.0990 ( 10901 PWs) bands (ev): -45.3569 -45.3569 -45.3002 -45.3002 -24.0624 -24.0624 -23.6678 -23.6678 -22.1247 -22.1247 -21.8664 -21.8664 -21.5022 -21.5022 -21.3182 -21.3182 -10.0037 -10.0037 -7.5151 -7.5151 -6.0158 -6.0158 -5.8771 -5.8771 -4.9661 -4.9661 -4.9423 -4.9423 -1.5027 -1.5027 -0.9257 -0.9257 -0.1722 -0.1722 0.5755 0.5755 0.7676 0.7676 1.2090 1.2090 2.3839 2.3839 3.3201 3.3201 3.3360 3.3360 3.9099 3.9099 4.0534 4.0534 4.2578 4.2578 4.5667 4.5667 4.7474 4.7474 4.8104 4.8104 5.2474 5.2474 5.5312 5.5312 5.8908 5.8908 7.5061 7.5061 7.6549 7.6549 7.6713 7.6713 7.9214 7.9214 8.0305 8.0305 8.8483 8.8483 9.6744 9.6744 9.9878 9.9878 10.0913 10.0913 11.4348 11.4348 11.6137 11.6137 11.8817 11.8818 k = 0.0000 0.0000 0.1188 ( 10881 PWs) bands (ev): -45.3561 -45.3561 -45.3009 -45.3009 -24.0568 -24.0568 -23.6715 -23.6715 -22.1232 -22.1232 -21.8716 -21.8716 -21.5000 -21.5000 -21.3205 -21.3205 -9.9769 -9.9769 -7.5517 -7.5517 -6.0033 -6.0033 -5.8662 -5.8662 -4.9773 -4.9773 -4.9559 -4.9559 -1.4925 -1.4925 -0.9237 -0.9237 -0.1523 -0.1523 0.5566 0.5566 0.8138 0.8138 1.1795 1.1795 2.3402 2.3402 3.3072 3.3072 3.3201 3.3201 3.8811 3.8811 3.9940 3.9940 4.2783 4.2783 4.6073 4.6073 4.8047 4.8047 4.8558 4.8558 5.2816 5.2816 5.5234 5.5234 5.8123 5.8123 7.5490 7.5490 7.6413 7.6413 7.7047 7.7047 7.9609 7.9609 8.0643 8.0643 8.8032 8.8032 9.6798 9.6798 9.9983 9.9983 10.1038 10.1038 11.4092 11.4092 11.5930 11.5930 11.8730 11.8730 k = 0.0000 0.0000 0.1386 ( 10893 PWs) bands (ev): -45.3553 -45.3553 -45.3017 -45.3017 -24.0503 -24.0503 -23.6760 -23.6760 -22.1215 -22.1215 -21.8777 -21.8777 -21.4975 -21.4975 -21.3233 -21.3233 -9.9453 -9.9453 -7.5941 -7.5941 -5.9886 -5.9886 -5.8533 -5.8533 -4.9905 -4.9905 -4.9718 -4.9718 -1.4806 -1.4806 -0.9216 -0.9216 -0.1289 -0.1289 0.5358 0.5358 0.8670 0.8670 1.1460 1.1460 2.2912 2.2912 3.2931 3.2931 3.3030 3.3030 3.8450 3.8450 3.9348 3.9348 4.3103 4.3103 4.6510 4.6510 4.8616 4.8616 4.9046 4.9046 5.3205 5.3205 5.4899 5.4899 5.7503 5.7503 7.5936 7.5936 7.6250 7.6250 7.7440 7.7440 8.0070 8.0070 8.1014 8.1014 8.7510 8.7510 9.6859 9.6859 10.0106 10.0106 10.1184 10.1184 11.3798 11.3798 11.5685 11.5685 11.8527 11.8527 k = 0.0000 0.0000 0.1584 ( 10881 PWs) bands (ev): -45.3544 -45.3544 -45.3026 -45.3026 -24.0428 -24.0428 -23.6811 -23.6811 -22.1194 -22.1194 -21.8845 -21.8845 -21.4946 -21.4946 -21.3263 -21.3263 -9.9092 -9.9092 -7.6422 -7.6422 -5.9718 -5.9718 -5.8387 -5.8387 -5.0055 -5.0055 -4.9899 -4.9899 -1.4669 -1.4669 -0.9197 -0.9197 -0.1018 -0.1018 0.5136 0.5136 0.9262 0.9262 1.1091 1.1091 2.2381 2.2381 3.2782 3.2782 3.2853 3.2853 3.8040 3.8040 3.8762 3.8762 4.3514 4.3514 4.6974 4.6974 4.9172 4.9172 4.9561 4.9561 5.3634 5.3634 5.4174 5.4174 5.7192 5.7192 7.6060 7.6060 7.6389 7.6389 7.7890 7.7890 8.0597 8.0597 8.1404 8.1404 8.6922 8.6922 9.6925 9.6925 10.0242 10.0242 10.1351 10.1351 11.3469 11.3469 11.5404 11.5404 11.7515 11.7515 k = 0.0000 0.0000 0.1782 ( 10861 PWs) bands (ev): -45.3532 -45.3532 -45.3036 -45.3036 -24.0345 -24.0345 -23.6869 -23.6869 -22.1170 -22.1170 -21.8919 -21.8919 -21.4913 -21.4913 -21.3298 -21.3298 -9.8686 -9.8686 -7.6954 -7.6954 -5.9529 -5.9529 -5.8223 -5.8223 -5.0223 -5.0223 -5.0101 -5.0101 -1.4515 -1.4515 -0.9182 -0.9182 -0.0713 -0.0713 0.4907 0.4907 0.9903 0.9903 1.0692 1.0692 2.1827 2.1827 3.2631 3.2631 3.2675 3.2675 3.7600 3.7600 3.8187 3.8187 4.3992 4.3992 4.7456 4.7456 4.9704 4.9704 5.0097 5.0097 5.3138 5.3138 5.4102 5.4102 5.7129 5.7129 7.5840 7.5840 7.6844 7.6844 7.8396 7.8396 8.1187 8.1187 8.1802 8.1802 8.6273 8.6273 9.6992 9.6992 10.0388 10.0388 10.1540 10.1540 11.3112 11.3112 11.5086 11.5086 11.6510 11.6510 k = 0.0000 0.0000 0.1980 ( 10841 PWs) bands (ev): -45.3521 -45.3521 -45.3046 -45.3046 -24.0253 -24.0253 -23.6934 -23.6934 -22.1143 -22.1143 -21.9000 -21.9000 -21.4877 -21.4877 -21.3336 -21.3336 -9.8237 -9.8237 -7.7535 -7.7535 -5.9321 -5.9321 -5.8042 -5.8042 -5.0408 -5.0408 -5.0324 -5.0324 -1.4345 -1.4345 -0.9174 -0.9174 -0.0373 -0.0373 0.4678 0.4678 1.0270 1.0270 1.0575 1.0575 2.1271 2.1271 3.2480 3.2480 3.2501 3.2501 3.7146 3.7146 3.7626 3.7626 4.4515 4.4515 4.7948 4.7948 5.0155 5.0155 5.0649 5.0649 5.1983 5.1983 5.4606 5.4606 5.7181 5.7181 7.5590 7.5590 7.7296 7.7296 7.8954 7.8954 8.1838 8.1838 8.2196 8.2196 8.5569 8.5569 9.7054 9.7054 10.0536 10.0536 10.1749 10.1749 11.2730 11.2730 11.4733 11.4733 11.5531 11.5531 k = 0.0000 0.0000 0.2178 ( 10848 PWs) bands (ev): -45.3508 -45.3508 -45.3059 -45.3059 -24.0154 -24.0154 -23.7006 -23.7006 -22.1113 -22.1113 -21.9087 -21.9087 -21.4838 -21.4838 -21.3377 -21.3377 -9.7747 -9.7747 -7.8161 -7.8161 -5.9094 -5.9094 -5.7845 -5.7845 -5.0610 -5.0610 -5.0567 -5.0567 -1.4160 -1.4160 -0.9175 -0.9175 0.0002 0.0002 0.4456 0.4456 0.9829 0.9829 1.1250 1.1250 2.0744 2.0744 3.2335 3.2335 3.2335 3.2335 3.6686 3.6686 3.7083 3.7083 4.5068 4.5068 4.8439 4.8439 5.0042 5.0042 5.1217 5.1217 5.1270 5.1270 5.5145 5.5145 5.7274 5.7274 7.5311 7.5311 7.7742 7.7742 7.9561 7.9561 8.2546 8.2546 8.2575 8.2575 8.4817 8.4817 9.7100 9.7100 10.0676 10.0676 10.1979 10.1979 11.2329 11.2329 11.4342 11.4342 11.4600 11.4600 k = 0.0000 0.0000 0.2376 ( 10840 PWs) bands (ev): -45.3495 -45.3495 -45.3073 -45.3073 -24.0048 -24.0048 -23.7084 -23.7084 -22.1079 -22.1079 -21.9178 -21.9178 -21.4795 -21.4795 -21.3422 -21.3422 -9.7218 -9.7218 -7.8827 -7.8827 -5.8848 -5.8848 -5.7633 -5.7633 -5.0828 -5.0828 -5.0827 -5.0827 -1.3960 -1.3960 -0.9188 -0.9188 0.0410 0.0410 0.4248 0.4248 0.9376 0.9376 1.1889 1.1889 2.0290 2.0290 3.2182 3.2182 3.2199 3.2199 3.6229 3.6229 3.6558 3.6558 4.5635 4.5635 4.8854 4.8854 4.8918 4.8918 5.1545 5.1545 5.1800 5.1800 5.5716 5.5716 5.7374 5.7374 7.5004 7.5004 7.8181 7.8181 8.0211 8.0211 8.2933 8.2933 8.3298 8.3298 8.4032 8.4032 9.7120 9.7120 10.0795 10.0795 10.2227 10.2227 11.1913 11.1913 11.3693 11.3693 11.3955 11.3955 k = 0.0000 0.0000 0.2574 ( 10848 PWs) bands (ev): -45.3481 -45.3481 -45.3087 -45.3087 -23.9935 -23.9935 -23.7169 -23.7169 -22.1041 -22.1041 -21.9272 -21.9272 -21.4750 -21.4750 -21.3469 -21.3469 -9.6650 -9.6650 -7.9530 -7.9530 -5.8585 -5.8585 -5.7406 -5.7406 -5.1107 -5.1107 -5.1059 -5.1059 -1.3746 -1.3746 -0.9216 -0.9216 0.0852 0.0852 0.4061 0.4061 0.8914 0.8914 1.2429 1.2429 1.9974 1.9974 3.2045 3.2045 3.2077 3.2077 3.5781 3.5781 3.6055 3.6055 4.6202 4.6202 4.7417 4.7417 4.9371 4.9371 5.2004 5.2004 5.2403 5.2403 5.6314 5.6314 5.7462 5.7462 7.4672 7.4672 7.8611 7.8611 8.0893 8.0893 8.3154 8.3154 8.3269 8.3269 8.4158 8.4158 9.7100 9.7100 10.0877 10.0877 10.2495 10.2495 11.1485 11.1485 11.2881 11.2881 11.3517 11.3517 k = 0.0000 0.0000 0.2772 ( 10872 PWs) bands (ev): -45.3467 -45.3467 -45.3102 -45.3102 -23.9816 -23.9816 -23.7260 -23.7260 -22.0999 -22.0999 -21.9370 -21.9370 -21.4702 -21.4702 -21.3519 -21.3519 -9.6046 -9.6046 -8.0264 -8.0264 -5.8307 -5.8307 -5.7165 -5.7165 -5.1401 -5.1401 -5.1305 -5.1305 -1.3519 -1.3519 -0.9262 -0.9262 0.1326 0.1326 0.3899 0.3899 0.8449 0.8449 1.2791 1.2791 1.9878 1.9878 3.1927 3.1927 3.1970 3.1970 3.5345 3.5345 3.5574 3.5574 4.5911 4.5911 4.6759 4.6759 4.9783 4.9783 5.2480 5.2480 5.3031 5.3031 5.6932 5.6932 5.7529 5.7529 7.4321 7.4321 7.9033 7.9033 8.1585 8.1585 8.2293 8.2293 8.3593 8.3593 8.5018 8.5018 9.7025 9.7025 10.0903 10.0903 10.2781 10.2781 11.1049 11.1049 11.2137 11.2137 11.3068 11.3068 k = 0.0000 0.0000 0.2970 ( 10880 PWs) bands (ev): -45.3452 -45.3452 -45.3118 -45.3118 -23.9692 -23.9692 -23.7357 -23.7357 -22.0953 -22.0953 -21.9470 -21.9470 -21.4651 -21.4651 -21.3572 -21.3572 -9.5408 -9.5408 -8.1027 -8.1027 -5.8013 -5.8013 -5.6912 -5.6912 -5.1710 -5.1710 -5.1563 -5.1563 -1.3280 -1.3280 -0.9327 -0.9327 0.1832 0.1832 0.3770 0.3770 0.7984 0.7984 1.2904 1.2904 2.0075 2.0075 3.1831 3.1831 3.1882 3.1882 3.4925 3.4925 3.5118 3.5118 4.4369 4.4369 4.7298 4.7298 5.0144 5.0144 5.2950 5.2950 5.3687 5.3687 5.7559 5.7559 5.7568 5.7568 7.3961 7.3961 7.9446 7.9446 8.1397 8.1397 8.2242 8.2242 8.3944 8.3944 8.5932 8.5932 9.6880 9.6880 10.0850 10.0850 10.3086 10.3086 11.0607 11.0607 11.1473 11.1473 11.2612 11.2612 k = 0.0000 0.0000 0.3168 ( 10876 PWs) bands (ev): -45.3436 -45.3436 -45.3134 -45.3134 -23.9564 -23.9564 -23.7460 -23.7460 -22.0903 -22.0903 -21.9571 -21.9571 -21.4598 -21.4598 -21.3627 -21.3627 -9.4738 -9.4738 -8.1814 -8.1814 -5.7705 -5.7705 -5.6647 -5.6647 -5.2032 -5.2032 -5.1833 -5.1833 -1.3032 -1.3032 -0.9414 -0.9414 0.2370 0.2370 0.3677 0.3677 0.7525 0.7525 1.2752 1.2752 2.0584 2.0584 3.1759 3.1759 3.1816 3.1816 3.4524 3.4524 3.4688 3.4688 4.2803 4.2803 4.7810 4.7810 5.0444 5.0444 5.3408 5.3408 5.4374 5.4374 5.7574 5.7574 5.8178 5.8178 7.3605 7.3605 7.9849 7.9849 8.0481 8.0481 8.2780 8.2780 8.4399 8.4399 8.6889 8.6889 9.6649 9.6649 10.0697 10.0697 10.3407 10.3407 11.0160 11.0160 11.0895 11.0895 11.2155 11.2155 k = 0.0000 0.0000 0.3366 ( 10876 PWs) bands (ev): -45.3418 -45.3418 -45.3152 -45.3152 -23.9431 -23.9431 -23.7569 -23.7569 -22.0848 -22.0848 -21.9673 -21.9673 -21.4543 -21.4543 -21.3684 -21.3684 -9.4038 -9.4038 -8.2621 -8.2621 -5.7384 -5.7384 -5.6372 -5.6372 -5.2366 -5.2366 -5.2113 -5.2113 -1.2775 -1.2775 -0.9523 -0.9523 0.2937 0.2937 0.3624 0.3624 0.7075 0.7075 1.2378 1.2378 2.1361 2.1361 3.1714 3.1714 3.1773 3.1773 3.4144 3.4144 3.4285 3.4285 4.1225 4.1225 4.8292 4.8292 5.0678 5.0678 5.3850 5.3850 5.5089 5.5089 5.7545 5.7545 5.8766 5.8766 7.3272 7.3272 7.9554 7.9554 8.0242 8.0242 8.3122 8.3122 8.5029 8.5029 8.7882 8.7882 9.6322 9.6322 10.0426 10.0426 10.3746 10.3746 10.9708 10.9708 11.0407 11.0407 11.1707 11.1707 k = 0.0000 0.0000 0.3564 ( 10868 PWs) bands (ev): -45.3400 -45.3400 -45.3170 -45.3170 -23.9296 -23.9296 -23.7683 -23.7683 -22.0790 -22.0790 -21.9774 -21.9774 -21.4486 -21.4486 -21.3742 -21.3742 -9.3311 -9.3311 -8.3444 -8.3444 -5.7052 -5.7052 -5.6087 -5.6087 -5.2710 -5.2710 -5.2402 -5.2402 -1.2510 -1.2510 -0.9657 -0.9657 0.3532 0.3532 0.3614 0.3614 0.6638 0.6638 1.1849 1.1849 2.2339 2.2339 3.1695 3.1695 3.1755 3.1755 3.3787 3.3787 3.3911 3.3911 3.9640 3.9640 4.8739 4.8739 5.0846 5.0846 5.4275 5.4275 5.5824 5.5824 5.7481 5.7481 5.9297 5.9297 7.2987 7.2987 7.8625 7.8625 8.0624 8.0624 8.3284 8.3284 8.5813 8.5813 8.8907 8.8907 9.5892 9.5892 10.0027 10.0027 10.4101 10.4101 10.9254 10.9254 11.0009 11.0009 11.1275 11.1275 k = 0.0000 0.0000 0.3762 ( 10868 PWs) bands (ev): -45.3382 -45.3382 -45.3188 -45.3188 -23.9158 -23.9158 -23.7803 -23.7803 -22.0726 -22.0726 -21.9875 -21.9875 -21.4427 -21.4427 -21.3802 -21.3802 -9.2559 -9.2559 -8.4280 -8.4280 -5.6710 -5.6710 -5.5794 -5.5794 -5.3063 -5.3063 -5.2698 -5.2698 -1.2241 -1.2241 -0.9814 -0.9814 0.3649 0.3649 0.4155 0.4155 0.6217 0.6217 1.1222 1.1222 2.3464 2.3464 3.1706 3.1706 3.1764 3.1764 3.3455 3.3455 3.3565 3.3565 3.8056 3.8056 4.9150 4.9150 5.0949 5.0949 5.4681 5.4681 5.6566 5.6566 5.7382 5.7382 5.9738 5.9738 7.2778 7.2778 7.7704 7.7704 8.0992 8.0992 8.3324 8.3324 8.6690 8.6690 8.9955 8.9955 9.5358 9.5358 9.9495 9.9495 10.4472 10.4472 10.8797 10.8797 10.9703 10.9703 11.0867 11.0867 k = 0.0000 0.0000 0.3960 ( 10856 PWs) bands (ev): -45.3363 -45.3363 -45.3206 -45.3206 -23.9018 -23.9018 -23.7926 -23.7926 -22.0659 -22.0659 -21.9974 -21.9974 -21.4367 -21.4367 -21.3864 -21.3864 -9.1785 -9.1785 -8.5124 -8.5124 -5.6360 -5.6360 -5.5494 -5.5494 -5.3423 -5.3423 -5.3001 -5.3001 -1.1968 -1.1968 -0.9994 -0.9994 0.3729 0.3729 0.4804 0.4804 0.5816 0.5816 1.0537 1.0537 2.4695 2.4695 3.1745 3.1745 3.1798 3.1798 3.3149 3.3149 3.3250 3.3250 3.6480 3.6480 4.9524 4.9524 5.0990 5.0990 5.5067 5.5067 5.7247 5.7247 5.7299 5.7299 6.0057 6.0057 7.2678 7.2678 7.6804 7.6804 8.1347 8.1347 8.3280 8.3280 8.7618 8.7618 9.1021 9.1021 9.4726 9.4726 9.8838 9.8838 10.4858 10.4858 10.8339 10.8339 10.9487 10.9487 11.0491 11.0491 k = 0.0000 0.0000 0.4158 ( 10868 PWs) bands (ev): -45.3345 -45.3345 -45.3226 -45.3226 -23.8878 -23.8878 -23.8054 -23.8054 -22.0587 -22.0587 -22.0071 -22.0071 -21.4305 -21.4305 -21.3926 -21.3926 -9.0991 -9.0991 -8.5973 -8.5973 -5.6002 -5.6002 -5.5188 -5.5188 -5.3788 -5.3788 -5.3309 -5.3309 -1.1695 -1.1695 -1.0194 -1.0194 0.3854 0.3854 0.5439 0.5439 0.5476 0.5476 0.9818 0.9818 2.6007 2.6007 3.1815 3.1815 3.1857 3.1857 3.2870 3.2870 3.2966 3.2966 3.4921 3.4921 4.9859 4.9859 5.0975 5.0975 5.5431 5.5431 5.7078 5.7078 5.8004 5.8004 6.0223 6.0223 7.2716 7.2716 7.5941 7.5941 8.1685 8.1685 8.3171 8.3171 8.8572 8.8572 9.2096 9.2096 9.4005 9.4005 9.8069 9.8069 10.5258 10.5258 10.7881 10.7881 10.9359 10.9359 11.0154 11.0154 k = 0.0000 0.0000 0.4356 ( 10876 PWs) bands (ev): -45.3325 -45.3325 -45.3246 -45.3246 -23.8737 -23.8737 -23.8186 -23.8186 -22.0511 -22.0511 -22.0166 -22.0166 -21.4243 -21.4243 -21.3989 -21.3989 -9.0180 -9.0180 -8.6825 -8.6825 -5.5638 -5.5638 -5.4879 -5.4879 -5.4157 -5.4157 -5.3621 -5.3621 -1.1424 -1.1424 -1.0413 -1.0413 0.4023 0.4023 0.5089 0.5089 0.6169 0.6169 0.9083 0.9083 2.7381 2.7381 3.1915 3.1915 3.1921 3.1921 3.2620 3.2620 3.2715 3.2715 3.3402 3.3402 5.0154 5.0154 5.0905 5.0905 5.5772 5.5772 5.6876 5.6876 5.8657 5.8657 6.0219 6.0219 7.2910 7.2910 7.5132 7.5132 8.2003 8.2003 8.3012 8.3012 8.9537 8.9537 9.3170 9.3170 9.3206 9.3206 9.7205 9.7205 10.5671 10.5671 10.7426 10.7426 10.9314 10.9314 10.9865 10.9865 k = 0.0000 0.0000 0.4554 ( 10896 PWs) bands (ev): -45.3306 -45.3306 -45.3266 -45.3266 -23.8597 -23.8597 -23.8321 -23.8321 -22.0430 -22.0430 -22.0258 -22.0258 -21.4180 -21.4180 -21.4053 -21.4053 -8.9355 -8.9355 -8.7674 -8.7674 -5.5270 -5.5270 -5.4565 -5.4565 -5.4528 -5.4528 -5.3935 -5.3935 -1.1157 -1.1157 -1.0649 -1.0649 0.4233 0.4233 0.4769 0.4769 0.6881 0.6881 0.8343 0.8343 2.8802 2.8802 3.1615 3.1615 3.2046 3.2046 3.2306 3.2306 3.2398 3.2398 3.2499 3.2499 5.0408 5.0408 5.0786 5.0786 5.6089 5.6089 5.6642 5.6642 5.9234 5.9234 6.0041 6.0041 7.3265 7.3265 7.4399 7.4399 8.2300 8.2300 8.2809 8.2809 9.0497 9.0497 9.2346 9.2346 9.4232 9.4232 9.6265 9.6265 10.6096 10.6096 10.6975 10.6975 10.9348 10.9348 10.9629 10.9629 k = 0.0000 0.0000 0.4752 ( 10900 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8518 -8.8518 -8.8518 -8.8518 -5.4899 -5.4899 -5.4899 -5.4899 -5.4251 -5.4251 -5.4251 -5.4251 -1.0898 -1.0898 -1.0898 -1.0898 0.4483 0.4483 0.4483 0.4483 0.7607 0.7607 0.7607 0.7607 3.0252 3.0252 3.0252 3.0252 3.2207 3.2207 3.2207 3.2207 3.2326 3.2326 3.2326 3.2326 5.0619 5.0619 5.0619 5.0619 5.6380 5.6380 5.6380 5.6380 5.9705 5.9705 5.9705 5.9705 7.3769 7.3769 7.3769 7.3769 8.2570 8.2570 8.2570 8.2570 9.1438 9.1438 9.1438 9.1438 9.5268 9.5268 9.5268 9.5268 10.6531 10.6531 10.6531 10.6531 10.9455 10.9455 10.9455 10.9455 k = 0.0000 0.0000 0.4752 ( 10900 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8518 -8.8518 -8.8518 -8.8518 -5.4899 -5.4899 -5.4899 -5.4899 -5.4251 -5.4251 -5.4251 -5.4251 -1.0898 -1.0898 -1.0898 -1.0898 0.4483 0.4483 0.4483 0.4483 0.7607 0.7607 0.7607 0.7607 3.0252 3.0252 3.0252 3.0252 3.2207 3.2207 3.2207 3.2207 3.2326 3.2326 3.2326 3.2326 5.0619 5.0619 5.0619 5.0619 5.6380 5.6380 5.6380 5.6380 5.9705 5.9705 5.9705 5.9705 7.3769 7.3769 7.3769 7.3769 8.2570 8.2570 8.2570 8.2570 9.1438 9.1438 9.1438 9.1438 9.5268 9.5268 9.5268 9.5268 10.6531 10.6531 10.6531 10.6531 10.9455 10.9455 10.9455 10.9455 k = 0.0000 0.0200 0.4752 ( 10898 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8517 -8.8517 -8.8517 -8.8517 -5.4903 -5.4903 -5.4903 -5.4903 -5.4255 -5.4255 -5.4254 -5.4254 -1.0887 -1.0887 -1.0886 -1.0886 0.4475 0.4475 0.4486 0.4486 0.7620 0.7620 0.7620 0.7620 3.0254 3.0254 3.0258 3.0258 3.2185 3.2185 3.2211 3.2211 3.2318 3.2318 3.2326 3.2326 5.0603 5.0603 5.0623 5.0623 5.6361 5.6361 5.6378 5.6378 5.9704 5.9704 5.9719 5.9719 7.3747 7.3747 7.3779 7.3779 8.2525 8.2525 8.2595 8.2595 9.1422 9.1422 9.1429 9.1429 9.5242 9.5242 9.5247 9.5247 10.6560 10.6560 10.6616 10.6616 10.9470 10.9470 10.9481 10.9481 k = 0.0000 0.0400 0.4752 ( 10902 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8512 -8.8512 -8.8512 -8.8512 -5.4915 -5.4915 -5.4914 -5.4914 -5.4266 -5.4266 -5.4266 -5.4266 -1.0852 -1.0852 -1.0851 -1.0851 0.4463 0.4463 0.4485 0.4485 0.7659 0.7659 0.7661 0.7661 3.0264 3.0264 3.0273 3.0273 3.2136 3.2136 3.2199 3.2199 3.2298 3.2298 3.2327 3.2327 5.0574 5.0574 5.0612 5.0612 5.6325 5.6325 5.6353 5.6353 5.9714 5.9714 5.9749 5.9749 7.3716 7.3716 7.3779 7.3779 8.2461 8.2461 8.2602 8.2602 9.1382 9.1382 9.1399 9.1399 9.5171 9.5171 9.5181 9.5181 10.6700 10.6700 10.6803 10.6803 10.9533 10.9533 10.9548 10.9548 k = 0.0000 0.0600 0.4752 ( 10898 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8505 -8.8505 -8.8505 -8.8505 -5.4935 -5.4935 -5.4933 -5.4933 -5.4284 -5.4284 -5.4283 -5.4283 -1.0796 -1.0796 -1.0794 -1.0794 0.4448 0.4448 0.4479 0.4479 0.7725 0.7725 0.7728 0.7728 3.0283 3.0283 3.0296 3.0296 3.2053 3.2053 3.2160 3.2160 3.2279 3.2279 3.2334 3.2334 5.0534 5.0534 5.0585 5.0585 5.6276 5.6276 5.6304 5.6304 5.9732 5.9732 5.9795 5.9795 7.3676 7.3676 7.3768 7.3768 8.2381 8.2381 8.2591 8.2591 9.1319 9.1319 9.1348 9.1348 9.5061 9.5061 9.5076 9.5076 10.6940 10.6940 10.7070 10.7070 10.9653 10.9653 10.9658 10.9658 k = 0.0000 0.0800 0.4752 ( 10878 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8494 -8.8494 -8.8494 -8.8494 -5.4965 -5.4965 -5.4962 -5.4962 -5.4306 -5.4306 -5.4305 -5.4305 -1.0719 -1.0719 -1.0716 -1.0716 0.4428 0.4428 0.4468 0.4468 0.7818 0.7818 0.7824 0.7824 3.0308 3.0308 3.0325 3.0325 3.1938 3.1938 3.2081 3.2081 3.2274 3.2274 3.2348 3.2348 5.0482 5.0482 5.0540 5.0540 5.6216 5.6216 5.6229 5.6229 5.9757 5.9757 5.9857 5.9857 7.3630 7.3630 7.3748 7.3748 8.2287 8.2287 8.2565 8.2565 9.1233 9.1233 9.1281 9.1281 9.4921 9.4921 9.4940 9.4940 10.7258 10.7258 10.7385 10.7385 10.9818 10.9818 10.9847 10.9847 k = 0.0000 0.1000 0.4752 ( 10860 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8481 -8.8481 -8.8481 -8.8481 -5.5005 -5.5005 -5.5001 -5.5001 -5.4330 -5.4330 -5.4330 -5.4330 -1.0622 -1.0622 -1.0620 -1.0620 0.4405 0.4405 0.4451 0.4451 0.7938 0.7938 0.7949 0.7949 3.0338 3.0338 3.0360 3.0360 3.1794 3.1794 3.1969 3.1969 3.2277 3.2277 3.2367 3.2367 5.0418 5.0418 5.0475 5.0475 5.6129 5.6129 5.6149 5.6149 5.9787 5.9787 5.9934 5.9934 7.3580 7.3580 7.3722 7.3722 8.2185 8.2185 8.2527 8.2527 9.1127 9.1127 9.1200 9.1200 9.4761 9.4761 9.4783 9.4783 10.7623 10.7623 10.7710 10.7710 11.0040 11.0040 11.0131 11.0131 k = 0.0000 0.1200 0.4752 ( 10850 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8466 -8.8466 -8.8466 -8.8466 -5.5058 -5.5058 -5.5053 -5.5053 -5.4354 -5.4354 -5.4354 -5.4354 -1.0509 -1.0509 -1.0506 -1.0506 0.4379 0.4379 0.4430 0.4430 0.8086 0.8086 0.8104 0.8104 3.0370 3.0370 3.0398 3.0398 3.1625 3.1625 3.1828 3.1828 3.2286 3.2286 3.2388 3.2388 5.0341 5.0341 5.0389 5.0389 5.6007 5.6007 5.6076 5.6076 5.9821 5.9821 6.0025 6.0025 7.3529 7.3529 7.3690 7.3690 8.2078 8.2078 8.2482 8.2482 9.1005 9.1005 9.1108 9.1108 9.4589 9.4589 9.4612 9.4612 10.8000 10.8000 10.8012 10.8012 11.0340 11.0340 11.0521 11.0521 k = 0.0000 0.1400 0.4752 ( 10854 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8448 -8.8448 -8.8448 -8.8448 -5.5123 -5.5123 -5.5117 -5.5117 -5.4376 -5.4376 -5.4376 -5.4376 -1.0381 -1.0381 -1.0379 -1.0379 0.4349 0.4349 0.4405 0.4405 0.8262 0.8262 0.8289 0.8289 3.0397 3.0397 3.0433 3.0433 3.1438 3.1438 3.1666 3.1666 3.2299 3.2299 3.2412 3.2412 5.0251 5.0251 5.0280 5.0280 5.5867 5.5867 5.5999 5.5999 5.9857 5.9857 6.0127 6.0127 7.3480 7.3480 7.3658 7.3658 8.1972 8.1972 8.2433 8.2433 9.0870 9.0870 9.1006 9.1006 9.4411 9.4411 9.4433 9.4433 10.8273 10.8273 10.8355 10.8355 11.0732 11.0732 11.1014 11.1014 k = 0.0000 0.1600 0.4752 ( 10866 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8428 -8.8428 -8.8428 -8.8428 -5.5200 -5.5200 -5.5194 -5.5194 -5.4395 -5.4395 -5.4394 -5.4394 -1.0241 -1.0241 -1.0240 -1.0240 0.4317 0.4317 0.4375 0.4375 0.8468 0.8468 0.8505 0.8505 3.0404 3.0404 3.0456 3.0456 3.1249 3.1249 3.1493 3.1493 3.2314 3.2314 3.2438 3.2438 5.0145 5.0145 5.0148 5.0148 5.5713 5.5713 5.5921 5.5921 5.9895 5.9895 6.0234 6.0234 7.3439 7.3439 7.3627 7.3627 8.1873 8.1873 8.2386 8.2386 9.0724 9.0724 9.0897 9.0897 9.4232 9.4232 9.4251 9.4251 10.8494 10.8494 10.8666 10.8666 11.1217 11.1217 11.1589 11.1589 k = 0.0000 0.1800 0.4752 ( 10872 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8406 -8.8406 -8.8406 -8.8406 -5.5289 -5.5289 -5.5281 -5.5281 -5.4410 -5.4410 -5.4409 -5.4409 -1.0093 -1.0093 -1.0092 -1.0092 0.4283 0.4283 0.4342 0.4342 0.8703 0.8703 0.8752 0.8752 3.0357 3.0357 3.0445 3.0445 3.1092 3.1092 3.1330 3.1330 3.2330 3.2330 3.2464 3.2464 4.9993 4.9993 5.0023 5.0023 5.5550 5.5550 5.5840 5.5840 5.9933 5.9933 6.0345 6.0345 7.3408 7.3408 7.3603 7.3603 8.1787 8.1787 8.2346 8.2346 9.0569 9.0569 9.0780 9.0780 9.4056 9.4056 9.4069 9.4069 10.8682 10.8682 10.8930 10.8930 11.1779 11.1779 11.2219 11.2219 k = 0.0000 0.2000 0.4752 ( 10870 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8383 -8.8383 -8.8383 -8.8383 -5.5387 -5.5387 -5.5379 -5.5379 -5.4421 -5.4421 -5.4420 -5.4420 -0.9939 -0.9939 -0.9939 -0.9939 0.4247 0.4247 0.4305 0.4305 0.8968 0.8968 0.9029 0.9029 3.0215 3.0215 3.0365 3.0365 3.1009 3.1009 3.1212 3.1212 3.2348 3.2348 3.2490 3.2490 4.9816 4.9816 4.9884 4.9884 5.5383 5.5383 5.5759 5.5759 5.9972 5.9972 6.0453 6.0453 7.3392 7.3392 7.3589 7.3589 8.1717 8.1717 8.2316 8.2316 9.0407 9.0407 9.0654 9.0654 9.3884 9.3884 9.3892 9.3892 10.8849 10.8849 10.9153 10.9153 11.2388 11.2388 11.2870 11.2870 k = 0.0000 0.2200 0.4752 ( 10882 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8359 -8.8359 -8.8359 -8.8359 -5.5492 -5.5492 -5.5483 -5.5483 -5.4429 -5.4429 -5.4428 -5.4428 -0.9784 -0.9784 -0.9783 -0.9783 0.4210 0.4210 0.4267 0.4267 0.9261 0.9261 0.9335 0.9335 2.9974 2.9974 3.0190 3.0190 3.1004 3.1004 3.1166 3.1166 3.2367 3.2367 3.2515 3.2515 4.9620 4.9620 4.9727 4.9727 5.5218 5.5218 5.5675 5.5675 6.0011 6.0011 6.0555 6.0555 7.3393 7.3393 7.3588 7.3588 8.1669 8.1669 8.2300 8.2300 9.0237 9.0237 9.0518 9.0518 9.3718 9.3718 9.3720 9.3720 10.9001 10.9001 10.9346 10.9346 11.3011 11.3011 11.3511 11.3511 k = 0.0000 0.2400 0.4752 ( 10884 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8334 -8.8334 -8.8334 -8.8334 -5.5601 -5.5601 -5.5593 -5.5593 -5.4434 -5.4434 -5.4432 -5.4432 -0.9629 -0.9629 -0.9627 -0.9627 0.4173 0.4173 0.4228 0.4228 0.9581 0.9581 0.9668 0.9668 2.9667 2.9667 2.9931 2.9931 3.1046 3.1046 3.1181 3.1181 3.2386 3.2386 3.2540 3.2540 4.9409 4.9409 4.9553 4.9553 5.5060 5.5060 5.5591 5.5591 6.0049 6.0049 6.0648 6.0648 7.3413 7.3413 7.3603 7.3603 8.1646 8.1646 8.2302 8.2302 9.0059 9.0059 9.0369 9.0369 9.3557 9.3557 9.3559 9.3559 10.9143 10.9143 10.9516 10.9516 11.3610 11.3610 11.4107 11.4107 k = 0.0000 0.2600 0.4752 ( 10896 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8309 -8.8309 -8.8309 -8.8309 -5.5713 -5.5713 -5.5705 -5.5705 -5.4436 -5.4436 -5.4435 -5.4435 -0.9477 -0.9477 -0.9474 -0.9474 0.4136 0.4136 0.4188 0.4188 0.9926 0.9926 1.0027 1.0027 2.9319 2.9319 2.9614 2.9614 3.1110 3.1110 3.1232 3.1232 3.2405 3.2405 3.2562 3.2562 4.9185 4.9185 4.9364 4.9364 5.4913 5.4913 5.5504 5.5504 6.0087 6.0087 6.0728 6.0728 7.3453 7.3453 7.3636 7.3636 8.1652 8.1652 8.2325 8.2325 8.9872 8.9872 9.0206 9.0206 9.3403 9.3403 9.3409 9.3409 10.9277 10.9277 10.9668 10.9668 11.4145 11.4145 11.4622 11.4622 k = 0.0000 0.2800 0.4752 ( 10896 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8285 -8.8285 -8.8284 -8.8284 -5.5826 -5.5826 -5.5817 -5.5817 -5.4437 -5.4437 -5.4436 -5.4436 -0.9330 -0.9330 -0.9326 -0.9326 0.4100 0.4100 0.4149 0.4149 1.0293 1.0293 1.0407 1.0407 2.8944 2.8944 2.9258 2.9258 3.1187 3.1187 3.1302 3.1302 3.2424 3.2424 3.2583 3.2583 4.8955 4.8955 4.9162 4.9162 5.4780 5.4780 5.5415 5.5415 6.0124 6.0124 6.0793 6.0793 7.3512 7.3512 7.3686 7.3686 8.1687 8.1687 8.2371 8.2371 8.9673 8.9673 9.0025 9.0025 9.3261 9.3261 9.3268 9.3268 10.9406 10.9406 10.9805 10.9805 11.4578 11.4578 11.5023 11.5023 k = 0.0000 0.3000 0.4752 ( 10890 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8260 -8.8260 -8.8260 -8.8260 -5.5936 -5.5936 -5.5928 -5.5928 -5.4437 -5.4437 -5.4435 -5.4435 -0.9191 -0.9191 -0.9186 -0.9186 0.4066 0.4066 0.4110 0.4110 1.0679 1.0679 1.0803 1.0803 2.8550 2.8550 2.8875 2.8875 3.1270 3.1270 3.1381 3.1381 3.2441 3.2441 3.2601 3.2601 4.8723 4.8723 4.8949 4.8949 5.4664 5.4664 5.5325 5.5325 6.0162 6.0162 6.0842 6.0842 7.3590 7.3590 7.3753 7.3753 8.1756 8.1756 8.2441 8.2441 8.9461 8.9461 8.9826 8.9826 9.3131 9.3131 9.3137 9.3137 10.9528 10.9528 10.9929 10.9929 11.4883 11.4883 11.5293 11.5293 k = 0.0000 0.3200 0.4752 ( 10886 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8237 -8.8237 -8.8236 -8.8236 -5.6041 -5.6041 -5.6034 -5.6034 -5.4435 -5.4435 -5.4434 -5.4434 -0.9061 -0.9061 -0.9056 -0.9056 0.4033 0.4033 0.4074 0.4074 1.1078 1.1078 1.1211 1.1211 2.8147 2.8147 2.8474 2.8474 3.1354 3.1354 3.1464 3.1464 3.2458 3.2458 3.2616 3.2616 4.8495 4.8495 4.8732 4.8732 5.4567 5.4567 5.5232 5.5232 6.0201 6.0201 6.0874 6.0874 7.3681 7.3681 7.3833 7.3833 8.1857 8.1857 8.2536 8.2536 8.9236 8.9236 8.9608 8.9608 9.3015 9.3015 9.3018 9.3018 10.9645 10.9645 11.0039 11.0039 11.5059 11.5059 11.5437 11.5437 k = 0.0000 0.3400 0.4752 ( 10870 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8214 -8.8214 -8.8214 -8.8214 -5.6141 -5.6141 -5.6134 -5.6134 -5.4433 -5.4433 -5.4432 -5.4432 -0.8943 -0.8943 -0.8937 -0.8937 0.4004 0.4004 0.4040 0.4040 1.1483 1.1483 1.1623 1.1623 2.7741 2.7741 2.8064 2.8064 3.1439 3.1439 3.1546 3.1546 3.2474 3.2474 3.2628 3.2628 4.8276 4.8276 4.8515 4.8515 5.4488 5.4488 5.5138 5.5138 6.0240 6.0240 6.0890 6.0890 7.3783 7.3783 7.3923 7.3923 8.1990 8.1990 8.2654 8.2654 8.8999 8.8999 8.9371 8.9371 9.2912 9.2912 9.2912 9.2912 10.9757 10.9757 11.0136 11.0136 11.5131 11.5131 11.5482 11.5482 k = 0.0000 0.3600 0.4752 ( 10866 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8194 -8.8194 -8.8193 -8.8193 -5.6234 -5.6234 -5.6227 -5.6227 -5.4431 -5.4431 -5.4429 -5.4429 -0.8836 -0.8836 -0.8830 -0.8830 0.3977 0.3977 0.4009 0.4009 1.1888 1.1888 1.2030 1.2030 2.7342 2.7342 2.7653 2.7653 3.1521 3.1521 3.1624 3.1624 3.2490 3.2490 3.2637 3.2637 4.8072 4.8072 4.8303 4.8303 5.4428 5.4428 5.5043 5.5043 6.0281 6.0281 6.0891 6.0891 7.3890 7.3890 7.4016 7.4016 8.2154 8.2154 8.2793 8.2793 8.8751 8.8751 8.9118 8.9118 9.2820 9.2820 9.2823 9.2823 10.9862 10.9862 11.0220 11.0220 11.5132 11.5132 11.5460 11.5460 k = 0.0000 0.3800 0.4752 ( 10874 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8175 -8.8175 -8.8175 -8.8175 -5.6317 -5.6317 -5.6311 -5.6311 -5.4428 -5.4428 -5.4427 -5.4427 -0.8742 -0.8742 -0.8736 -0.8736 0.3953 0.3953 0.3981 0.3981 1.2281 1.2281 1.2421 1.2421 2.6960 2.6960 2.7251 2.7251 3.1598 3.1598 3.1697 3.1697 3.2504 3.2504 3.2642 3.2642 4.7888 4.7888 4.8102 4.8102 5.4387 5.4387 5.4949 5.4949 6.0324 6.0324 6.0878 6.0878 7.3998 7.3998 7.4109 7.4109 8.2345 8.2345 8.2947 8.2947 8.8498 8.8498 8.8853 8.8853 9.2741 9.2741 9.2747 9.2747 10.9961 10.9961 11.0289 11.0289 11.5094 11.5094 11.5396 11.5396 k = 0.0000 0.4000 0.4752 ( 10874 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8159 -8.8159 -8.8159 -8.8159 -5.6389 -5.6389 -5.6384 -5.6384 -5.4426 -5.4426 -5.4425 -5.4425 -0.8662 -0.8662 -0.8656 -0.8656 0.3933 0.3933 0.3956 0.3956 1.2653 1.2653 1.2784 1.2784 2.6608 2.6608 2.6870 2.6870 3.1670 3.1670 3.1760 3.1760 3.2518 3.2518 3.2643 3.2643 4.7728 4.7728 4.7918 4.7918 5.4364 5.4364 5.4857 5.4857 6.0369 6.0369 6.0853 6.0853 7.4100 7.4100 7.4196 7.4196 8.2557 8.2557 8.3108 8.3108 8.8248 8.8248 8.8583 8.8583 9.2675 9.2675 9.2684 9.2684 11.0052 11.0052 11.0343 11.0343 11.5041 11.5041 11.5311 11.5311 k = 0.0000 0.4200 0.4752 ( 10870 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8145 -8.8145 -8.8145 -8.8145 -5.6450 -5.6450 -5.6446 -5.6446 -5.4423 -5.4423 -5.4422 -5.4422 -0.8595 -0.8595 -0.8591 -0.8591 0.3917 0.3917 0.3936 0.3936 1.2989 1.2989 1.3106 1.3106 2.6298 2.6298 2.6523 2.6523 3.1734 3.1734 3.1813 3.1813 3.2533 3.2533 3.2640 3.2640 4.7595 4.7595 4.7756 4.7756 5.4357 5.4357 5.4768 5.4768 6.0417 6.0417 6.0819 6.0819 7.4193 7.4193 7.4272 7.4272 8.2781 8.2781 8.3263 8.3263 8.8015 8.8015 8.8317 8.8317 9.2623 9.2623 9.2632 9.2632 11.0136 11.0136 11.0381 11.0381 11.4987 11.4987 11.5219 11.5219 k = 0.0000 0.4400 0.4752 ( 10866 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8134 -8.8134 -8.8134 -8.8134 -5.6498 -5.6498 -5.6495 -5.6495 -5.4421 -5.4421 -5.4421 -5.4421 -0.8543 -0.8543 -0.8540 -0.8540 0.3905 0.3905 0.3919 0.3919 1.3277 1.3277 1.3372 1.3372 2.6045 2.6045 2.6223 2.6223 3.1788 3.1788 3.1852 3.1852 3.2548 3.2548 3.2633 3.2633 4.7494 4.7494 4.7619 4.7619 5.4366 5.4366 5.4684 5.4684 6.0467 6.0467 6.0777 6.0777 7.4272 7.4272 7.4332 7.4332 8.3003 8.3003 8.3397 8.3397 8.7814 8.7814 8.8068 8.8068 9.2584 9.2584 9.2592 9.2592 11.0211 11.0211 11.0402 11.0402 11.4945 11.4945 11.5129 11.5129 k = 0.0000 0.4600 0.4752 ( 10868 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.8126 -8.8126 -8.8126 -8.8126 -5.6533 -5.6533 -5.6531 -5.6531 -5.4420 -5.4420 -5.4419 -5.4419 -0.8506 -0.8506 -0.8503 -0.8503 0.3897 0.3897 0.3906 0.3906 1.3501 1.3501 1.3569 1.3569 2.5862 2.5862 2.5986 2.5986 3.1833 3.1833 3.1878 3.1878 3.2563 3.2563 3.2623 3.2623 4.7427 4.7427 4.7513 4.7513 5.4390 5.4390 5.4606 5.4606 6.0518 6.0518 6.0729 6.0729 7.4334 7.4334 7.4375 7.4375 8.3207 8.3207 8.3490 8.3490 8.7665 8.7665 8.7852 8.7852 9.2557 9.2557 9.2564 9.2564 11.0276 11.0276 11.0408 11.0408 11.4921 11.4921 11.5049 11.5049 k = 0.0000 0.4800 0.4752 ( 10842 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8121 -8.8121 -8.8121 -8.8121 -5.6553 -5.6553 -5.6552 -5.6552 -5.4419 -5.4419 -5.4419 -5.4419 -0.8483 -0.8483 -0.8482 -0.8482 0.3893 0.3893 0.3897 0.3897 1.3649 1.3649 1.3685 1.3685 2.5761 2.5761 2.5825 2.5825 3.1865 3.1865 3.1888 3.1888 3.2579 3.2579 3.2610 3.2610 4.7395 4.7395 4.7439 4.7439 5.4427 5.4427 5.4537 5.4537 6.0572 6.0572 6.0678 6.0678 7.4376 7.4376 7.4397 7.4397 8.3374 8.3374 8.3523 8.3523 8.7589 8.7589 8.7689 8.7689 9.2542 9.2542 9.2546 9.2546 11.0329 11.0329 11.0397 11.0397 11.4919 11.4919 11.4985 11.4985 k = 0.0000 0.5000 0.4752 ( 10844 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8119 -8.8119 -8.8119 -8.8119 -5.6560 -5.6560 -5.6560 -5.6560 -5.4419 -5.4419 -5.4419 -5.4419 -0.8475 -0.8475 -0.8475 -0.8475 0.3893 0.3893 0.3893 0.3893 1.3712 1.3712 1.3712 1.3712 2.5748 2.5748 2.5748 2.5748 3.1884 3.1884 3.1884 3.1884 3.2595 3.2595 3.2595 3.2595 4.7399 4.7399 4.7399 4.7399 5.4477 5.4477 5.4477 5.4477 6.0625 6.0625 6.0625 6.0625 7.4397 7.4397 7.4397 7.4397 8.3483 8.3483 8.3483 8.3483 8.7597 8.7597 8.7597 8.7597 9.2539 9.2539 9.2539 9.2539 11.0370 11.0370 11.0370 11.0370 11.4941 11.4941 11.4941 11.4941 k = 0.0000 0.5000 0.4752 ( 10844 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8119 -8.8119 -8.8119 -8.8119 -5.6560 -5.6560 -5.6560 -5.6560 -5.4419 -5.4419 -5.4419 -5.4419 -0.8475 -0.8475 -0.8475 -0.8475 0.3893 0.3893 0.3893 0.3893 1.3712 1.3712 1.3712 1.3712 2.5748 2.5748 2.5748 2.5748 3.1884 3.1884 3.1884 3.1884 3.2595 3.2595 3.2595 3.2595 4.7399 4.7399 4.7399 4.7399 5.4477 5.4477 5.4477 5.4477 6.0625 6.0625 6.0625 6.0625 7.4397 7.4397 7.4397 7.4397 8.3483 8.3483 8.3483 8.3483 8.7597 8.7597 8.7597 8.7597 9.2539 9.2539 9.2539 9.2539 11.0370 11.0370 11.0370 11.0370 11.4941 11.4941 11.4941 11.4941 k = 0.0200 0.5000 0.4752 ( 10848 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8118 -8.8118 -8.8118 -8.8118 -5.6560 -5.6560 -5.6560 -5.6560 -5.4427 -5.4427 -5.4426 -5.4426 -0.8464 -0.8464 -0.8462 -0.8462 0.3886 0.3886 0.3909 0.3909 1.3709 1.3709 1.3724 1.3724 2.5746 2.5746 2.5751 2.5751 3.1878 3.1878 3.1892 3.1892 3.2579 3.2579 3.2588 3.2588 4.7386 4.7386 4.7420 4.7420 5.4425 5.4425 5.4510 5.4510 6.0610 6.0610 6.0648 6.0648 7.4379 7.4379 7.4393 7.4393 8.3460 8.3460 8.3483 8.3483 8.7549 8.7549 8.7586 8.7586 9.2548 9.2548 9.2559 9.2559 11.0355 11.0355 11.0373 11.0373 11.4934 11.4934 11.5015 11.5015 k = 0.0400 0.5000 0.4752 ( 10844 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8113 -8.8113 -8.8113 -8.8113 -5.6559 -5.6559 -5.6559 -5.6559 -5.4451 -5.4451 -5.4449 -5.4449 -0.8427 -0.8427 -0.8423 -0.8423 0.3888 0.3888 0.3935 0.3935 1.3715 1.3715 1.3745 1.3745 2.5747 2.5747 2.5756 2.5756 3.1872 3.1872 3.1904 3.1904 3.2544 3.2544 3.2556 3.2556 4.7382 4.7382 4.7450 4.7450 5.4357 5.4357 5.4523 5.4523 6.0604 6.0604 6.0677 6.0677 7.4338 7.4338 7.4367 7.4367 8.3412 8.3412 8.3458 8.3458 8.7445 8.7445 8.7516 8.7516 9.2585 9.2585 9.2605 9.2605 11.0328 11.0328 11.0364 11.0364 11.4992 11.4992 11.5151 11.5151 k = 0.0600 0.5000 0.4752 ( 10856 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.8106 -8.8106 -8.8106 -8.8106 -5.6557 -5.6557 -5.6557 -5.6557 -5.4490 -5.4490 -5.4487 -5.4487 -0.8367 -0.8367 -0.8361 -0.8361 0.3901 0.3901 0.3971 0.3971 1.3731 1.3731 1.3774 1.3774 2.5749 2.5749 2.5763 2.5763 3.1859 3.1859 3.1917 3.1917 3.2495 3.2495 3.2503 3.2503 4.7387 4.7387 4.7486 4.7486 5.4273 5.4273 5.4515 5.4515 6.0608 6.0608 6.0711 6.0711 7.4278 7.4278 7.4320 7.4320 8.3343 8.3343 8.3409 8.3409 8.7292 8.7292 8.7394 8.7394 9.2647 9.2647 9.2672 9.2672 11.0290 11.0290 11.0343 11.0343 11.5103 11.5103 11.5335 11.5335 k = 0.0800 0.5000 0.4752 ( 10868 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.8095 -8.8095 -8.8095 -8.8095 -5.6555 -5.6555 -5.6554 -5.6554 -5.4544 -5.4544 -5.4540 -5.4540 -0.8285 -0.8285 -0.8276 -0.8276 0.3924 0.3924 0.4017 0.4017 1.3757 1.3757 1.3813 1.3813 2.5754 2.5754 2.5771 2.5771 3.1825 3.1825 3.1925 3.1925 3.2435 3.2435 3.2447 3.2447 4.7400 4.7400 4.7529 4.7529 5.4173 5.4173 5.4484 5.4484 6.0621 6.0621 6.0749 6.0749 7.4200 7.4200 7.4258 7.4258 8.3254 8.3254 8.3340 8.3340 8.7102 8.7102 8.7228 8.7228 9.2727 9.2727 9.2751 9.2751 11.0242 11.0242 11.0312 11.0312 11.5249 11.5249 11.5545 11.5545 k = 0.1000 0.5000 0.4752 ( 10864 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.8082 -8.8082 -8.8082 -8.8082 -5.6552 -5.6552 -5.6552 -5.6552 -5.4611 -5.4611 -5.4606 -5.4606 -0.8184 -0.8184 -0.8172 -0.8172 0.3959 0.3959 0.4074 0.4074 1.3793 1.3793 1.3862 1.3862 2.5760 2.5760 2.5780 2.5780 3.1754 3.1754 3.1908 3.1908 3.2370 3.2370 3.2417 3.2417 4.7421 4.7421 4.7575 4.7575 5.4060 5.4060 5.4429 5.4429 6.0645 6.0645 6.0790 6.0790 7.4110 7.4110 7.4183 7.4183 8.3148 8.3148 8.3251 8.3251 8.6886 8.6886 8.7030 8.7030 9.2816 9.2816 9.2835 9.2835 11.0185 11.0185 11.0270 11.0270 11.5408 11.5408 11.5754 11.5754 k = 0.1200 0.5000 0.4752 ( 10856 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.8066 -8.8066 -8.8066 -8.8066 -5.6549 -5.6549 -5.6548 -5.6548 -5.4691 -5.4691 -5.4685 -5.4685 -0.8065 -0.8065 -0.8050 -0.8050 0.4007 0.4007 0.4144 0.4144 1.3841 1.3841 1.3921 1.3921 2.5768 2.5768 2.5791 2.5791 3.1632 3.1632 3.1839 3.1839 3.2336 3.2336 3.2416 3.2416 4.7448 4.7448 4.7624 4.7624 5.3933 5.3933 5.4349 5.4349 6.0678 6.0678 6.0831 6.0831 7.4013 7.4013 7.4101 7.4101 8.3030 8.3030 8.3147 8.3147 8.6653 8.6653 8.6810 8.6810 9.2909 9.2909 9.2918 9.2918 11.0120 11.0120 11.0217 11.0217 11.5555 11.5555 11.5929 11.5929 k = 0.1400 0.5000 0.4752 ( 10852 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.8048 -8.8048 -8.8048 -8.8048 -5.6545 -5.6545 -5.6545 -5.6545 -5.4781 -5.4781 -5.4775 -5.4775 -0.7932 -0.7932 -0.7914 -0.7914 0.4069 0.4069 0.4226 0.4226 1.3900 1.3900 1.3990 1.3990 2.5777 2.5777 2.5801 2.5801 3.1459 3.1459 3.1702 3.1702 3.2348 3.2348 3.2444 3.2444 4.7479 4.7479 4.7674 4.7674 5.3794 5.3794 5.4244 5.4244 6.0720 6.0720 6.0872 6.0872 7.3915 7.3915 7.4019 7.4019 8.2901 8.2901 8.3031 8.3031 8.6412 8.6412 8.6575 8.6575 9.2995 9.2995 9.2999 9.2999 11.0045 11.0045 11.0155 11.0155 11.5663 11.5663 11.6039 11.6039 k = 0.1600 0.5000 0.4752 ( 10852 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.8028 -8.8028 -8.8028 -8.8028 -5.6541 -5.6541 -5.6541 -5.6541 -5.4880 -5.4880 -5.4873 -5.4873 -0.7790 -0.7790 -0.7768 -0.7768 0.4146 0.4146 0.4322 0.4322 1.3973 1.3973 1.4071 1.4071 2.5787 2.5787 2.5812 2.5812 3.1243 3.1243 3.1508 3.1508 3.2396 3.2396 3.2497 3.2497 4.7515 4.7515 4.7721 4.7721 5.3644 5.3644 5.4113 5.4113 6.0769 6.0769 6.0911 6.0911 7.3825 7.3825 7.3944 7.3944 8.2767 8.2767 8.2906 8.2906 8.6170 8.6170 8.6333 8.6333 9.3062 9.3062 9.3083 9.3083 10.9961 10.9961 11.0080 11.0080 11.5715 11.5715 11.6048 11.6048 k = 0.1800 0.5000 0.4752 ( 10860 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.8006 -8.8006 -8.8006 -8.8006 -5.6538 -5.6538 -5.6537 -5.6537 -5.4986 -5.4986 -5.4979 -5.4979 -0.7640 -0.7640 -0.7615 -0.7615 0.4238 0.4238 0.4432 0.4432 1.4059 1.4059 1.4164 1.4164 2.5798 2.5798 2.5823 2.5823 3.0988 3.0988 3.1269 3.1269 3.2465 3.2465 3.2566 3.2566 4.7551 4.7551 4.7764 4.7764 5.3484 5.3484 5.3959 5.3959 6.0823 6.0823 6.0947 6.0947 7.3750 7.3750 7.3883 7.3883 8.2628 8.2628 8.2775 8.2775 8.5930 8.5930 8.6090 8.6090 9.3117 9.3117 9.3156 9.3156 10.9867 10.9867 10.9992 10.9992 11.5696 11.5696 11.5931 11.5931 k = 0.2000 0.5000 0.4752 ( 10856 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7983 -8.7983 -8.7982 -8.7982 -5.6534 -5.6534 -5.6534 -5.6534 -5.5098 -5.5098 -5.5091 -5.5091 -0.7488 -0.7488 -0.7459 -0.7459 0.4347 0.4347 0.4556 0.4556 1.4161 1.4161 1.4270 1.4270 2.5809 2.5809 2.5834 2.5834 3.0701 3.0701 3.0994 3.0994 3.2549 3.2549 3.2648 3.2648 4.7588 4.7588 4.7801 4.7801 5.3316 5.3316 5.3783 5.3783 6.0881 6.0881 6.0979 6.0979 7.3697 7.3697 7.3843 7.3843 8.2489 8.2489 8.2641 8.2641 8.5697 8.5697 8.5850 8.5850 9.3157 9.3157 9.3216 9.3216 10.9760 10.9760 10.9890 10.9890 11.5605 11.5605 11.5699 11.5699 k = 0.2200 0.5000 0.4752 ( 10852 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7958 -8.7958 -8.7958 -8.7958 -5.6531 -5.6531 -5.6531 -5.6531 -5.5213 -5.5213 -5.5206 -5.5206 -0.7336 -0.7336 -0.7304 -0.7304 0.4471 0.4471 0.4693 0.4693 1.4278 1.4278 1.4390 1.4390 2.5821 2.5821 2.5843 2.5843 3.0385 3.0385 3.0686 3.0686 3.2643 3.2643 3.2740 3.2740 4.7623 4.7623 4.7829 4.7829 5.3142 5.3142 5.3588 5.3588 6.0938 6.0938 6.1006 6.1006 7.3674 7.3674 7.3830 7.3830 8.2350 8.2350 8.2507 8.2507 8.5473 8.5473 8.5615 8.5615 9.3183 9.3183 9.3261 9.3261 10.9640 10.9640 10.9772 10.9772 11.5412 11.5412 11.5448 11.5448 k = 0.2400 0.5000 0.4752 ( 10844 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7933 -8.7933 -8.7933 -8.7933 -5.6529 -5.6529 -5.6529 -5.6529 -5.5329 -5.5329 -5.5322 -5.5322 -0.7187 -0.7187 -0.7153 -0.7153 0.4610 0.4610 0.4843 0.4843 1.4413 1.4413 1.4524 1.4524 2.5833 2.5833 2.5851 2.5851 3.0044 3.0044 3.0350 3.0350 3.2744 3.2744 3.2837 3.2837 4.7654 4.7654 4.7847 4.7847 5.2965 5.2965 5.3378 5.3378 6.0993 6.0993 6.1028 6.1028 7.3684 7.3684 7.3848 7.3848 8.2211 8.2211 8.2373 8.2373 8.5259 8.5259 8.5389 8.5389 9.3194 9.3194 9.3292 9.3292 10.9506 10.9506 10.9637 10.9637 11.5115 11.5115 11.5243 11.5243 k = 0.2600 0.5000 0.4752 ( 10840 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7908 -8.7908 -8.7907 -8.7907 -5.6528 -5.6528 -5.6528 -5.6528 -5.5444 -5.5444 -5.5437 -5.5437 -0.7045 -0.7045 -0.7009 -0.7009 0.4763 0.4763 0.5002 0.5002 1.4566 1.4566 1.4674 1.4674 2.5844 2.5844 2.5857 2.5857 2.9682 2.9682 2.9988 2.9988 3.2850 3.2850 3.2940 3.2940 4.7679 4.7679 4.7853 4.7853 5.2787 5.2787 5.3159 5.3159 6.1044 6.1044 6.1045 6.1045 7.3733 7.3733 7.3900 7.3900 8.2075 8.2075 8.2240 8.2240 8.5058 8.5058 8.5174 8.5174 9.3190 9.3190 9.3305 9.3305 10.9358 10.9358 10.9485 10.9485 11.4829 11.4829 11.5011 11.5011 k = 0.2800 0.5000 0.4752 ( 10848 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7882 -8.7882 -8.7882 -8.7882 -5.6528 -5.6528 -5.6528 -5.6528 -5.5556 -5.5556 -5.5549 -5.5549 -0.6912 -0.6912 -0.6874 -0.6874 0.4928 0.4928 0.5169 0.5169 1.4737 1.4737 1.4839 1.4839 2.5854 2.5854 2.5860 2.5860 2.9303 2.9303 2.9606 2.9606 3.2958 3.2958 3.3044 3.3044 4.7697 4.7697 4.7846 4.7846 5.2611 5.2611 5.2934 5.2934 6.1058 6.1058 6.1088 6.1088 7.3822 7.3822 7.3988 7.3988 8.1941 8.1941 8.2109 8.2109 8.4869 8.4869 8.4972 8.4972 9.3172 9.3172 9.3303 9.3303 10.9195 10.9195 10.9315 10.9315 11.4566 11.4566 11.4773 11.4773 k = 0.3000 0.5000 0.4752 ( 10852 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7858 -8.7858 -8.7857 -8.7857 -5.6531 -5.6531 -5.6531 -5.6531 -5.5662 -5.5662 -5.5655 -5.5655 -0.6789 -0.6789 -0.6751 -0.6751 0.5100 0.5100 0.5339 0.5339 1.4925 1.4925 1.5019 1.5019 2.5859 2.5859 2.5862 2.5862 2.8913 2.8913 2.9206 2.9206 3.3068 3.3068 3.3149 3.3149 4.7706 4.7706 4.7828 4.7828 5.2441 5.2441 5.2712 5.2712 6.1067 6.1067 6.1125 6.1125 7.3948 7.3948 7.4110 7.4110 8.1808 8.1808 8.1980 8.1980 8.4695 8.4695 8.4784 8.4784 9.3140 9.3140 9.3284 9.3284 10.9021 10.9021 10.9131 10.9131 11.4329 11.4329 11.4541 11.4541 k = 0.3200 0.5000 0.4752 ( 10860 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7834 -8.7834 -8.7833 -8.7833 -5.6537 -5.6537 -5.6536 -5.6536 -5.5760 -5.5760 -5.5755 -5.5755 -0.6677 -0.6677 -0.6639 -0.6639 0.5276 0.5276 0.5509 0.5509 1.5130 1.5130 1.5214 1.5214 2.5854 2.5854 2.5868 2.5868 2.8519 2.8519 2.8797 2.8797 3.3177 3.3177 3.3252 3.3252 4.7706 4.7706 4.7798 4.7798 5.2280 5.2280 5.2496 5.2496 6.1074 6.1074 6.1153 6.1153 7.4111 7.4111 7.4262 7.4262 8.1678 8.1678 8.1853 8.1853 8.4535 8.4535 8.4612 8.4612 9.3098 9.3098 9.3251 9.3251 10.8836 10.8836 10.8934 10.8934 11.4121 11.4121 11.4325 11.4325 k = 0.3400 0.5000 0.4752 ( 10856 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7811 -8.7811 -8.7811 -8.7811 -5.6546 -5.6546 -5.6545 -5.6545 -5.5849 -5.5849 -5.5844 -5.5844 -0.6578 -0.6578 -0.6542 -0.6542 0.5453 0.5453 0.5674 0.5674 1.5348 1.5348 1.5420 1.5420 2.5843 2.5843 2.5870 2.5870 2.8129 2.8129 2.8384 2.8384 3.3282 3.3282 3.3351 3.3351 4.7696 4.7696 4.7759 4.7759 5.2130 5.2130 5.2294 5.2294 6.1078 6.1078 6.1173 6.1173 7.4302 7.4302 7.4440 7.4440 8.1551 8.1551 8.1726 8.1726 8.4391 8.4391 8.4456 8.4456 9.3046 9.3046 9.3204 9.3204 10.8646 10.8646 10.8731 10.8731 11.3942 11.3942 11.4127 11.4127 k = 0.3600 0.5000 0.4752 ( 10856 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7790 -8.7790 -8.7790 -8.7790 -5.6558 -5.6558 -5.6556 -5.6556 -5.5926 -5.5926 -5.5922 -5.5922 -0.6491 -0.6491 -0.6457 -0.6457 0.5624 0.5624 0.5829 0.5829 1.5577 1.5577 1.5635 1.5635 2.5823 2.5823 2.5866 2.5866 2.7753 2.7753 2.7978 2.7978 3.3383 3.3383 3.3444 3.3444 4.7677 4.7677 4.7713 4.7713 5.1993 5.1993 5.2110 5.2110 6.1082 6.1082 6.1185 6.1185 7.4515 7.4515 7.4636 7.4636 8.1427 8.1427 8.1601 8.1601 8.4263 8.4263 8.4317 8.4317 9.2988 9.2988 9.3145 9.3145 10.8456 10.8456 10.8527 10.8527 11.3790 11.3790 11.3950 11.3950 k = 0.3800 0.5000 0.4752 ( 10840 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7771 -8.7771 -8.7771 -8.7771 -5.6573 -5.6573 -5.6571 -5.6571 -5.5991 -5.5991 -5.5988 -5.5988 -0.6417 -0.6417 -0.6386 -0.6386 0.5787 0.5787 0.5971 0.5971 1.5808 1.5808 1.5852 1.5852 2.5791 2.5791 2.5853 2.5853 2.7406 2.7406 2.7591 2.7591 3.3476 3.3476 3.3530 3.3530 4.7650 4.7650 4.7663 4.7663 5.1871 5.1871 5.1948 5.1948 6.1086 6.1086 6.1191 6.1191 7.4739 7.4739 7.4841 7.4841 8.1310 8.1310 8.1478 8.1478 8.4152 8.4152 8.4196 8.4196 9.2928 9.2928 9.3079 9.3079 10.8272 10.8272 10.8330 10.8330 11.3665 11.3665 11.3794 11.3794 k = 0.4000 0.5000 0.4752 ( 10844 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7755 -8.7755 -8.7755 -8.7755 -5.6591 -5.6591 -5.6589 -5.6589 -5.6043 -5.6043 -5.6041 -5.6041 -0.6355 -0.6355 -0.6328 -0.6328 0.5935 0.5935 0.6095 0.6095 1.6035 1.6035 1.6066 1.6066 2.5744 2.5744 2.5827 2.5827 2.7101 2.7101 2.7238 2.7238 3.3559 3.3559 3.3605 3.3605 4.7614 4.7614 4.7617 4.7617 5.1766 5.1766 5.1810 5.1810 6.1091 6.1091 6.1190 6.1190 7.4963 7.4963 7.5044 7.5044 8.1201 8.1201 8.1358 8.1358 8.4058 8.4058 8.4094 8.4094 9.2871 9.2871 9.3009 9.3009 10.8101 10.8101 10.8146 10.8146 11.3563 11.3563 11.3656 11.3656 k = 0.4200 0.5000 0.4752 ( 10832 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8457 -23.8457 -23.8457 -23.8457 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7741 -8.7741 -8.7741 -8.7741 -5.6609 -5.6609 -5.6608 -5.6608 -5.6083 -5.6083 -5.6082 -5.6082 -0.6305 -0.6305 -0.6282 -0.6282 0.6066 0.6066 0.6198 0.6198 1.6245 1.6245 1.6265 1.6265 2.5680 2.5680 2.5781 2.5781 2.6853 2.6853 2.6940 2.6940 3.3632 3.3632 3.3669 3.3669 4.7568 4.7568 4.7581 4.7581 5.1678 5.1678 5.1699 5.1699 6.1097 6.1097 6.1184 6.1184 7.5173 7.5173 7.5234 7.5234 8.1106 8.1106 8.1245 8.1245 8.3981 8.3981 8.4010 8.4010 9.2819 9.2819 9.2939 9.2939 10.7951 10.7951 10.7985 10.7985 11.3480 11.3480 11.3537 11.3537 k = 0.4400 0.5000 0.4752 ( 10832 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8457 -23.8457 -23.8457 -23.8457 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7730 -8.7730 -8.7729 -8.7729 -5.6627 -5.6627 -5.6625 -5.6625 -5.6112 -5.6112 -5.6111 -5.6111 -0.6266 -0.6266 -0.6248 -0.6248 0.6175 0.6175 0.6277 0.6277 1.6428 1.6428 1.6439 1.6439 2.5605 2.5605 2.5712 2.5712 2.6672 2.6672 2.6714 2.6714 3.3691 3.3691 3.3719 3.3719 4.7530 4.7530 4.7547 4.7547 5.1608 5.1608 5.1615 5.1615 6.1105 6.1105 6.1175 6.1175 7.5356 7.5356 7.5399 7.5399 8.1029 8.1029 8.1142 8.1142 8.3922 8.3922 8.3944 8.3944 9.2778 9.2778 9.2873 9.2873 10.7827 10.7827 10.7851 10.7851 11.3414 11.3414 11.3440 11.3440 k = 0.4600 0.5000 0.4752 ( 10836 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8457 -23.8457 -23.8457 -23.8457 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7721 -8.7721 -8.7721 -8.7721 -5.6641 -5.6641 -5.6640 -5.6640 -5.6131 -5.6131 -5.6131 -5.6131 -0.6237 -0.6237 -0.6225 -0.6225 0.6261 0.6261 0.6330 0.6330 1.6571 1.6571 1.6575 1.6575 2.5536 2.5536 2.5625 2.5625 2.6553 2.6553 2.6567 2.6567 3.3736 3.3736 3.3755 3.3755 4.7503 4.7503 4.7517 4.7517 5.1556 5.1556 5.1557 5.1557 6.1115 6.1115 6.1164 6.1164 7.5500 7.5500 7.5526 7.5526 8.0976 8.0976 8.1056 8.1056 8.3882 8.3882 8.3896 8.3896 9.2751 9.2751 9.2818 9.2818 10.7735 10.7735 10.7750 10.7750 11.3361 11.3361 11.3369 11.3369 k = 0.4800 0.5000 0.4752 ( 10836 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7717 -8.7717 -8.7717 -8.7717 -5.6650 -5.6650 -5.6649 -5.6649 -5.6142 -5.6142 -5.6142 -5.6142 -0.6219 -0.6219 -0.6213 -0.6213 0.6320 0.6320 0.6355 0.6355 1.6662 1.6662 1.6663 1.6663 2.5494 2.5494 2.5544 2.5544 2.6488 2.6488 2.6490 2.6490 3.3765 3.3765 3.3775 3.3775 4.7488 4.7488 4.7496 4.7496 5.1523 5.1523 5.1524 5.1524 6.1126 6.1126 6.1151 6.1151 7.5593 7.5593 7.5605 7.5605 8.0951 8.0951 8.0993 8.0993 8.3859 8.3859 8.3866 8.3866 9.2741 9.2741 9.2775 9.2775 10.7680 10.7680 10.7687 10.7687 11.3325 11.3325 11.3325 11.3326 k = 0.5000 0.5000 0.4752 ( 10816 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8457 -23.8457 -23.8457 -23.8457 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7715 -8.7715 -8.7715 -8.7715 -5.6653 -5.6653 -5.6653 -5.6653 -5.6145 -5.6145 -5.6145 -5.6145 -0.6211 -0.6211 -0.6211 -0.6211 0.6351 0.6351 0.6351 0.6351 1.6693 1.6693 1.6693 1.6693 2.5496 2.5496 2.5496 2.5496 2.6467 2.6467 2.6467 2.6467 3.3778 3.3778 3.3778 3.3778 4.7485 4.7485 4.7485 4.7485 5.1513 5.1513 5.1513 5.1513 6.1138 6.1138 6.1138 6.1138 7.5629 7.5629 7.5629 7.5629 8.0956 8.0956 8.0956 8.0956 8.3853 8.3853 8.3853 8.3853 9.2749 9.2749 9.2749 9.2749 10.7664 10.7664 10.7664 10.7664 11.3312 11.3312 11.3312 11.3312 k = 0.5000 0.5000 0.4752 ( 10816 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8457 -23.8457 -23.8457 -23.8457 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7715 -8.7715 -8.7715 -8.7715 -5.6653 -5.6653 -5.6653 -5.6653 -5.6145 -5.6145 -5.6145 -5.6145 -0.6211 -0.6211 -0.6211 -0.6211 0.6351 0.6351 0.6351 0.6351 1.6693 1.6693 1.6693 1.6693 2.5496 2.5496 2.5496 2.5496 2.6467 2.6467 2.6467 2.6467 3.3778 3.3778 3.3778 3.3778 4.7485 4.7485 4.7485 4.7485 5.1513 5.1513 5.1513 5.1513 6.1138 6.1138 6.1138 6.1138 7.5629 7.5629 7.5629 7.5629 8.0956 8.0956 8.0956 8.0956 8.3853 8.3853 8.3853 8.3853 9.2749 9.2749 9.2749 9.2749 10.7664 10.7664 10.7664 10.7664 11.3312 11.3312 11.3312 11.3312 k = 0.4857 0.4857 0.4752 ( 10836 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7717 -8.7717 -8.7717 -8.7717 -5.6650 -5.6650 -5.6649 -5.6649 -5.6142 -5.6142 -5.6142 -5.6142 -0.6219 -0.6219 -0.6213 -0.6213 0.6319 0.6319 0.6354 0.6354 1.6661 1.6661 1.6662 1.6662 2.5494 2.5494 2.5547 2.5547 2.6488 2.6488 2.6489 2.6489 3.3765 3.3765 3.3775 3.3775 4.7488 4.7488 4.7496 4.7496 5.1523 5.1523 5.1525 5.1525 6.1126 6.1126 6.1151 6.1151 7.5592 7.5592 7.5605 7.5605 8.0950 8.0950 8.0994 8.0994 8.3859 8.3859 8.3865 8.3865 9.2741 9.2741 9.2775 9.2775 10.7680 10.7680 10.7688 10.7688 11.3323 11.3323 11.3326 11.3326 k = 0.4714 0.4714 0.4752 ( 10828 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8457 -23.8457 -23.8457 -23.8457 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7722 -8.7722 -8.7722 -8.7722 -5.6640 -5.6640 -5.6639 -5.6639 -5.6131 -5.6131 -5.6131 -5.6131 -0.6237 -0.6237 -0.6225 -0.6225 0.6259 0.6259 0.6329 0.6329 1.6567 1.6567 1.6570 1.6570 2.5540 2.5540 2.5645 2.5645 2.6553 2.6553 2.6555 2.6555 3.3735 3.3735 3.3754 3.3754 4.7503 4.7503 4.7520 4.7520 5.1556 5.1556 5.1558 5.1558 6.1114 6.1114 6.1165 6.1165 7.5499 7.5499 7.5522 7.5522 8.0969 8.0969 8.1060 8.1060 8.3888 8.3888 8.3895 8.3895 9.2751 9.2751 9.2819 9.2819 10.7739 10.7739 10.7752 10.7752 11.3337 11.3337 11.3358 11.3358 k = 0.4571 0.4571 0.4752 ( 10828 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8457 -23.8457 -23.8457 -23.8457 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7730 -8.7730 -8.7730 -8.7730 -5.6624 -5.6624 -5.6622 -5.6622 -5.6113 -5.6113 -5.6113 -5.6113 -0.6267 -0.6267 -0.6249 -0.6249 0.6174 0.6174 0.6276 0.6276 1.6416 1.6416 1.6419 1.6419 2.5631 2.5631 2.5787 2.5787 2.6657 2.6657 2.6663 2.6663 3.3689 3.3689 3.3717 3.3717 4.7531 4.7531 4.7556 4.7556 5.1610 5.1610 5.1614 5.1614 6.1103 6.1103 6.1178 6.1178 7.5356 7.5356 7.5390 7.5390 8.1002 8.1002 8.1149 8.1149 8.3943 8.3943 8.3945 8.3945 9.2779 9.2779 9.2878 9.2878 10.7838 10.7838 10.7857 10.7857 11.3336 11.3336 11.3377 11.3377 k = 0.4429 0.4429 0.4752 ( 10832 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8457 -23.8457 -23.8457 -23.8457 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7742 -8.7742 -8.7741 -8.7741 -5.6601 -5.6601 -5.6599 -5.6599 -5.6089 -5.6089 -5.6087 -5.6087 -0.6307 -0.6307 -0.6284 -0.6284 0.6065 0.6065 0.6198 0.6198 1.6212 1.6212 1.6216 1.6216 2.5763 2.5763 2.5968 2.5968 2.6799 2.6799 2.6808 2.6808 3.3627 3.3627 3.3665 3.3665 4.7572 4.7572 4.7603 4.7603 5.1686 5.1686 5.1690 5.1690 6.1092 6.1092 6.1191 6.1191 7.5174 7.5174 7.5217 7.5217 8.1035 8.1035 8.1247 8.1247 8.4015 8.4015 8.4037 8.4037 9.2823 9.2823 9.2950 9.2950 10.7979 10.7979 10.8001 10.8001 11.3322 11.3322 11.3377 11.3377 k = 0.4286 0.4286 0.4752 ( 10846 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7756 -8.7756 -8.7756 -8.7756 -5.6571 -5.6571 -5.6569 -5.6569 -5.6057 -5.6057 -5.6055 -5.6055 -0.6358 -0.6358 -0.6330 -0.6330 0.5937 0.5937 0.6097 0.6097 1.5962 1.5962 1.5966 1.5966 2.5933 2.5933 2.6183 2.6183 2.6973 2.6973 2.6987 2.6987 3.3551 3.3551 3.3597 3.3597 4.7625 4.7625 4.7662 4.7662 5.1783 5.1783 5.1785 5.1785 6.1081 6.1081 6.1203 6.1203 7.4964 7.4964 7.5014 7.5014 8.1058 8.1058 8.1343 8.1343 8.4115 8.4115 8.4169 8.4169 9.2880 9.2880 9.3030 9.3030 10.8161 10.8161 10.8183 10.8183 11.3299 11.3299 11.3364 11.3364 k = 0.4143 0.4143 0.4752 ( 10854 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7774 -8.7774 -8.7774 -8.7774 -5.6536 -5.6536 -5.6533 -5.6533 -5.6019 -5.6019 -5.6017 -5.6017 -0.6422 -0.6422 -0.6390 -0.6390 0.5795 0.5795 0.5978 0.5978 1.5674 1.5674 1.5678 1.5678 2.6135 2.6135 2.6426 2.6426 2.7175 2.7175 2.7195 2.7195 3.3461 3.3461 3.3516 3.3516 4.7690 4.7690 4.7730 4.7730 5.1899 5.1899 5.1900 5.1900 6.1069 6.1069 6.1213 6.1213 7.4738 7.4738 7.4793 7.4793 8.1061 8.1061 8.1425 8.1425 8.4247 8.4247 8.4343 8.4343 9.2946 9.2946 9.3115 9.3115 10.8383 10.8383 10.8403 10.8403 11.3270 11.3270 11.3343 11.3343 k = 0.4000 0.4000 0.4752 ( 10844 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7794 -8.7794 -8.7794 -8.7794 -5.6495 -5.6495 -5.6491 -5.6491 -5.5974 -5.5974 -5.5972 -5.5972 -0.6499 -0.6499 -0.6463 -0.6463 0.5641 0.5641 0.5844 0.5844 1.5354 1.5354 1.5358 1.5358 2.6364 2.6364 2.6691 2.6691 2.7401 2.7401 2.7426 2.7426 3.3360 3.3360 3.3422 3.3422 4.7767 4.7767 4.7809 4.7809 5.2031 5.2031 5.2033 5.2033 6.1057 6.1057 6.1220 6.1220 7.4507 7.4507 7.4563 7.4563 8.1044 8.1044 8.1487 8.1487 8.4416 8.4416 8.4557 8.4557 9.3020 9.3020 9.3201 9.3201 10.8643 10.8643 10.8658 10.8658 11.3238 11.3238 11.3317 11.3317 k = 0.3857 0.3857 0.4752 ( 10852 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7817 -8.7817 -8.7817 -8.7817 -5.6448 -5.6448 -5.6444 -5.6444 -5.5923 -5.5923 -5.5921 -5.5921 -0.6589 -0.6589 -0.6551 -0.6551 0.5482 0.5482 0.5701 0.5701 1.5007 1.5007 1.5011 1.5011 2.6616 2.6616 2.6972 2.6972 2.7644 2.7644 2.7674 2.7674 3.3247 3.3247 3.3317 3.3317 4.7854 4.7854 4.7896 4.7896 5.2177 5.2177 5.2183 5.2183 6.1044 6.1044 6.1223 6.1223 7.4277 7.4277 7.4333 7.4333 8.1008 8.1008 8.1527 8.1527 8.4619 8.4619 8.4806 8.4806 9.3096 9.3096 9.3286 9.3286 10.8940 10.8940 10.8946 10.8946 11.3205 11.3205 11.3287 11.3287 k = 0.3714 0.3714 0.4752 ( 10854 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7843 -8.7843 -8.7843 -8.7843 -5.6396 -5.6396 -5.6391 -5.6391 -5.5867 -5.5867 -5.5864 -5.5864 -0.6694 -0.6694 -0.6654 -0.6654 0.5321 0.5321 0.5552 0.5552 1.4641 1.4641 1.4645 1.4645 2.6886 2.6886 2.7265 2.7265 2.7902 2.7902 2.7935 2.7935 3.3126 3.3126 3.3203 3.3203 4.7951 4.7951 4.7991 4.7991 5.2338 5.2338 5.2349 5.2349 6.1028 6.1028 6.1222 6.1222 7.4056 7.4056 7.4108 7.4108 8.0959 8.0959 8.1547 8.1547 8.4854 8.4854 8.5083 8.5083 9.3172 9.3172 9.3365 9.3365 10.9266 10.9266 10.9269 10.9269 11.3172 11.3172 11.3254 11.3254 k = 0.3571 0.3571 0.4752 ( 10862 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7871 -8.7871 -8.7871 -8.7871 -5.6339 -5.6339 -5.6334 -5.6334 -5.5805 -5.5805 -5.5802 -5.5802 -0.6813 -0.6813 -0.6772 -0.6772 0.5162 0.5162 0.5402 0.5402 1.4260 1.4260 1.4264 1.4264 2.7170 2.7170 2.7564 2.7564 2.8169 2.8169 2.8204 2.8204 3.2998 3.2998 3.3080 3.3080 4.8058 4.8058 4.8093 4.8093 5.2511 5.2511 5.2528 5.2528 6.1009 6.1009 6.1216 6.1216 7.3851 7.3851 7.3895 7.3895 8.0902 8.0902 8.1551 8.1551 8.5115 8.5115 8.5383 8.5383 9.3246 9.3246 9.3437 9.3437 10.9613 10.9613 10.9627 10.9627 11.3142 11.3142 11.3222 11.3222 k = 0.3429 0.3429 0.4752 ( 10872 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7901 -8.7901 -8.7900 -8.7900 -5.6277 -5.6277 -5.6272 -5.6272 -5.5738 -5.5738 -5.5736 -5.5736 -0.6947 -0.6947 -0.6906 -0.6906 0.5010 0.5010 0.5255 0.5255 1.3869 1.3869 1.3872 1.3872 2.7464 2.7464 2.7867 2.7867 2.8442 2.8442 2.8476 2.8476 3.2863 3.2863 3.2952 3.2952 4.8173 4.8173 4.8201 4.8201 5.2693 5.2693 5.2718 5.2718 6.0987 6.0987 6.1203 6.1203 7.3665 7.3665 7.3698 7.3698 8.0844 8.0844 8.1546 8.1546 8.5397 8.5397 8.5700 8.5700 9.3315 9.3315 9.3500 9.3500 10.9982 10.9982 11.0007 11.0007 11.3120 11.3120 11.3192 11.3192 k = 0.3286 0.3286 0.4752 ( 10876 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7932 -8.7932 -8.7932 -8.7932 -5.6211 -5.6211 -5.6206 -5.6206 -5.5668 -5.5668 -5.5664 -5.5664 -0.7096 -0.7096 -0.7056 -0.7056 0.4868 0.4868 0.5114 0.5114 1.3471 1.3471 1.3474 1.3474 2.7765 2.7765 2.8167 2.8167 2.8718 2.8718 2.8749 2.8749 3.2725 3.2725 3.2819 3.2819 4.8295 4.8295 4.8315 4.8315 5.2885 5.2885 5.2917 5.2917 6.0961 6.0961 6.1183 6.1183 7.3502 7.3502 7.3521 7.3521 8.0789 8.0789 8.1536 8.1536 8.5697 8.5697 8.6030 8.6030 9.3378 9.3378 9.3552 9.3552 11.0366 11.0366 11.0399 11.0399 11.3112 11.3112 11.3170 11.3170 k = 0.3143 0.3143 0.4752 ( 10872 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7965 -8.7965 -8.7965 -8.7965 -5.6142 -5.6142 -5.6136 -5.6136 -5.5593 -5.5593 -5.5590 -5.5590 -0.7260 -0.7260 -0.7222 -0.7222 0.4738 0.4738 0.4983 0.4983 1.3070 1.3070 1.3072 1.3072 2.8070 2.8070 2.8463 2.8463 2.8994 2.8994 2.9018 2.9018 3.2584 3.2584 3.2684 3.2684 4.8424 4.8424 4.8433 4.8433 5.3083 5.3083 5.3124 5.3124 6.0930 6.0930 6.1155 6.1155 7.3364 7.3364 7.3366 7.3366 8.0743 8.0743 8.1527 8.1527 8.6010 8.6010 8.6368 8.6368 9.3434 9.3434 9.3593 9.3593 11.0752 11.0752 11.0786 11.0786 11.3132 11.3132 11.3167 11.3167 k = 0.3000 0.3000 0.4752 ( 10868 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.7999 -8.7999 -8.7999 -8.7999 -5.6070 -5.6070 -5.6064 -5.6064 -5.5515 -5.5515 -5.5512 -5.5512 -0.7438 -0.7438 -0.7402 -0.7402 0.4621 0.4621 0.4862 0.4862 1.2669 1.2669 1.2671 1.2671 2.8374 2.8374 2.8751 2.8751 2.9267 2.9267 2.9282 2.9282 3.2442 3.2442 3.2548 3.2548 4.8555 4.8555 4.8559 4.8559 5.3286 5.3286 5.3335 5.3335 6.0893 6.0893 6.1119 6.1119 7.3234 7.3234 7.3252 7.3252 8.0709 8.0709 8.1522 8.1522 8.6333 8.6333 8.6713 8.6713 9.3483 9.3483 9.3624 9.3624 11.1119 11.1119 11.1143 11.1143 11.3200 11.3200 11.3202 11.3202 k = 0.2857 0.2857 0.4752 ( 10872 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.8034 -8.8034 -8.8034 -8.8034 -5.5996 -5.5996 -5.5989 -5.5989 -5.5434 -5.5434 -5.5431 -5.5431 -0.7629 -0.7629 -0.7596 -0.7596 0.4521 0.4521 0.4755 0.4755 1.2271 1.2271 1.2273 1.2273 2.8675 2.8675 2.9027 2.9027 2.9536 2.9536 2.9537 2.9537 3.2302 3.2302 3.2414 3.2414 4.8680 4.8680 4.8698 4.8698 5.3492 5.3492 5.3550 5.3550 6.0851 6.0851 6.1075 6.1075 7.3128 7.3128 7.3168 7.3168 8.0689 8.0689 8.1525 8.1525 8.6664 8.6664 8.7061 8.7061 9.3525 9.3525 9.3645 9.3645 11.1433 11.1433 11.1433 11.1433 11.3300 11.3300 11.3355 11.3355 k = 0.2714 0.2714 0.4752 ( 10876 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.8070 -8.8070 -8.8070 -8.8070 -5.5919 -5.5919 -5.5912 -5.5912 -5.5352 -5.5352 -5.5348 -5.5348 -0.7831 -0.7831 -0.7802 -0.7802 0.4436 0.4436 0.4662 0.4662 1.1879 1.1879 1.1880 1.1880 2.8971 2.8971 2.9290 2.9290 2.9781 2.9781 2.9797 2.9797 3.2165 3.2165 3.2282 3.2282 4.8808 4.8808 4.8840 4.8840 5.3699 5.3699 5.3766 5.3766 6.0804 6.0804 6.1022 6.1022 7.3046 7.3046 7.3110 7.3110 8.0687 8.0687 8.1537 8.1537 8.7001 8.7001 8.7413 8.7413 9.3562 9.3562 9.3658 9.3658 11.1622 11.1622 11.1655 11.1655 11.3501 11.3501 11.3617 11.3617 k = 0.2571 0.2571 0.4752 ( 10870 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4118 -21.4118 -21.4118 -21.4118 -8.8106 -8.8106 -8.8106 -8.8106 -5.5841 -5.5841 -5.5835 -5.5835 -5.5268 -5.5268 -5.5264 -5.5264 -0.8043 -0.8043 -0.8018 -0.8018 0.4367 0.4367 0.4584 0.4584 1.1494 1.1494 1.1495 1.1495 2.9259 2.9259 2.9536 2.9536 3.0013 3.0013 3.0051 3.0051 3.2034 3.2034 3.2157 3.2157 4.8938 4.8938 4.8985 4.8985 5.3906 5.3906 5.3982 5.3982 6.0750 6.0750 6.0961 6.0961 7.2989 7.2989 7.3077 7.3077 8.0703 8.0703 8.1561 8.1561 8.7342 8.7342 8.7764 8.7764 9.3595 9.3595 9.3666 9.3666 11.1708 11.1708 11.1766 11.1766 11.3817 11.3817 11.3988 11.3988 k = 0.2429 0.2429 0.4752 ( 10874 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8142 -8.8142 -8.8142 -8.8142 -5.5763 -5.5763 -5.5756 -5.5756 -5.5183 -5.5183 -5.5179 -5.5179 -0.8263 -0.8263 -0.8241 -0.8241 0.4314 0.4314 0.4520 0.4520 1.1119 1.1119 1.1119 1.1119 2.9536 2.9536 2.9763 2.9763 3.0229 3.0229 3.0294 3.0294 3.1911 3.1911 3.2040 3.2040 4.9068 4.9068 4.9131 4.9131 5.4113 5.4113 5.4196 5.4196 6.0691 6.0691 6.0893 6.0893 7.2956 7.2956 7.3067 7.3067 8.0738 8.0738 8.1596 8.1596 8.7686 8.7686 8.8115 8.8115 9.3626 9.3626 9.3670 9.3670 11.1713 11.1713 11.1782 11.1782 11.4221 11.4221 11.4436 11.4436 k = 0.2286 0.2286 0.4752 ( 10870 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8178 -8.8178 -8.8178 -8.8178 -5.5684 -5.5684 -5.5677 -5.5677 -5.5098 -5.5098 -5.5094 -5.5094 -0.8488 -0.8488 -0.8470 -0.8470 0.4275 0.4275 0.4470 0.4470 1.0755 1.0755 1.0755 1.0755 2.9800 2.9800 2.9967 2.9967 3.0426 3.0426 3.0526 3.0526 3.1802 3.1802 3.1935 3.1935 4.9199 4.9199 4.9276 4.9276 5.4316 5.4316 5.4407 5.4407 6.0626 6.0626 6.0819 6.0819 7.2945 7.2945 7.3079 7.3079 8.0793 8.0793 8.1644 8.1644 8.8032 8.8032 8.8462 8.8462 9.3658 9.3658 9.3674 9.3674 11.1661 11.1661 11.1731 11.1731 11.4660 11.4660 11.4914 11.4914 k = 0.2143 0.2143 0.4752 ( 10882 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8213 -8.8213 -8.8213 -8.8213 -5.5606 -5.5606 -5.5599 -5.5599 -5.5014 -5.5014 -5.5010 -5.5010 -0.8716 -0.8716 -0.8701 -0.8701 0.4251 0.4251 0.4432 0.4432 1.0405 1.0405 1.0405 1.0405 3.0047 3.0047 3.0146 3.0146 3.0600 3.0600 3.0745 3.0745 3.1712 3.1712 3.1847 3.1847 4.9329 4.9329 4.9420 4.9420 5.4516 5.4516 5.4613 5.4613 6.0557 6.0557 6.0739 6.0739 7.2954 7.2954 7.3109 7.3109 8.0866 8.0866 8.1703 8.1703 8.8376 8.8376 8.8804 8.8804 9.3683 9.3683 9.3694 9.3694 11.1569 11.1569 11.1635 11.1635 11.5003 11.5003 11.5328 11.5328 k = 0.2000 0.2000 0.4752 ( 10878 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8248 -8.8248 -8.8247 -8.8247 -5.5529 -5.5529 -5.5523 -5.5523 -5.4931 -5.4931 -5.4927 -5.4927 -0.8944 -0.8944 -0.8933 -0.8933 0.4238 0.4238 0.4407 0.4407 1.0069 1.0069 1.0069 1.0069 3.0270 3.0270 3.0293 3.0293 3.0748 3.0748 3.0950 3.0950 3.1652 3.1652 3.1782 3.1782 4.9458 4.9458 4.9561 4.9561 5.4710 5.4710 5.4813 5.4813 6.0484 6.0484 6.0654 6.0654 7.2980 7.2980 7.3154 7.3154 8.0957 8.0957 8.1772 8.1772 8.8718 8.8718 8.9138 8.9138 9.3699 9.3699 9.3736 9.3736 11.1446 11.1446 11.1504 11.1504 11.4807 11.4807 11.5286 11.5286 k = 0.1857 0.1857 0.4752 ( 10864 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8281 -8.8281 -8.8281 -8.8281 -5.5454 -5.5454 -5.5448 -5.5448 -5.4849 -5.4849 -5.4846 -5.4846 -0.9170 -0.9170 -0.9162 -0.9162 0.4236 0.4236 0.4392 0.4392 0.9750 0.9750 0.9751 0.9751 3.0403 3.0403 3.0455 3.0455 3.0871 3.0871 3.1140 3.1140 3.1632 3.1632 3.1745 3.1745 4.9585 4.9585 4.9698 4.9698 5.4899 5.4899 5.5007 5.5007 6.0408 6.0408 6.0567 6.0567 7.3022 7.3022 7.3210 7.3210 8.1064 8.1064 8.1850 8.1850 8.9054 8.9054 8.9459 8.9459 9.3729 9.3729 9.3789 9.3789 11.1298 11.1298 11.1347 11.1347 11.4049 11.4049 11.4575 11.4575 k = 0.1714 0.1714 0.4752 ( 10864 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8313 -8.8313 -8.8312 -8.8312 -5.5382 -5.5382 -5.5376 -5.5376 -5.4771 -5.4771 -5.4768 -5.4768 -0.9391 -0.9391 -0.9386 -0.9386 0.4243 0.4243 0.4386 0.4386 0.9449 0.9449 0.9450 0.9450 3.0475 3.0475 3.0577 3.0577 3.0991 3.0991 3.1313 3.1313 3.1657 3.1657 3.1742 3.1742 4.9709 4.9709 4.9830 4.9830 5.5082 5.5082 5.5191 5.5191 6.0329 6.0329 6.0477 6.0477 7.3075 7.3075 7.3274 7.3274 8.1184 8.1184 8.1935 8.1935 8.9380 8.9380 8.9763 8.9763 9.3777 9.3777 9.3855 9.3855 11.1124 11.1124 11.1163 11.1163 11.3169 11.3169 11.3686 11.3686 k = 0.1571 0.1571 0.4752 ( 10872 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8343 -8.8343 -8.8343 -8.8343 -5.5312 -5.5312 -5.5306 -5.5306 -5.4696 -5.4696 -5.4693 -5.4693 -0.9605 -0.9605 -0.9602 -0.9602 0.4257 0.4257 0.4387 0.4387 0.9168 0.9168 0.9168 0.9168 3.0508 3.0508 3.0622 3.0622 3.1130 3.1130 3.1469 3.1469 3.1718 3.1718 3.1771 3.1771 4.9829 4.9829 4.9955 4.9955 5.5256 5.5256 5.5367 5.5367 6.0250 6.0250 6.0386 6.0386 7.3138 7.3138 7.3344 7.3344 8.1316 8.1316 8.2025 8.2025 8.9693 8.9693 9.0047 9.0047 9.3846 9.3846 9.3937 9.3937 11.0923 11.0923 11.0949 11.0949 11.2297 11.2297 11.2794 11.2794 k = 0.1429 0.1429 0.4752 ( 10864 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8372 -8.8372 -8.8371 -8.8371 -5.5247 -5.5247 -5.5241 -5.5241 -5.4625 -5.4625 -5.4622 -5.4622 -0.9808 -0.9808 -0.9807 -0.9807 0.4276 0.4276 0.4393 0.4393 0.8906 0.8906 0.8907 0.8907 3.0510 3.0510 3.0611 3.0611 3.1284 3.1284 3.1606 3.1606 3.1799 3.1799 3.1828 3.1828 4.9943 4.9943 5.0072 5.0072 5.5422 5.5422 5.5533 5.5533 6.0171 6.0171 6.0296 6.0296 7.3207 7.3207 7.3415 7.3415 8.1456 8.1456 8.2117 8.2117 8.9989 8.9989 9.0307 9.0307 9.3941 9.3941 9.4038 9.4038 11.0675 11.0675 11.0682 11.0682 11.1502 11.1502 11.1954 11.1954 k = 0.1286 0.1286 0.4752 ( 10852 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8398 -8.8398 -8.8398 -8.8398 -5.5185 -5.5185 -5.5180 -5.5180 -5.4559 -5.4559 -5.4556 -5.4556 -1.0000 -1.0000 -1.0000 -1.0000 0.4299 0.4299 0.4404 0.4404 0.8666 0.8666 0.8667 0.8667 3.0490 3.0490 3.0572 3.0572 3.1437 3.1437 3.1726 3.1726 3.1886 3.1886 3.1903 3.1903 5.0052 5.0052 5.0180 5.0180 5.5579 5.5579 5.5687 5.5687 6.0093 6.0093 6.0208 6.0208 7.3281 7.3281 7.3485 7.3485 8.1601 8.1601 8.2209 8.2209 9.0263 9.0263 9.0538 9.0538 9.4063 9.4063 9.4158 9.4158 11.0233 11.0233 11.0352 11.0352 11.0911 11.0911 11.1233 11.1233 k = 0.1143 0.1143 0.4752 ( 10862 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8422 -8.8422 -8.8422 -8.8422 -5.5129 -5.5129 -5.5124 -5.5124 -5.4497 -5.4497 -5.4495 -5.4495 -1.0179 -1.0179 -1.0177 -1.0177 0.4325 0.4325 0.4417 0.4417 0.8449 0.8449 0.8450 0.8450 3.0457 3.0457 3.0521 3.0521 3.1582 3.1582 3.1831 3.1831 3.1972 3.1972 3.1984 3.1984 5.0154 5.0154 5.0278 5.0278 5.5726 5.5726 5.5830 5.5830 6.0019 6.0019 6.0122 6.0122 7.3355 7.3355 7.3551 7.3551 8.1747 8.1747 8.2296 8.2296 9.0512 9.0512 9.0739 9.0739 9.4210 9.4210 9.4297 9.4297 10.9597 10.9597 10.9852 10.9852 11.0567 11.0567 11.0732 11.0732 k = 0.1000 0.1000 0.4752 ( 10868 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8444 -8.8444 -8.8444 -8.8444 -5.5077 -5.5077 -5.5073 -5.5073 -5.4442 -5.4442 -5.4440 -5.4440 -1.0341 -1.0341 -1.0338 -1.0338 0.4352 0.4352 0.4432 0.4432 0.8255 0.8255 0.8256 0.8256 3.0418 3.0418 3.0467 3.0467 3.1714 3.1714 3.1922 3.1922 3.2052 3.2052 3.2065 3.2065 5.0249 5.0249 5.0365 5.0365 5.5861 5.5861 5.5958 5.5958 5.9949 5.9949 6.0041 6.0041 7.3428 7.3428 7.3612 7.3612 8.1891 8.1891 8.2378 8.2378 9.0732 9.0732 9.0911 9.0911 9.4376 9.4376 9.4450 9.4450 10.8934 10.8934 10.9229 10.9229 11.0319 11.0319 11.0414 11.0414 k = 0.0857 0.0857 0.4752 ( 10868 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8463 -8.8463 -8.8463 -8.8463 -5.5032 -5.5032 -5.5028 -5.5028 -5.4393 -5.4393 -5.4391 -5.4391 -1.0484 -1.0484 -1.0482 -1.0482 0.4379 0.4379 0.4447 0.4447 0.8085 0.8085 0.8086 0.8086 3.0378 3.0378 3.0416 3.0416 3.1833 3.1833 3.2001 3.2001 3.2123 3.2123 3.2137 3.2137 5.0334 5.0334 5.0440 5.0440 5.5983 5.5983 5.6072 5.6072 5.9884 5.9884 5.9965 5.9965 7.3499 7.3499 7.3665 7.3665 8.2029 8.2029 8.2451 8.2451 9.0923 9.0923 9.1056 9.1056 9.4555 9.4555 9.4614 9.4614 10.8318 10.8318 10.8604 10.8604 11.0105 11.0105 11.0174 11.0174 k = 0.0714 0.0714 0.4752 ( 10872 PWs) bands (ev): -45.3285 -45.3285 -45.3285 -45.3285 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8480 -8.8480 -8.8480 -8.8480 -5.4992 -5.4992 -5.4989 -5.4989 -5.4350 -5.4350 -5.4349 -5.4349 -1.0608 -1.0608 -1.0606 -1.0606 0.4404 0.4404 0.4460 0.4460 0.7940 0.7940 0.7941 0.7941 3.0341 3.0341 3.0370 3.0370 3.1936 3.1936 3.2069 3.2069 3.2184 3.2184 3.2199 3.2199 5.0410 5.0410 5.0503 5.0503 5.6092 5.6092 5.6170 5.6170 5.9827 5.9827 5.9897 5.9897 7.3564 7.3564 7.3709 7.3709 8.2158 8.2158 8.2511 8.2511 9.1083 9.1083 9.1175 9.1175 9.4735 9.4735 9.4779 9.4779 10.7776 10.7776 10.8032 10.8032 10.9917 10.9917 10.9971 10.9971 k = 0.0571 0.0571 0.4752 ( 10882 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8494 -8.8494 -8.8494 -8.8494 -5.4960 -5.4960 -5.4957 -5.4957 -5.4315 -5.4315 -5.4314 -5.4314 -1.0712 -1.0712 -1.0709 -1.0709 0.4427 0.4427 0.4472 0.4472 0.7821 0.7821 0.7822 0.7822 3.0309 3.0309 3.0330 3.0330 3.2024 3.2024 3.2124 3.2124 3.2234 3.2234 3.2249 3.2249 5.0476 5.0476 5.0553 5.0553 5.6185 5.6185 5.6251 5.6251 5.9780 5.9780 5.9836 5.9836 7.3622 7.3622 7.3743 7.3743 8.2274 8.2274 8.2558 8.2558 9.1211 9.1211 9.1270 9.1270 9.4905 9.4905 9.4935 9.4935 10.7319 10.7319 10.7535 10.7535 10.9754 10.9754 10.9799 10.9799 k = 0.0429 0.0429 0.4752 ( 10890 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8504 -8.8504 -8.8504 -8.8504 -5.4934 -5.4934 -5.4932 -5.4932 -5.4287 -5.4287 -5.4286 -5.4286 -1.0793 -1.0793 -1.0791 -1.0791 0.4447 0.4447 0.4480 0.4480 0.7727 0.7727 0.7728 0.7728 3.0283 3.0283 3.0298 3.0298 3.2095 3.2095 3.2167 3.2167 3.2273 3.2273 3.2286 3.2286 5.0530 5.0530 5.0590 5.0590 5.6262 5.6262 5.6313 5.6313 5.9742 5.9742 5.9786 5.9786 7.3673 7.3673 7.3766 7.3766 8.2375 8.2375 8.2589 8.2589 9.1310 9.1310 9.1345 9.1345 9.5053 9.5053 9.5072 9.5072 10.6959 10.6959 10.7127 10.7127 10.9623 10.9623 10.9657 10.9657 k = 0.0286 0.0286 0.4752 ( 10902 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8512 -8.8512 -8.8512 -8.8512 -5.4915 -5.4915 -5.4914 -5.4914 -5.4267 -5.4267 -5.4266 -5.4266 -1.0851 -1.0851 -1.0850 -1.0850 0.4463 0.4463 0.4485 0.4485 0.7661 0.7661 0.7661 0.7661 3.0264 3.0264 3.0274 3.0274 3.2150 3.2150 3.2196 3.2196 3.2301 3.2301 3.2311 3.2311 5.0572 5.0572 5.0613 5.0613 5.6321 5.6321 5.6356 5.6356 5.9717 5.9717 5.9746 5.9746 7.3715 7.3715 7.3778 7.3778 8.2459 8.2459 8.2601 8.2601 9.1380 9.1380 9.1398 9.1398 9.5168 9.5168 9.5179 9.5179 10.6704 10.6704 10.6819 10.6819 10.9527 10.9527 10.9550 10.9550 k = 0.0143 0.0143 0.4752 ( 10902 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8517 -8.8517 -8.8517 -8.8517 -5.4903 -5.4903 -5.4903 -5.4903 -5.4255 -5.4255 -5.4255 -5.4255 -1.0886 -1.0886 -1.0886 -1.0886 0.4475 0.4475 0.4486 0.4486 0.7620 0.7620 0.7621 0.7621 3.0254 3.0254 3.0258 3.0258 3.2187 3.2187 3.2210 3.2210 3.2319 3.2319 3.2324 3.2324 5.0602 5.0602 5.0623 5.0623 5.6360 5.6360 5.6378 5.6378 5.9704 5.9704 5.9719 5.9719 7.3747 7.3747 7.3779 7.3779 8.2524 8.2524 8.2595 8.2595 9.1422 9.1422 9.1429 9.1429 9.5242 9.5242 9.5247 9.5247 10.6560 10.6560 10.6619 10.6619 10.9470 10.9470 10.9482 10.9482 k = 0.0000 0.0000 0.4752 ( 10900 PWs) bands (ev): -45.3286 -45.3286 -45.3286 -45.3286 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4116 -21.4116 -21.4116 -21.4116 -8.8518 -8.8518 -8.8518 -8.8518 -5.4899 -5.4899 -5.4899 -5.4899 -5.4251 -5.4251 -5.4251 -5.4251 -1.0898 -1.0898 -1.0898 -1.0898 0.4483 0.4483 0.4483 0.4483 0.7607 0.7607 0.7607 0.7607 3.0252 3.0252 3.0252 3.0252 3.2207 3.2207 3.2207 3.2207 3.2326 3.2326 3.2326 3.2326 5.0619 5.0619 5.0619 5.0619 5.6380 5.6380 5.6380 5.6380 5.9705 5.9705 5.9705 5.9705 7.3769 7.3769 7.3769 7.3769 8.2570 8.2570 8.2570 8.2570 9.1438 9.1438 9.1438 9.1438 9.5268 9.5268 9.5268 9.5268 10.6531 10.6531 10.6531 10.6531 10.9455 10.9455 10.9455 10.9455 k = 0.0000 0.5000-0.0000 ( 10884 PWs) bands (ev): -45.3583 -45.3583 -45.2986 -45.2986 -24.0753 -24.0753 -23.6593 -23.6593 -22.1280 -22.1280 -21.8543 -21.8543 -21.5074 -21.5074 -21.3130 -21.3130 -10.0335 -10.0335 -7.3798 -7.3798 -6.1381 -6.1381 -5.9390 -5.9390 -5.2068 -5.2068 -4.9064 -4.9064 -1.2268 -1.2268 -0.9335 -0.9335 0.3611 0.3611 0.7781 0.7781 0.8837 0.8837 1.1881 1.1881 3.2174 3.2174 3.3279 3.3279 3.3717 3.3717 3.4700 3.4700 3.7548 3.7548 3.8801 3.8801 4.2873 4.2873 4.4084 4.4084 4.6150 4.6150 4.7510 4.7510 5.2290 5.2290 6.2010 6.2010 7.1607 7.1607 7.4795 7.4795 7.5719 7.5719 7.9433 7.9433 8.4861 8.4861 9.0321 9.0321 9.0358 9.0358 9.5200 9.5200 11.5894 11.5894 11.8718 11.8718 11.9460 11.9460 12.2598 12.2598 k = 0.0000 0.5000 0.0198 ( 10894 PWs) bands (ev): -45.3583 -45.3583 -45.2987 -45.2987 -24.0748 -24.0748 -23.6596 -23.6596 -22.1278 -22.1278 -21.8548 -21.8548 -21.5072 -21.5072 -21.3132 -21.3132 -10.0310 -10.0310 -7.3833 -7.3833 -6.1370 -6.1370 -5.9379 -5.9379 -5.2077 -5.2077 -4.9076 -4.9076 -1.2258 -1.2258 -0.9328 -0.9328 0.3627 0.3627 0.7823 0.7823 0.8814 0.8814 1.1854 1.1854 3.2110 3.2110 3.3198 3.3198 3.3684 3.3684 3.4649 3.4649 3.7503 3.7503 3.8952 3.8952 4.2927 4.2927 4.4059 4.4059 4.6228 4.6228 4.7565 4.7565 5.2304 5.2304 6.1902 6.1902 7.1646 7.1646 7.4817 7.4817 7.5753 7.5753 7.9481 7.9481 8.4840 8.4840 9.0250 9.0250 9.0412 9.0412 9.5214 9.5214 11.5873 11.5873 11.8640 11.8640 11.9482 11.9482 12.2600 12.2600 k = 0.0000 0.5000 0.0396 ( 10900 PWs) bands (ev): -45.3581 -45.3581 -45.2988 -45.2988 -24.0732 -24.0732 -23.6607 -23.6607 -22.1274 -22.1274 -21.8563 -21.8563 -21.5066 -21.5066 -21.3138 -21.3138 -10.0235 -10.0235 -7.3937 -7.3937 -6.1339 -6.1339 -5.9349 -5.9349 -5.2105 -5.2105 -4.9112 -4.9112 -1.2230 -1.2230 -0.9309 -0.9309 0.3674 0.3674 0.7945 0.7945 0.8750 0.8750 1.1773 1.1773 3.1925 3.1925 3.2955 3.2955 3.3613 3.3613 3.4483 3.4483 3.7432 3.7432 3.9322 3.9322 4.3070 4.3070 4.4020 4.4020 4.6445 4.6445 4.7728 4.7728 5.2346 5.2346 6.1584 6.1584 7.1762 7.1762 7.4885 7.4885 7.5852 7.5852 7.9623 7.9623 8.4777 8.4777 9.0147 9.0147 9.0462 9.0462 9.5256 9.5256 11.5813 11.5813 11.8427 11.8427 11.9542 11.9542 12.2606 12.2606 k = 0.0000 0.5000 0.0594 ( 10888 PWs) bands (ev): -45.3577 -45.3577 -45.2992 -45.2992 -24.0706 -24.0706 -23.6623 -23.6623 -22.1268 -22.1268 -21.8587 -21.8587 -21.5056 -21.5056 -21.3149 -21.3149 -10.0110 -10.0110 -7.4110 -7.4110 -6.1286 -6.1286 -5.9297 -5.9297 -5.2150 -5.2150 -4.9170 -4.9170 -1.2182 -1.2182 -0.9276 -0.9276 0.3751 0.3751 0.8126 0.8126 0.8666 0.8666 1.1641 1.1641 3.1628 3.1628 3.2584 3.2584 3.3529 3.3529 3.4189 3.4189 3.7395 3.7395 3.9806 3.9806 4.3236 4.3236 4.4066 4.4066 4.6761 4.6761 4.7993 4.7993 5.2414 5.2414 6.1071 6.1071 7.1953 7.1953 7.5000 7.5000 7.6003 7.6003 7.9856 7.9856 8.4673 8.4673 9.0028 9.0028 9.0491 9.0491 9.5325 9.5325 11.5715 11.5715 11.8119 11.8119 11.9633 11.9633 12.2620 12.2620 k = 0.0000 0.5000 0.0792 ( 10880 PWs) bands (ev): -45.3573 -45.3573 -45.2996 -45.2996 -24.0670 -24.0670 -23.6647 -23.6647 -22.1259 -22.1259 -21.8621 -21.8621 -21.5042 -21.5042 -21.3164 -21.3164 -9.9936 -9.9936 -7.4351 -7.4351 -6.1213 -6.1213 -5.9226 -5.9226 -5.2214 -5.2214 -4.9252 -4.9252 -1.2116 -1.2116 -0.9232 -0.9232 0.3859 0.3859 0.8240 0.8240 0.8689 0.8689 1.1461 1.1461 3.1236 3.1236 3.2132 3.2132 3.3427 3.3427 3.3793 3.3793 3.7379 3.7379 4.0351 4.0351 4.3330 4.3330 4.4313 4.4313 4.7149 4.7149 4.8351 4.8351 5.2508 5.2508 6.0385 6.0385 7.2215 7.2215 7.5166 7.5166 7.6187 7.6187 8.0171 8.0171 8.4525 8.4525 8.9896 8.9896 9.0498 9.0498 9.5421 9.5421 11.5586 11.5586 11.7759 11.7759 11.9747 11.9747 12.2646 12.2646 k = 0.0000 0.5000 0.0990 ( 10868 PWs) bands (ev): -45.3567 -45.3567 -45.3001 -45.3001 -24.0624 -24.0624 -23.6678 -23.6678 -22.1247 -22.1247 -21.8665 -21.8665 -21.5024 -21.5024 -21.3183 -21.3183 -9.9713 -9.9713 -7.4656 -7.4656 -6.1119 -6.1119 -5.9134 -5.9134 -5.2296 -5.2296 -4.9357 -4.9357 -1.2032 -1.2032 -0.9175 -0.9175 0.3996 0.3996 0.8120 0.8120 0.8987 0.8987 1.1239 1.1239 3.0767 3.0767 3.1635 3.1635 3.3227 3.3227 3.3404 3.3404 3.7346 3.7346 4.0932 4.0932 4.3370 4.3370 4.4751 4.4751 4.7590 4.7590 4.8788 4.8788 5.2624 5.2624 5.9549 5.9549 7.2542 7.2542 7.5384 7.5384 7.6388 7.6388 8.0560 8.0560 8.4334 8.4334 8.9751 8.9751 9.0480 9.0480 9.5543 9.5543 11.5431 11.5431 11.7381 11.7381 11.9875 11.9875 12.2681 12.2681 k = 0.0000 0.5000 0.1188 ( 10890 PWs) bands (ev): -45.3561 -45.3561 -45.3009 -45.3009 -24.0568 -24.0568 -23.6716 -23.6716 -22.1232 -22.1232 -21.8717 -21.8717 -21.5002 -21.5002 -21.3206 -21.3206 -9.9443 -9.9443 -7.5024 -7.5024 -6.1006 -6.1006 -5.9023 -5.9023 -5.2395 -5.2395 -4.9483 -4.9483 -1.1929 -1.1929 -0.9108 -0.9108 0.4160 0.4160 0.7895 0.7895 0.9433 0.9433 1.0983 1.0983 3.0236 3.0236 3.1114 3.1114 3.2739 3.2739 3.3238 3.3238 3.7269 3.7269 4.1535 4.1535 4.3424 4.3424 4.5304 4.5304 4.8077 4.8077 4.9289 4.9289 5.2761 5.2761 5.8591 5.8591 7.2928 7.2928 7.5656 7.5656 7.6590 7.6590 8.1010 8.1010 8.4099 8.4099 8.9593 8.9593 9.0440 9.0440 9.5689 9.5689 11.5259 11.5259 11.7010 11.7010 12.0002 12.0002 12.2709 12.2709 k = 0.0000 0.5000 0.1386 ( 10896 PWs) bands (ev): -45.3553 -45.3553 -45.3017 -45.3017 -24.0502 -24.0502 -23.6760 -23.6760 -22.1215 -22.1215 -21.8777 -21.8777 -21.4977 -21.4977 -21.3233 -21.3233 -9.9125 -9.9125 -7.5452 -7.5452 -6.0873 -6.0873 -5.8892 -5.8892 -5.2512 -5.2512 -4.9632 -4.9632 -1.1809 -1.1809 -0.9030 -0.9030 0.4349 0.4349 0.7623 0.7623 0.9960 0.9960 1.0706 1.0706 2.9659 2.9659 3.0585 3.0585 3.2180 3.2180 3.3104 3.3104 3.7137 3.7137 4.2150 4.2150 4.3523 4.3523 4.5927 4.5927 4.8604 4.8604 4.9834 4.9834 5.2915 5.2915 5.7541 5.7541 7.3364 7.3364 7.5980 7.5980 7.6785 7.6785 8.1508 8.1508 8.3818 8.3818 8.9421 8.9421 9.0378 9.0378 9.5855 9.5855 11.5079 11.5079 11.6664 11.6664 12.0113 12.0113 12.2620 12.2620 k = 0.0000 0.5000 0.1584 ( 10888 PWs) bands (ev): -45.3544 -45.3544 -45.3026 -45.3026 -24.0428 -24.0428 -23.6812 -23.6812 -22.1194 -22.1194 -21.8845 -21.8845 -21.4948 -21.4948 -21.3264 -21.3264 -9.8762 -9.8762 -7.5936 -7.5936 -6.0722 -6.0722 -5.8743 -5.8743 -5.2646 -5.2646 -4.9801 -4.9801 -1.1673 -1.1673 -0.8945 -0.8945 0.4558 0.4558 0.7322 0.7322 1.0309 1.0309 1.0663 1.0663 2.9046 2.9046 3.0058 3.0058 3.1601 3.1601 3.2968 3.2968 3.6949 3.6949 4.2768 4.2768 4.3674 4.3674 4.6593 4.6593 4.9166 4.9166 5.0394 5.0394 5.3083 5.3083 5.6441 5.6441 7.3840 7.3840 7.6338 7.6338 7.6980 7.6980 8.2042 8.2042 8.3491 8.3491 8.9238 8.9238 9.0298 9.0298 9.6038 9.6038 11.4900 11.4900 11.6356 11.6356 12.0181 12.0181 12.2042 12.2042 k = 0.0000 0.5000 0.1782 ( 10894 PWs) bands (ev): -45.3534 -45.3534 -45.3036 -45.3036 -24.0344 -24.0344 -23.6870 -23.6870 -22.1171 -22.1171 -21.8920 -21.8920 -21.4915 -21.4915 -21.3299 -21.3299 -9.8354 -9.8354 -7.6473 -7.6473 -6.0553 -6.0553 -5.8576 -5.8576 -5.2796 -5.2796 -4.9990 -4.9990 -1.1521 -1.1521 -0.8852 -0.8852 0.4781 0.4781 0.7003 0.7003 1.0037 1.0037 1.1296 1.1296 2.8409 2.8409 2.9543 2.9543 3.1017 3.1017 3.2832 3.2832 3.6712 3.6712 4.3378 4.3378 4.3872 4.3872 4.7281 4.7281 4.9756 4.9756 5.0911 5.0911 5.3253 5.3253 5.5369 5.5369 7.4348 7.4348 7.6664 7.6664 7.7235 7.7235 8.2598 8.2598 8.3118 8.3118 8.9044 8.9044 9.0202 9.0202 9.6231 9.6231 11.4731 11.4731 11.6092 11.6092 12.0138 12.0138 12.1099 12.1099 k = 0.0000 0.5000 0.1980 ( 10876 PWs) bands (ev): -45.3523 -45.3523 -45.3047 -45.3047 -24.0253 -24.0253 -23.6935 -23.6935 -22.1143 -22.1143 -21.9001 -21.9001 -21.4879 -21.4879 -21.3337 -21.3337 -9.7902 -9.7902 -7.7058 -7.7058 -6.0366 -6.0366 -5.8391 -5.8391 -5.2962 -5.2962 -5.0198 -5.0198 -1.1353 -1.1353 -0.8755 -0.8755 0.5005 0.5005 0.6677 0.6677 0.9728 0.9728 1.2024 1.2024 2.7758 2.7758 2.9046 2.9046 3.0440 3.0440 3.2697 3.2697 3.6437 3.6437 4.3950 4.3950 4.4132 4.4132 4.7975 4.7975 5.0350 5.0350 5.1232 5.1232 5.3393 5.3393 5.4541 5.4541 7.4879 7.4879 7.6843 7.6843 7.7656 7.7656 8.2699 8.2699 8.3162 8.3162 8.8843 8.8843 9.0097 9.0097 9.6427 9.6427 11.4579 11.4579 11.5874 11.5874 11.9563 11.9563 12.0480 12.0480 k = 0.0000 0.5000 0.2178 ( 10876 PWs) bands (ev): -45.3510 -45.3510 -45.3059 -45.3059 -24.0154 -24.0154 -23.7006 -23.7006 -22.1113 -22.1113 -21.9087 -21.9087 -21.4840 -21.4840 -21.3378 -21.3378 -9.7409 -9.7409 -7.7688 -7.7688 -6.0163 -6.0163 -5.8189 -5.8189 -5.3144 -5.3144 -5.0425 -5.0425 -1.1172 -1.1172 -0.8654 -0.8654 0.5209 0.5209 0.6360 0.6360 0.9437 0.9437 1.2798 1.2798 2.7104 2.7104 2.8573 2.8573 2.9880 2.9880 3.2568 3.2568 3.6134 3.6134 4.4316 4.4316 4.4600 4.4600 4.8660 4.8660 5.0654 5.0654 5.1271 5.1271 5.3511 5.3511 5.4330 5.4330 7.5427 7.5427 7.6885 7.6885 7.8224 7.8224 8.2238 8.2238 8.3721 8.3721 8.8637 8.8637 8.9984 8.9984 9.6614 9.6614 11.4448 11.4448 11.5697 11.5697 11.8447 11.8447 12.0303 12.0303 k = 0.0000 0.5000 0.2376 ( 10868 PWs) bands (ev): -45.3497 -45.3497 -45.3072 -45.3072 -24.0047 -24.0047 -23.7084 -23.7084 -22.1079 -22.1079 -21.9178 -21.9178 -21.4797 -21.4797 -21.3422 -21.3422 -9.6876 -9.6876 -7.8359 -7.8359 -5.9945 -5.9945 -5.7970 -5.7970 -5.3341 -5.3341 -5.0668 -5.0668 -1.0978 -1.0978 -0.8553 -0.8553 0.5342 0.5342 0.6088 0.6088 0.9195 0.9195 1.3597 1.3597 2.6466 2.6466 2.8129 2.8129 2.9344 2.9344 3.2448 3.2448 3.5813 3.5813 4.4596 4.4596 4.5139 4.5139 4.9295 4.9295 4.9855 4.9855 5.1792 5.1792 5.3790 5.3790 5.4630 5.4630 7.5984 7.5984 7.6839 7.6839 7.8877 7.8877 8.1739 8.1739 8.4264 8.4264 8.8435 8.8435 8.9870 8.9870 9.6779 9.6779 11.4342 11.4342 11.5541 11.5541 11.7292 11.7292 12.0091 12.0091 k = 0.0000 0.5000 0.2574 ( 10870 PWs) bands (ev): -45.3482 -45.3482 -45.3087 -45.3087 -23.9935 -23.9935 -23.7169 -23.7169 -22.1041 -22.1041 -21.9273 -21.9273 -21.4752 -21.4752 -21.3470 -21.3470 -9.6305 -9.6305 -7.9067 -7.9067 -5.9712 -5.9712 -5.7737 -5.7737 -5.3552 -5.3552 -5.0927 -5.0927 -1.0773 -1.0773 -0.8455 -0.8455 0.5308 0.5308 0.5934 0.5934 0.9035 0.9035 1.4397 1.4397 2.5869 2.5869 2.7716 2.7716 2.8836 2.8836 3.2340 3.2340 3.5483 3.5483 4.4874 4.4874 4.5644 4.5644 4.8523 4.8523 5.0002 5.0002 5.2418 5.2418 5.4167 5.4167 5.5179 5.5179 7.6502 7.6502 7.6766 7.6766 7.9572 7.9572 8.1222 8.1222 8.4781 8.4781 8.8243 8.8243 8.9757 8.9757 9.6907 9.6907 11.4264 11.4264 11.5298 11.5298 11.6296 11.6296 11.9470 11.9470 k = 0.0000 0.5000 0.2772 ( 10870 PWs) bands (ev): -45.3467 -45.3467 -45.3102 -45.3102 -23.9816 -23.9816 -23.7260 -23.7260 -22.0999 -22.0999 -21.9371 -21.9371 -21.4703 -21.4703 -21.3520 -21.3520 -9.5697 -9.5697 -7.9807 -7.9807 -5.9466 -5.9466 -5.7488 -5.7488 -5.3777 -5.3777 -5.1201 -5.1201 -1.0559 -1.0559 -0.8362 -0.8362 0.5102 0.5102 0.5879 0.5879 0.8995 0.8995 1.5162 1.5162 2.5351 2.5351 2.7338 2.7338 2.8362 2.8362 3.2247 3.2247 3.5149 3.5149 4.5148 4.5148 4.6101 4.6101 4.7127 4.7127 5.0603 5.0603 5.3005 5.3005 5.4607 5.4607 5.5857 5.5857 7.6467 7.6467 7.7182 7.7182 8.0126 8.0126 8.0855 8.0855 8.5262 8.5262 8.8070 8.8070 8.9648 8.9648 9.6981 9.6981 11.4214 11.4214 11.4631 11.4631 11.5819 11.5819 11.8425 11.8425 k = 0.0000 0.5000 0.2970 ( 10874 PWs) bands (ev): -45.3451 -45.3451 -45.3119 -45.3119 -23.9692 -23.9692 -23.7357 -23.7357 -22.0953 -22.0953 -21.9470 -21.9470 -21.4653 -21.4653 -21.3573 -21.3573 -9.5055 -9.5055 -8.0575 -8.0575 -5.9208 -5.9208 -5.7226 -5.7226 -5.4014 -5.4014 -5.1487 -5.1487 -1.0337 -1.0337 -0.8278 -0.8278 0.4838 0.4838 0.5794 0.5794 0.9100 0.9100 1.5839 1.5839 2.4964 2.4964 2.6997 2.6997 2.7922 2.7922 3.2172 3.2172 3.4819 3.4819 4.5322 4.5322 4.5748 4.5748 4.6506 4.6506 5.1174 5.1174 5.3498 5.3498 5.5147 5.5147 5.6592 5.6592 7.6212 7.6212 7.7751 7.7751 7.9855 7.9855 8.1321 8.1321 8.5702 8.5702 8.7921 8.7921 8.9549 8.9549 9.6982 9.6982 11.3700 11.3700 11.4192 11.4192 11.5710 11.5710 11.7331 11.7331 k = 0.0000 0.5000 0.3168 ( 10874 PWs) bands (ev): -45.3434 -45.3434 -45.3136 -45.3136 -23.9563 -23.9563 -23.7460 -23.7460 -22.0903 -22.0903 -21.9572 -21.9572 -21.4600 -21.4600 -21.3628 -21.3628 -9.4381 -9.4381 -8.1368 -8.1368 -5.8939 -5.8939 -5.6951 -5.6951 -5.4263 -5.4263 -5.1786 -5.1786 -1.0111 -1.0111 -0.8208 -0.8208 0.4577 0.4577 0.5634 0.5634 0.9344 0.9344 1.6361 1.6361 2.4779 2.4779 2.6695 2.6695 2.7520 2.7520 3.2115 3.2115 3.4496 3.4496 4.4081 4.4081 4.5745 4.5745 4.6843 4.6843 5.1708 5.1708 5.3879 5.3879 5.5793 5.5793 5.7344 5.7344 7.5897 7.5897 7.8249 7.8249 7.9362 7.9362 8.2069 8.2069 8.6095 8.6095 8.7805 8.7805 8.9468 8.9468 9.6893 9.6893 11.2796 11.2796 11.4196 11.4196 11.5684 11.5684 11.6264 11.6264 k = 0.0000 0.5000 0.3366 ( 10858 PWs) bands (ev): -45.3416 -45.3416 -45.3153 -45.3153 -23.9431 -23.9431 -23.7569 -23.7569 -22.0849 -22.0849 -21.9673 -21.9673 -21.4544 -21.4544 -21.3685 -21.3685 -9.3676 -9.3676 -8.2181 -8.2181 -5.8661 -5.8661 -5.6664 -5.6664 -5.4523 -5.4523 -5.2095 -5.2095 -0.9881 -0.9881 -0.8154 -0.8154 0.4339 0.4339 0.5416 0.5416 0.9702 0.9702 1.6656 1.6656 2.4867 2.4867 2.6434 2.6434 2.7156 2.7156 3.2080 3.2080 3.4184 3.4184 4.2552 4.2552 4.5999 4.5999 4.7115 4.7115 5.2204 5.2204 5.4165 5.4165 5.6513 5.6513 5.8083 5.8083 7.5544 7.5544 7.8223 7.8223 7.9356 7.9356 8.2807 8.2807 8.6436 8.6436 8.7725 8.7725 8.9422 8.9422 9.6700 9.6700 11.1988 11.1988 11.4223 11.4223 11.5241 11.5241 11.5675 11.5675 k = 0.0000 0.5000 0.3564 ( 10846 PWs) bands (ev): -45.3398 -45.3398 -45.3170 -45.3170 -23.9295 -23.9295 -23.7683 -23.7683 -22.0790 -22.0790 -21.9775 -21.9775 -21.4487 -21.4487 -21.3743 -21.3743 -9.2945 -9.2945 -8.3010 -8.3010 -5.8374 -5.8374 -5.6367 -5.6367 -5.4793 -5.4793 -5.2412 -5.2412 -0.9652 -0.9652 -0.8120 -0.8120 0.4135 0.4135 0.5164 0.5164 1.0145 1.0145 1.6690 1.6690 2.5260 2.5260 2.6220 2.6220 2.6832 2.6832 3.2068 3.2068 3.3888 3.3888 4.1005 4.1005 4.6250 4.6250 4.7322 4.7322 5.2661 5.2661 5.4380 5.4380 5.7263 5.7263 5.8784 5.8784 7.5178 7.5178 7.7659 7.7659 7.9881 7.9881 8.3465 8.3465 8.6724 8.6724 8.7684 8.7684 8.9441 8.9441 9.6394 9.6394 11.1304 11.1304 11.4209 11.4209 11.4347 11.4347 11.5645 11.5645 k = 0.0000 0.5000 0.3762 ( 10836 PWs) bands (ev): -45.3381 -45.3381 -45.3188 -45.3188 -23.9157 -23.9157 -23.7803 -23.7803 -22.0727 -22.0727 -21.9875 -21.9875 -21.4428 -21.4428 -21.3803 -21.3803 -9.2188 -9.2188 -8.3851 -8.3851 -5.8081 -5.8081 -5.6060 -5.6060 -5.5071 -5.5071 -5.2737 -5.2737 -0.9426 -0.9426 -0.8110 -0.8110 0.3973 0.3973 0.4901 0.4901 1.0652 1.0652 1.6482 1.6482 2.5854 2.5854 2.6138 2.6138 2.6548 2.6548 3.2080 3.2080 3.3608 3.3608 3.9455 3.9455 4.6490 4.6490 4.7465 4.7465 5.3078 5.3078 5.4536 5.4536 5.8009 5.8009 5.9420 5.9420 7.4825 7.4825 7.7002 7.7002 8.0505 8.0505 8.3975 8.3975 8.6960 8.6960 8.7678 8.7678 8.9575 8.9575 9.5973 9.5973 11.0760 11.0760 11.3380 11.3380 11.4357 11.4357 11.5587 11.5587 k = 0.0000 0.5000 0.3960 ( 10854 PWs) bands (ev): -45.3362 -45.3362 -45.3207 -45.3207 -23.9018 -23.9018 -23.7926 -23.7926 -22.0659 -22.0659 -21.9975 -21.9975 -21.4368 -21.4368 -21.3865 -21.3865 -9.1408 -9.1408 -8.4701 -8.4701 -5.7782 -5.7782 -5.5748 -5.5748 -5.5354 -5.5354 -5.3068 -5.3068 -0.9207 -0.9207 -0.8126 -0.8126 0.3856 0.3856 0.4645 0.4645 1.1208 1.1208 1.6090 1.6090 2.5860 2.5860 2.6304 2.6304 2.6921 2.6921 3.2117 3.2117 3.3348 3.3348 3.7913 3.7913 4.6714 4.6714 4.7549 4.7549 5.3453 5.3453 5.4635 5.4635 5.8720 5.8720 5.9962 5.9962 7.4519 7.4519 7.6346 7.6346 8.1147 8.1147 8.4277 8.4277 8.7152 8.7152 8.7688 8.7688 8.9873 8.9873 9.5442 9.5442 11.0368 11.0368 11.2572 11.2572 11.4445 11.4445 11.5493 11.5493 k = 0.0000 0.5000 0.4158 ( 10854 PWs) bands (ev): -45.3343 -45.3343 -45.3226 -45.3226 -23.8878 -23.8878 -23.8054 -23.8054 -22.0587 -22.0587 -22.0072 -22.0072 -21.4306 -21.4306 -21.3927 -21.3927 -9.0609 -9.0609 -8.5557 -8.5557 -5.7479 -5.7479 -5.5661 -5.5661 -5.5411 -5.5411 -5.3403 -5.3403 -0.8999 -0.8999 -0.8171 -0.8171 0.3789 0.3789 0.4407 0.4407 1.1802 1.1802 1.5576 1.5576 2.5774 2.5774 2.6102 2.6102 2.8011 2.8011 3.2178 3.2178 3.3110 3.3110 3.6385 3.6385 4.6921 4.6921 4.7579 4.7579 5.3783 5.3783 5.4680 5.4680 5.9367 5.9367 6.0378 6.0378 7.4294 7.4294 7.5727 7.5727 8.1783 8.1783 8.4348 8.4348 8.7307 8.7307 8.7691 8.7691 9.0358 9.0358 9.4813 9.4813 11.0133 11.0133 11.1853 11.1853 11.4551 11.4551 11.5372 11.5372 k = 0.0000 0.5000 0.4356 ( 10854 PWs) bands (ev): -45.3324 -45.3324 -45.3245 -45.3245 -23.8737 -23.8737 -23.8186 -23.8186 -22.0511 -22.0511 -22.0166 -22.0166 -21.4244 -21.4244 -21.3990 -21.3990 -8.9792 -8.9792 -8.6414 -8.6414 -5.7174 -5.7174 -5.5953 -5.5953 -5.5088 -5.5088 -5.3741 -5.3741 -0.8805 -0.8805 -0.8244 -0.8244 0.3773 0.3773 0.4198 0.4198 1.2422 1.2422 1.4988 1.4988 2.5724 2.5724 2.5942 2.5942 2.9232 2.9232 3.2264 3.2264 3.2895 3.2895 3.4883 3.4883 4.7106 4.7106 4.7560 4.7560 5.4066 5.4066 5.4668 5.4668 5.9921 5.9921 6.0639 6.0639 7.4185 7.4185 7.5177 7.5177 8.2397 8.2397 8.4210 8.4210 8.7431 8.7431 8.7678 8.7678 9.1001 9.1001 9.4103 9.4103 11.0058 11.0058 11.1239 11.1239 11.4670 11.4670 11.5233 11.5233 k = 0.0000 0.5000 0.4554 ( 10856 PWs) bands (ev): -45.3305 -45.3305 -45.3265 -45.3265 -23.8597 -23.8597 -23.8321 -23.8321 -22.0430 -22.0430 -22.0258 -22.0258 -21.4181 -21.4181 -21.4054 -21.4054 -8.8962 -8.8962 -8.7269 -8.7269 -5.6867 -5.6867 -5.6255 -5.6255 -5.4755 -5.4755 -5.4080 -5.4080 -0.8629 -0.8629 -0.8346 -0.8346 0.3808 0.3808 0.4024 0.4024 1.3062 1.3062 1.4359 1.4359 2.5715 2.5715 2.5824 2.5824 3.0541 3.0541 3.2360 3.2360 3.2704 3.2704 3.3430 3.3430 4.7267 4.7267 4.7498 4.7498 5.4298 5.4298 5.4601 5.4601 6.0350 6.0350 6.0724 6.0724 7.4216 7.4216 7.4724 7.4724 8.2971 8.2971 8.3908 8.3908 8.7527 8.7527 8.7647 8.7647 9.1746 9.1746 9.3336 9.3336 11.0139 11.0139 11.0740 11.0740 11.4801 11.4801 11.5086 11.5086 k = 0.0000 0.5000 0.4752 ( 10844 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8458 -23.8458 -23.8458 -23.8458 -22.0346 -22.0346 -22.0346 -22.0346 -21.4117 -21.4117 -21.4117 -21.4117 -8.8119 -8.8119 -8.8119 -8.8119 -5.6560 -5.6560 -5.6560 -5.6560 -5.4419 -5.4419 -5.4419 -5.4419 -0.8475 -0.8475 -0.8475 -0.8475 0.3893 0.3893 0.3893 0.3893 1.3712 1.3712 1.3712 1.3712 2.5748 2.5748 2.5748 2.5748 3.1884 3.1884 3.1884 3.1884 3.2595 3.2595 3.2595 3.2595 4.7399 4.7399 4.7399 4.7399 5.4477 5.4477 5.4477 5.4477 6.0625 6.0625 6.0625 6.0625 7.4397 7.4397 7.4397 7.4397 8.3483 8.3483 8.3483 8.3483 8.7597 8.7597 8.7597 8.7597 9.2539 9.2539 9.2539 9.2539 11.0370 11.0370 11.0370 11.0370 11.4941 11.4941 11.4941 11.4941 k = 0.5000 0.5000-0.0000 ( 10768 PWs) bands (ev): -45.3582 -45.3582 -45.2979 -45.2979 -24.0752 -24.0752 -23.6593 -23.6593 -22.1279 -22.1279 -21.8543 -21.8543 -21.5076 -21.5076 -21.3130 -21.3130 -10.0012 -10.0012 -7.3285 -7.3285 -6.1684 -6.1684 -6.0381 -6.0381 -5.2082 -5.2082 -5.1666 -5.1666 -1.0037 -1.0037 -0.6797 -0.6797 0.7114 0.7114 0.9052 0.9052 1.0261 1.0261 1.4911 1.4911 3.2570 3.2570 3.3111 3.3111 3.3385 3.3385 3.6178 3.6178 3.6573 3.6573 3.7923 3.7923 3.9732 3.9732 3.9808 3.9808 4.3562 4.3562 4.6231 4.6231 4.7258 4.7258 6.2744 6.2744 7.0132 7.0132 7.1324 7.1324 7.9538 7.9538 7.9607 7.9607 8.5389 8.5389 8.6924 8.6924 8.9057 8.9057 9.2124 9.2124 11.7727 11.7727 11.9474 11.9474 12.3707 12.3707 12.4475 12.4475 k = 0.5000 0.5000 0.0198 ( 10792 PWs) bands (ev): -45.3583 -45.3583 -45.2980 -45.2980 -24.0747 -24.0747 -23.6597 -23.6597 -22.1278 -22.1278 -21.8548 -21.8548 -21.5074 -21.5074 -21.3132 -21.3132 -9.9986 -9.9986 -7.3320 -7.3320 -6.1673 -6.1673 -6.0372 -6.0372 -5.2090 -5.2090 -5.1676 -5.1676 -1.0028 -1.0028 -0.6791 -0.6791 0.7132 0.7132 0.9097 0.9097 1.0236 1.0236 1.4876 1.4876 3.2458 3.2458 3.3044 3.3044 3.3359 3.3359 3.5839 3.5839 3.6804 3.6804 3.7981 3.7981 3.9787 3.9787 3.9888 3.9888 4.3641 4.3641 4.6291 4.6291 4.7313 4.7313 6.2648 6.2648 7.0153 7.0153 7.1349 7.1349 7.9598 7.9598 7.9600 7.9600 8.5378 8.5378 8.6925 8.6925 8.9107 8.9107 9.2069 9.2069 11.7711 11.7711 11.9501 11.9501 12.3468 12.3468 12.4419 12.4419 k = 0.5000 0.5000 0.0396 ( 10796 PWs) bands (ev): -45.3581 -45.3581 -45.2982 -45.2982 -24.0731 -24.0731 -23.6607 -23.6607 -22.1274 -22.1274 -21.8563 -21.8563 -21.5068 -21.5068 -21.3139 -21.3139 -9.9911 -9.9911 -7.3425 -7.3425 -6.1641 -6.1641 -6.0344 -6.0344 -5.2115 -5.2115 -5.1708 -5.1708 -1.0000 -1.0000 -0.6771 -0.6771 0.7188 0.7188 0.9232 0.9232 1.0163 1.0163 1.4774 1.4774 3.2167 3.2167 3.2853 3.2853 3.3252 3.3252 3.5304 3.5304 3.6997 3.6997 3.8155 3.8155 3.9969 3.9969 4.0114 4.0114 4.3869 4.3869 4.6467 4.6467 4.7475 4.7475 6.2364 6.2364 7.0215 7.0215 7.1426 7.1426 7.9579 7.9579 7.9776 7.9776 8.5345 8.5345 8.6928 8.6928 8.9252 8.9252 9.1907 9.1907 11.7661 11.7661 11.9584 11.9584 12.2788 12.2788 12.4250 12.4250 k = 0.5000 0.5000 0.0594 ( 10804 PWs) bands (ev): -45.3578 -45.3578 -45.2986 -45.2986 -24.0705 -24.0705 -23.6624 -23.6624 -22.1268 -22.1268 -21.8588 -21.8588 -21.5058 -21.5058 -21.3149 -21.3149 -9.9785 -9.9785 -7.3600 -7.3600 -6.1588 -6.1588 -6.0298 -6.0298 -5.2157 -5.2157 -5.1760 -5.1760 -0.9955 -0.9955 -0.6739 -0.6739 0.7280 0.7280 0.9455 0.9455 1.0042 1.0042 1.4607 1.4607 3.1769 3.1769 3.2556 3.2556 3.3033 3.3033 3.4723 3.4723 3.6984 3.6984 3.8440 3.8440 4.0305 4.0305 4.0454 4.0454 4.4225 4.4225 4.6753 4.6753 4.7742 4.7742 6.1899 6.1899 7.0318 7.0318 7.1553 7.1553 7.9543 7.9543 8.0067 8.0067 8.5296 8.5296 8.6934 8.6934 8.9480 8.9480 9.1640 9.1640 11.7569 11.7569 11.9722 11.9722 12.1819 12.1819 12.3965 12.3965 k = 0.5000 0.5000 0.0792 ( 10828 PWs) bands (ev): -45.3574 -45.3574 -45.2992 -45.2992 -24.0669 -24.0669 -23.6648 -23.6648 -22.1259 -22.1259 -21.8622 -21.8622 -21.5044 -21.5044 -21.3164 -21.3164 -9.9610 -9.9610 -7.3842 -7.3842 -6.1513 -6.1513 -6.0234 -6.0234 -5.2216 -5.2216 -5.1833 -5.1833 -0.9891 -0.9891 -0.6696 -0.6696 0.7409 0.7409 0.9764 0.9764 0.9877 0.9877 1.4379 1.4379 3.1311 3.1311 3.2180 3.2180 3.2709 3.2709 3.4121 3.4121 3.6765 3.6765 3.8817 3.8817 4.0779 4.0779 4.0877 4.0877 4.4677 4.4677 4.7139 4.7139 4.8110 4.8110 6.1267 6.1267 7.0464 7.0464 7.1731 7.1731 7.9491 7.9491 8.0462 8.0462 8.5238 8.5238 8.6943 8.6943 8.9774 8.9774 9.1274 9.1274 11.7424 11.7424 11.9914 11.9914 12.0710 12.0710 12.3561 12.3561 k = 0.5000 0.5000 0.0990 ( 10820 PWs) bands (ev): -45.3568 -45.3568 -45.2997 -45.2997 -24.0623 -24.0623 -23.6679 -23.6679 -22.1247 -22.1247 -21.8666 -21.8666 -21.5026 -21.5026 -21.3183 -21.3183 -9.9386 -9.9386 -7.4150 -7.4150 -6.1418 -6.1418 -6.0152 -6.0152 -5.2291 -5.2291 -5.1926 -5.1926 -0.9810 -0.9810 -0.6640 -0.6640 0.7574 0.7574 0.9672 0.9672 1.0158 1.0158 1.4095 1.4095 3.0822 3.0822 3.1750 3.1750 3.2306 3.2306 3.3509 3.3509 3.6382 3.6382 3.9262 3.9262 4.1345 4.1345 4.1357 4.1357 4.5200 4.5200 4.7615 4.7615 4.8571 4.8571 6.0483 6.0483 7.0652 7.0652 7.1960 7.1960 7.9422 7.9422 8.0951 8.0951 8.5175 8.5175 8.6957 8.6957 9.0116 9.0116 9.0813 9.0813 11.7215 11.7215 11.9544 11.9544 12.0157 12.0157 12.3039 12.3039 k = 0.5000 0.5000 0.1188 ( 10836 PWs) bands (ev): -45.3561 -45.3561 -45.3005 -45.3005 -24.0567 -24.0567 -23.6716 -23.6716 -22.1232 -22.1232 -21.8718 -21.8718 -21.5004 -21.5004 -21.3206 -21.3206 -9.9114 -9.9114 -7.4521 -7.4521 -6.1303 -6.1303 -6.0053 -6.0053 -5.2382 -5.2382 -5.2040 -5.2040 -0.9711 -0.9711 -0.6574 -0.6574 0.7776 0.7776 0.9432 0.9432 1.0631 1.0631 1.3762 1.3762 3.0320 3.0320 3.1288 3.1288 3.1850 3.1850 3.2896 3.2896 3.5877 3.5877 3.9755 3.9755 4.1876 4.1876 4.1968 4.1968 4.5767 4.5767 4.8169 4.8169 4.9118 4.9118 5.9565 5.9565 7.0882 7.0882 7.2239 7.2239 7.9333 7.9333 8.1521 8.1521 8.5111 8.5111 8.6974 8.6974 9.0267 9.0267 9.0489 9.0489 11.6930 11.6930 11.8362 11.8362 12.0445 12.0445 12.2411 12.2411 k = 0.5000 0.5000 0.1386 ( 10812 PWs) bands (ev): -45.3552 -45.3552 -45.3013 -45.3013 -24.0502 -24.0502 -23.6761 -23.6761 -22.1215 -22.1215 -21.8778 -21.8778 -21.4979 -21.4979 -21.3233 -21.3233 -9.8795 -9.8795 -7.4952 -7.4952 -6.1167 -6.1167 -5.9937 -5.9937 -5.2489 -5.2489 -5.2173 -5.2173 -0.9595 -0.9595 -0.6499 -0.6499 0.8014 0.8014 0.9163 0.9163 1.1180 1.1180 1.3387 1.3387 2.9818 2.9818 3.0810 3.0810 3.1363 3.1363 3.2286 3.2286 3.5279 3.5279 4.0277 4.0277 4.2420 4.2420 4.2621 4.2621 4.6358 4.6358 4.8790 4.8790 4.9742 4.9742 5.8531 5.8531 7.1155 7.1155 7.2568 7.2568 7.9223 7.9223 8.2159 8.2159 8.5049 8.5049 8.6997 8.6997 8.9642 8.9642 9.0877 9.0877 11.6560 11.6560 11.7195 11.7195 12.0736 12.0736 12.1728 12.1728 k = 0.5000 0.5000 0.1584 ( 10804 PWs) bands (ev): -45.3542 -45.3542 -45.3022 -45.3022 -24.0427 -24.0427 -23.6812 -23.6812 -22.1194 -22.1194 -21.8846 -21.8846 -21.4949 -21.4949 -21.3264 -21.3264 -9.8429 -9.8429 -7.5440 -7.5440 -6.1012 -6.1012 -5.9805 -5.9805 -5.2611 -5.2611 -5.2325 -5.2325 -0.9463 -0.9463 -0.6417 -0.6417 0.8288 0.8288 0.8870 0.8870 1.1799 1.1799 1.2975 1.2975 2.9323 2.9323 3.0330 3.0330 3.0861 3.0861 3.1685 3.1685 3.4613 3.4613 4.0817 4.0817 4.2978 4.2978 4.3288 4.3288 4.6953 4.6953 4.9470 4.9470 5.0431 5.0431 5.7401 5.7401 7.1471 7.1471 7.2945 7.2945 7.9090 7.9090 8.2850 8.2850 8.4990 8.4990 8.7025 8.7025 8.8947 8.8947 9.1267 9.1267 11.5955 11.5955 11.6211 11.6211 12.0596 12.0596 12.1289 12.1289 k = 0.5000 0.5000 0.1782 ( 10804 PWs) bands (ev): -45.3531 -45.3531 -45.3033 -45.3033 -24.0344 -24.0344 -23.6870 -23.6870 -22.1170 -22.1170 -21.8921 -21.8921 -21.4917 -21.4917 -21.3299 -21.3299 -9.8018 -9.8018 -7.5981 -7.5981 -6.0839 -6.0839 -5.9657 -5.9657 -5.2749 -5.2749 -5.2495 -5.2495 -0.9315 -0.9315 -0.6328 -0.6328 0.8561 0.8561 0.8597 0.8597 1.2482 1.2482 1.2535 1.2535 2.8844 2.8844 2.9857 2.9857 3.0355 3.0355 3.1097 3.1097 3.3900 3.3900 4.1366 4.1366 4.3539 4.3539 4.3958 4.3958 4.7535 4.7535 5.0200 5.0200 5.1177 5.1177 5.6194 5.6194 7.1828 7.1828 7.3371 7.3371 7.8931 7.8931 8.3580 8.3580 8.4932 8.4932 8.7057 8.7057 8.8189 8.8189 9.1647 9.1647 11.4885 11.4885 11.5660 11.5660 11.9794 11.9794 12.0405 12.0405 k = 0.5000 0.5000 0.1980 ( 10820 PWs) bands (ev): -45.3520 -45.3520 -45.3046 -45.3046 -24.0252 -24.0252 -23.6935 -23.6935 -22.1143 -22.1143 -21.9002 -21.9002 -21.4880 -21.4880 -21.3337 -21.3337 -9.7564 -9.7564 -7.6571 -7.6571 -6.0648 -6.0648 -5.9494 -5.9494 -5.2901 -5.2901 -5.2684 -5.2684 -0.9152 -0.9152 -0.6235 -0.6235 0.8242 0.8242 0.8941 0.8941 1.2073 1.2073 1.3221 1.3221 2.8385 2.8385 2.9399 2.9399 2.9854 2.9854 3.0528 3.0528 3.3156 3.3156 4.1918 4.1918 4.4093 4.4093 4.4622 4.4622 4.8084 4.8084 5.0973 5.0973 5.1969 5.1969 5.4933 5.4933 7.2227 7.2227 7.3842 7.3842 7.8744 7.8744 8.4336 8.4336 8.4877 8.4877 8.7090 8.7090 8.7378 8.7378 9.2008 9.2008 11.3822 11.3822 11.5094 11.5094 11.8870 11.8870 11.9468 11.9468 k = 0.5000 0.5000 0.2178 ( 10808 PWs) bands (ev): -45.3507 -45.3507 -45.3058 -45.3058 -24.0153 -24.0153 -23.7006 -23.7006 -22.1113 -22.1113 -21.9088 -21.9088 -21.4841 -21.4841 -21.3378 -21.3378 -9.7068 -9.7068 -7.7206 -7.7206 -6.0439 -6.0439 -5.9317 -5.9317 -5.3067 -5.3067 -5.2889 -5.2889 -0.8976 -0.8976 -0.6141 -0.6141 0.7920 0.7920 0.9320 0.9320 1.1595 1.1595 1.4004 1.4004 2.7951 2.7951 2.8962 2.8962 2.9365 2.9365 2.9980 2.9980 3.2400 3.2400 4.2465 4.2465 4.4631 4.4631 4.5270 4.5270 4.8572 4.8572 5.1783 5.1783 5.2798 5.2798 5.3652 5.3652 7.2668 7.2668 7.4356 7.4356 7.8529 7.8529 8.4809 8.4809 8.5115 8.5115 8.6518 8.6518 8.7124 8.7124 9.2343 9.2343 11.2814 11.2814 11.4487 11.4487 11.7916 11.7916 11.8503 11.8503 k = 0.5000 0.5000 0.2376 ( 10824 PWs) bands (ev): -45.3496 -45.3496 -45.3071 -45.3071 -24.0047 -24.0047 -23.7084 -23.7084 -22.1079 -22.1079 -21.9179 -21.9179 -21.4799 -21.4799 -21.3423 -21.3423 -9.6531 -9.6531 -7.7882 -7.7882 -6.0214 -6.0214 -5.9126 -5.9126 -5.3246 -5.3246 -5.3111 -5.3111 -0.8786 -0.8786 -0.6048 -0.6048 0.7602 0.7602 0.9732 0.9732 1.1108 1.1108 1.4819 1.4819 2.7544 2.7544 2.8550 2.8550 2.8892 2.8892 2.9458 2.9458 3.1649 3.1649 4.3005 4.3005 4.5144 4.5144 4.5893 4.5893 4.8937 4.8937 5.2422 5.2422 5.2623 5.2623 5.3655 5.3655 7.3149 7.3149 7.4910 7.4910 7.8289 7.8289 8.4747 8.4747 8.5622 8.5622 8.5884 8.5884 8.7150 8.7150 9.2645 9.2645 11.1872 11.1872 11.3850 11.3850 11.6968 11.6968 11.7535 11.7535 k = 0.5000 0.5000 0.2574 ( 10840 PWs) bands (ev): -45.3482 -45.3482 -45.3086 -45.3086 -23.9934 -23.9934 -23.7169 -23.7169 -22.1041 -22.1041 -21.9274 -21.9274 -21.4753 -21.4753 -21.3470 -21.3470 -9.5956 -9.5956 -7.8595 -7.8595 -5.9974 -5.9974 -5.8923 -5.8923 -5.3438 -5.3438 -5.3348 -5.3348 -0.8585 -0.8585 -0.5959 -0.5959 0.7295 0.7295 1.0178 1.0178 1.0616 1.0616 1.5648 1.5648 2.7169 2.7169 2.8167 2.8167 2.8440 2.8440 2.8970 2.8970 3.0922 3.0922 4.3532 4.3532 4.5625 4.5625 4.6463 4.6463 4.9000 4.9000 5.1444 5.1444 5.3485 5.3485 5.4531 5.4531 7.3670 7.3670 7.5491 7.5491 7.8030 7.8030 8.4670 8.4670 8.4694 8.4694 8.6648 8.6648 8.7164 8.7164 9.2910 9.2910 11.1007 11.1007 11.3195 11.3195 11.6053 11.6053 11.6590 11.6590 k = 0.5000 0.5000 0.2772 ( 10852 PWs) bands (ev): -45.3467 -45.3467 -45.3101 -45.3101 -23.9816 -23.9816 -23.7260 -23.7260 -22.0999 -22.0999 -21.9371 -21.9371 -21.4705 -21.4705 -21.3521 -21.3521 -9.5344 -9.5344 -7.9341 -7.9341 -5.9720 -5.9720 -5.8708 -5.8708 -5.3643 -5.3643 -5.3600 -5.3600 -0.8374 -0.8374 -0.5878 -0.5878 0.7005 0.7005 1.0126 1.0126 1.0655 1.0655 1.6465 1.6465 2.6826 2.6826 2.7818 2.7818 2.8012 2.8012 2.8525 2.8525 3.0238 3.0238 4.4042 4.4042 4.6065 4.6065 4.6870 4.6870 4.8530 4.8530 5.1061 5.1061 5.4362 5.4362 5.5417 5.5417 7.4229 7.4229 7.6073 7.6073 7.7780 7.7780 8.3744 8.3744 8.4572 8.4572 8.7156 8.7156 8.7396 8.7396 9.3134 9.3134 11.0225 11.0225 11.2536 11.2536 11.5194 11.5194 11.5694 11.5694 k = 0.5000 0.5000 0.2970 ( 10860 PWs) bands (ev): -45.3451 -45.3451 -45.3118 -45.3118 -23.9692 -23.9692 -23.7357 -23.7357 -22.0953 -22.0953 -21.9471 -21.9471 -21.4654 -21.4654 -21.3574 -21.3574 -9.4698 -9.4698 -8.0115 -8.0115 -5.9452 -5.9452 -5.8482 -5.8482 -5.3865 -5.3865 -5.3858 -5.3858 -0.8154 -0.8154 -0.5809 -0.5809 0.6741 0.6741 0.9643 0.9643 1.1163 1.1163 1.7236 1.7236 2.6518 2.6518 2.7507 2.7507 2.7610 2.7610 2.8140 2.8140 2.9619 2.9619 4.4532 4.4532 4.6459 4.6459 4.6543 4.6543 4.8233 4.8233 5.1136 5.1136 5.5245 5.5245 5.6303 5.6303 7.4824 7.4824 7.6539 7.6539 7.7656 7.7656 8.2781 8.2781 8.4448 8.4448 8.7116 8.7116 8.8119 8.8119 9.3315 9.3315 10.9532 10.9532 11.1882 11.1882 11.4415 11.4415 11.4870 11.4870 k = 0.5000 0.5000 0.3168 ( 10860 PWs) bands (ev): -45.3434 -45.3434 -45.3136 -45.3136 -23.9563 -23.9563 -23.7460 -23.7460 -22.0903 -22.0903 -21.9572 -21.9572 -21.4601 -21.4601 -21.3629 -21.3629 -9.4019 -9.4019 -8.0913 -8.0913 -5.9172 -5.9172 -5.8247 -5.8247 -5.4143 -5.4143 -5.4084 -5.4084 -0.7927 -0.7927 -0.5755 -0.5755 0.6508 0.6508 0.9170 0.9170 1.1700 1.1700 1.7912 1.7912 2.6247 2.6247 2.7237 2.7237 2.7238 2.7238 2.7841 2.7841 2.9089 2.9089 4.4998 4.4998 4.5363 4.5363 4.6802 4.6802 4.8564 4.8564 5.1335 5.1335 5.6125 5.6125 5.7175 5.7175 7.5452 7.5452 7.6602 7.6602 7.7948 7.7948 8.1814 8.1814 8.4286 8.4286 8.7034 8.7034 8.8810 8.8810 9.3449 9.3449 10.8935 10.8935 11.1244 11.1244 11.3735 11.3735 11.4142 11.4142 k = 0.5000 0.5000 0.3366 ( 10860 PWs) bands (ev): -45.3417 -45.3417 -45.3153 -45.3153 -23.9431 -23.9431 -23.7569 -23.7569 -22.0849 -22.0849 -21.9674 -21.9674 -21.4546 -21.4546 -21.3686 -21.3686 -9.3310 -9.3310 -8.1732 -8.1732 -5.8882 -5.8882 -5.8003 -5.8003 -5.4431 -5.4431 -5.4319 -5.4319 -0.7697 -0.7697 -0.5720 -0.5720 0.6313 0.6313 0.8714 0.8714 1.2265 1.2265 1.8436 1.8436 2.6014 2.6014 2.6897 2.6897 2.7007 2.7007 2.7643 2.7643 2.8695 2.8695 4.3953 4.3953 4.5436 4.5436 4.7089 4.7089 4.9022 4.9022 5.1535 5.1535 5.6991 5.6991 5.8019 5.8019 7.6108 7.6108 7.6359 7.6359 7.8562 7.8562 8.0858 8.0858 8.4079 8.4079 8.6897 8.6897 8.9465 8.9465 9.3537 9.3537 10.8436 10.8436 11.0633 11.0633 11.3173 11.3173 11.3530 11.3530 k = 0.5000 0.5000 0.3564 ( 10860 PWs) bands (ev): -45.3399 -45.3399 -45.3170 -45.3170 -23.9295 -23.9295 -23.7684 -23.7684 -22.0790 -22.0790 -21.9775 -21.9775 -21.4489 -21.4489 -21.3744 -21.3744 -9.2574 -9.2574 -8.2568 -8.2568 -5.8581 -5.8581 -5.7751 -5.7751 -5.4730 -5.4730 -5.4563 -5.4563 -0.7464 -0.7464 -0.5708 -0.5708 0.6162 0.6162 0.8278 0.8278 1.2855 1.2855 1.8751 1.8751 2.5820 2.5820 2.6588 2.6588 2.6812 2.6812 2.7501 2.7501 2.8548 2.8548 4.2479 4.2479 4.5845 4.5845 4.7320 4.7320 4.9483 4.9483 5.1699 5.1699 5.7829 5.7829 5.8815 5.8815 7.6044 7.6044 7.6789 7.6789 7.9239 7.9239 7.9960 7.9960 8.3818 8.3818 8.6694 8.6694 9.0078 9.0078 9.3576 9.3576 10.8037 10.8037 11.0054 11.0054 11.2744 11.2744 11.3052 11.3052 k = 0.5000 0.5000 0.3762 ( 10856 PWs) bands (ev): -45.3381 -45.3381 -45.3188 -45.3188 -23.9157 -23.9157 -23.7803 -23.7803 -22.0727 -22.0727 -21.9876 -21.9876 -21.4430 -21.4430 -21.3804 -21.3804 -9.1812 -9.1812 -8.3415 -8.3415 -5.8273 -5.8273 -5.7493 -5.7493 -5.5037 -5.5037 -5.4815 -5.4815 -0.7233 -0.7233 -0.5722 -0.5722 0.6059 0.6059 0.7868 0.7868 1.3468 1.3468 1.8825 1.8825 2.5665 2.5665 2.6314 2.6314 2.6653 2.6653 2.7312 2.7312 2.8786 2.8786 4.0984 4.0984 4.6219 4.6219 4.7492 4.7492 4.9921 4.9921 5.1811 5.1811 5.8623 5.8623 5.9541 5.9541 7.5737 7.5737 7.7488 7.7488 7.8940 7.8940 8.0109 8.0109 8.3496 8.3496 8.6416 8.6416 9.0646 9.0646 9.3565 9.3565 10.7737 10.7737 10.9517 10.9517 11.2459 11.2459 11.2725 11.2725 k = 0.5000 0.5000 0.3960 ( 10848 PWs) bands (ev): -45.3363 -45.3363 -45.3206 -45.3206 -23.9018 -23.9018 -23.7927 -23.7927 -22.0659 -22.0659 -21.9975 -21.9975 -21.4369 -21.4369 -21.3866 -21.3866 -9.1027 -9.1027 -8.4272 -8.4272 -5.7957 -5.7957 -5.7229 -5.7229 -5.5351 -5.5351 -5.5072 -5.5072 -0.7006 -0.7006 -0.5763 -0.5763 0.6008 0.6008 0.7487 0.7487 1.4100 1.4100 1.8671 1.8671 2.5550 2.5550 2.6075 2.6075 2.6531 2.6531 2.7086 2.7086 2.9384 2.9384 3.9490 3.9490 4.6558 4.6558 4.7605 4.7605 5.0325 5.0325 5.1867 5.1867 5.9354 5.9354 6.0170 6.0170 7.5481 7.5481 7.8101 7.8101 7.8197 7.8197 8.0866 8.0866 8.3110 8.3110 8.6058 8.6058 9.1167 9.1167 9.3504 9.3504 10.7537 10.7537 10.9027 10.9027 11.2326 11.2326 11.2557 11.2557 k = 0.5000 0.5000 0.4158 ( 10844 PWs) bands (ev): -45.3343 -45.3343 -45.3226 -45.3226 -23.8877 -23.8877 -23.8054 -23.8054 -22.0587 -22.0587 -22.0072 -22.0072 -21.4308 -21.4308 -21.3928 -21.3928 -9.0222 -9.0222 -8.5134 -8.5134 -5.7636 -5.7636 -5.6961 -5.6961 -5.5671 -5.5671 -5.5336 -5.5336 -0.6786 -0.6786 -0.5833 -0.5833 0.6011 0.6011 0.7141 0.7141 1.4746 1.4746 1.8333 1.8333 2.5476 2.5476 2.5873 2.5873 2.6451 2.6451 2.6874 2.6874 3.0247 3.0247 3.8010 3.8010 4.6856 4.6856 4.7659 4.7659 5.0690 5.0690 5.1865 5.1865 5.9998 5.9998 6.0670 6.0670 7.5312 7.5312 7.7316 7.7316 7.8908 7.8908 8.1641 8.1641 8.2659 8.2659 8.5618 8.5618 9.1639 9.1639 9.3393 9.3393 10.7434 10.7434 10.8591 10.8591 11.2347 11.2347 11.2553 11.2553 k = 0.5000 0.5000 0.4356 ( 10820 PWs) bands (ev): -45.3323 -45.3323 -45.3245 -45.3245 -23.8737 -23.8737 -23.8186 -23.8186 -22.0511 -22.0511 -22.0167 -22.0167 -21.4245 -21.4245 -21.3991 -21.3991 -8.9400 -8.9400 -8.5997 -8.5997 -5.7311 -5.7311 -5.6691 -5.6691 -5.5996 -5.5996 -5.5603 -5.5603 -0.6578 -0.6578 -0.5932 -0.5932 0.6070 0.6070 0.6833 0.6833 1.5400 1.5400 1.7862 1.7862 2.5442 2.5442 2.5708 2.5708 2.6413 2.6413 2.6696 2.6696 3.1300 3.1300 3.6556 3.6556 4.7112 4.7112 4.7656 4.7656 5.1012 5.1012 5.1804 5.1804 6.0529 6.0529 6.1011 6.1011 7.5264 7.5264 7.6624 7.6624 7.9612 7.9612 8.2145 8.2145 8.2407 8.2407 8.5099 8.5099 9.2060 9.2060 9.3230 9.3230 10.7424 10.7424 10.8214 10.8214 11.2523 11.2523 11.2714 11.2714 k = 0.5000 0.5000 0.4554 ( 10832 PWs) bands (ev): -45.3304 -45.3304 -45.3264 -45.3264 -23.8596 -23.8596 -23.8320 -23.8320 -22.0431 -22.0431 -22.0258 -22.0258 -21.4182 -21.4182 -21.4055 -21.4055 -8.8563 -8.8563 -8.6859 -8.6859 -5.6982 -5.6982 -5.6418 -5.6418 -5.6324 -5.6324 -5.5873 -5.5873 -0.6385 -0.6385 -0.6059 -0.6059 0.6184 0.6184 0.6569 0.6569 1.6053 1.6053 1.7304 1.7304 2.5449 2.5449 2.5582 2.5582 2.6418 2.6418 2.6560 2.6560 3.2489 3.2489 3.5140 3.5140 4.7323 4.7323 4.7597 4.7597 5.1287 5.1287 5.1686 5.1686 6.0918 6.0918 6.1171 6.1171 7.5365 7.5365 7.6054 7.6054 8.0299 8.0299 8.1575 8.1575 8.3149 8.3149 8.4507 8.4507 9.2431 9.2431 9.3015 9.3015 10.7502 10.7502 10.7903 10.7903 11.2847 11.2847 11.3033 11.3033 k = 0.5000 0.5000 0.4752 ( 10816 PWs) bands (ev): -45.3284 -45.3284 -45.3284 -45.3284 -23.8457 -23.8457 -23.8457 -23.8457 -22.0346 -22.0346 -22.0346 -22.0346 -21.4119 -21.4119 -21.4119 -21.4119 -8.7715 -8.7715 -8.7715 -8.7715 -5.6653 -5.6653 -5.6653 -5.6653 -5.6145 -5.6145 -5.6145 -5.6145 -0.6211 -0.6211 -0.6211 -0.6211 0.6351 0.6351 0.6351 0.6351 1.6693 1.6693 1.6693 1.6693 2.5496 2.5496 2.5496 2.5496 2.6467 2.6467 2.6467 2.6467 3.3778 3.3778 3.3778 3.3778 4.7485 4.7485 4.7485 4.7485 5.1513 5.1513 5.1513 5.1513 6.1138 6.1138 6.1138 6.1138 7.5629 7.5629 7.5629 7.5629 8.0956 8.0956 8.0956 8.0956 8.3853 8.3853 8.3853 8.3853 9.2749 9.2749 9.2749 9.2749 10.7664 10.7664 10.7664 10.7664 11.3312 11.3312 11.3312 11.3312 Writing output data file NbTe4.save init_run : 0.41s CPU 0.55s WALL ( 1 calls) electrons : 1140.86s CPU 1147.83s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.03s WALL ( 1 calls) potinit : 0.06s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 1140.84s CPU 1147.82s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.13s CPU 0.16s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.11s CPU 0.14s WALL ( 251 calls) cegterg : 1079.57s CPU 1085.67s WALL ( 649 calls) Called by sum_band: Called by *egterg: h_psi : 588.66s CPU 593.95s WALL ( 11194 calls) s_psi : 27.80s CPU 27.78s WALL ( 11194 calls) g_psi : 0.53s CPU 0.56s WALL ( 10294 calls) cdiaghg : 427.82s CPU 428.82s WALL ( 10545 calls) cegterg:over : 39.56s CPU 39.72s WALL ( 10294 calls) cegterg:upda : 23.45s CPU 23.32s WALL ( 10294 calls) cegterg:last : 13.32s CPU 13.41s WALL ( 1402 calls) cdiaghg:chol : 14.43s CPU 14.48s WALL ( 10545 calls) cdiaghg:inve : 11.55s CPU 11.63s WALL ( 10545 calls) cdiaghg:para : 37.51s CPU 37.71s WALL ( 21090 calls) Called by h_psi: h_psi:vloc : 523.12s CPU 528.15s WALL ( 11194 calls) h_psi:vnl : 64.88s CPU 65.13s WALL ( 11194 calls) add_vuspsi : 31.86s CPU 32.10s WALL ( 11194 calls) General routines calbec : 32.95s CPU 32.99s WALL ( 11194 calls) fft : 0.02s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 514.68s CPU 519.98s WALL ( 1450036 calls) interpolate : 0.01s CPU 0.00s WALL ( 4 calls) davcio : 0.24s CPU 0.43s WALL ( 502 calls) Parallel routines fft_scatter : 425.96s CPU 430.18s WALL ( 1450059 calls) PWSCF : 20m34.91s CPU 21m 1.81s WALL This run was terminated on: 8:39:10 1Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=