Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:46:32 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./KCuTe.save/ file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 38 25 7 2514 1343 209 Max 39 26 8 2522 1366 218 Sum 1369 913 253 90591 48765 7555 bravais-lattice index = 14 lattice parameter (alat) = 8.4282 a.u. unit-cell volume = 1156.6979 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 278.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.428178 celldm(2)= 1.000000 celldm(3)= 2.230942 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500000 0.866025 0.000000 ) a(3) = ( 0.000000 0.000000 2.230942 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 0.448241 ) PseudoPot. # 1 for K read from file: /users/gautes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 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 PseudoPot. # 3 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential K 9.00 39.09830 K( 1.00) Te 6.00 127.60000 Te( 1.00) Cu 11.00 63.54600 Cu( 1.00) 24 Sym. Ops., with inversion, found (12 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1154709 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 1 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 ) ( 1.1154709 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 60 deg rotation - cryst. axis [0,0,1] cryst. s( 5) = ( 1 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 5) = ( 0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1154709 ) isym = 6 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 6) = ( 0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1154709 ) isym = 7 120 deg rotation - cryst. axis [0,0,1] cryst. s( 7) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 8) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 9) = ( 0 -1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 9) = ( 0.5000000 -0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.1154709 ) isym = 10 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( 1 1 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(10) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.1154709 ) isym = 11 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(11) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 12 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(12) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 13 inversion cryst. s(13) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(13) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(14) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(14) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.1154709 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1154709 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s(16) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 17 inv. 60 deg rotation - cryst. axis [0,0,1] cryst. s(17) = ( -1 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(17) = ( -0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.1154709 ) isym = 18 inv. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(18) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(18) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.1154709 ) isym = 19 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s(19) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s(19) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 20 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(20) = ( 1 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(20) = ( 0.5000000 -0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 21 inv. 180 deg rotation - cryst. axis [1,-1,0] cryst. s(21) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(21) = ( -0.5000000 0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1154709 ) isym = 22 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(22) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(22) = ( -0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1154709 ) isym = 23 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(23) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(23) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 24 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(24) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(24) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_6h(6/mmm) there are 18 classes and 6 irreducible representations the character table: E -E 2C6 -2C6 2C3 -2C3 C2 3C2' 3C2'' i -i 2S3 -C2 -3C2' -3C2' G_7+ 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 1.73 G_8+ 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 -1.73 G_9+ 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 2.00 -2.00 0.00 G_7- 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 -1.73 G_8- 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 1.73 G_9- 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 -2.00 2.00 0.00 -2S3 2S6 -2S6 s_h 3s_v 3s_d -s_h -3s_v -3s_d G_7+ -1.73 1.00 -1.00 0.00 0.00 0.00 G_8+ 1.73 1.00 -1.00 0.00 0.00 0.00 G_9+ 0.00 -2.00 2.00 0.00 0.00 0.00 G_7- 1.73 -1.00 1.00 0.00 0.00 0.00 G_8- -1.73 -1.00 1.00 0.00 0.00 0.00 G_9- 0.00 2.00 -2.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C6 5 6 60 deg rotation - cryst. axis [0,0,1] -2C6 -5 -6 60 deg rotation - cryst. axis [0,0,1] E 2C3 7 8 120 deg rotation - cryst. axis [0,0,1] -2C3 -7 -8 120 deg rotation - cryst. axis [0,0,1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 3C2'-3C2' 4 -4 12 -11 11 -12 180 deg rotation - cart. axis [1,0,0] 3C2''-3C2' 3 -3 9 10 -10 -9 180 deg rotation - cart. axis [0,1,0] i 13 inversion -i -13 inversion E 2S3 17 18 inv. 60 deg rotation - cryst. axis [0,0,1] -2S3 -17 -18 inv. 60 deg rotation - cryst. axis [0,0,1] E 2S6 19 20 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -19 -20 inv. 120 deg rotation - cryst. axis [0,0,1] E s_h -s_h 14 -14 inv. 180 deg rotation - cart. axis [0,0,1] 3s_v-3s_v 16 -16 24 -23 23 -24 inv. 180 deg rotation - cart. axis [1,0,0] 3s_d-3s_d 15 -15 21 22 -22 -21 inv. 180 deg rotation - cart. axis [0,1,0] Cartesian axes number of k points= 281 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 2) = ( 0.0121951 0.0070409 -0.0000000), wk = 0.0035587 k( 3) = ( 0.0243902 0.0140817 -0.0000000), wk = 0.0035587 k( 4) = ( 0.0365854 0.0211226 -0.0000000), wk = 0.0035587 k( 5) = ( 0.0487805 0.0281634 -0.0000000), wk = 0.0035587 k( 6) = ( 0.0609756 0.0352043 -0.0000000), wk = 0.0035587 k( 7) = ( 0.0731707 0.0422451 -0.0000000), wk = 0.0035587 k( 8) = ( 0.0853658 0.0492860 -0.0000000), wk = 0.0035587 k( 9) = ( 0.0975610 0.0563269 -0.0000000), wk = 0.0035587 k( 10) = ( 0.1097561 0.0633677 -0.0000000), wk = 0.0035587 k( 11) = ( 0.1219512 0.0704086 -0.0000000), wk = 0.0035587 k( 12) = ( 0.1341463 0.0774494 -0.0000000), wk = 0.0035587 k( 13) = ( 0.1463415 0.0844903 -0.0000000), wk = 0.0035587 k( 14) = ( 0.1585366 0.0915311 -0.0000000), wk = 0.0035587 k( 15) = ( 0.1707317 0.0985720 -0.0000000), wk = 0.0035587 k( 16) = ( 0.1829268 0.1056129 -0.0000000), wk = 0.0035587 k( 17) = ( 0.1951219 0.1126537 -0.0000000), wk = 0.0035587 k( 18) = ( 0.2073171 0.1196946 -0.0000000), wk = 0.0035587 k( 19) = ( 0.2195122 0.1267354 -0.0000000), wk = 0.0035587 k( 20) = ( 0.2317073 0.1337763 -0.0000000), wk = 0.0035587 k( 21) = ( 0.2439024 0.1408171 -0.0000000), wk = 0.0035587 k( 22) = ( 0.2560976 0.1478580 -0.0000000), wk = 0.0035587 k( 23) = ( 0.2682927 0.1548989 -0.0000000), wk = 0.0035587 k( 24) = ( 0.2804878 0.1619397 -0.0000000), wk = 0.0035587 k( 25) = ( 0.2926829 0.1689806 -0.0000000), wk = 0.0035587 k( 26) = ( 0.3048781 0.1760214 -0.0000000), wk = 0.0035587 k( 27) = ( 0.3170732 0.1830623 -0.0000000), wk = 0.0035587 k( 28) = ( 0.3292683 0.1901031 -0.0000000), wk = 0.0035587 k( 29) = ( 0.3414634 0.1971440 -0.0000000), wk = 0.0035587 k( 30) = ( 0.3536585 0.2041849 -0.0000000), wk = 0.0035587 k( 31) = ( 0.3658537 0.2112257 -0.0000000), wk = 0.0035587 k( 32) = ( 0.3780488 0.2182666 -0.0000000), wk = 0.0035587 k( 33) = ( 0.3902439 0.2253074 -0.0000000), wk = 0.0035587 k( 34) = ( 0.4024390 0.2323483 -0.0000000), wk = 0.0035587 k( 35) = ( 0.4146341 0.2393891 -0.0000000), wk = 0.0035587 k( 36) = ( 0.4268293 0.2464300 -0.0000000), wk = 0.0035587 k( 37) = ( 0.4390244 0.2534708 -0.0000000), wk = 0.0035587 k( 38) = ( 0.4512195 0.2605117 -0.0000000), wk = 0.0035587 k( 39) = ( 0.4634146 0.2675526 -0.0000000), wk = 0.0035587 k( 40) = ( 0.4756098 0.2745934 -0.0000000), wk = 0.0035587 k( 41) = ( 0.4878049 0.2816343 -0.0000000), wk = 0.0035587 k( 42) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035587 k( 43) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035587 k( 44) = ( 0.4930556 0.3007033 -0.0000000), wk = 0.0035587 k( 45) = ( 0.4861111 0.3127314 -0.0000000), wk = 0.0035587 k( 46) = ( 0.4791667 0.3247595 -0.0000000), wk = 0.0035587 k( 47) = ( 0.4722222 0.3367877 -0.0000000), wk = 0.0035587 k( 48) = ( 0.4652778 0.3488158 -0.0000000), wk = 0.0035587 k( 49) = ( 0.4583333 0.3608439 -0.0000000), wk = 0.0035587 k( 50) = ( 0.4513889 0.3728720 -0.0000000), wk = 0.0035587 k( 51) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0035587 k( 52) = ( 0.4375000 0.3969283 -0.0000000), wk = 0.0035587 k( 53) = ( 0.4305556 0.4089564 -0.0000000), wk = 0.0035587 k( 54) = ( 0.4236111 0.4209846 -0.0000000), wk = 0.0035587 k( 55) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0035587 k( 56) = ( 0.4097222 0.4450408 -0.0000000), wk = 0.0035587 k( 57) = ( 0.4027778 0.4570690 -0.0000000), wk = 0.0035587 k( 58) = ( 0.3958333 0.4690971 -0.0000000), wk = 0.0035587 k( 59) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0035587 k( 60) = ( 0.3819444 0.4931534 -0.0000000), wk = 0.0035587 k( 61) = ( 0.3750000 0.5051815 -0.0000000), wk = 0.0035587 k( 62) = ( 0.3680556 0.5172096 -0.0000000), wk = 0.0035587 k( 63) = ( 0.3611111 0.5292377 -0.0000000), wk = 0.0035587 k( 64) = ( 0.3541667 0.5412659 -0.0000000), wk = 0.0035587 k( 65) = ( 0.3472222 0.5532940 -0.0000000), wk = 0.0035587 k( 66) = ( 0.3402778 0.5653221 -0.0000000), wk = 0.0035587 k( 67) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035587 k( 68) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035587 k( 69) = ( 0.3262411 0.5650662 -0.0000000), wk = 0.0035587 k( 70) = ( 0.3191489 0.5527822 -0.0000000), wk = 0.0035587 k( 71) = ( 0.3120567 0.5404981 -0.0000000), wk = 0.0035587 k( 72) = ( 0.3049645 0.5282141 -0.0000000), wk = 0.0035587 k( 73) = ( 0.2978723 0.5159300 -0.0000000), wk = 0.0035587 k( 74) = ( 0.2907801 0.5036460 -0.0000000), wk = 0.0035587 k( 75) = ( 0.2836879 0.4913619 -0.0000000), wk = 0.0035587 k( 76) = ( 0.2765957 0.4790779 -0.0000000), wk = 0.0035587 k( 77) = ( 0.2695035 0.4667938 -0.0000000), wk = 0.0035587 k( 78) = ( 0.2624113 0.4545098 -0.0000000), wk = 0.0035587 k( 79) = ( 0.2553191 0.4422257 -0.0000000), wk = 0.0035587 k( 80) = ( 0.2482270 0.4299417 -0.0000000), wk = 0.0035587 k( 81) = ( 0.2411348 0.4176576 -0.0000000), wk = 0.0035587 k( 82) = ( 0.2340425 0.4053736 -0.0000000), wk = 0.0035587 k( 83) = ( 0.2269503 0.3930895 -0.0000000), wk = 0.0035587 k( 84) = ( 0.2198582 0.3808055 -0.0000000), wk = 0.0035587 k( 85) = ( 0.2127660 0.3685215 -0.0000000), wk = 0.0035587 k( 86) = ( 0.2056738 0.3562374 -0.0000000), wk = 0.0035587 k( 87) = ( 0.1985816 0.3439534 -0.0000000), wk = 0.0035587 k( 88) = ( 0.1914894 0.3316693 -0.0000000), wk = 0.0035587 k( 89) = ( 0.1843972 0.3193852 -0.0000000), wk = 0.0035587 k( 90) = ( 0.1773050 0.3071012 -0.0000000), wk = 0.0035587 k( 91) = ( 0.1702128 0.2948172 -0.0000000), wk = 0.0035587 k( 92) = ( 0.1631206 0.2825331 -0.0000000), wk = 0.0035587 k( 93) = ( 0.1560284 0.2702491 -0.0000000), wk = 0.0035587 k( 94) = ( 0.1489362 0.2579650 -0.0000000), wk = 0.0035587 k( 95) = ( 0.1418440 0.2456810 -0.0000000), wk = 0.0035587 k( 96) = ( 0.1347518 0.2333969 -0.0000000), wk = 0.0035587 k( 97) = ( 0.1276596 0.2211129 -0.0000000), wk = 0.0035587 k( 98) = ( 0.1205674 0.2088288 -0.0000000), wk = 0.0035587 k( 99) = ( 0.1134752 0.1965448 -0.0000000), wk = 0.0035587 k( 100) = ( 0.1063830 0.1842607 -0.0000000), wk = 0.0035587 k( 101) = ( 0.0992908 0.1719767 -0.0000000), wk = 0.0035587 k( 102) = ( 0.0921986 0.1596926 -0.0000000), wk = 0.0035587 k( 103) = ( 0.0851064 0.1474086 -0.0000000), wk = 0.0035587 k( 104) = ( 0.0780142 0.1351245 -0.0000000), wk = 0.0035587 k( 105) = ( 0.0709220 0.1228405 -0.0000000), wk = 0.0035587 k( 106) = ( 0.0638298 0.1105564 -0.0000000), wk = 0.0035587 k( 107) = ( 0.0567376 0.0982724 -0.0000000), wk = 0.0035587 k( 108) = ( 0.0496454 0.0859883 -0.0000000), wk = 0.0035587 k( 109) = ( 0.0425532 0.0737043 -0.0000000), wk = 0.0035587 k( 110) = ( 0.0354610 0.0614202 -0.0000000), wk = 0.0035587 k( 111) = ( 0.0283688 0.0491362 -0.0000000), wk = 0.0035587 k( 112) = ( 0.0212766 0.0368522 -0.0000000), wk = 0.0035587 k( 113) = ( 0.0141844 0.0245681 -0.0000000), wk = 0.0035587 k( 114) = ( 0.0070922 0.0122841 -0.0000000), wk = 0.0035587 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 117) = ( 0.0000000 0.0000000 0.0140075), wk = 0.0035587 k( 118) = ( 0.0000000 0.0000000 0.0280151), wk = 0.0035587 k( 119) = ( 0.0000000 0.0000000 0.0420226), wk = 0.0035587 k( 120) = ( 0.0000000 0.0000000 0.0560302), wk = 0.0035587 k( 121) = ( 0.0000000 0.0000000 0.0700377), wk = 0.0035587 k( 122) = ( 0.0000000 0.0000000 0.0840452), wk = 0.0035587 k( 123) = ( 0.0000000 0.0000000 0.0980528), wk = 0.0035587 k( 124) = ( 0.0000000 0.0000000 0.1120603), wk = 0.0035587 k( 125) = ( 0.0000000 0.0000000 0.1260678), wk = 0.0035587 k( 126) = ( 0.0000000 0.0000000 0.1400754), wk = 0.0035587 k( 127) = ( 0.0000000 0.0000000 0.1540829), wk = 0.0035587 k( 128) = ( 0.0000000 0.0000000 0.1680905), wk = 0.0035587 k( 129) = ( 0.0000000 0.0000000 0.1820980), wk = 0.0035587 k( 130) = ( 0.0000000 0.0000000 0.1961055), wk = 0.0035587 k( 131) = ( 0.0000000 0.0000000 0.2101131), wk = 0.0035587 k( 132) = ( 0.0000000 0.0000000 0.2241206), wk = 0.0035587 k( 133) = ( 0.0000000 0.0000000 0.2241206), wk = 0.0035587 k( 134) = ( 0.0121951 0.0070409 0.2241206), wk = 0.0035587 k( 135) = ( 0.0243902 0.0140817 0.2241206), wk = 0.0035587 k( 136) = ( 0.0365854 0.0211226 0.2241206), wk = 0.0035587 k( 137) = ( 0.0487805 0.0281634 0.2241206), wk = 0.0035587 k( 138) = ( 0.0609756 0.0352043 0.2241206), wk = 0.0035587 k( 139) = ( 0.0731707 0.0422451 0.2241206), wk = 0.0035587 k( 140) = ( 0.0853658 0.0492860 0.2241206), wk = 0.0035587 k( 141) = ( 0.0975610 0.0563269 0.2241206), wk = 0.0035587 k( 142) = ( 0.1097561 0.0633677 0.2241206), wk = 0.0035587 k( 143) = ( 0.1219512 0.0704086 0.2241206), wk = 0.0035587 k( 144) = ( 0.1341463 0.0774494 0.2241206), wk = 0.0035587 k( 145) = ( 0.1463415 0.0844903 0.2241206), wk = 0.0035587 k( 146) = ( 0.1585366 0.0915311 0.2241206), wk = 0.0035587 k( 147) = ( 0.1707317 0.0985720 0.2241206), wk = 0.0035587 k( 148) = ( 0.1829268 0.1056129 0.2241206), wk = 0.0035587 k( 149) = ( 0.1951219 0.1126537 0.2241206), wk = 0.0035587 k( 150) = ( 0.2073171 0.1196946 0.2241206), wk = 0.0035587 k( 151) = ( 0.2195122 0.1267354 0.2241206), wk = 0.0035587 k( 152) = ( 0.2317073 0.1337763 0.2241206), wk = 0.0035587 k( 153) = ( 0.2439024 0.1408171 0.2241206), wk = 0.0035587 k( 154) = ( 0.2560976 0.1478580 0.2241206), wk = 0.0035587 k( 155) = ( 0.2682927 0.1548989 0.2241206), wk = 0.0035587 k( 156) = ( 0.2804878 0.1619397 0.2241206), wk = 0.0035587 k( 157) = ( 0.2926829 0.1689806 0.2241206), wk = 0.0035587 k( 158) = ( 0.3048781 0.1760214 0.2241206), wk = 0.0035587 k( 159) = ( 0.3170732 0.1830623 0.2241206), wk = 0.0035587 k( 160) = ( 0.3292683 0.1901031 0.2241206), wk = 0.0035587 k( 161) = ( 0.3414634 0.1971440 0.2241206), wk = 0.0035587 k( 162) = ( 0.3536585 0.2041849 0.2241206), wk = 0.0035587 k( 163) = ( 0.3658537 0.2112257 0.2241206), wk = 0.0035587 k( 164) = ( 0.3780488 0.2182666 0.2241206), wk = 0.0035587 k( 165) = ( 0.3902439 0.2253074 0.2241206), wk = 0.0035587 k( 166) = ( 0.4024390 0.2323483 0.2241206), wk = 0.0035587 k( 167) = ( 0.4146341 0.2393891 0.2241206), wk = 0.0035587 k( 168) = ( 0.4268293 0.2464300 0.2241206), wk = 0.0035587 k( 169) = ( 0.4390244 0.2534708 0.2241206), wk = 0.0035587 k( 170) = ( 0.4512195 0.2605117 0.2241206), wk = 0.0035587 k( 171) = ( 0.4634146 0.2675526 0.2241206), wk = 0.0035587 k( 172) = ( 0.4756098 0.2745934 0.2241206), wk = 0.0035587 k( 173) = ( 0.4878049 0.2816343 0.2241206), wk = 0.0035587 k( 174) = ( 0.5000000 0.2886751 0.2241206), wk = 0.0035587 k( 175) = ( 0.5000000 0.2886751 0.2241206), wk = 0.0035587 k( 176) = ( 0.4930556 0.3007033 0.2241206), wk = 0.0035587 k( 177) = ( 0.4861111 0.3127314 0.2241206), wk = 0.0035587 k( 178) = ( 0.4791667 0.3247595 0.2241206), wk = 0.0035587 k( 179) = ( 0.4722222 0.3367877 0.2241206), wk = 0.0035587 k( 180) = ( 0.4652778 0.3488158 0.2241206), wk = 0.0035587 k( 181) = ( 0.4583333 0.3608439 0.2241206), wk = 0.0035587 k( 182) = ( 0.4513889 0.3728720 0.2241206), wk = 0.0035587 k( 183) = ( 0.4444444 0.3849002 0.2241206), wk = 0.0035587 k( 184) = ( 0.4375000 0.3969283 0.2241206), wk = 0.0035587 k( 185) = ( 0.4305556 0.4089564 0.2241206), wk = 0.0035587 k( 186) = ( 0.4236111 0.4209846 0.2241206), wk = 0.0035587 k( 187) = ( 0.4166667 0.4330127 0.2241206), wk = 0.0035587 k( 188) = ( 0.4097222 0.4450408 0.2241206), wk = 0.0035587 k( 189) = ( 0.4027778 0.4570690 0.2241206), wk = 0.0035587 k( 190) = ( 0.3958333 0.4690971 0.2241206), wk = 0.0035587 k( 191) = ( 0.3888889 0.4811252 0.2241206), wk = 0.0035587 k( 192) = ( 0.3819444 0.4931534 0.2241206), wk = 0.0035587 k( 193) = ( 0.3750000 0.5051815 0.2241206), wk = 0.0035587 k( 194) = ( 0.3680556 0.5172096 0.2241206), wk = 0.0035587 k( 195) = ( 0.3611111 0.5292377 0.2241206), wk = 0.0035587 k( 196) = ( 0.3541667 0.5412659 0.2241206), wk = 0.0035587 k( 197) = ( 0.3472222 0.5532940 0.2241206), wk = 0.0035587 k( 198) = ( 0.3402778 0.5653221 0.2241206), wk = 0.0035587 k( 199) = ( 0.3333333 0.5773503 0.2241206), wk = 0.0035587 k( 200) = ( 0.3333333 0.5773503 0.2241206), wk = 0.0035587 k( 201) = ( 0.3262411 0.5650662 0.2241206), wk = 0.0035587 k( 202) = ( 0.3191489 0.5527822 0.2241206), wk = 0.0035587 k( 203) = ( 0.3120567 0.5404981 0.2241206), wk = 0.0035587 k( 204) = ( 0.3049645 0.5282141 0.2241206), wk = 0.0035587 k( 205) = ( 0.2978723 0.5159300 0.2241206), wk = 0.0035587 k( 206) = ( 0.2907801 0.5036460 0.2241206), wk = 0.0035587 k( 207) = ( 0.2836879 0.4913619 0.2241206), wk = 0.0035587 k( 208) = ( 0.2765957 0.4790779 0.2241206), wk = 0.0035587 k( 209) = ( 0.2695035 0.4667938 0.2241206), wk = 0.0035587 k( 210) = ( 0.2624113 0.4545098 0.2241206), wk = 0.0035587 k( 211) = ( 0.2553191 0.4422257 0.2241206), wk = 0.0035587 k( 212) = ( 0.2482270 0.4299417 0.2241206), wk = 0.0035587 k( 213) = ( 0.2411348 0.4176576 0.2241206), wk = 0.0035587 k( 214) = ( 0.2340425 0.4053736 0.2241206), wk = 0.0035587 k( 215) = ( 0.2269503 0.3930895 0.2241206), wk = 0.0035587 k( 216) = ( 0.2198582 0.3808055 0.2241206), wk = 0.0035587 k( 217) = ( 0.2127660 0.3685215 0.2241206), wk = 0.0035587 k( 218) = ( 0.2056738 0.3562374 0.2241206), wk = 0.0035587 k( 219) = ( 0.1985816 0.3439534 0.2241206), wk = 0.0035587 k( 220) = ( 0.1914894 0.3316693 0.2241206), wk = 0.0035587 k( 221) = ( 0.1843972 0.3193852 0.2241206), wk = 0.0035587 k( 222) = ( 0.1773050 0.3071012 0.2241206), wk = 0.0035587 k( 223) = ( 0.1702128 0.2948172 0.2241206), wk = 0.0035587 k( 224) = ( 0.1631206 0.2825331 0.2241206), wk = 0.0035587 k( 225) = ( 0.1560284 0.2702491 0.2241206), wk = 0.0035587 k( 226) = ( 0.1489362 0.2579650 0.2241206), wk = 0.0035587 k( 227) = ( 0.1418440 0.2456810 0.2241206), wk = 0.0035587 k( 228) = ( 0.1347518 0.2333969 0.2241206), wk = 0.0035587 k( 229) = ( 0.1276596 0.2211129 0.2241206), wk = 0.0035587 k( 230) = ( 0.1205674 0.2088288 0.2241206), wk = 0.0035587 k( 231) = ( 0.1134752 0.1965448 0.2241206), wk = 0.0035587 k( 232) = ( 0.1063830 0.1842607 0.2241206), wk = 0.0035587 k( 233) = ( 0.0992908 0.1719767 0.2241206), wk = 0.0035587 k( 234) = ( 0.0921986 0.1596926 0.2241206), wk = 0.0035587 k( 235) = ( 0.0851064 0.1474086 0.2241206), wk = 0.0035587 k( 236) = ( 0.0780142 0.1351245 0.2241206), wk = 0.0035587 k( 237) = ( 0.0709220 0.1228405 0.2241206), wk = 0.0035587 k( 238) = ( 0.0638298 0.1105564 0.2241206), wk = 0.0035587 k( 239) = ( 0.0567376 0.0982724 0.2241206), wk = 0.0035587 k( 240) = ( 0.0496454 0.0859883 0.2241206), wk = 0.0035587 k( 241) = ( 0.0425532 0.0737043 0.2241206), wk = 0.0035587 k( 242) = ( 0.0354610 0.0614202 0.2241206), wk = 0.0035587 k( 243) = ( 0.0283688 0.0491362 0.2241206), wk = 0.0035587 k( 244) = ( 0.0212766 0.0368522 0.2241206), wk = 0.0035587 k( 245) = ( 0.0141844 0.0245681 0.2241206), wk = 0.0035587 k( 246) = ( 0.0070922 0.0122841 0.2241206), wk = 0.0035587 k( 247) = ( 0.0000000 0.0000000 0.2241206), wk = 0.0035587 k( 248) = ( 0.5000000 0.2886751 0.2241206), wk = 0.0035587 k( 249) = ( 0.5000000 0.2886751 0.2101131), wk = 0.0035587 k( 250) = ( 0.5000000 0.2886751 0.1961055), wk = 0.0035587 k( 251) = ( 0.5000000 0.2886751 0.1820980), wk = 0.0035587 k( 252) = ( 0.5000000 0.2886751 0.1680905), wk = 0.0035587 k( 253) = ( 0.5000000 0.2886751 0.1540829), wk = 0.0035587 k( 254) = ( 0.5000000 0.2886751 0.1400754), wk = 0.0035587 k( 255) = ( 0.5000000 0.2886751 0.1260678), wk = 0.0035587 k( 256) = ( 0.5000000 0.2886751 0.1120603), wk = 0.0035587 k( 257) = ( 0.5000000 0.2886751 0.0980528), wk = 0.0035587 k( 258) = ( 0.5000000 0.2886751 0.0840452), wk = 0.0035587 k( 259) = ( 0.5000000 0.2886751 0.0700377), wk = 0.0035587 k( 260) = ( 0.5000000 0.2886751 0.0560302), wk = 0.0035587 k( 261) = ( 0.5000000 0.2886751 0.0420226), wk = 0.0035587 k( 262) = ( 0.5000000 0.2886751 0.0280151), wk = 0.0035587 k( 263) = ( 0.5000000 0.2886751 0.0140075), wk = 0.0035587 k( 264) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035587 k( 265) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035587 k( 266) = ( 0.3333333 0.5773503 0.0140075), wk = 0.0035587 k( 267) = ( 0.3333333 0.5773503 0.0280151), wk = 0.0035587 k( 268) = ( 0.3333333 0.5773503 0.0420226), wk = 0.0035587 k( 269) = ( 0.3333333 0.5773503 0.0560302), wk = 0.0035587 k( 270) = ( 0.3333333 0.5773503 0.0700377), wk = 0.0035587 k( 271) = ( 0.3333333 0.5773503 0.0840452), wk = 0.0035587 k( 272) = ( 0.3333333 0.5773503 0.0980528), wk = 0.0035587 k( 273) = ( 0.3333333 0.5773503 0.1120603), wk = 0.0035587 k( 274) = ( 0.3333333 0.5773503 0.1260678), wk = 0.0035587 k( 275) = ( 0.3333333 0.5773503 0.1400754), wk = 0.0035587 k( 276) = ( 0.3333333 0.5773503 0.1540829), wk = 0.0035587 k( 277) = ( 0.3333333 0.5773503 0.1680905), wk = 0.0035587 k( 278) = ( 0.3333333 0.5773503 0.1820980), wk = 0.0035587 k( 279) = ( 0.3333333 0.5773503 0.1961055), wk = 0.0035587 k( 280) = ( 0.3333333 0.5773503 0.2101131), wk = 0.0035587 k( 281) = ( 0.3333333 0.5773503 0.2241206), wk = 0.0035587 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 2) = ( 0.0121951 -0.0000000 -0.0000000), wk = 0.0035587 k( 3) = ( 0.0243902 -0.0000000 -0.0000000), wk = 0.0035587 k( 4) = ( 0.0365854 0.0000000 0.0000000), wk = 0.0035587 k( 5) = ( 0.0487805 0.0000000 -0.0000000), wk = 0.0035587 k( 6) = ( 0.0609756 -0.0000000 -0.0000000), wk = 0.0035587 k( 7) = ( 0.0731707 0.0000000 -0.0000000), wk = 0.0035587 k( 8) = ( 0.0853658 0.0000000 0.0000000), wk = 0.0035587 k( 9) = ( 0.0975610 0.0000000 -0.0000000), wk = 0.0035587 k( 10) = ( 0.1097561 0.0000000 -0.0000000), wk = 0.0035587 k( 11) = ( 0.1219512 -0.0000000 -0.0000000), wk = 0.0035587 k( 12) = ( 0.1341463 0.0000000 0.0000000), wk = 0.0035587 k( 13) = ( 0.1463415 0.0000000 -0.0000000), wk = 0.0035587 k( 14) = ( 0.1585366 -0.0000000 -0.0000000), wk = 0.0035587 k( 15) = ( 0.1707317 0.0000000 -0.0000000), wk = 0.0035587 k( 16) = ( 0.1829268 -0.0000000 -0.0000000), wk = 0.0035587 k( 17) = ( 0.1951219 0.0000000 -0.0000000), wk = 0.0035587 k( 18) = ( 0.2073171 -0.0000000 -0.0000000), wk = 0.0035587 k( 19) = ( 0.2195122 0.0000000 -0.0000000), wk = 0.0035587 k( 20) = ( 0.2317073 -0.0000000 -0.0000000), wk = 0.0035587 k( 21) = ( 0.2439024 -0.0000000 -0.0000000), wk = 0.0035587 k( 22) = ( 0.2560976 0.0000000 -0.0000000), wk = 0.0035587 k( 23) = ( 0.2682927 0.0000000 0.0000000), wk = 0.0035587 k( 24) = ( 0.2804878 0.0000000 -0.0000000), wk = 0.0035587 k( 25) = ( 0.2926829 -0.0000000 -0.0000000), wk = 0.0035587 k( 26) = ( 0.3048781 -0.0000000 -0.0000000), wk = 0.0035587 k( 27) = ( 0.3170732 0.0000000 0.0000000), wk = 0.0035587 k( 28) = ( 0.3292683 0.0000000 -0.0000000), wk = 0.0035587 k( 29) = ( 0.3414634 -0.0000000 -0.0000000), wk = 0.0035587 k( 30) = ( 0.3536585 0.0000000 -0.0000000), wk = 0.0035587 k( 31) = ( 0.3658537 -0.0000000 -0.0000000), wk = 0.0035587 k( 32) = ( 0.3780488 -0.0000000 -0.0000000), wk = 0.0035587 k( 33) = ( 0.3902439 0.0000000 -0.0000000), wk = 0.0035587 k( 34) = ( 0.4024390 -0.0000000 -0.0000000), wk = 0.0035587 k( 35) = ( 0.4146341 -0.0000000 -0.0000000), wk = 0.0035587 k( 36) = ( 0.4268293 -0.0000000 0.0000000), wk = 0.0035587 k( 37) = ( 0.4390244 -0.0000000 -0.0000000), wk = 0.0035587 k( 38) = ( 0.4512195 -0.0000000 -0.0000000), wk = 0.0035587 k( 39) = ( 0.4634146 -0.0000000 0.0000000), wk = 0.0035587 k( 40) = ( 0.4756098 -0.0000000 -0.0000000), wk = 0.0035587 k( 41) = ( 0.4878049 -0.0000000 -0.0000000), wk = 0.0035587 k( 42) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035587 k( 43) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035587 k( 44) = ( 0.4930556 0.0138889 -0.0000000), wk = 0.0035587 k( 45) = ( 0.4861111 0.0277778 -0.0000000), wk = 0.0035587 k( 46) = ( 0.4791667 0.0416667 -0.0000000), wk = 0.0035587 k( 47) = ( 0.4722222 0.0555556 -0.0000000), wk = 0.0035587 k( 48) = ( 0.4652778 0.0694444 0.0000000), wk = 0.0035587 k( 49) = ( 0.4583333 0.0833333 -0.0000000), wk = 0.0035587 k( 50) = ( 0.4513889 0.0972222 -0.0000000), wk = 0.0035587 k( 51) = ( 0.4444444 0.1111111 -0.0000000), wk = 0.0035587 k( 52) = ( 0.4375000 0.1250000 -0.0000000), wk = 0.0035587 k( 53) = ( 0.4305556 0.1388889 0.0000000), wk = 0.0035587 k( 54) = ( 0.4236111 0.1527778 -0.0000000), wk = 0.0035587 k( 55) = ( 0.4166667 0.1666667 0.0000000), wk = 0.0035587 k( 56) = ( 0.4097222 0.1805556 0.0000000), wk = 0.0035587 k( 57) = ( 0.4027778 0.1944444 0.0000000), wk = 0.0035587 k( 58) = ( 0.3958333 0.2083333 -0.0000000), wk = 0.0035587 k( 59) = ( 0.3888889 0.2222222 -0.0000000), wk = 0.0035587 k( 60) = ( 0.3819444 0.2361111 -0.0000000), wk = 0.0035587 k( 61) = ( 0.3750000 0.2500000 -0.0000000), wk = 0.0035587 k( 62) = ( 0.3680556 0.2638889 0.0000000), wk = 0.0035587 k( 63) = ( 0.3611111 0.2777778 -0.0000000), wk = 0.0035587 k( 64) = ( 0.3541667 0.2916667 -0.0000000), wk = 0.0035587 k( 65) = ( 0.3472222 0.3055556 0.0000000), wk = 0.0035587 k( 66) = ( 0.3402778 0.3194444 -0.0000000), wk = 0.0035587 k( 67) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0035587 k( 68) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0035587 k( 69) = ( 0.3262411 0.3262411 0.0000000), wk = 0.0035587 k( 70) = ( 0.3191489 0.3191489 0.0000000), wk = 0.0035587 k( 71) = ( 0.3120567 0.3120567 -0.0000000), wk = 0.0035587 k( 72) = ( 0.3049645 0.3049645 -0.0000000), wk = 0.0035587 k( 73) = ( 0.2978723 0.2978723 -0.0000000), wk = 0.0035587 k( 74) = ( 0.2907801 0.2907801 -0.0000000), wk = 0.0035587 k( 75) = ( 0.2836879 0.2836879 0.0000000), wk = 0.0035587 k( 76) = ( 0.2765957 0.2765957 0.0000000), wk = 0.0035587 k( 77) = ( 0.2695035 0.2695035 -0.0000000), wk = 0.0035587 k( 78) = ( 0.2624113 0.2624113 -0.0000000), wk = 0.0035587 k( 79) = ( 0.2553191 0.2553191 -0.0000000), wk = 0.0035587 k( 80) = ( 0.2482270 0.2482270 0.0000000), wk = 0.0035587 k( 81) = ( 0.2411348 0.2411347 -0.0000000), wk = 0.0035587 k( 82) = ( 0.2340425 0.2340425 -0.0000000), wk = 0.0035587 k( 83) = ( 0.2269503 0.2269503 -0.0000000), wk = 0.0035587 k( 84) = ( 0.2198582 0.2198582 -0.0000000), wk = 0.0035587 k( 85) = ( 0.2127660 0.2127660 -0.0000000), wk = 0.0035587 k( 86) = ( 0.2056738 0.2056738 0.0000000), wk = 0.0035587 k( 87) = ( 0.1985816 0.1985816 -0.0000000), wk = 0.0035587 k( 88) = ( 0.1914894 0.1914894 -0.0000000), wk = 0.0035587 k( 89) = ( 0.1843972 0.1843972 -0.0000000), wk = 0.0035587 k( 90) = ( 0.1773050 0.1773050 0.0000000), wk = 0.0035587 k( 91) = ( 0.1702128 0.1702128 -0.0000000), wk = 0.0035587 k( 92) = ( 0.1631206 0.1631206 0.0000000), wk = 0.0035587 k( 93) = ( 0.1560284 0.1560284 -0.0000000), wk = 0.0035587 k( 94) = ( 0.1489362 0.1489362 -0.0000000), wk = 0.0035587 k( 95) = ( 0.1418440 0.1418440 0.0000000), wk = 0.0035587 k( 96) = ( 0.1347518 0.1347518 0.0000000), wk = 0.0035587 k( 97) = ( 0.1276596 0.1276596 -0.0000000), wk = 0.0035587 k( 98) = ( 0.1205674 0.1205674 -0.0000000), wk = 0.0035587 k( 99) = ( 0.1134752 0.1134752 -0.0000000), wk = 0.0035587 k( 100) = ( 0.1063830 0.1063830 -0.0000000), wk = 0.0035587 k( 101) = ( 0.0992908 0.0992908 -0.0000000), wk = 0.0035587 k( 102) = ( 0.0921986 0.0921986 -0.0000000), wk = 0.0035587 k( 103) = ( 0.0851064 0.0851064 0.0000000), wk = 0.0035587 k( 104) = ( 0.0780142 0.0780142 0.0000000), wk = 0.0035587 k( 105) = ( 0.0709220 0.0709220 -0.0000000), wk = 0.0035587 k( 106) = ( 0.0638298 0.0638298 -0.0000000), wk = 0.0035587 k( 107) = ( 0.0567376 0.0567376 -0.0000000), wk = 0.0035587 k( 108) = ( 0.0496454 0.0496454 -0.0000000), wk = 0.0035587 k( 109) = ( 0.0425532 0.0425532 0.0000000), wk = 0.0035587 k( 110) = ( 0.0354610 0.0354610 -0.0000000), wk = 0.0035587 k( 111) = ( 0.0283688 0.0283688 0.0000000), wk = 0.0035587 k( 112) = ( 0.0212766 0.0212766 0.0000000), wk = 0.0035587 k( 113) = ( 0.0141844 0.0141844 0.0000000), wk = 0.0035587 k( 114) = ( 0.0070922 0.0070922 0.0000000), wk = 0.0035587 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 117) = ( 0.0000000 0.0000000 0.0312500), wk = 0.0035587 k( 118) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0035587 k( 119) = ( 0.0000000 0.0000000 0.0937500), wk = 0.0035587 k( 120) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0035587 k( 121) = ( 0.0000000 0.0000000 0.1562500), wk = 0.0035587 k( 122) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0035587 k( 123) = ( 0.0000000 0.0000000 0.2187500), wk = 0.0035587 k( 124) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0035587 k( 125) = ( 0.0000000 0.0000000 0.2812500), wk = 0.0035587 k( 126) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0035587 k( 127) = ( 0.0000000 0.0000000 0.3437500), wk = 0.0035587 k( 128) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0035587 k( 129) = ( 0.0000000 0.0000000 0.4062500), wk = 0.0035587 k( 130) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0035587 k( 131) = ( 0.0000000 0.0000000 0.4687500), wk = 0.0035587 k( 132) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035587 k( 133) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035587 k( 134) = ( 0.0121951 -0.0000000 0.5000000), wk = 0.0035587 k( 135) = ( 0.0243902 -0.0000000 0.5000000), wk = 0.0035587 k( 136) = ( 0.0365854 0.0000000 0.5000000), wk = 0.0035587 k( 137) = ( 0.0487805 0.0000000 0.5000000), wk = 0.0035587 k( 138) = ( 0.0609756 -0.0000000 0.5000000), wk = 0.0035587 k( 139) = ( 0.0731707 0.0000000 0.5000000), wk = 0.0035587 k( 140) = ( 0.0853658 0.0000000 0.5000000), wk = 0.0035587 k( 141) = ( 0.0975610 0.0000000 0.5000000), wk = 0.0035587 k( 142) = ( 0.1097561 0.0000000 0.5000000), wk = 0.0035587 k( 143) = ( 0.1219512 -0.0000000 0.5000000), wk = 0.0035587 k( 144) = ( 0.1341463 0.0000000 0.5000000), wk = 0.0035587 k( 145) = ( 0.1463415 0.0000000 0.5000000), wk = 0.0035587 k( 146) = ( 0.1585366 -0.0000000 0.5000000), wk = 0.0035587 k( 147) = ( 0.1707317 0.0000000 0.5000000), wk = 0.0035587 k( 148) = ( 0.1829268 -0.0000000 0.5000000), wk = 0.0035587 k( 149) = ( 0.1951219 0.0000000 0.5000000), wk = 0.0035587 k( 150) = ( 0.2073171 -0.0000000 0.5000000), wk = 0.0035587 k( 151) = ( 0.2195122 0.0000000 0.5000000), wk = 0.0035587 k( 152) = ( 0.2317073 -0.0000000 0.5000000), wk = 0.0035587 k( 153) = ( 0.2439024 -0.0000000 0.5000000), wk = 0.0035587 k( 154) = ( 0.2560976 0.0000000 0.5000000), wk = 0.0035587 k( 155) = ( 0.2682927 0.0000000 0.5000000), wk = 0.0035587 k( 156) = ( 0.2804878 0.0000000 0.5000000), wk = 0.0035587 k( 157) = ( 0.2926829 -0.0000000 0.5000000), wk = 0.0035587 k( 158) = ( 0.3048781 -0.0000000 0.5000000), wk = 0.0035587 k( 159) = ( 0.3170732 0.0000000 0.5000000), wk = 0.0035587 k( 160) = ( 0.3292683 0.0000000 0.5000000), wk = 0.0035587 k( 161) = ( 0.3414634 -0.0000000 0.5000000), wk = 0.0035587 k( 162) = ( 0.3536585 0.0000000 0.5000000), wk = 0.0035587 k( 163) = ( 0.3658537 -0.0000000 0.5000000), wk = 0.0035587 k( 164) = ( 0.3780488 -0.0000000 0.5000000), wk = 0.0035587 k( 165) = ( 0.3902439 0.0000000 0.5000000), wk = 0.0035587 k( 166) = ( 0.4024390 -0.0000000 0.5000000), wk = 0.0035587 k( 167) = ( 0.4146341 -0.0000000 0.5000000), wk = 0.0035587 k( 168) = ( 0.4268293 -0.0000000 0.5000000), wk = 0.0035587 k( 169) = ( 0.4390244 -0.0000000 0.5000000), wk = 0.0035587 k( 170) = ( 0.4512195 -0.0000000 0.5000000), wk = 0.0035587 k( 171) = ( 0.4634146 -0.0000000 0.5000000), wk = 0.0035587 k( 172) = ( 0.4756098 -0.0000000 0.5000000), wk = 0.0035587 k( 173) = ( 0.4878049 -0.0000000 0.5000000), wk = 0.0035587 k( 174) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035587 k( 175) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035587 k( 176) = ( 0.4930556 0.0138889 0.5000000), wk = 0.0035587 k( 177) = ( 0.4861111 0.0277778 0.5000000), wk = 0.0035587 k( 178) = ( 0.4791667 0.0416667 0.5000000), wk = 0.0035587 k( 179) = ( 0.4722222 0.0555556 0.5000000), wk = 0.0035587 k( 180) = ( 0.4652778 0.0694444 0.5000000), wk = 0.0035587 k( 181) = ( 0.4583333 0.0833333 0.5000000), wk = 0.0035587 k( 182) = ( 0.4513889 0.0972222 0.5000000), wk = 0.0035587 k( 183) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0035587 k( 184) = ( 0.4375000 0.1250000 0.5000000), wk = 0.0035587 k( 185) = ( 0.4305556 0.1388889 0.5000000), wk = 0.0035587 k( 186) = ( 0.4236111 0.1527778 0.5000000), wk = 0.0035587 k( 187) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0035587 k( 188) = ( 0.4097222 0.1805556 0.5000000), wk = 0.0035587 k( 189) = ( 0.4027778 0.1944444 0.5000000), wk = 0.0035587 k( 190) = ( 0.3958333 0.2083333 0.5000000), wk = 0.0035587 k( 191) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0035587 k( 192) = ( 0.3819444 0.2361111 0.5000000), wk = 0.0035587 k( 193) = ( 0.3750000 0.2500000 0.5000000), wk = 0.0035587 k( 194) = ( 0.3680556 0.2638889 0.5000000), wk = 0.0035587 k( 195) = ( 0.3611111 0.2777778 0.5000000), wk = 0.0035587 k( 196) = ( 0.3541667 0.2916667 0.5000000), wk = 0.0035587 k( 197) = ( 0.3472222 0.3055556 0.5000000), wk = 0.0035587 k( 198) = ( 0.3402778 0.3194444 0.5000000), wk = 0.0035587 k( 199) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035587 k( 200) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035587 k( 201) = ( 0.3262411 0.3262411 0.5000000), wk = 0.0035587 k( 202) = ( 0.3191489 0.3191489 0.5000000), wk = 0.0035587 k( 203) = ( 0.3120567 0.3120567 0.5000000), wk = 0.0035587 k( 204) = ( 0.3049645 0.3049645 0.5000000), wk = 0.0035587 k( 205) = ( 0.2978723 0.2978723 0.5000000), wk = 0.0035587 k( 206) = ( 0.2907801 0.2907801 0.5000000), wk = 0.0035587 k( 207) = ( 0.2836879 0.2836879 0.5000000), wk = 0.0035587 k( 208) = ( 0.2765957 0.2765957 0.5000000), wk = 0.0035587 k( 209) = ( 0.2695035 0.2695035 0.5000000), wk = 0.0035587 k( 210) = ( 0.2624113 0.2624113 0.5000000), wk = 0.0035587 k( 211) = ( 0.2553191 0.2553191 0.5000000), wk = 0.0035587 k( 212) = ( 0.2482270 0.2482270 0.5000000), wk = 0.0035587 k( 213) = ( 0.2411348 0.2411347 0.5000000), wk = 0.0035587 k( 214) = ( 0.2340425 0.2340425 0.5000000), wk = 0.0035587 k( 215) = ( 0.2269503 0.2269503 0.5000000), wk = 0.0035587 k( 216) = ( 0.2198582 0.2198582 0.5000000), wk = 0.0035587 k( 217) = ( 0.2127660 0.2127660 0.5000000), wk = 0.0035587 k( 218) = ( 0.2056738 0.2056738 0.5000000), wk = 0.0035587 k( 219) = ( 0.1985816 0.1985816 0.5000000), wk = 0.0035587 k( 220) = ( 0.1914894 0.1914894 0.5000000), wk = 0.0035587 k( 221) = ( 0.1843972 0.1843972 0.5000000), wk = 0.0035587 k( 222) = ( 0.1773050 0.1773050 0.5000000), wk = 0.0035587 k( 223) = ( 0.1702128 0.1702128 0.5000000), wk = 0.0035587 k( 224) = ( 0.1631206 0.1631206 0.5000000), wk = 0.0035587 k( 225) = ( 0.1560284 0.1560284 0.5000000), wk = 0.0035587 k( 226) = ( 0.1489362 0.1489362 0.5000000), wk = 0.0035587 k( 227) = ( 0.1418440 0.1418440 0.5000000), wk = 0.0035587 k( 228) = ( 0.1347518 0.1347518 0.5000000), wk = 0.0035587 k( 229) = ( 0.1276596 0.1276596 0.5000000), wk = 0.0035587 k( 230) = ( 0.1205674 0.1205674 0.5000000), wk = 0.0035587 k( 231) = ( 0.1134752 0.1134752 0.5000000), wk = 0.0035587 k( 232) = ( 0.1063830 0.1063830 0.5000000), wk = 0.0035587 k( 233) = ( 0.0992908 0.0992908 0.5000000), wk = 0.0035587 k( 234) = ( 0.0921986 0.0921986 0.5000000), wk = 0.0035587 k( 235) = ( 0.0851064 0.0851064 0.5000000), wk = 0.0035587 k( 236) = ( 0.0780142 0.0780142 0.5000000), wk = 0.0035587 k( 237) = ( 0.0709220 0.0709220 0.5000000), wk = 0.0035587 k( 238) = ( 0.0638298 0.0638298 0.5000000), wk = 0.0035587 k( 239) = ( 0.0567376 0.0567376 0.5000000), wk = 0.0035587 k( 240) = ( 0.0496454 0.0496454 0.5000000), wk = 0.0035587 k( 241) = ( 0.0425532 0.0425532 0.5000000), wk = 0.0035587 k( 242) = ( 0.0354610 0.0354610 0.5000000), wk = 0.0035587 k( 243) = ( 0.0283688 0.0283688 0.5000000), wk = 0.0035587 k( 244) = ( 0.0212766 0.0212766 0.5000000), wk = 0.0035587 k( 245) = ( 0.0141844 0.0141844 0.5000000), wk = 0.0035587 k( 246) = ( 0.0070922 0.0070922 0.5000000), wk = 0.0035587 k( 247) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035587 k( 248) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035587 k( 249) = ( 0.5000000 0.0000000 0.4687500), wk = 0.0035587 k( 250) = ( 0.5000000 0.0000000 0.4375000), wk = 0.0035587 k( 251) = ( 0.5000000 0.0000000 0.4062500), wk = 0.0035587 k( 252) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0035587 k( 253) = ( 0.5000000 0.0000000 0.3437500), wk = 0.0035587 k( 254) = ( 0.5000000 0.0000000 0.3125000), wk = 0.0035587 k( 255) = ( 0.5000000 0.0000000 0.2812500), wk = 0.0035587 k( 256) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0035587 k( 257) = ( 0.5000000 0.0000000 0.2187500), wk = 0.0035587 k( 258) = ( 0.5000000 0.0000000 0.1875000), wk = 0.0035587 k( 259) = ( 0.5000000 0.0000000 0.1562500), wk = 0.0035587 k( 260) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0035587 k( 261) = ( 0.5000000 0.0000000 0.0937500), wk = 0.0035587 k( 262) = ( 0.5000000 0.0000000 0.0625000), wk = 0.0035587 k( 263) = ( 0.5000000 0.0000000 0.0312500), wk = 0.0035587 k( 264) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035587 k( 265) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0035587 k( 266) = ( 0.3333333 0.3333333 0.0312500), wk = 0.0035587 k( 267) = ( 0.3333333 0.3333333 0.0625000), wk = 0.0035587 k( 268) = ( 0.3333333 0.3333333 0.0937500), wk = 0.0035587 k( 269) = ( 0.3333333 0.3333333 0.1250000), wk = 0.0035587 k( 270) = ( 0.3333333 0.3333333 0.1562500), wk = 0.0035587 k( 271) = ( 0.3333333 0.3333333 0.1875000), wk = 0.0035587 k( 272) = ( 0.3333333 0.3333333 0.2187500), wk = 0.0035587 k( 273) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0035587 k( 274) = ( 0.3333333 0.3333333 0.2812500), wk = 0.0035587 k( 275) = ( 0.3333333 0.3333333 0.3125000), wk = 0.0035587 k( 276) = ( 0.3333333 0.3333333 0.3437500), wk = 0.0035587 k( 277) = ( 0.3333333 0.3333333 0.3750000), wk = 0.0035587 k( 278) = ( 0.3333333 0.3333333 0.4062500), wk = 0.0035587 k( 279) = ( 0.3333333 0.3333333 0.4375000), wk = 0.0035587 k( 280) = ( 0.3333333 0.3333333 0.4687500), wk = 0.0035587 k( 281) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035587 Dense grid: 90591 G-vectors FFT dimensions: ( 45, 45, 100) Smooth grid: 48765 G-vectors FFT dimensions: ( 40, 40, 81) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.34 Mb ( 362, 62) NL pseudopotentials 0.56 Mb ( 181, 204) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.02 Mb ( 2522) G-vector shells 0.01 Mb ( 1130) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.37 Mb ( 362, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.39 Mb ( 204, 2, 62) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./KCuTe.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.5 secs Computing kpt #: 2 total cpu time spent up to now is 5.3 secs Computing kpt #: 3 total cpu time spent up to now is 6.2 secs Computing kpt #: 4 total cpu time spent up to now is 7.2 secs Computing kpt #: 5 total cpu time spent up to now is 8.3 secs Computing kpt #: 6 total cpu time spent up to now is 9.3 secs Computing kpt #: 7 total cpu time spent up to now is 10.2 secs Computing kpt #: 8 total cpu time spent up to now is 11.1 secs Computing kpt #: 9 total cpu time spent up to now is 12.0 secs Computing kpt #: 10 total cpu time spent up to now is 12.8 secs Computing kpt #: 11 total cpu time spent up to now is 13.7 secs Computing kpt #: 12 total cpu time spent up to now is 14.6 secs Computing kpt #: 13 total cpu time spent up to now is 15.5 secs Computing kpt #: 14 total cpu time spent up to now is 16.3 secs Computing kpt #: 15 total cpu time spent up to now is 17.1 secs Computing kpt #: 16 total cpu time spent up to now is 17.8 secs Computing kpt #: 17 total cpu time spent up to now is 18.5 secs Computing kpt #: 18 total cpu time spent up to now is 19.2 secs Computing kpt #: 19 total cpu time spent up to now is 20.0 secs Computing kpt #: 20 total cpu time spent up to now is 20.6 secs Computing kpt #: 21 total cpu time spent up to now is 21.3 secs Computing kpt #: 22 total cpu time spent up to now is 22.0 secs Computing kpt #: 23 total cpu time spent up to now is 22.7 secs Computing kpt #: 24 total cpu time spent up to now is 23.4 secs Computing kpt #: 25 total cpu time spent up to now is 24.0 secs Computing kpt #: 26 total cpu time spent up to now is 24.7 secs Computing kpt #: 27 total cpu time spent up to now is 25.4 secs Computing kpt #: 28 total cpu time spent up to now is 26.0 secs Computing kpt #: 29 total cpu time spent up to now is 26.7 secs Computing kpt #: 30 total cpu time spent up to now is 27.3 secs Computing kpt #: 31 total cpu time spent up to now is 27.9 secs Computing kpt #: 32 total cpu time spent up to now is 28.6 secs Computing kpt #: 33 total cpu time spent up to now is 29.3 secs Computing kpt #: 34 total cpu time spent up to now is 29.9 secs Computing kpt #: 35 total cpu time spent up to now is 30.6 secs Computing kpt #: 36 total cpu time spent up to now is 31.2 secs Computing kpt #: 37 total cpu time spent up to now is 31.9 secs Computing kpt #: 38 total cpu time spent up to now is 32.6 secs Computing kpt #: 39 total cpu time spent up to now is 33.2 secs Computing kpt #: 40 total cpu time spent up to now is 33.9 secs Computing kpt #: 41 total cpu time spent up to now is 34.6 secs Computing kpt #: 42 total cpu time spent up to now is 35.3 secs Computing kpt #: 43 total cpu time spent up to now is 35.9 secs Computing kpt #: 44 total cpu time spent up to now is 36.6 secs Computing kpt #: 45 total cpu time spent up to now is 37.3 secs Computing kpt #: 46 total cpu time spent up to now is 38.0 secs Computing kpt #: 47 total cpu time spent up to now is 38.7 secs Computing kpt #: 48 total cpu time spent up to now is 39.4 secs Computing kpt #: 49 total cpu time spent up to now is 40.1 secs Computing kpt #: 50 total cpu time spent up to now is 40.9 secs Computing kpt #: 51 total cpu time spent up to now is 41.6 secs Computing kpt #: 52 total cpu time spent up to now is 42.3 secs Computing kpt #: 53 total cpu time spent up to now is 43.0 secs Computing kpt #: 54 total cpu time spent up to now is 43.8 secs Computing kpt #: 55 total cpu time spent up to now is 44.5 secs Computing kpt #: 56 total cpu time spent up to now is 45.3 secs Computing kpt #: 57 total cpu time spent up to now is 46.3 secs Computing kpt #: 58 total cpu time spent up to now is 47.1 secs Computing kpt #: 59 total cpu time spent up to now is 47.9 secs Computing kpt #: 60 total cpu time spent up to now is 48.7 secs Computing kpt #: 61 total cpu time spent up to now is 49.4 secs Computing kpt #: 62 total cpu time spent up to now is 50.1 secs Computing kpt #: 63 total cpu time spent up to now is 50.8 secs Computing kpt #: 64 total cpu time spent up to now is 51.5 secs Computing kpt #: 65 total cpu time spent up to now is 52.2 secs Computing kpt #: 66 total cpu time spent up to now is 52.9 secs Computing kpt #: 67 total cpu time spent up to now is 53.6 secs Computing kpt #: 68 total cpu time spent up to now is 54.3 secs Computing kpt #: 69 total cpu time spent up to now is 55.0 secs Computing kpt #: 70 total cpu time spent up to now is 55.7 secs Computing kpt #: 71 total cpu time spent up to now is 56.4 secs Computing kpt #: 72 total cpu time spent up to now is 57.1 secs Computing kpt #: 73 total cpu time spent up to now is 57.8 secs Computing kpt #: 74 total cpu time spent up to now is 58.6 secs Computing kpt #: 75 total cpu time spent up to now is 59.3 secs Computing kpt #: 76 total cpu time spent up to now is 60.0 secs Computing kpt #: 77 total cpu time spent up to now is 60.8 secs Computing kpt #: 78 total cpu time spent up to now is 61.6 secs Computing kpt #: 79 total cpu time spent up to now is 62.5 secs Computing kpt #: 80 total cpu time spent up to now is 63.4 secs Computing kpt #: 81 total cpu time spent up to now is 64.3 secs Computing kpt #: 82 total cpu time spent up to now is 65.2 secs Computing kpt #: 83 total cpu time spent up to now is 66.0 secs Computing kpt #: 84 total cpu time spent up to now is 66.9 secs Computing kpt #: 85 total cpu time spent up to now is 67.8 secs Computing kpt #: 86 total cpu time spent up to now is 68.7 secs Computing kpt #: 87 total cpu time spent up to now is 69.4 secs Computing kpt #: 88 total cpu time spent up to now is 70.2 secs Computing kpt #: 89 total cpu time spent up to now is 71.0 secs Computing kpt #: 90 total cpu time spent up to now is 71.8 secs Computing kpt #: 91 total cpu time spent up to now is 72.6 secs Computing kpt #: 92 total cpu time spent up to now is 73.3 secs Computing kpt #: 93 total cpu time spent up to now is 74.1 secs Computing kpt #: 94 total cpu time spent up to now is 74.9 secs Computing kpt #: 95 total cpu time spent up to now is 75.6 secs Computing kpt #: 96 total cpu time spent up to now is 76.4 secs Computing kpt #: 97 total cpu time spent up to now is 77.1 secs Computing kpt #: 98 total cpu time spent up to now is 77.9 secs Computing kpt #: 99 total cpu time spent up to now is 78.6 secs Computing kpt #: 100 total cpu time spent up to now is 79.4 secs Computing kpt #: 101 total cpu time spent up to now is 80.2 secs Computing kpt #: 102 total cpu time spent up to now is 81.0 secs Computing kpt #: 103 total cpu time spent up to now is 81.8 secs Computing kpt #: 104 total cpu time spent up to now is 82.6 secs Computing kpt #: 105 total cpu time spent up to now is 83.5 secs Computing kpt #: 106 total cpu time spent up to now is 84.3 secs Computing kpt #: 107 total cpu time spent up to now is 85.2 secs Computing kpt #: 108 total cpu time spent up to now is 86.1 secs Computing kpt #: 109 total cpu time spent up to now is 86.9 secs Computing kpt #: 110 total cpu time spent up to now is 87.7 secs Computing kpt #: 111 total cpu time spent up to now is 88.6 secs Computing kpt #: 112 total cpu time spent up to now is 89.5 secs Computing kpt #: 113 total cpu time spent up to now is 90.4 secs Computing kpt #: 114 total cpu time spent up to now is 91.2 secs Computing kpt #: 115 total cpu time spent up to now is 92.0 secs Computing kpt #: 116 total cpu time spent up to now is 92.9 secs Computing kpt #: 117 total cpu time spent up to now is 93.7 secs Computing kpt #: 118 total cpu time spent up to now is 94.6 secs Computing kpt #: 119 total cpu time spent up to now is 95.4 secs Computing kpt #: 120 total cpu time spent up to now is 96.3 secs Computing kpt #: 121 total cpu time spent up to now is 97.2 secs Computing kpt #: 122 total cpu time spent up to now is 98.1 secs Computing kpt #: 123 total cpu time spent up to now is 99.1 secs Computing kpt #: 124 total cpu time spent up to now is 100.0 secs Computing kpt #: 125 total cpu time spent up to now is 101.0 secs Computing kpt #: 126 total cpu time spent up to now is 101.9 secs Computing kpt #: 127 total cpu time spent up to now is 102.8 secs Computing kpt #: 128 total cpu time spent up to now is 103.7 secs Computing kpt #: 129 total cpu time spent up to now is 104.6 secs Computing kpt #: 130 total cpu time spent up to now is 105.5 secs Computing kpt #: 131 total cpu time spent up to now is 106.4 secs Computing kpt #: 132 total cpu time spent up to now is 107.3 secs Computing kpt #: 133 total cpu time spent up to now is 108.2 secs Computing kpt #: 134 total cpu time spent up to now is 109.1 secs Computing kpt #: 135 total cpu time spent up to now is 109.9 secs Computing kpt #: 136 total cpu time spent up to now is 110.7 secs Computing kpt #: 137 total cpu time spent up to now is 111.5 secs Computing kpt #: 138 total cpu time spent up to now is 112.3 secs Computing kpt #: 139 total cpu time spent up to now is 113.0 secs Computing kpt #: 140 total cpu time spent up to now is 113.8 secs Computing kpt #: 141 total cpu time spent up to now is 114.5 secs Computing kpt #: 142 total cpu time spent up to now is 115.3 secs Computing kpt #: 143 total cpu time spent up to now is 116.1 secs Computing kpt #: 144 total cpu time spent up to now is 116.8 secs Computing kpt #: 145 total cpu time spent up to now is 117.5 secs Computing kpt #: 146 total cpu time spent up to now is 118.3 secs Computing kpt #: 147 total cpu time spent up to now is 119.0 secs Computing kpt #: 148 total cpu time spent up to now is 119.7 secs Computing kpt #: 149 total cpu time spent up to now is 120.5 secs Computing kpt #: 150 total cpu time spent up to now is 121.2 secs Computing kpt #: 151 total cpu time spent up to now is 121.9 secs Computing kpt #: 152 total cpu time spent up to now is 122.7 secs Computing kpt #: 153 total cpu time spent up to now is 123.5 secs Computing kpt #: 154 total cpu time spent up to now is 124.2 secs Computing kpt #: 155 total cpu time spent up to now is 124.9 secs Computing kpt #: 156 total cpu time spent up to now is 125.7 secs Computing kpt #: 157 total cpu time spent up to now is 126.4 secs Computing kpt #: 158 total cpu time spent up to now is 127.1 secs Computing kpt #: 159 total cpu time spent up to now is 127.8 secs Computing kpt #: 160 total cpu time spent up to now is 128.5 secs Computing kpt #: 161 total cpu time spent up to now is 129.2 secs Computing kpt #: 162 total cpu time spent up to now is 130.0 secs Computing kpt #: 163 total cpu time spent up to now is 130.7 secs Computing kpt #: 164 total cpu time spent up to now is 131.4 secs Computing kpt #: 165 total cpu time spent up to now is 132.1 secs Computing kpt #: 166 total cpu time spent up to now is 132.9 secs Computing kpt #: 167 total cpu time spent up to now is 133.7 secs Computing kpt #: 168 total cpu time spent up to now is 134.4 secs Computing kpt #: 169 total cpu time spent up to now is 135.2 secs Computing kpt #: 170 total cpu time spent up to now is 136.0 secs Computing kpt #: 171 total cpu time spent up to now is 136.9 secs Computing kpt #: 172 total cpu time spent up to now is 137.7 secs Computing kpt #: 173 total cpu time spent up to now is 138.6 secs Computing kpt #: 174 total cpu time spent up to now is 139.5 secs Computing kpt #: 175 total cpu time spent up to now is 140.3 secs Computing kpt #: 176 total cpu time spent up to now is 141.2 secs Computing kpt #: 177 total cpu time spent up to now is 142.1 secs Computing kpt #: 178 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 144.2 secs Computing kpt #: 179 total cpu time spent up to now is 146.0 secs Computing kpt #: 180 total cpu time spent up to now is 147.4 secs Computing kpt #: 181 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 149.5 secs Computing kpt #: 182 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 151.6 secs Computing kpt #: 183 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 153.8 secs Computing kpt #: 184 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 155.9 secs Computing kpt #: 185 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 158.1 secs Computing kpt #: 186 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 160.4 secs Computing kpt #: 187 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 162.5 secs Computing kpt #: 188 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 164.6 secs Computing kpt #: 189 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 166.7 secs Computing kpt #: 190 total cpu time spent up to now is 167.9 secs Computing kpt #: 191 total cpu time spent up to now is 168.7 secs Computing kpt #: 192 total cpu time spent up to now is 169.6 secs Computing kpt #: 193 total cpu time spent up to now is 170.5 secs Computing kpt #: 194 total cpu time spent up to now is 171.4 secs Computing kpt #: 195 total cpu time spent up to now is 172.2 secs Computing kpt #: 196 total cpu time spent up to now is 173.1 secs Computing kpt #: 197 total cpu time spent up to now is 174.0 secs Computing kpt #: 198 total cpu time spent up to now is 174.9 secs Computing kpt #: 199 total cpu time spent up to now is 175.7 secs Computing kpt #: 200 total cpu time spent up to now is 176.6 secs Computing kpt #: 201 total cpu time spent up to now is 177.5 secs Computing kpt #: 202 total cpu time spent up to now is 178.3 secs Computing kpt #: 203 total cpu time spent up to now is 179.2 secs Computing kpt #: 204 total cpu time spent up to now is 180.1 secs Computing kpt #: 205 total cpu time spent up to now is 181.0 secs Computing kpt #: 206 total cpu time spent up to now is 181.8 secs Computing kpt #: 207 total cpu time spent up to now is 182.6 secs Computing kpt #: 208 total cpu time spent up to now is 183.4 secs Computing kpt #: 209 total cpu time spent up to now is 184.2 secs Computing kpt #: 210 total cpu time spent up to now is 185.1 secs Computing kpt #: 211 total cpu time spent up to now is 185.8 secs Computing kpt #: 212 total cpu time spent up to now is 186.7 secs Computing kpt #: 213 total cpu time spent up to now is 187.6 secs Computing kpt #: 214 total cpu time spent up to now is 188.5 secs Computing kpt #: 215 total cpu time spent up to now is 189.4 secs Computing kpt #: 216 total cpu time spent up to now is 190.2 secs Computing kpt #: 217 total cpu time spent up to now is 190.9 secs Computing kpt #: 218 total cpu time spent up to now is 191.7 secs Computing kpt #: 219 total cpu time spent up to now is 192.5 secs Computing kpt #: 220 total cpu time spent up to now is 193.2 secs Computing kpt #: 221 total cpu time spent up to now is 194.0 secs Computing kpt #: 222 total cpu time spent up to now is 195.1 secs Computing kpt #: 223 total cpu time spent up to now is 195.9 secs Computing kpt #: 224 total cpu time spent up to now is 196.7 secs Computing kpt #: 225 total cpu time spent up to now is 197.4 secs Computing kpt #: 226 total cpu time spent up to now is 198.2 secs Computing kpt #: 227 total cpu time spent up to now is 199.0 secs Computing kpt #: 228 total cpu time spent up to now is 199.7 secs Computing kpt #: 229 total cpu time spent up to now is 200.5 secs Computing kpt #: 230 total cpu time spent up to now is 201.3 secs Computing kpt #: 231 total cpu time spent up to now is 202.1 secs Computing kpt #: 232 total cpu time spent up to now is 202.9 secs Computing kpt #: 233 total cpu time spent up to now is 203.7 secs Computing kpt #: 234 total cpu time spent up to now is 204.6 secs Computing kpt #: 235 total cpu time spent up to now is 205.4 secs Computing kpt #: 236 total cpu time spent up to now is 206.2 secs Computing kpt #: 237 total cpu time spent up to now is 207.0 secs Computing kpt #: 238 total cpu time spent up to now is 207.8 secs Computing kpt #: 239 total cpu time spent up to now is 208.6 secs Computing kpt #: 240 total cpu time spent up to now is 209.4 secs Computing kpt #: 241 total cpu time spent up to now is 210.2 secs Computing kpt #: 242 total cpu time spent up to now is 210.9 secs Computing kpt #: 243 total cpu time spent up to now is 211.9 secs Computing kpt #: 244 total cpu time spent up to now is 212.8 secs Computing kpt #: 245 total cpu time spent up to now is 213.7 secs Computing kpt #: 246 total cpu time spent up to now is 214.7 secs Computing kpt #: 247 total cpu time spent up to now is 215.6 secs Computing kpt #: 248 total cpu time spent up to now is 216.4 secs Computing kpt #: 249 total cpu time spent up to now is 217.6 secs Computing kpt #: 250 total cpu time spent up to now is 218.6 secs Computing kpt #: 251 total cpu time spent up to now is 219.6 secs Computing kpt #: 252 total cpu time spent up to now is 220.5 secs Computing kpt #: 253 total cpu time spent up to now is 221.5 secs Computing kpt #: 254 total cpu time spent up to now is 222.5 secs Computing kpt #: 255 total cpu time spent up to now is 223.4 secs Computing kpt #: 256 total cpu time spent up to now is 224.3 secs Computing kpt #: 257 total cpu time spent up to now is 225.2 secs Computing kpt #: 258 total cpu time spent up to now is 225.9 secs Computing kpt #: 259 total cpu time spent up to now is 226.6 secs Computing kpt #: 260 total cpu time spent up to now is 227.3 secs Computing kpt #: 261 total cpu time spent up to now is 228.1 secs Computing kpt #: 262 total cpu time spent up to now is 228.7 secs Computing kpt #: 263 total cpu time spent up to now is 229.4 secs Computing kpt #: 264 total cpu time spent up to now is 230.1 secs Computing kpt #: 265 total cpu time spent up to now is 230.8 secs Computing kpt #: 266 total cpu time spent up to now is 231.5 secs Computing kpt #: 267 total cpu time spent up to now is 232.2 secs Computing kpt #: 268 total cpu time spent up to now is 232.9 secs Computing kpt #: 269 total cpu time spent up to now is 233.6 secs Computing kpt #: 270 total cpu time spent up to now is 234.4 secs Computing kpt #: 271 total cpu time spent up to now is 235.1 secs Computing kpt #: 272 total cpu time spent up to now is 235.8 secs Computing kpt #: 273 total cpu time spent up to now is 236.5 secs Computing kpt #: 274 total cpu time spent up to now is 237.2 secs Computing kpt #: 275 total cpu time spent up to now is 237.9 secs Computing kpt #: 276 total cpu time spent up to now is 238.7 secs Computing kpt #: 277 total cpu time spent up to now is 239.4 secs Computing kpt #: 278 total cpu time spent up to now is 240.2 secs Computing kpt #: 279 total cpu time spent up to now is 240.9 secs Computing kpt #: 280 total cpu time spent up to now is 241.7 secs Computing kpt #: 281 total cpu time spent up to now is 242.6 secs ethr = 1.92E-08, avg # of iterations = 24.1 total cpu time spent up to now is 242.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6095 PWs) bands (ev): -24.7195 -24.7195 -24.7185 -24.7185 -8.4487 -8.4487 -8.3944 -8.3944 -8.2010 -8.2010 -8.1363 -8.1363 -8.1212 -8.1212 -8.1176 -8.1176 -5.6215 -5.6215 -5.3560 -5.3560 2.1208 2.1208 2.2785 2.2785 2.3659 2.3659 2.4107 2.4107 2.5032 2.5032 3.4178 3.4178 3.4987 3.4987 3.6664 3.6664 3.6692 3.6692 3.6949 3.6949 3.7135 3.7135 3.7909 3.7909 5.7461 5.7461 5.8986 5.8986 5.9669 5.9669 6.1337 6.1337 6.6738 6.6738 7.1631 7.1631 8.3244 8.3244 9.6930 9.6930 9.7182 9.7182 k = 0.0122 0.0070-0.0000 ( 6095 PWs) bands (ev): -24.7195 -24.7195 -24.7185 -24.7185 -8.4487 -8.4487 -8.3944 -8.3944 -8.2010 -8.2010 -8.1363 -8.1363 -8.1213 -8.1213 -8.1177 -8.1177 -5.6207 -5.6207 -5.3556 -5.3556 2.1207 2.1207 2.2777 2.2777 2.3656 2.3656 2.4102 2.4102 2.5035 2.5035 3.4172 3.4172 3.4990 3.4990 3.6554 3.6554 3.6683 3.6683 3.6951 3.6951 3.7265 3.7265 3.7910 3.7910 5.7389 5.7389 5.8880 5.8880 5.9575 5.9575 6.1178 6.1178 6.6953 6.6953 7.1779 7.1779 8.3277 8.3277 9.6965 9.6965 9.7213 9.7213 k = 0.0244 0.0141-0.0000 ( 6099 PWs) bands (ev): -24.7194 -24.7194 -24.7184 -24.7184 -8.4485 -8.4485 -8.3947 -8.3947 -8.2010 -8.2010 -8.1364 -8.1364 -8.1217 -8.1217 -8.1180 -8.1180 -5.6181 -5.6181 -5.3543 -5.3543 2.1204 2.1204 2.2752 2.2752 2.3645 2.3645 2.4086 2.4086 2.5046 2.5046 3.4155 3.4155 3.4997 3.4997 3.6343 3.6343 3.6684 3.6684 3.6959 3.6959 3.7511 3.7511 3.7912 3.7912 5.7165 5.7165 5.8549 5.8549 5.9320 5.9320 6.0797 6.0797 6.7517 6.7517 7.2202 7.2202 8.3377 8.3377 9.7052 9.7052 9.7327 9.7327 k = 0.0366 0.0211-0.0000 ( 6087 PWs) bands (ev): -24.7194 -24.7194 -24.7184 -24.7184 -8.4482 -8.4482 -8.3949 -8.3949 -8.2010 -8.2010 -8.1365 -8.1365 -8.1224 -8.1224 -8.1185 -8.1185 -5.6138 -5.6138 -5.3522 -5.3522 2.1198 2.1198 2.2708 2.2708 2.3629 2.3629 2.4065 2.4065 2.5064 2.5064 3.4125 3.4125 3.5008 3.5008 3.6123 3.6123 3.6686 3.6686 3.6972 3.6972 3.7788 3.7788 3.7916 3.7916 5.6769 5.6769 5.7981 5.7981 5.8973 5.8973 6.0352 6.0352 6.8283 6.8283 7.2851 7.2851 8.3541 8.3541 9.7161 9.7161 9.7553 9.7553 k = 0.0488 0.0282-0.0000 ( 6091 PWs) bands (ev): -24.7193 -24.7193 -24.7183 -24.7183 -8.4479 -8.4479 -8.3954 -8.3954 -8.2009 -8.2009 -8.1368 -8.1368 -8.1233 -8.1233 -8.1192 -8.1192 -5.6078 -5.6078 -5.3492 -5.3492 2.1187 2.1187 2.2639 2.2639 2.3606 2.3606 2.4040 2.4040 2.5092 2.5092 3.4079 3.4079 3.5024 3.5024 3.5916 3.5916 3.6688 3.6688 3.6989 3.6989 3.7920 3.7920 3.8081 3.8081 5.6194 5.6194 5.7208 5.7208 5.8599 5.8599 5.9923 5.9923 6.9144 6.9144 7.3665 7.3665 8.3767 8.3767 9.7292 9.7292 9.7896 9.7896 k = 0.0610 0.0352-0.0000 ( 6093 PWs) bands (ev): -24.7192 -24.7192 -24.7183 -24.7183 -8.4474 -8.4474 -8.3960 -8.3960 -8.2009 -8.2009 -8.1371 -8.1371 -8.1244 -8.1244 -8.1201 -8.1201 -5.6002 -5.6002 -5.3454 -5.3454 2.1166 2.1166 2.2541 2.2541 2.3579 2.3579 2.4019 2.4019 2.5130 2.5130 3.4015 3.4015 3.5043 3.5043 3.5730 3.5730 3.6692 3.6692 3.7013 3.7013 3.7927 3.7927 3.8382 3.8382 5.5459 5.5459 5.6298 5.6298 5.8229 5.8229 5.9506 5.9506 7.0037 7.0037 7.4589 7.4589 8.4051 8.4051 9.7461 9.7461 9.8342 9.8342 k = 0.0732 0.0422-0.0000 ( 6085 PWs) bands (ev): -24.7191 -24.7191 -24.7182 -24.7182 -8.4468 -8.4468 -8.3967 -8.3967 -8.2008 -8.2008 -8.1376 -8.1376 -8.1256 -8.1256 -8.1211 -8.1211 -5.5910 -5.5910 -5.3408 -5.3408 2.1134 2.1134 2.2409 2.2409 2.3550 2.3550 2.4007 2.4007 2.5179 2.5179 3.3929 3.3929 3.5065 3.5065 3.5570 3.5570 3.6696 3.6696 3.7041 3.7041 3.7936 3.7936 3.8690 3.8690 5.4607 5.4607 5.5311 5.5311 5.7862 5.7862 5.9082 5.9082 7.0926 7.0926 7.5576 7.5576 8.4388 8.4388 9.7684 9.7684 9.8879 9.8879 k = 0.0854 0.0493-0.0000 ( 6079 PWs) bands (ev): -24.7190 -24.7190 -24.7180 -24.7180 -8.4462 -8.4462 -8.3976 -8.3976 -8.2007 -8.2007 -8.1383 -8.1383 -8.1269 -8.1269 -8.1223 -8.1223 -5.5801 -5.5801 -5.3353 -5.3353 2.1083 2.1083 2.2239 2.2239 2.3522 2.3522 2.4007 2.4007 2.5240 2.5240 3.3818 3.3818 3.5090 3.5090 3.5440 3.5440 3.6702 3.6702 3.7076 3.7076 3.7949 3.7949 3.9003 3.9003 5.3677 5.3677 5.4291 5.4291 5.7487 5.7487 5.8636 5.8636 7.1791 7.1791 7.6586 7.6586 8.4775 8.4775 9.7972 9.7972 9.9493 9.9493 k = 0.0976 0.0563-0.0000 ( 6083 PWs) bands (ev): -24.7189 -24.7189 -24.7179 -24.7179 -8.4455 -8.4455 -8.3986 -8.3986 -8.2006 -8.2006 -8.1392 -8.1392 -8.1282 -8.1282 -8.1236 -8.1236 -5.5678 -5.5678 -5.3291 -5.3291 2.1009 2.1009 2.2029 2.2029 2.3499 2.3499 2.4021 2.4021 2.5314 2.5314 3.3684 3.3684 3.5114 3.5114 3.5341 3.5341 3.6708 3.6708 3.7115 3.7115 3.7966 3.7966 3.9321 3.9321 5.2700 5.2700 5.3263 5.3263 5.7096 5.7096 5.8162 5.8162 7.2618 7.2618 7.7579 7.7579 8.5206 8.5206 9.8333 9.8333 10.0143 10.0143 k = 0.1098 0.0634-0.0000 ( 6079 PWs) bands (ev): -24.7188 -24.7188 -24.7178 -24.7178 -8.4448 -8.4448 -8.3997 -8.3997 -8.2005 -8.2005 -8.1405 -8.1405 -8.1294 -8.1294 -8.1251 -8.1251 -5.5539 -5.5539 -5.3221 -5.3221 2.0906 2.0906 2.1780 2.1780 2.3487 2.3487 2.4050 2.4050 2.5399 2.5399 3.3530 3.3530 3.5134 3.5134 3.5274 3.5274 3.6716 3.6716 3.7160 3.7160 3.7989 3.7989 3.9642 3.9642 5.1701 5.1701 5.2243 5.2243 5.6684 5.6684 5.7660 5.7660 7.3403 7.3403 7.8519 7.8519 8.5682 8.5682 9.8757 9.8757 9.9762 9.9762 k = 0.1220 0.0704-0.0000 ( 6072 PWs) bands (ev): -24.7186 -24.7186 -24.7176 -24.7176 -8.4440 -8.4440 -8.4009 -8.4009 -8.2004 -8.2004 -8.1422 -8.1422 -8.1303 -8.1303 -8.1267 -8.1267 -5.5387 -5.5387 -5.3143 -5.3143 2.0771 2.0771 2.1493 2.1493 2.3489 2.3489 2.4094 2.4094 2.5496 2.5496 3.3358 3.3358 3.5140 3.5140 3.5246 3.5246 3.6724 3.6724 3.7209 3.7209 3.8021 3.8021 3.9967 3.9967 5.0696 5.0696 5.1239 5.1239 5.6252 5.6252 5.7132 5.7132 7.4144 7.4144 7.9368 7.9368 8.6203 8.6203 9.8556 9.8556 9.9271 9.9271 k = 0.1341 0.0774-0.0000 ( 6066 PWs) bands (ev): -24.7184 -24.7184 -24.7174 -24.7174 -8.4433 -8.4433 -8.4023 -8.4023 -8.2002 -8.2002 -8.1443 -8.1443 -8.1311 -8.1311 -8.1284 -8.1284 -5.5221 -5.5221 -5.3058 -5.3058 2.0598 2.0598 2.1168 2.1168 2.3508 2.3508 2.4151 2.4151 2.5604 2.5604 3.3175 3.3175 3.5129 3.5129 3.5252 3.5252 3.6733 3.6733 3.7260 3.7260 3.8064 3.8064 4.0293 4.0293 4.9698 4.9698 5.0258 5.0258 5.5798 5.5798 5.6581 5.6581 7.4842 7.4842 8.0090 8.0090 8.6770 8.6770 9.7397 9.7397 9.9675 9.9675 k = 0.1463 0.0845-0.0000 ( 6060 PWs) bands (ev): -24.7183 -24.7183 -24.7173 -24.7173 -8.4425 -8.4425 -8.4038 -8.4038 -8.2000 -8.2000 -8.1466 -8.1466 -8.1317 -8.1317 -8.1302 -8.1302 -5.5042 -5.5042 -5.2966 -5.2966 2.0388 2.0388 2.0810 2.0810 2.3547 2.3547 2.4221 2.4221 2.5721 2.5721 3.2983 3.2983 3.5116 3.5116 3.5275 3.5275 3.6742 3.6742 3.7310 3.7310 3.8122 3.8122 4.0620 4.0620 4.8719 4.8719 4.9305 4.9305 5.5324 5.5324 5.6011 5.6011 7.5499 7.5499 8.0661 8.0661 8.7379 8.7379 9.6237 9.6237 9.9827 9.9827 k = 0.1585 0.0915-0.0000 ( 6070 PWs) bands (ev): -24.7181 -24.7181 -24.7171 -24.7171 -8.4418 -8.4418 -8.4054 -8.4054 -8.1997 -8.1997 -8.1493 -8.1493 -8.1323 -8.1323 -8.1319 -8.1319 -5.4852 -5.4852 -5.2867 -5.2867 2.0140 2.0140 2.0420 2.0420 2.3604 2.3604 2.4301 2.4301 2.5847 2.5847 3.2787 3.2787 3.5109 3.5109 3.5300 3.5300 3.6752 3.6752 3.7357 3.7357 3.8198 3.8198 4.0946 4.0946 4.7766 4.7766 4.8380 4.8380 5.4834 5.4834 5.5426 5.5426 7.6120 7.6120 8.1070 8.1070 8.8014 8.8014 9.5088 9.5088 9.9663 9.9663 k = 0.1707 0.0986-0.0000 ( 6064 PWs) bands (ev): -24.7179 -24.7179 -24.7169 -24.7169 -8.4411 -8.4411 -8.4071 -8.4071 -8.1995 -8.1995 -8.1521 -8.1521 -8.1340 -8.1340 -8.1324 -8.1324 -5.4651 -5.4651 -5.2762 -5.2762 1.9849 1.9849 2.0007 2.0007 2.3680 2.3680 2.4391 2.4391 2.5980 2.5980 3.2588 3.2588 3.5108 3.5108 3.5327 3.5327 3.6763 3.6763 3.7399 3.7399 3.8298 3.8298 4.1270 4.1270 4.6846 4.6846 4.7490 4.7490 5.4329 5.4329 5.4830 5.4830 7.6708 7.6708 8.1322 8.1322 8.8648 8.8648 9.3954 9.3954 9.9323 9.9323 k = 0.1829 0.1056-0.0000 ( 6060 PWs) bands (ev): -24.7177 -24.7177 -24.7167 -24.7167 -8.4404 -8.4404 -8.4089 -8.4089 -8.1992 -8.1992 -8.1551 -8.1551 -8.1360 -8.1360 -8.1327 -8.1327 -5.4440 -5.4440 -5.2650 -5.2650 1.9490 1.9490 1.9603 1.9603 2.3772 2.3772 2.4491 2.4491 2.6119 2.6119 3.2390 3.2390 3.5111 3.5111 3.5352 3.5352 3.6774 3.6774 3.7433 3.7433 3.8423 3.8423 4.1589 4.1589 4.5963 4.5963 4.6636 4.6636 5.3811 5.3811 5.4226 5.4226 7.7266 7.7266 8.1436 8.1436 8.9252 8.9252 9.2835 9.2835 9.8882 9.8882 k = 0.1951 0.1127-0.0000 ( 6068 PWs) bands (ev): -24.7175 -24.7175 -24.7165 -24.7165 -8.4398 -8.4398 -8.4108 -8.4108 -8.1989 -8.1989 -8.1582 -8.1582 -8.1379 -8.1379 -8.1328 -8.1328 -5.4220 -5.4220 -5.2533 -5.2533 1.9038 1.9038 1.9235 1.9235 2.3878 2.3878 2.4598 2.4598 2.6262 2.6262 3.2194 3.2194 3.5119 3.5119 3.5376 3.5376 3.6786 3.6786 3.7459 3.7459 3.8574 3.8574 4.1899 4.1899 4.5121 4.5121 4.5824 4.5824 5.3283 5.3283 5.3619 5.3619 7.7796 7.7796 8.1435 8.1435 8.9800 8.9800 9.1732 9.1732 9.8370 9.8370 k = 0.2073 0.1197-0.0000 ( 6072 PWs) bands (ev): -24.7172 -24.7172 -24.7163 -24.7163 -8.4394 -8.4394 -8.4128 -8.4128 -8.1986 -8.1986 -8.1613 -8.1613 -8.1398 -8.1398 -8.1330 -8.1330 -5.3993 -5.3993 -5.2411 -5.2411 1.8543 1.8543 1.8862 1.8862 2.3997 2.3997 2.4714 2.4714 2.6408 2.6408 3.2000 3.2000 3.5129 3.5129 3.5396 3.5396 3.6797 3.6797 3.7477 3.7477 3.8751 3.8751 4.2190 4.2190 4.4324 4.4324 4.5062 4.5062 5.2746 5.2746 5.3014 5.3014 7.8300 7.8300 8.1341 8.1341 9.0276 9.0276 9.0650 9.0650 9.7807 9.7807 k = 0.2195 0.1267-0.0000 ( 6074 PWs) bands (ev): -24.7170 -24.7170 -24.7161 -24.7161 -8.4390 -8.4390 -8.4149 -8.4149 -8.1983 -8.1983 -8.1645 -8.1645 -8.1417 -8.1417 -8.1330 -8.1330 -5.3761 -5.3761 -5.2283 -5.2283 1.8023 1.8023 1.8470 1.8470 2.4126 2.4126 2.4838 2.4838 2.6557 2.6557 3.1810 3.1810 3.5141 3.5141 3.5415 3.5415 3.6809 3.6809 3.7489 3.7489 3.8954 3.8954 4.2435 4.2435 4.3576 4.3576 4.4374 4.4374 5.2201 5.2201 5.2415 5.2415 7.8778 7.8778 8.1177 8.1177 8.9567 8.9567 9.0706 9.0706 9.7206 9.7206 k = 0.2317 0.1338-0.0000 ( 6080 PWs) bands (ev): -24.7168 -24.7168 -24.7158 -24.7158 -8.4387 -8.4387 -8.4171 -8.4171 -8.1980 -8.1980 -8.1676 -8.1676 -8.1435 -8.1435 -8.1331 -8.1331 -5.3523 -5.3523 -5.2151 -5.2151 1.7485 1.7485 1.8061 1.8061 2.4266 2.4266 2.4968 2.4968 2.6706 2.6706 3.1625 3.1625 3.5155 3.5155 3.5430 3.5430 3.6819 3.6819 3.7494 3.7494 3.9180 3.9180 4.2525 4.2525 4.2903 4.2903 4.3846 4.3846 5.1648 5.1648 5.1829 5.1829 7.9231 7.9231 8.0959 8.0959 8.8513 8.8513 9.1072 9.1072 9.6580 9.6580 k = 0.2439 0.1408-0.0000 ( 6078 PWs) bands (ev): -24.7165 -24.7165 -24.7156 -24.7156 -8.4385 -8.4385 -8.4193 -8.4193 -8.1977 -8.1977 -8.1707 -8.1707 -8.1451 -8.1451 -8.1331 -8.1331 -5.3282 -5.3282 -5.2014 -5.2014 1.6932 1.6932 1.7638 1.7638 2.4413 2.4413 2.5104 2.5104 2.6854 2.6854 3.1444 3.1444 3.5170 3.5170 3.5443 3.5443 3.6829 3.6829 3.7494 3.7494 3.9426 3.9426 4.2138 4.2138 4.2433 4.2433 4.3672 4.3672 5.1088 5.1088 5.1259 5.1259 7.9654 7.9654 8.0704 8.0704 8.7473 8.7473 9.1405 9.1405 9.5939 9.5939 k = 0.2561 0.1479-0.0000 ( 6076 PWs) bands (ev): -24.7163 -24.7163 -24.7154 -24.7154 -8.4384 -8.4384 -8.4215 -8.4215 -8.1975 -8.1975 -8.1737 -8.1737 -8.1467 -8.1467 -8.1331 -8.1331 -5.3040 -5.3040 -5.1874 -5.1874 1.6368 1.6368 1.7203 1.7203 2.4567 2.4567 2.5245 2.5245 2.7001 2.7001 3.1270 3.1270 3.5185 3.5185 3.5453 3.5453 3.6838 3.6838 3.7489 3.7489 3.9685 3.9685 4.1560 4.1560 4.1935 4.1935 4.3803 4.3803 5.0525 5.0525 5.0708 5.0708 8.0034 8.0034 8.0437 8.0437 8.6452 8.6452 9.1723 9.1723 9.5293 9.5293 k = 0.2683 0.1549-0.0000 ( 6080 PWs) bands (ev): -24.7161 -24.7161 -24.7152 -24.7152 -8.4385 -8.4385 -8.4237 -8.4237 -8.1973 -8.1973 -8.1766 -8.1766 -8.1481 -8.1481 -8.1331 -8.1331 -5.2798 -5.2798 -5.1730 -5.1730 1.5798 1.5798 1.6760 1.6760 2.4727 2.4727 2.5390 2.5390 2.7145 2.7145 3.1101 3.1101 3.5200 3.5200 3.5461 3.5461 3.6845 3.6845 3.7478 3.7478 3.9933 3.9933 4.1036 4.1036 4.1391 4.1391 4.4029 4.4029 4.9967 4.9967 5.0173 5.0173 8.0073 8.0073 8.0466 8.0466 8.5449 8.5449 9.2040 9.2040 9.4649 9.4649 k = 0.2805 0.1619-0.0000 ( 6082 PWs) bands (ev): -24.7158 -24.7158 -24.7149 -24.7149 -8.4388 -8.4388 -8.4260 -8.4260 -8.1972 -8.1972 -8.1793 -8.1793 -8.1494 -8.1494 -8.1330 -8.1330 -5.2558 -5.2558 -5.1582 -5.1582 1.5225 1.5225 1.6314 1.6314 2.4892 2.4892 2.5539 2.5539 2.7286 2.7286 3.0940 3.0940 3.5215 3.5215 3.5466 3.5466 3.6848 3.6848 3.7462 3.7462 4.0048 4.0048 4.0682 4.0682 4.0881 4.0881 4.4275 4.4275 4.9423 4.9423 4.9652 4.9652 7.9779 7.9779 8.0785 8.0785 8.4466 8.4466 9.2371 9.2371 9.4015 9.4015 k = 0.2927 0.1690-0.0000 ( 6082 PWs) bands (ev): -24.7156 -24.7156 -24.7147 -24.7147 -8.4391 -8.4391 -8.4281 -8.4281 -8.1973 -8.1973 -8.1819 -8.1819 -8.1505 -8.1505 -8.1330 -8.1330 -5.2323 -5.2323 -5.1431 -5.1431 1.4653 1.4653 1.5867 1.5867 2.5059 2.5059 2.5692 2.5692 2.7422 2.7422 3.0784 3.0784 3.5229 3.5229 3.5469 3.5469 3.6848 3.6848 3.7439 3.7439 3.9794 3.9794 4.0313 4.0313 4.0844 4.0844 4.4517 4.4517 4.8899 4.8899 4.9147 4.9147 7.9467 7.9467 8.1086 8.1086 8.3508 8.3508 9.2724 9.2724 9.3397 9.3397 k = 0.3049 0.1760-0.0000 ( 6074 PWs) bands (ev): -24.7154 -24.7154 -24.7145 -24.7145 -8.4397 -8.4397 -8.4302 -8.4302 -8.1975 -8.1975 -8.1843 -8.1843 -8.1514 -8.1514 -8.1329 -8.1329 -5.2094 -5.2094 -5.1277 -5.1277 1.4086 1.4086 1.5422 1.5422 2.5229 2.5229 2.5846 2.5846 2.7553 2.7553 3.0636 3.0636 3.5243 3.5243 3.5470 3.5470 3.6841 3.6841 3.7408 3.7408 3.9410 3.9410 3.9844 3.9844 4.1132 4.1132 4.4740 4.4740 4.8404 4.8404 4.8660 4.8660 7.9155 7.9155 8.1347 8.1347 8.2582 8.2582 9.2798 9.2798 9.3108 9.3108 k = 0.3171 0.1831-0.0000 ( 6078 PWs) bands (ev): -24.7152 -24.7152 -24.7143 -24.7143 -8.4404 -8.4404 -8.4321 -8.4321 -8.1979 -8.1979 -8.1865 -8.1865 -8.1521 -8.1521 -8.1328 -8.1328 -5.1876 -5.1876 -5.1119 -5.1119 1.3529 1.3529 1.4985 1.4985 2.5399 2.5399 2.6002 2.6002 2.7679 2.7679 3.0496 3.0496 3.5256 3.5256 3.5469 3.5469 3.6826 3.6826 3.7366 3.7366 3.9040 3.9040 3.9409 3.9409 4.1472 4.1472 4.4930 4.4930 4.7946 4.7946 4.8194 4.8194 7.8848 7.8848 8.1434 8.1434 8.1826 8.1826 9.2225 9.2225 9.3523 9.3523 k = 0.3293 0.1901-0.0000 ( 6082 PWs) bands (ev): -24.7149 -24.7149 -24.7141 -24.7141 -8.4413 -8.4413 -8.4339 -8.4339 -8.1985 -8.1985 -8.1885 -8.1885 -8.1527 -8.1527 -8.1327 -8.1327 -5.1669 -5.1669 -5.0958 -5.0958 1.2985 1.2985 1.4557 1.4557 2.5569 2.5569 2.6157 2.6157 2.7799 2.7799 3.0363 3.0363 3.5268 3.5268 3.5466 3.5466 3.6799 3.6799 3.7308 3.7308 3.8712 3.8712 3.9015 3.9015 4.1832 4.1832 4.5069 4.5069 4.7535 4.7535 4.7761 4.7761 7.8550 7.8550 8.0714 8.0714 8.1875 8.1875 9.1679 9.1679 9.3973 9.3973 k = 0.3415 0.1971-0.0000 ( 6084 PWs) bands (ev): -24.7147 -24.7147 -24.7139 -24.7139 -8.4425 -8.4425 -8.4354 -8.4354 -8.1993 -8.1993 -8.1901 -8.1901 -8.1530 -8.1530 -8.1326 -8.1326 -5.1476 -5.1476 -5.0794 -5.0794 1.2459 1.2459 1.4143 1.4143 2.5736 2.5736 2.6311 2.6311 2.7913 2.7913 3.0238 3.0238 3.5279 3.5279 3.5461 3.5461 3.6756 3.6756 3.7229 3.7229 3.8436 3.8436 3.8668 3.8668 4.2201 4.2201 4.5131 4.5131 4.7167 4.7167 4.7393 4.7393 7.8263 7.8263 7.9877 7.9877 8.2046 8.2046 9.1165 9.1165 9.4456 9.4456 k = 0.3537 0.2042-0.0000 ( 6092 PWs) bands (ev): -24.7146 -24.7146 -24.7137 -24.7137 -8.4439 -8.4439 -8.4367 -8.4367 -8.2004 -8.2004 -8.1915 -8.1915 -8.1532 -8.1532 -8.1325 -8.1325 -5.1298 -5.1298 -5.0627 -5.0627 1.1954 1.1954 1.3745 1.3745 2.5901 2.5901 2.6461 2.6461 2.8021 2.8021 3.0120 3.0120 3.5288 3.5288 3.5454 3.5454 3.6692 3.6692 3.7125 3.7125 3.8217 3.8217 3.8374 3.8374 4.2571 4.2571 4.5090 4.5090 4.6808 4.6808 4.7155 4.7155 7.7987 7.7987 7.9067 7.9067 8.2201 8.2201 9.0684 9.0684 9.4971 9.4971 k = 0.3659 0.2112-0.0000 ( 6090 PWs) bands (ev): -24.7144 -24.7144 -24.7136 -24.7136 -8.4454 -8.4454 -8.4377 -8.4377 -8.2015 -8.2015 -8.1926 -8.1926 -8.1533 -8.1533 -8.1324 -8.1324 -5.1137 -5.1137 -5.0461 -5.0461 1.1475 1.1475 1.3367 1.3367 2.6062 2.6062 2.6609 2.6609 2.8121 2.8121 3.0012 3.0012 3.5297 3.5297 3.5445 3.5445 3.6604 3.6604 3.6994 3.6994 3.8054 3.8054 3.8136 3.8136 4.2935 4.2935 4.4943 4.4943 4.6455 4.6455 4.7058 4.7058 7.7715 7.7715 7.8306 7.8306 8.2335 8.2335 9.0238 9.0238 9.5512 9.5512 k = 0.3780 0.2183-0.0000 ( 6090 PWs) bands (ev): -24.7142 -24.7142 -24.7134 -24.7134 -8.4469 -8.4469 -8.4387 -8.4387 -8.2028 -8.2028 -8.1935 -8.1935 -8.1532 -8.1532 -8.1323 -8.1323 -5.0991 -5.0991 -5.0297 -5.0297 1.1024 1.1024 1.3011 1.3011 2.6216 2.6216 2.6750 2.6750 2.8215 2.8215 2.9912 2.9912 3.5305 3.5305 3.5434 3.5434 3.6492 3.6492 3.6846 3.6846 3.7937 3.7937 3.7956 3.7956 4.3283 4.3283 4.4719 4.4719 4.6129 4.6129 4.7057 4.7057 7.7371 7.7371 7.7677 7.7677 8.2447 8.2447 8.9829 8.9829 9.6075 9.6075 k = 0.3902 0.2253-0.0000 ( 6092 PWs) bands (ev): -24.7141 -24.7141 -24.7132 -24.7132 -8.4485 -8.4485 -8.4395 -8.4395 -8.2040 -8.2040 -8.1943 -8.1943 -8.1530 -8.1530 -8.1322 -8.1322 -5.0860 -5.0860 -5.0139 -5.0139 1.0606 1.0606 1.2680 1.2680 2.6363 2.6363 2.6884 2.6884 2.8302 2.8302 2.9821 2.9821 3.5312 3.5312 3.5419 3.5419 3.6361 3.6361 3.6691 3.6691 3.7827 3.7827 3.7856 3.7856 4.3599 4.3599 4.4457 4.4457 4.5851 4.5851 4.7109 4.7109 7.6787 7.6787 7.7355 7.7355 8.2541 8.2541 8.9456 8.9456 9.6654 9.6654 k = 0.4024 0.2323-0.0000 ( 6078 PWs) bands (ev): -24.7139 -24.7139 -24.7131 -24.7131 -8.4499 -8.4499 -8.4402 -8.4402 -8.2052 -8.2052 -8.1950 -8.1950 -8.1528 -8.1528 -8.1321 -8.1321 -5.0744 -5.0744 -4.9990 -4.9990 1.0222 1.0222 1.2378 1.2378 2.6500 2.6500 2.7009 2.7009 2.8382 2.8382 2.9739 2.9739 3.5317 3.5317 3.5403 3.5403 3.6222 3.6222 3.6541 3.6541 3.7739 3.7739 3.7797 3.7797 4.3859 4.3859 4.4187 4.4187 4.5645 4.5645 4.7181 4.7181 7.6167 7.6167 7.7142 7.7142 8.2618 8.2618 8.9123 8.9123 9.7242 9.7242 k = 0.4146 0.2394-0.0000 ( 6094 PWs) bands (ev): -24.7138 -24.7138 -24.7130 -24.7130 -8.4513 -8.4513 -8.4408 -8.4408 -8.2063 -8.2063 -8.1956 -8.1956 -8.1525 -8.1525 -8.1320 -8.1320 -5.0643 -5.0643 -4.9852 -4.9852 0.9877 0.9877 1.2105 1.2105 2.6627 2.6627 2.7123 2.7123 2.8454 2.8454 2.9666 2.9666 3.5321 3.5321 3.5382 3.5382 3.6084 3.6084 3.6403 3.6403 3.7682 3.7682 3.7753 3.7753 4.3925 4.3925 4.4026 4.4026 4.5545 4.5545 4.7255 4.7255 7.5592 7.5592 7.6963 7.6963 8.2681 8.2681 8.8827 8.8827 9.7831 9.7831 k = 0.4268 0.2464-0.0000 ( 6094 PWs) bands (ev): -24.7137 -24.7137 -24.7129 -24.7129 -8.4525 -8.4525 -8.4414 -8.4414 -8.2073 -8.2073 -8.1962 -8.1962 -8.1523 -8.1523 -8.1319 -8.1319 -5.0554 -5.0554 -4.9727 -4.9727 0.9572 0.9572 1.1864 1.1864 2.6741 2.6741 2.7226 2.7226 2.8518 2.8518 2.9604 2.9604 3.5323 3.5323 3.5359 3.5359 3.5955 3.5955 3.6284 3.6284 3.7645 3.7645 3.7720 3.7720 4.3685 4.3685 4.4078 4.4078 4.5571 4.5571 4.7320 4.7320 7.5076 7.5076 7.6810 7.6810 8.2732 8.2732 8.8571 8.8571 9.8410 9.8410 k = 0.4390 0.2535-0.0000 ( 6098 PWs) bands (ev): -24.7136 -24.7136 -24.7128 -24.7128 -8.4536 -8.4536 -8.4419 -8.4419 -8.2082 -8.2082 -8.1966 -8.1966 -8.1520 -8.1520 -8.1318 -8.1318 -5.0480 -5.0480 -4.9619 -4.9619 0.9310 0.9310 1.1658 1.1658 2.6841 2.6841 2.7314 2.7314 2.8574 2.8574 2.9550 2.9550 3.5322 3.5322 3.5334 3.5334 3.5842 3.5842 3.6186 3.6186 3.7623 3.7623 3.7693 3.7693 4.3473 4.3473 4.4038 4.4038 4.5696 4.5696 4.7371 4.7371 7.4628 7.4628 7.6680 7.6680 8.2772 8.2772 8.8354 8.8354 9.8968 9.8968 k = 0.4512 0.2605-0.0000 ( 6098 PWs) bands (ev): -24.7135 -24.7135 -24.7127 -24.7127 -8.4544 -8.4544 -8.4423 -8.4423 -8.2089 -8.2089 -8.1970 -8.1970 -8.1518 -8.1518 -8.1318 -8.1318 -5.0419 -5.0419 -4.9528 -4.9528 0.9093 0.9093 1.1486 1.1486 2.6925 2.6925 2.7388 2.7388 2.8620 2.8620 2.9507 2.9507 3.5304 3.5304 3.5324 3.5324 3.5749 3.5749 3.6109 3.6109 3.7611 3.7611 3.7671 3.7671 4.3294 4.3294 4.3956 4.3956 4.5864 4.5864 4.7404 4.7404 7.4253 7.4253 7.6574 7.6574 8.2803 8.2803 8.8177 8.8177 9.9489 9.9489 k = 0.4634 0.2676-0.0000 ( 6090 PWs) bands (ev): -24.7134 -24.7134 -24.7127 -24.7127 -8.4551 -8.4551 -8.4426 -8.4426 -8.2094 -8.2094 -8.1973 -8.1973 -8.1515 -8.1515 -8.1317 -8.1317 -5.0371 -5.0371 -4.9456 -4.9456 0.8923 0.8923 1.1352 1.1352 2.6993 2.6993 2.7446 2.7446 2.8657 2.8657 2.9474 2.9474 3.5278 3.5278 3.5321 3.5321 3.5677 3.5677 3.6051 3.6051 3.7606 3.7606 3.7654 3.7654 4.3151 4.3151 4.3869 4.3869 4.6033 4.6033 4.7421 4.7421 7.3955 7.3955 7.6491 7.6491 8.2825 8.2825 8.8039 8.8039 9.9951 9.9951 k = 0.4756 0.2746-0.0000 ( 6106 PWs) bands (ev): -24.7134 -24.7134 -24.7126 -24.7126 -8.4557 -8.4557 -8.4428 -8.4428 -8.2098 -8.2098 -8.1975 -8.1975 -8.1514 -8.1514 -8.1317 -8.1317 -5.0337 -5.0337 -4.9404 -4.9404 0.8800 0.8800 1.1255 1.1255 2.7042 2.7042 2.7488 2.7488 2.8683 2.8683 2.9450 2.9450 3.5256 3.5256 3.5318 3.5318 3.5627 3.5627 3.6011 3.6011 3.7606 3.7606 3.7639 3.7639 4.3048 4.3048 4.3798 4.3798 4.6175 4.6175 4.7425 4.7425 7.3740 7.3740 7.6432 7.6432 8.2841 8.2841 8.7940 8.7940 10.0326 10.0326 k = 0.4878 0.2816-0.0000 ( 6110 PWs) bands (ev): -24.7134 -24.7134 -24.7126 -24.7126 -8.4560 -8.4560 -8.4430 -8.4430 -8.2101 -8.2101 -8.1976 -8.1976 -8.1513 -8.1513 -8.1317 -8.1317 -5.0316 -5.0316 -4.9372 -4.9372 0.8726 0.8726 1.1196 1.1196 2.7072 2.7072 2.7512 2.7512 2.8699 2.8699 2.9435 2.9435 3.5241 3.5241 3.5316 3.5316 3.5599 3.5599 3.5988 3.5988 3.7609 3.7609 3.7627 3.7627 4.2985 4.2985 4.3751 4.3751 4.6269 4.6269 4.7423 4.7423 7.3609 7.3609 7.6397 7.6397 8.2850 8.2850 8.7881 8.7881 10.0576 10.0576 k = 0.5000 0.2887-0.0000 ( 6110 PWs) bands (ev): -24.7134 -24.7134 -24.7126 -24.7126 -8.4561 -8.4561 -8.4430 -8.4430 -8.2102 -8.2102 -8.1977 -8.1977 -8.1513 -8.1513 -8.1317 -8.1317 -5.0309 -5.0309 -4.9361 -4.9361 0.8701 0.8701 1.1177 1.1177 2.7082 2.7082 2.7521 2.7521 2.8704 2.8704 2.9431 2.9431 3.5236 3.5236 3.5315 3.5315 3.5589 3.5589 3.5980 3.5980 3.7613 3.7613 3.7620 3.7620 4.2963 4.2963 4.3736 4.3736 4.6302 4.6302 4.7421 4.7421 7.3565 7.3565 7.6385 7.6385 8.2853 8.2853 8.7862 8.7862 10.0665 10.0665 k = 0.5000 0.2887-0.0000 ( 6110 PWs) bands (ev): -24.7134 -24.7134 -24.7126 -24.7126 -8.4561 -8.4561 -8.4430 -8.4430 -8.2102 -8.2102 -8.1977 -8.1977 -8.1513 -8.1513 -8.1317 -8.1317 -5.0309 -5.0309 -4.9361 -4.9361 0.8701 0.8701 1.1177 1.1177 2.7082 2.7082 2.7521 2.7521 2.8704 2.8704 2.9431 2.9431 3.5236 3.5236 3.5315 3.5315 3.5589 3.5589 3.5980 3.5980 3.7613 3.7613 3.7620 3.7620 4.2963 4.2963 4.3736 4.3736 4.6302 4.6302 4.7421 4.7421 7.3565 7.3565 7.6385 7.6385 8.2853 8.2853 8.7862 8.7862 10.0665 10.0665 k = 0.4931 0.3007-0.0000 ( 6110 PWs) bands (ev): -24.7134 -24.7134 -24.7126 -24.7126 -8.4561 -8.4561 -8.4430 -8.4430 -8.2102 -8.2102 -8.1977 -8.1977 -8.1513 -8.1513 -8.1317 -8.1317 -5.0306 -5.0306 -4.9360 -4.9360 0.8711 0.8711 1.1182 1.1182 2.7068 2.7068 2.7517 2.7517 2.8705 2.8705 2.9430 2.9430 3.5216 3.5216 3.5331 3.5331 3.5580 3.5580 3.5983 3.5983 3.7605 3.7605 3.7626 3.7626 4.2930 4.2930 4.3692 4.3692 4.6299 4.6299 4.7424 4.7424 7.3580 7.3580 7.6482 7.6482 8.2931 8.2931 8.7830 8.7830 10.0690 10.0690 k = 0.4861 0.3127-0.0000 ( 6120 PWs) bands (ev): -24.7134 -24.7134 -24.7126 -24.7126 -8.4560 -8.4560 -8.4430 -8.4430 -8.2102 -8.2102 -8.1976 -8.1976 -8.1515 -8.1515 -8.1319 -8.1319 -5.0294 -5.0294 -4.9356 -4.9356 0.8739 0.8739 1.1198 1.1198 2.7026 2.7026 2.7504 2.7504 2.8706 2.8706 2.9425 2.9425 3.5173 3.5173 3.5358 3.5358 3.5554 3.5554 3.5991 3.5991 3.7591 3.7591 3.7633 3.7633 4.2832 4.2832 4.3562 4.3562 4.6292 4.6292 4.7436 4.7436 7.3623 7.3623 7.6771 7.6771 8.3163 8.3163 8.7738 8.7738 10.0767 10.0767 k = 0.4792 0.3248-0.0000 ( 6120 PWs) bands (ev): -24.7134 -24.7134 -24.7126 -24.7126 -8.4559 -8.4559 -8.4430 -8.4430 -8.2103 -8.2103 -8.1975 -8.1975 -8.1519 -8.1519 -8.1322 -8.1322 -5.0275 -5.0275 -4.9349 -4.9349 0.8786 0.8786 1.1224 1.1224 2.6955 2.6955 2.7484 2.7484 2.8708 2.8708 2.9417 2.9417 3.5122 3.5122 3.5382 3.5382 3.5515 3.5515 3.6003 3.6003 3.7576 3.7576 3.7638 3.7638 4.2672 4.2672 4.3349 4.3349 4.6287 4.6287 4.7455 4.7455 7.3696 7.3696 7.7242 7.7242 8.3544 8.3544 8.7586 8.7586 10.0896 10.0896 k = 0.4722 0.3368-0.0000 ( 6114 PWs) bands (ev): -24.7133 -24.7133 -24.7125 -24.7125 -8.4557 -8.4557 -8.4430 -8.4430 -8.2103 -8.2103 -8.1974 -8.1974 -8.1523 -8.1523 -8.1326 -8.1326 -5.0250 -5.0250 -4.9340 -4.9340 0.8850 0.8850 1.1260 1.1260 2.6850 2.6850 2.7458 2.7458 2.8710 2.8710 2.9408 2.9408 3.5065 3.5065 3.5392 3.5392 3.5474 3.5474 3.6016 3.6016 3.7557 3.7557 3.7643 3.7643 4.2454 4.2454 4.3063 4.3063 4.6290 4.6290 4.7482 4.7482 7.3796 7.3796 7.7882 7.7882 8.4064 8.4064 8.7379 8.7379 10.1076 10.1076 k = 0.4653 0.3488-0.0000 ( 6114 PWs) bands (ev): -24.7133 -24.7133 -24.7125 -24.7125 -8.4554 -8.4554 -8.4429 -8.4429 -8.2104 -8.2104 -8.1972 -8.1972 -8.1529 -8.1529 -8.1331 -8.1331 -5.0217 -5.0217 -4.9329 -4.9329 0.8932 0.8932 1.1307 1.1307 2.6712 2.6712 2.7427 2.7427 2.8712 2.8712 2.9396 2.9396 3.5002 3.5002 3.5361 3.5361 3.5460 3.5460 3.6029 3.6029 3.7536 3.7536 3.7646 3.7646 4.2182 4.2182 4.2718 4.2718 4.6306 4.6306 4.7517 4.7517 7.3924 7.3924 7.8674 7.8674 8.4709 8.4709 8.7126 8.7126 10.1308 10.1308 k = 0.4583 0.3608-0.0000 ( 6112 PWs) bands (ev): -24.7133 -24.7133 -24.7125 -24.7125 -8.4552 -8.4552 -8.4429 -8.4429 -8.2106 -8.2106 -8.1970 -8.1970 -8.1536 -8.1536 -8.1337 -8.1337 -5.0177 -5.0177 -4.9315 -4.9315 0.9029 0.9029 1.1365 1.1365 2.6537 2.6537 2.7389 2.7389 2.8715 2.8715 2.9383 2.9383 3.4932 3.4932 3.5296 3.5296 3.5466 3.5466 3.6041 3.6041 3.7511 3.7511 3.7648 3.7648 4.1861 4.1861 4.2336 4.2336 4.6337 4.6337 4.7561 4.7561 7.4078 7.4078 7.9599 7.9599 8.5450 8.5450 8.6845 8.6845 10.1594 10.1594 k = 0.4514 0.3729-0.0000 ( 6110 PWs) bands (ev): -24.7133 -24.7133 -24.7124 -24.7124 -8.4549 -8.4549 -8.4428 -8.4428 -8.2108 -8.2108 -8.1968 -8.1968 -8.1544 -8.1544 -8.1344 -8.1344 -5.0132 -5.0132 -4.9300 -4.9300 0.9140 0.9140 1.1433 1.1433 2.6326 2.6326 2.7344 2.7344 2.8716 2.8716 2.9370 2.9370 3.4856 3.4856 3.5219 3.5219 3.5475 3.5475 3.6051 3.6051 3.7484 3.7484 3.7649 3.7649 4.1490 4.1490 4.1944 4.1944 4.6383 4.6383 4.7612 4.7612 7.4257 7.4257 8.0635 8.0635 8.6117 8.6117 8.6699 8.6699 10.1934 10.1934 k = 0.4444 0.3849-0.0000 ( 6113 PWs) bands (ev): -24.7132 -24.7132 -24.7124 -24.7124 -8.4545 -8.4545 -8.4428 -8.4428 -8.2110 -8.2110 -8.1965 -8.1965 -8.1553 -8.1553 -8.1351 -8.1351 -5.0080 -5.0080 -4.9282 -4.9282 0.9264 0.9264 1.1513 1.1513 2.6077 2.6077 2.7290 2.7290 2.8717 2.8717 2.9358 2.9358 3.4771 3.4771 3.5138 3.5138 3.5480 3.5480 3.6057 3.6057 3.7455 3.7455 3.7650 3.7650 4.1075 4.1075 4.1562 4.1562 4.6442 4.6442 4.7672 4.7672 7.4460 7.4460 8.1759 8.1759 8.5992 8.5992 8.7395 8.7395 10.2330 10.2330 k = 0.4375 0.3969-0.0000 ( 6105 PWs) bands (ev): -24.7132 -24.7132 -24.7124 -24.7124 -8.4541 -8.4541 -8.4427 -8.4427 -8.2112 -8.2112 -8.1962 -8.1962 -8.1563 -8.1563 -8.1358 -8.1358 -5.0024 -5.0024 -4.9264 -4.9264 0.9397 0.9397 1.1603 1.1603 2.5791 2.5791 2.7227 2.7227 2.8717 2.8717 2.9347 2.9347 3.4677 3.4677 3.5059 3.5059 3.5481 3.5481 3.6060 3.6060 3.7423 3.7423 3.7650 3.7650 4.0634 4.0634 4.1203 4.1203 4.6515 4.6515 4.7737 4.7737 7.4686 7.4686 8.2940 8.2940 8.5632 8.5632 8.8374 8.8374 10.2784 10.2784 k = 0.4306 0.4090-0.0000 ( 6097 PWs) bands (ev): -24.7131 -24.7131 -24.7123 -24.7123 -8.4538 -8.4538 -8.4427 -8.4427 -8.2116 -8.2116 -8.1959 -8.1959 -8.1572 -8.1572 -8.1366 -8.1366 -4.9963 -4.9963 -4.9244 -4.9244 0.9537 0.9537 1.1705 1.1705 2.5469 2.5469 2.7153 2.7153 2.8715 2.8715 2.9339 2.9339 3.4574 3.4574 3.4982 3.4982 3.5479 3.5479 3.6058 3.6058 3.7389 3.7389 3.7650 3.7650 4.0186 4.0186 4.0865 4.0865 4.6598 4.6598 4.7808 4.7808 7.4931 7.4931 8.4090 8.4090 8.5312 8.5312 8.9412 8.9412 10.3298 10.3298 k = 0.4236 0.4210-0.0000 ( 6095 PWs) bands (ev): -24.7131 -24.7131 -24.7123 -24.7123 -8.4534 -8.4534 -8.4427 -8.4427 -8.2119 -8.2119 -8.1955 -8.1955 -8.1583 -8.1583 -8.1374 -8.1374 -4.9898 -4.9898 -4.9224 -4.9224 0.9681 0.9681 1.1820 1.1820 2.5112 2.5112 2.7070 2.7070 2.8712 2.8712 2.9334 2.9334 3.4464 3.4464 3.4910 3.4910 3.5472 3.5472 3.6049 3.6049 3.7354 3.7354 3.7649 3.7649 3.9751 3.9751 4.0552 4.0552 4.6691 4.6691 4.7883 4.7883 7.5196 7.5196 8.4490 8.4490 8.5750 8.5750 9.0467 9.0467 10.3876 10.3876 k = 0.4167 0.4330-0.0000 ( 6103 PWs) bands (ev): -24.7130 -24.7130 -24.7122 -24.7122 -8.4530 -8.4530 -8.4426 -8.4426 -8.2124 -8.2124 -8.1952 -8.1952 -8.1593 -8.1593 -8.1382 -8.1382 -4.9831 -4.9831 -4.9204 -4.9204 0.9824 0.9824 1.1948 1.1948 2.4725 2.4725 2.6976 2.6976 2.8707 2.8707 2.9333 2.9333 3.4350 3.4350 3.4843 3.4843 3.5462 3.5462 3.6033 3.6033 3.7316 3.7316 3.7647 3.7647 3.9341 3.9341 4.0262 4.0262 4.6792 4.6792 4.7961 4.7961 7.5476 7.5476 8.4127 8.4127 8.6948 8.6948 9.1510 9.1510 10.4520 10.4520 k = 0.4097 0.4450-0.0000 ( 6099 PWs) bands (ev): -24.7130 -24.7130 -24.7122 -24.7122 -8.4526 -8.4526 -8.4426 -8.4426 -8.2128 -8.2128 -8.1948 -8.1948 -8.1603 -8.1603 -8.1389 -8.1389 -4.9761 -4.9761 -4.9185 -4.9185 0.9964 0.9964 1.2089 1.2089 2.4313 2.4313 2.6875 2.6875 2.8701 2.8701 2.9336 2.9336 3.4235 3.4235 3.4781 3.4781 3.5450 3.5450 3.6006 3.6006 3.7278 3.7278 3.7644 3.7644 3.8969 3.8969 4.0000 4.0000 4.6899 4.6899 4.8039 4.8039 7.5771 7.5771 8.3675 8.3675 8.8217 8.8217 9.2511 9.2511 10.5236 10.5236 k = 0.4028 0.4571-0.0000 ( 6097 PWs) bands (ev): -24.7129 -24.7129 -24.7122 -24.7122 -8.4523 -8.4523 -8.4426 -8.4426 -8.2133 -8.2133 -8.1944 -8.1944 -8.1613 -8.1613 -8.1396 -8.1396 -4.9690 -4.9690 -4.9166 -4.9166 1.0096 1.0096 1.2242 1.2242 2.3882 2.3882 2.6768 2.6768 2.8693 2.8693 2.9343 2.9343 3.4123 3.4123 3.4724 3.4724 3.5435 3.5435 3.5969 3.5969 3.7240 3.7240 3.7640 3.7640 3.8640 3.8640 3.9765 3.9765 4.7011 4.7011 4.8117 4.8117 7.6076 7.6076 8.3204 8.3204 8.9467 8.9467 9.3441 9.3441 10.5318 10.5318 k = 0.3958 0.4691-0.0000 ( 6097 PWs) bands (ev): -24.7129 -24.7129 -24.7121 -24.7121 -8.4520 -8.4520 -8.4426 -8.4426 -8.2138 -8.2138 -8.1941 -8.1941 -8.1622 -8.1622 -8.1403 -8.1403 -4.9619 -4.9619 -4.9148 -4.9148 1.0217 1.0217 1.2407 1.2407 2.3441 2.3441 2.6657 2.6657 2.8684 2.8684 2.9352 2.9352 3.4017 3.4017 3.4673 3.4673 3.5419 3.5419 3.5919 3.5919 3.7203 3.7203 3.7635 3.7635 3.8361 3.8361 3.9556 3.9556 4.7126 4.7126 4.8192 4.8192 7.6389 7.6389 8.2730 8.2730 9.0667 9.0667 9.4277 9.4277 10.4491 10.4491 k = 0.3889 0.4811-0.0000 ( 6101 PWs) bands (ev): -24.7128 -24.7128 -24.7121 -24.7121 -8.4517 -8.4517 -8.4426 -8.4426 -8.2144 -8.2144 -8.1938 -8.1938 -8.1630 -8.1630 -8.1409 -8.1409 -4.9548 -4.9548 -4.9132 -4.9132 1.0324 1.0324 1.2582 1.2582 2.3000 2.3000 2.6547 2.6547 2.8675 2.8675 2.9364 2.9364 3.3918 3.3918 3.4626 3.4626 3.5402 3.5402 3.5857 3.5857 3.7167 3.7167 3.7626 3.7626 3.8133 3.8133 3.9374 3.9374 4.7241 4.7241 4.8262 4.8262 7.6707 7.6707 8.2260 8.2260 9.1788 9.1788 9.5004 9.5004 10.3728 10.3728 k = 0.3819 0.4932-0.0000 ( 6097 PWs) bands (ev): -24.7128 -24.7128 -24.7120 -24.7120 -8.4515 -8.4515 -8.4426 -8.4426 -8.2149 -8.2149 -8.1936 -8.1936 -8.1638 -8.1638 -8.1414 -8.1414 -4.9479 -4.9479 -4.9119 -4.9119 1.0416 1.0416 1.2761 1.2761 2.2568 2.2568 2.6439 2.6439 2.8665 2.8665 2.9377 2.9377 3.3829 3.3829 3.4584 3.4584 3.5385 3.5385 3.5785 3.5785 3.7135 3.7135 3.7612 3.7612 3.7957 3.7957 3.9217 3.9217 4.7356 4.7356 4.8326 4.8326 7.7028 7.7028 8.1798 8.1798 9.2805 9.2805 9.5618 9.5618 10.3038 10.3038 k = 0.3750 0.5052-0.0000 ( 6093 PWs) bands (ev): -24.7127 -24.7127 -24.7120 -24.7120 -8.4513 -8.4513 -8.4426 -8.4426 -8.2154 -8.2154 -8.1934 -8.1934 -8.1644 -8.1644 -8.1419 -8.1419 -4.9413 -4.9413 -4.9108 -4.9108 1.0491 1.0491 1.2939 1.2939 2.2159 2.2159 2.6339 2.6339 2.8656 2.8656 2.9390 2.9390 3.3750 3.3750 3.4547 3.4547 3.5368 3.5368 3.5707 3.5707 3.7108 3.7108 3.7585 3.7585 3.7834 3.7834 3.9084 3.9084 4.7468 4.7468 4.8383 4.8383 7.7347 7.7347 8.1350 8.1350 9.3696 9.3696 9.6125 9.6125 10.2425 10.2425 k = 0.3681 0.5172-0.0000 ( 6093 PWs) bands (ev): -24.7127 -24.7127 -24.7119 -24.7119 -8.4511 -8.4511 -8.4426 -8.4426 -8.2158 -8.2158 -8.1932 -8.1932 -8.1649 -8.1649 -8.1423 -8.1423 -4.9351 -4.9351 -4.9101 -4.9101 1.0550 1.0550 1.3109 1.3109 2.1784 2.1784 2.6249 2.6249 2.8647 2.8647 2.9403 2.9403 3.3683 3.3683 3.4516 3.4516 3.5353 3.5353 3.5628 3.5628 3.7087 3.7087 3.7544 3.7544 3.7761 3.7761 3.8974 3.8974 4.7573 4.7573 4.8430 4.8430 7.7663 7.7663 8.0918 8.0918 9.4439 9.4439 9.6540 9.6540 10.1898 10.1898 k = 0.3611 0.5292-0.0000 ( 6097 PWs) bands (ev): -24.7127 -24.7127 -24.7119 -24.7119 -8.4510 -8.4510 -8.4427 -8.4427 -8.2162 -8.2162 -8.1931 -8.1931 -8.1653 -8.1653 -8.1426 -8.1426 -4.9293 -4.9293 -4.9098 -4.9098 1.0595 1.0595 1.3263 1.3263 2.1457 2.1457 2.6173 2.6173 2.8640 2.8640 2.9414 2.9414 3.3628 3.3628 3.4489 3.4489 3.5341 3.5341 3.5554 3.5554 3.7071 3.7071 3.7495 3.7495 3.7724 3.7724 3.8885 3.8885 4.7671 4.7671 4.8466 4.8466 7.7973 7.7973 8.0508 8.0508 9.5021 9.5021 9.6879 9.6879 10.1460 10.1460 k = 0.3542 0.5413-0.0000 ( 6097 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4509 -8.4509 -8.4427 -8.4427 -8.2166 -8.2166 -8.1931 -8.1931 -8.1656 -8.1656 -8.1428 -8.1428 -4.9242 -4.9242 -4.9100 -4.9100 1.0625 1.0625 1.3392 1.3392 2.1189 2.1189 2.6112 2.6112 2.8634 2.8634 2.9423 2.9423 3.3584 3.3584 3.4469 3.4469 3.5332 3.5332 3.5489 3.5489 3.7060 3.7060 3.7450 3.7450 3.7706 3.7706 3.8816 3.8816 4.7756 4.7756 4.8492 4.8492 7.8276 7.8276 8.0122 8.0122 9.5442 9.5442 9.7150 9.7150 10.1116 10.1116 k = 0.3472 0.5533-0.0000 ( 6109 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4509 -8.4509 -8.4427 -8.4427 -8.2168 -8.2168 -8.1930 -8.1930 -8.1658 -8.1658 -8.1430 -8.1430 -4.9199 -4.9199 -4.9106 -4.9106 1.0643 1.0643 1.3488 1.3488 2.0991 2.0991 2.6068 2.6068 2.8629 2.8629 2.9430 2.9430 3.3552 3.3552 3.4454 3.4454 3.5327 3.5327 3.5437 3.5437 3.7054 3.7054 3.7416 3.7416 3.7697 3.7697 3.8768 3.8768 4.7824 4.7824 4.8507 4.8507 7.8571 7.8571 7.9763 7.9763 9.5714 9.5714 9.7353 9.7353 10.0869 10.0869 k = 0.3403 0.5653-0.0000 ( 6123 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4509 -8.4509 -8.4427 -8.4427 -8.2170 -8.2170 -8.1930 -8.1930 -8.1659 -8.1659 -8.1431 -8.1431 -4.9163 -4.9163 -4.9118 -4.9118 1.0652 1.0652 1.3547 1.3547 2.0870 2.0870 2.6042 2.6042 2.8627 2.8627 2.9433 2.9433 3.3533 3.3533 3.4445 3.4445 3.5326 3.5326 3.5402 3.5402 3.7051 3.7051 3.7394 3.7394 3.7692 3.7692 3.8738 3.8738 4.7870 4.7870 4.8513 4.8513 7.8858 7.8858 7.9434 7.9434 9.5861 9.5861 9.7479 9.7479 10.0721 10.0721 k = 0.3333 0.5774-0.0000 ( 6123 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4509 -8.4509 -8.4427 -8.4427 -8.2171 -8.2171 -8.1930 -8.1930 -8.1660 -8.1660 -8.1432 -8.1432 -4.9141 -4.9141 -4.9132 -4.9132 1.0655 1.0655 1.3566 1.3566 2.0830 2.0830 2.6033 2.6033 2.8626 2.8626 2.9435 2.9435 3.3526 3.3526 3.4442 3.4442 3.5326 3.5326 3.5390 3.5390 3.7050 3.7050 3.7387 3.7387 3.7691 3.7691 3.8729 3.8729 4.7887 4.7887 4.8515 4.8515 7.9131 7.9131 7.9146 7.9146 9.5905 9.5905 9.7521 9.7521 10.0671 10.0671 k = 0.3333 0.5774-0.0000 ( 6123 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4509 -8.4509 -8.4427 -8.4427 -8.2171 -8.2171 -8.1930 -8.1930 -8.1660 -8.1660 -8.1432 -8.1432 -4.9141 -4.9141 -4.9132 -4.9132 1.0655 1.0655 1.3566 1.3566 2.0830 2.0830 2.6033 2.6033 2.8626 2.8626 2.9435 2.9435 3.3526 3.3526 3.4442 3.4442 3.5326 3.5326 3.5390 3.5390 3.7050 3.7050 3.7387 3.7387 3.7691 3.7691 3.8729 3.8729 4.7887 4.7887 4.8515 4.8515 7.9131 7.9131 7.9146 7.9146 9.5905 9.5905 9.7521 9.7521 10.0671 10.0671 k = 0.3262 0.5651-0.0000 ( 6125 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4509 -8.4509 -8.4427 -8.4427 -8.2170 -8.2170 -8.1930 -8.1930 -8.1659 -8.1659 -8.1431 -8.1431 -4.9162 -4.9162 -4.9120 -4.9120 1.0653 1.0653 1.3548 1.3548 2.0870 2.0870 2.6041 2.6041 2.8627 2.8627 2.9434 2.9434 3.3533 3.3533 3.4445 3.4445 3.5326 3.5326 3.5402 3.5402 3.7050 3.7050 3.7395 3.7395 3.7692 3.7692 3.8739 3.8739 4.7867 4.7867 4.8514 4.8514 7.8874 7.8874 7.9421 7.9421 9.5863 9.5863 9.7479 9.7479 10.0722 10.0722 k = 0.3191 0.5528-0.0000 ( 6121 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4509 -8.4509 -8.4427 -8.4427 -8.2168 -8.2168 -8.1930 -8.1930 -8.1659 -8.1659 -8.1430 -8.1430 -4.9194 -4.9194 -4.9116 -4.9116 1.0651 1.0651 1.3499 1.3499 2.0985 2.0985 2.6065 2.6065 2.8629 2.8629 2.9431 2.9431 3.3555 3.3555 3.4453 3.4453 3.5333 3.5333 3.5436 3.5436 3.7053 3.7053 3.7417 3.7417 3.7697 3.7697 3.8769 3.8769 4.7806 4.7806 4.8512 4.8512 7.8648 7.8648 7.9703 7.9703 9.5745 9.5745 9.7360 9.7360 10.0872 10.0872 k = 0.3121 0.5405-0.0000 ( 6109 PWs) bands (ev): -24.7127 -24.7127 -24.7119 -24.7119 -8.4508 -8.4508 -8.4427 -8.4427 -8.2165 -8.2165 -8.1929 -8.1929 -8.1658 -8.1658 -8.1429 -8.1429 -4.9233 -4.9233 -4.9125 -4.9125 1.0652 1.0652 1.3430 1.3430 2.1162 2.1162 2.6101 2.6101 2.8631 2.8631 2.9427 2.9427 3.3594 3.3594 3.4467 3.4467 3.5348 3.5348 3.5488 3.5488 3.7056 3.7056 3.7453 3.7453 3.7708 3.7708 3.8822 3.8822 4.7704 4.7704 4.8507 4.8507 7.8465 7.8465 7.9989 7.9989 9.5553 9.5553 9.7179 9.7179 10.1116 10.1116 k = 0.3050 0.5282-0.0000 ( 6113 PWs) bands (ev): -24.7127 -24.7127 -24.7119 -24.7119 -8.4508 -8.4508 -8.4426 -8.4426 -8.2160 -8.2160 -8.1928 -8.1928 -8.1656 -8.1656 -8.1427 -8.1427 -4.9280 -4.9280 -4.9147 -4.9147 1.0659 1.0659 1.3351 1.3351 2.1390 2.1390 2.6146 2.6146 2.8633 2.8633 2.9422 2.9422 3.3651 3.3651 3.4484 3.4484 3.5372 3.5372 3.5557 3.5557 3.7062 3.7062 3.7499 3.7499 3.7730 3.7730 3.8895 3.8895 4.7562 4.7562 4.8494 4.8494 7.8326 7.8326 8.0284 8.0284 9.5290 9.5290 9.6955 9.6955 10.1450 10.1450 k = 0.2979 0.5159-0.0000 ( 6117 PWs) bands (ev): -24.7127 -24.7127 -24.7120 -24.7120 -8.4506 -8.4506 -8.4425 -8.4425 -8.2154 -8.2154 -8.1927 -8.1927 -8.1655 -8.1655 -8.1424 -8.1424 -4.9335 -4.9335 -4.9184 -4.9184 1.0676 1.0676 1.3274 1.3274 2.1655 2.1655 2.6196 2.6196 2.8634 2.8634 2.9420 2.9420 3.3727 3.3727 3.4504 3.4504 3.5404 3.5404 3.5644 3.5644 3.7070 3.7070 3.7549 3.7549 3.7773 3.7773 3.8991 3.8991 4.7382 4.7382 4.8470 4.8470 7.8232 7.8232 8.0593 8.0593 9.4955 9.4955 9.6706 9.6706 10.1866 10.1866 k = 0.2908 0.5036-0.0000 ( 6119 PWs) bands (ev): -24.7128 -24.7128 -24.7120 -24.7120 -8.4504 -8.4504 -8.4424 -8.4424 -8.2147 -8.2147 -8.1925 -8.1925 -8.1654 -8.1654 -8.1422 -8.1422 -4.9398 -4.9398 -4.9235 -4.9235 1.0706 1.0706 1.3208 1.3208 2.1944 2.1944 2.6247 2.6247 2.8631 2.8631 2.9421 2.9421 3.3825 3.3825 3.4528 3.4528 3.5442 3.5442 3.5747 3.5747 3.7082 3.7082 3.7589 3.7589 3.7854 3.7854 3.9112 3.9112 4.7168 4.7168 4.8431 4.8431 7.8187 7.8187 8.0922 8.0922 9.4553 9.4553 9.6441 9.6441 10.2357 10.2357 k = 0.2837 0.4914-0.0000 ( 6123 PWs) bands (ev): -24.7129 -24.7129 -24.7121 -24.7121 -8.4501 -8.4501 -8.4422 -8.4422 -8.2139 -8.2139 -8.1923 -8.1923 -8.1653 -8.1653 -8.1419 -8.1419 -4.9468 -4.9468 -4.9302 -4.9302 1.0753 1.0753 1.3161 1.3161 2.2246 2.2246 2.6297 2.6297 2.8623 2.8623 2.9428 2.9428 3.3948 3.3948 3.4553 3.4553 3.5484 3.5484 3.5865 3.5865 3.7098 3.7098 3.7617 3.7617 3.7982 3.7982 3.9257 3.9257 4.6921 4.6921 4.8376 4.8376 7.8189 7.8189 8.1274 8.1274 9.4090 9.4090 9.6169 9.6169 10.2916 10.2916 k = 0.2766 0.4791-0.0000 ( 6115 PWs) bands (ev): -24.7130 -24.7130 -24.7122 -24.7122 -8.4497 -8.4497 -8.4420 -8.4420 -8.2129 -8.2129 -8.1920 -8.1920 -8.1652 -8.1652 -8.1415 -8.1415 -4.9547 -4.9547 -4.9384 -4.9384 1.0819 1.0819 1.3138 1.3138 2.2549 2.2549 2.6340 2.6340 2.8609 2.8609 2.9442 2.9442 3.4096 3.4096 3.4580 3.4580 3.5528 3.5528 3.5997 3.5997 3.7119 3.7119 3.7637 3.7637 3.8156 3.8156 3.9431 3.9431 4.6646 4.6646 4.8302 4.8302 7.8242 7.8242 8.1654 8.1654 9.3576 9.3576 9.5891 9.5891 10.3533 10.3533 k = 0.2695 0.4668-0.0000 ( 6109 PWs) bands (ev): -24.7130 -24.7130 -24.7123 -24.7123 -8.4492 -8.4492 -8.4418 -8.4418 -8.2117 -8.2117 -8.1917 -8.1917 -8.1650 -8.1650 -8.1412 -8.1412 -4.9633 -4.9633 -4.9482 -4.9482 1.0907 1.0907 1.3144 1.3144 2.2846 2.2846 2.6375 2.6375 2.8588 2.8588 2.9465 2.9465 3.4272 3.4272 3.4608 3.4608 3.5572 3.5572 3.6140 3.6140 3.7147 3.7147 3.7653 3.7653 3.8378 3.8378 3.9632 3.9632 4.6343 4.6343 4.8209 4.8209 7.8344 7.8344 8.2066 8.2066 9.3020 9.3020 9.5606 9.5606 10.4201 10.4201 k = 0.2624 0.4545-0.0000 ( 6113 PWs) bands (ev): -24.7132 -24.7132 -24.7124 -24.7124 -8.4486 -8.4486 -8.4415 -8.4415 -8.2105 -8.2105 -8.1914 -8.1914 -8.1649 -8.1649 -8.1408 -8.1408 -4.9727 -4.9727 -4.9595 -4.9595 1.1020 1.1020 1.3182 1.3182 2.3128 2.3128 2.6398 2.6398 2.8557 2.8557 2.9497 2.9497 3.4475 3.4475 3.4636 3.4636 3.5614 3.5614 3.6290 3.6290 3.7184 3.7184 3.7670 3.7670 3.8647 3.8647 3.9864 3.9864 4.6017 4.6017 4.8097 4.8097 7.8497 7.8497 8.2512 8.2512 9.2432 9.2432 9.5312 9.5312 10.4911 10.4911 k = 0.2553 0.4422-0.0000 ( 6113 PWs) bands (ev): -24.7133 -24.7133 -24.7125 -24.7125 -8.4479 -8.4479 -8.4412 -8.4412 -8.2091 -8.2091 -8.1911 -8.1911 -8.1647 -8.1647 -8.1404 -8.1404 -4.9828 -4.9828 -4.9725 -4.9725 1.1161 1.1161 1.3253 1.3253 2.3389 2.3389 2.6407 2.6407 2.8518 2.8518 2.9540 2.9540 3.4664 3.4664 3.4707 3.4707 3.5651 3.5651 3.6441 3.6441 3.7237 3.7237 3.7689 3.7689 3.8964 3.8964 4.0129 4.0129 4.5671 4.5671 4.7965 4.7965 7.8701 7.8701 8.2993 8.2993 9.1821 9.1821 9.5009 9.5009 10.5652 10.5652 k = 0.2482 0.4299-0.0000 ( 6109 PWs) bands (ev): -24.7134 -24.7134 -24.7126 -24.7126 -8.4471 -8.4471 -8.4409 -8.4409 -8.2076 -8.2076 -8.1908 -8.1908 -8.1645 -8.1645 -8.1400 -8.1400 -4.9936 -4.9936 -4.9869 -4.9869 1.1329 1.1329 1.3357 1.3357 2.3625 2.3625 2.6402 2.6402 2.8470 2.8470 2.9593 2.9593 3.4693 3.4693 3.4963 3.4963 3.5684 3.5684 3.6587 3.6587 3.7313 3.7313 3.7712 3.7712 3.9330 3.9330 4.0428 4.0428 4.5308 4.5308 4.7815 4.7815 7.8954 7.8954 8.3510 8.3510 9.1191 9.1191 9.4694 9.4694 10.5579 10.5579 k = 0.2411 0.4177-0.0000 ( 6103 PWs) bands (ev): -24.7135 -24.7135 -24.7128 -24.7128 -8.4461 -8.4461 -8.4404 -8.4404 -8.2060 -8.2060 -8.1905 -8.1905 -8.1642 -8.1642 -8.1396 -8.1396 -5.0051 -5.0051 -5.0027 -5.0027 1.1528 1.1528 1.3496 1.3496 2.3832 2.3832 2.6382 2.6382 2.8414 2.8414 2.9656 2.9656 3.4722 3.4722 3.5240 3.5240 3.5711 3.5711 3.6719 3.6719 3.7422 3.7422 3.7744 3.7744 3.9742 3.9742 4.0762 4.0762 4.4931 4.4931 4.7648 4.7648 7.9257 7.9257 8.4063 8.4063 9.0550 9.0550 9.4368 9.4368 10.4537 10.4537 k = 0.2340 0.4054-0.0000 ( 6087 PWs) bands (ev): -24.7137 -24.7137 -24.7129 -24.7129 -8.4450 -8.4450 -8.4399 -8.4399 -8.2043 -8.2043 -8.1902 -8.1902 -8.1638 -8.1638 -8.1392 -8.1392 -5.0200 -5.0200 -5.0171 -5.0171 1.1758 1.1758 1.3668 1.3668 2.4008 2.4008 2.6348 2.6348 2.8348 2.8348 2.9728 2.9728 3.4750 3.4750 3.5531 3.5531 3.5732 3.5732 3.6829 3.6829 3.7574 3.7574 3.7790 3.7790 4.0198 4.0198 4.1134 4.1134 4.4548 4.4548 4.7464 4.7464 7.9609 7.9609 8.4651 8.4651 8.9902 8.9902 9.4030 9.4030 10.3512 10.3512 k = 0.2270 0.3931-0.0000 ( 6105 PWs) bands (ev): -24.7139 -24.7139 -24.7131 -24.7131 -8.4439 -8.4439 -8.4394 -8.4394 -8.2025 -8.2025 -8.1901 -8.1901 -8.1633 -8.1633 -8.1388 -8.1388 -5.0386 -5.0386 -5.0297 -5.0297 1.2019 1.2019 1.3872 1.3872 2.4152 2.4152 2.6298 2.6298 2.8275 2.8275 2.9810 2.9810 3.4776 3.4776 3.5746 3.5746 3.5824 3.5824 3.6920 3.6920 3.7757 3.7757 3.7865 3.7865 4.0688 4.0688 4.1542 4.1542 4.4164 4.4164 4.7267 4.7267 8.0009 8.0009 8.5268 8.5268 8.9251 8.9251 9.3680 9.3680 10.2507 10.2507 k = 0.2199 0.3808-0.0000 ( 6099 PWs) bands (ev): -24.7140 -24.7140 -24.7133 -24.7133 -8.4427 -8.4427 -8.4387 -8.4387 -8.2007 -8.2007 -8.1899 -8.1899 -8.1626 -8.1626 -8.1384 -8.1384 -5.0584 -5.0584 -5.0428 -5.0428 1.2311 1.2311 1.4106 1.4106 2.4266 2.4266 2.6234 2.6234 2.8193 2.8193 2.9901 2.9901 3.4803 3.4803 3.5756 3.5756 3.6099 3.6099 3.7001 3.7001 3.7909 3.7909 3.8044 3.8044 4.1203 4.1203 4.1987 4.1987 4.3792 4.3792 4.7060 4.7060 8.0456 8.0456 8.5908 8.5908 8.8606 8.8606 9.3320 9.3320 10.1524 10.1524 k = 0.2128 0.3685-0.0000 ( 6099 PWs) bands (ev): -24.7142 -24.7142 -24.7134 -24.7134 -8.4416 -8.4416 -8.4379 -8.4379 -8.1989 -8.1989 -8.1897 -8.1897 -8.1619 -8.1619 -8.1381 -8.1381 -5.0794 -5.0794 -5.0563 -5.0563 1.2632 1.2632 1.4369 1.4369 2.4351 2.4351 2.6158 2.6158 2.8103 2.8103 3.0001 3.0001 3.4827 3.4827 3.5760 3.5760 3.6335 3.6335 3.7081 3.7081 3.8054 3.8054 3.8312 3.8312 4.1708 4.1708 4.2464 4.2464 4.3466 4.3466 4.6848 4.6848 8.0949 8.0949 8.6539 8.6539 8.7996 8.7996 9.2951 9.2951 10.0563 10.0563 k = 0.2057 0.3562-0.0000 ( 6105 PWs) bands (ev): -24.7144 -24.7144 -24.7136 -24.7136 -8.4406 -8.4406 -8.4368 -8.4368 -8.1971 -8.1971 -8.1895 -8.1895 -8.1609 -8.1609 -8.1377 -8.1377 -5.1013 -5.1013 -5.0702 -5.0702 1.2983 1.2983 1.4658 1.4658 2.4407 2.4407 2.6071 2.6071 2.8006 2.8006 3.0109 3.0109 3.4851 3.4851 3.5760 3.5760 3.6513 3.6513 3.7165 3.7165 3.8258 3.8258 3.8619 3.8619 4.2085 4.2085 4.2967 4.2967 4.3302 4.3302 4.6639 4.6639 8.1486 8.1486 8.6889 8.6889 8.7690 8.7690 9.2576 9.2576 9.9626 9.9626 k = 0.1986 0.3440-0.0000 ( 6111 PWs) bands (ev): -24.7146 -24.7146 -24.7138 -24.7138 -8.4398 -8.4398 -8.4354 -8.4354 -8.1956 -8.1956 -8.1889 -8.1889 -8.1599 -8.1599 -8.1374 -8.1374 -5.1241 -5.1241 -5.0844 -5.0844 1.3361 1.3361 1.4971 1.4971 2.4439 2.4439 2.5974 2.5974 2.7902 2.7902 3.0225 3.0225 3.4872 3.4872 3.5755 3.5755 3.6629 3.6629 3.7244 3.7244 3.8536 3.8536 3.8958 3.8958 4.2100 4.2100 4.3484 4.3484 4.3531 4.3531 4.6450 4.6450 8.2066 8.2066 8.6454 8.6454 8.8181 8.8181 9.2202 9.2202 9.8713 9.8713 k = 0.1915 0.3317-0.0000 ( 6103 PWs) bands (ev): -24.7149 -24.7149 -24.7140 -24.7140 -8.4392 -8.4392 -8.4338 -8.4338 -8.1947 -8.1947 -8.1878 -8.1878 -8.1586 -8.1586 -8.1370 -8.1370 -5.1477 -5.1477 -5.0987 -5.0987 1.3764 1.3764 1.5305 1.5305 2.4448 2.4448 2.5869 2.5869 2.7791 2.7791 3.0350 3.0350 3.4893 3.4893 3.5747 3.5747 3.6701 3.6701 3.7309 3.7309 3.8884 3.8884 3.9328 3.9328 4.1846 4.1846 4.3973 4.3973 4.4065 4.4065 4.6317 4.6317 8.2687 8.2687 8.5832 8.5832 8.8850 8.8850 9.1849 9.1849 9.7825 9.7825 k = 0.1844 0.3194-0.0000 ( 6105 PWs) bands (ev): -24.7151 -24.7151 -24.7142 -24.7142 -8.4387 -8.4387 -8.4319 -8.4319 -8.1943 -8.1943 -8.1861 -8.1861 -8.1573 -8.1573 -8.1367 -8.1367 -5.1719 -5.1719 -5.1133 -5.1133 1.4190 1.4190 1.5658 1.5658 2.4437 2.4437 2.5757 2.5757 2.7673 2.7673 3.0482 3.0482 3.4911 3.4911 3.5736 3.5736 3.6744 3.6744 3.7359 3.7359 3.9287 3.9287 3.9727 3.9727 4.1520 4.1520 4.4348 4.4348 4.4714 4.4714 4.6316 4.6316 8.3347 8.3347 8.5187 8.5187 8.9472 8.9472 9.1573 9.1573 9.6962 9.6962 k = 0.1773 0.3071-0.0000 ( 6107 PWs) bands (ev): -24.7153 -24.7153 -24.7145 -24.7145 -8.4384 -8.4384 -8.4300 -8.4300 -8.1943 -8.1943 -8.1840 -8.1840 -8.1558 -8.1558 -8.1364 -8.1364 -5.1966 -5.1966 -5.1279 -5.1279 1.4636 1.4636 1.6025 1.6025 2.4408 2.4408 2.5640 2.5640 2.7549 2.7549 3.0622 3.0622 3.4928 3.4928 3.5721 3.5721 3.6771 3.6771 3.7396 3.7396 3.9724 3.9724 4.0151 4.0151 4.1191 4.1191 4.4517 4.4517 4.5406 4.5406 4.6550 4.6550 8.4026 8.4026 8.4557 8.4557 8.9846 8.9846 9.1552 9.1552 9.6125 9.6125 k = 0.1702 0.2948-0.0000 ( 6101 PWs) bands (ev): -24.7155 -24.7155 -24.7147 -24.7147 -8.4382 -8.4382 -8.4279 -8.4279 -8.1946 -8.1946 -8.1815 -8.1815 -8.1542 -8.1542 -8.1361 -8.1361 -5.2217 -5.2217 -5.1425 -5.1425 1.5098 1.5098 1.6405 1.6405 2.4365 2.4365 2.5519 2.5519 2.7419 2.7419 3.0770 3.0770 3.4943 3.4943 3.5703 3.5703 3.6786 3.6786 3.7424 3.7424 4.0152 4.0152 4.0584 4.0584 4.0933 4.0933 4.4473 4.4473 4.6125 4.6125 4.7022 4.7022 8.3850 8.3850 8.4818 8.4818 8.9781 8.9781 9.1968 9.1968 9.5313 9.5313 k = 0.1631 0.2825-0.0000 ( 6093 PWs) bands (ev): -24.7158 -24.7158 -24.7149 -24.7149 -8.4380 -8.4380 -8.4258 -8.4258 -8.1950 -8.1950 -8.1789 -8.1789 -8.1524 -8.1524 -8.1358 -8.1358 -5.2470 -5.2470 -5.1571 -5.1571 1.5574 1.5574 1.6793 1.6793 2.4308 2.4308 2.5396 2.5396 2.7285 2.7285 3.0925 3.0925 3.4956 3.4956 3.5683 3.5683 3.6795 3.6795 3.7445 3.7445 4.0286 4.0286 4.0915 4.0915 4.1142 4.1142 4.4306 4.4306 4.6861 4.6861 4.7640 4.7640 8.3205 8.3205 8.5586 8.5586 8.9440 8.9440 9.2644 9.2644 9.4529 9.4529 k = 0.1560 0.2702-0.0000 ( 6101 PWs) bands (ev): -24.7160 -24.7160 -24.7151 -24.7151 -8.4380 -8.4380 -8.4236 -8.4236 -8.1955 -8.1955 -8.1761 -8.1761 -8.1506 -8.1506 -8.1355 -8.1355 -5.2724 -5.2724 -5.1715 -5.1715 1.6060 1.6060 1.7186 1.7186 2.4241 2.4241 2.5272 2.5272 2.7145 2.7145 3.1086 3.1086 3.4967 3.4967 3.5661 3.5661 3.6799 3.6799 3.7459 3.7459 4.0052 4.0052 4.1402 4.1402 4.1629 4.1629 4.4089 4.4089 4.7610 4.7610 4.8334 4.8334 8.2552 8.2552 8.6397 8.6397 8.8987 8.8987 9.3387 9.3387 9.3792 9.3792 k = 0.1489 0.2580-0.0000 ( 6101 PWs) bands (ev): -24.7163 -24.7163 -24.7154 -24.7154 -8.4380 -8.4380 -8.4214 -8.4214 -8.1961 -8.1961 -8.1732 -8.1732 -8.1487 -8.1487 -8.1352 -8.1352 -5.2977 -5.2977 -5.1858 -5.1858 1.6552 1.6552 1.7581 1.7581 2.4166 2.4166 2.5148 2.5148 2.7002 2.7002 3.1254 3.1254 3.4977 3.4977 3.5636 3.5636 3.6799 3.6799 3.7469 3.7469 3.9771 3.9771 4.1973 4.1973 4.2128 4.2128 4.3877 4.3877 4.8365 4.8365 4.9067 4.9067 8.1899 8.1899 8.7243 8.7243 8.8474 8.8474 9.3012 9.3012 9.4227 9.4227 k = 0.1418 0.2457-0.0000 ( 6105 PWs) bands (ev): -24.7165 -24.7165 -24.7156 -24.7156 -8.4382 -8.4382 -8.4193 -8.4193 -8.1966 -8.1966 -8.1702 -8.1702 -8.1468 -8.1468 -8.1349 -8.1349 -5.3228 -5.3228 -5.1998 -5.1998 1.7045 1.7045 1.7975 1.7975 2.4086 2.4086 2.5025 2.5025 2.6857 2.6857 3.1429 3.1429 3.4985 3.4985 3.5608 3.5608 3.6796 3.6796 3.7475 3.7475 3.9496 3.9496 4.2532 4.2532 4.2603 4.2603 4.3766 4.3766 4.9125 4.9125 4.9823 4.9823 8.1247 8.1247 8.7902 8.7902 8.8138 8.8138 9.2304 9.2304 9.5021 9.5021 k = 0.1348 0.2334-0.0000 ( 6101 PWs) bands (ev): -24.7167 -24.7167 -24.7158 -24.7158 -8.4384 -8.4384 -8.4171 -8.4171 -8.1972 -8.1972 -8.1672 -8.1672 -8.1448 -8.1448 -8.1346 -8.1346 -5.3477 -5.3477 -5.2134 -5.2134 1.7535 1.7535 1.8364 1.8364 2.4001 2.4001 2.4905 2.4905 2.6709 2.6709 3.1609 3.1609 3.4992 3.4992 3.5579 3.5579 3.6792 3.6792 3.7476 3.7476 3.9240 3.9240 4.2675 4.2675 4.3249 4.3249 4.3965 4.3965 4.9884 4.9884 5.0588 5.0588 8.0593 8.0593 8.7312 8.7312 8.9038 8.9038 9.1617 9.1617 9.5805 9.5805 k = 0.1277 0.2211-0.0000 ( 6093 PWs) bands (ev): -24.7170 -24.7170 -24.7160 -24.7160 -8.4388 -8.4388 -8.4150 -8.4150 -8.1977 -8.1977 -8.1641 -8.1641 -8.1427 -8.1427 -8.1343 -8.1343 -5.3721 -5.3721 -5.2267 -5.2267 1.8018 1.8018 1.8746 1.8746 2.3916 2.3916 2.4788 2.4788 2.6561 2.6561 3.1794 3.1794 3.4998 3.4998 3.5548 3.5548 3.6786 3.6786 3.7472 3.7472 3.9005 3.9005 4.2521 4.2521 4.3940 4.3940 4.4484 4.4484 5.0638 5.0638 5.1355 5.1355 7.9938 7.9938 8.6670 8.6670 8.9960 8.9960 9.0970 9.0970 9.6563 9.6563 k = 0.1206 0.2088-0.0000 ( 6085 PWs) bands (ev): -24.7172 -24.7172 -24.7163 -24.7163 -8.4392 -8.4392 -8.4129 -8.4129 -8.1982 -8.1982 -8.1610 -8.1610 -8.1406 -8.1406 -8.1340 -8.1340 -5.3959 -5.3959 -5.2396 -5.2396 1.8488 1.8488 1.9118 1.9118 2.3831 2.3831 2.4676 2.4676 2.6414 2.6414 3.1984 3.1984 3.5004 3.5004 3.5515 3.5515 3.6780 3.6780 3.7462 3.7462 3.8794 3.8794 4.2257 4.2257 4.4669 4.4669 4.5146 4.5146 5.1383 5.1383 5.2118 5.2118 7.9280 7.9280 8.5985 8.5985 9.0226 9.0226 9.1029 9.1029 9.7282 9.7282 k = 0.1135 0.1965-0.0000 ( 6077 PWs) bands (ev): -24.7174 -24.7174 -24.7165 -24.7165 -8.4397 -8.4397 -8.4109 -8.4109 -8.1986 -8.1986 -8.1579 -8.1579 -8.1385 -8.1385 -8.1337 -8.1337 -5.4190 -5.4190 -5.2520 -5.2520 1.8938 1.8938 1.9480 1.9480 2.3750 2.3750 2.4570 2.4570 2.6268 2.6268 3.2178 3.2178 3.5009 3.5009 3.5480 3.5480 3.6772 3.6772 3.7445 3.7445 3.8610 3.8610 4.1955 4.1955 4.5435 4.5435 4.5881 4.5881 5.2114 5.2114 5.2872 5.2872 7.8617 7.8617 8.5253 8.5253 8.9627 8.9627 9.2002 9.2002 9.7948 9.7948 k = 0.1064 0.1843-0.0000 ( 6079 PWs) bands (ev): -24.7176 -24.7176 -24.7167 -24.7167 -8.4403 -8.4403 -8.4090 -8.4090 -8.1990 -8.1990 -8.1549 -8.1549 -8.1365 -8.1365 -8.1334 -8.1334 -5.4413 -5.4413 -5.2638 -5.2638 1.9359 1.9359 1.9833 1.9833 2.3674 2.3674 2.4469 2.4469 2.6125 2.6125 3.2375 3.2375 3.5016 3.5016 3.5444 3.5444 3.6764 3.6764 3.7422 3.7422 3.8452 3.8452 4.1638 4.1638 4.6238 4.6238 4.6671 4.6671 5.2826 5.2826 5.3611 5.3611 7.7946 7.7946 8.4473 8.4473 8.9017 8.9017 9.3031 9.3031 9.8548 9.8548 k = 0.0993 0.1720-0.0000 ( 6077 PWs) bands (ev): -24.7178 -24.7178 -24.7169 -24.7169 -8.4410 -8.4410 -8.4072 -8.4072 -8.1993 -8.1993 -8.1520 -8.1520 -8.1344 -8.1344 -8.1330 -8.1330 -5.4628 -5.4628 -5.2751 -5.2751 1.9740 1.9740 2.0180 2.0180 2.3608 2.3608 2.4376 2.4376 2.5986 2.5986 3.2573 3.2573 3.5024 3.5024 3.5408 3.5408 3.6755 3.6755 3.7390 3.7390 3.8321 3.8321 4.1312 4.1312 4.7078 4.7078 4.7505 4.7505 5.3514 5.3514 5.4331 5.4331 7.7265 7.7265 8.3644 8.3644 8.8420 8.8420 9.4091 9.4091 9.9074 9.9074 k = 0.0922 0.1597-0.0000 ( 6073 PWs) bands (ev): -24.7180 -24.7180 -24.7171 -24.7171 -8.4417 -8.4417 -8.4055 -8.4055 -8.1997 -8.1997 -8.1492 -8.1492 -8.1326 -8.1326 -8.1324 -8.1324 -5.4832 -5.4832 -5.2858 -5.2858 2.0071 2.0071 2.0526 2.0526 2.3552 2.3552 2.4290 2.4290 2.5853 2.5853 3.2772 3.2772 3.5036 3.5036 3.5372 3.5372 3.6747 3.6747 3.7351 3.7351 3.8216 3.8216 4.0983 4.0983 4.7953 4.7953 4.8381 4.8381 5.4175 5.4175 5.5030 5.5030 7.6569 7.6569 8.2765 8.2765 8.7838 8.7838 9.5179 9.5179 9.9466 9.9466 k = 0.0851 0.1474-0.0000 ( 6059 PWs) bands (ev): -24.7182 -24.7182 -24.7173 -24.7173 -8.4424 -8.4424 -8.4038 -8.4038 -8.1999 -8.1999 -8.1466 -8.1466 -8.1320 -8.1320 -8.1305 -8.1305 -5.5025 -5.5025 -5.2958 -5.2958 2.0349 2.0349 2.0867 2.0867 2.3511 2.3511 2.4214 2.4214 2.5727 2.5727 3.2970 3.2970 3.5052 3.5052 3.5337 3.5337 3.6738 3.6738 3.7306 3.7306 3.8135 3.8135 4.0652 4.0652 4.8860 4.8860 4.9295 4.9295 5.4803 5.4803 5.5704 5.5704 7.5854 7.5854 8.1838 8.1838 8.7273 8.7273 9.6291 9.6291 9.9242 9.9242 k = 0.0780 0.1351-0.0000 ( 6053 PWs) bands (ev): -24.7184 -24.7184 -24.7174 -24.7174 -8.4432 -8.4432 -8.4023 -8.4023 -8.2001 -8.2001 -8.1442 -8.1442 -8.1314 -8.1314 -8.1286 -8.1286 -5.5206 -5.5206 -5.3051 -5.3051 2.0576 2.0576 2.1196 2.1196 2.3484 2.3484 2.4147 2.4147 2.5610 2.5610 3.3163 3.3163 3.5072 3.5072 3.5308 3.5308 3.6730 3.6730 3.7257 3.7257 3.8073 3.8073 4.0322 4.0322 4.9794 4.9794 5.0244 5.0244 5.5396 5.5396 5.6348 5.6348 7.5117 7.5117 8.0867 8.0867 8.6727 8.6727 9.7421 9.7421 9.8894 9.8894 k = 0.0709 0.1228-0.0000 ( 6063 PWs) bands (ev): -24.7186 -24.7186 -24.7176 -24.7176 -8.4440 -8.4440 -8.4010 -8.4010 -8.2003 -8.2003 -8.1422 -8.1422 -8.1305 -8.1305 -8.1269 -8.1269 -5.5375 -5.5375 -5.3137 -5.3137 2.0757 2.0757 2.1502 2.1502 2.3473 2.3473 2.4092 2.4092 2.5502 2.5502 3.3348 3.3348 3.5094 3.5094 3.5290 3.5290 3.6722 3.6722 3.7208 3.7208 3.8027 3.8027 3.9992 3.9992 5.0751 5.0751 5.1222 5.1222 5.5951 5.5951 5.6961 5.6961 7.4353 7.4353 7.9858 7.9858 8.6201 8.6201 9.8421 9.8421 9.8724 9.8724 k = 0.0638 0.1106-0.0000 ( 6075 PWs) bands (ev): -24.7188 -24.7188 -24.7178 -24.7178 -8.4447 -8.4447 -8.3997 -8.3997 -8.2005 -8.2005 -8.1405 -8.1405 -8.1295 -8.1295 -8.1252 -8.1252 -5.5529 -5.5529 -5.3216 -5.3216 2.0898 2.0898 2.1780 2.1780 2.3477 2.3477 2.4049 2.4049 2.5404 2.5404 3.3521 3.3521 3.5107 3.5107 3.5298 3.5298 3.6715 3.6715 3.7160 3.7160 3.7993 3.7993 3.9664 3.9664 5.1722 5.1722 5.2226 5.2226 5.6467 5.6467 5.7538 5.7538 7.3558 7.3558 7.8818 7.8818 8.5701 8.5701 9.8240 9.8240 9.9787 9.9787 k = 0.0567 0.0983-0.0000 ( 6079 PWs) bands (ev): -24.7189 -24.7189 -24.7179 -24.7179 -8.4455 -8.4455 -8.3986 -8.3986 -8.2006 -8.2006 -8.1392 -8.1392 -8.1283 -8.1283 -8.1237 -8.1237 -5.5670 -5.5670 -5.3287 -5.3287 2.1004 2.1004 2.2025 2.2025 2.3493 2.3493 2.4020 2.4020 2.5318 2.5318 3.3677 3.3677 3.5103 3.5103 3.5347 3.5347 3.6708 3.6708 3.7116 3.7116 3.7969 3.7969 3.9340 3.9340 5.2696 5.2696 5.3247 5.3247 5.6944 5.6944 5.8079 5.8079 7.2731 7.2731 7.7758 7.7758 8.5231 8.5231 9.7986 9.7986 10.0505 10.0505 k = 0.0496 0.0860-0.0000 ( 6073 PWs) bands (ev): -24.7190 -24.7190 -24.7180 -24.7180 -8.4462 -8.4462 -8.3976 -8.3976 -8.2007 -8.2007 -8.1383 -8.1383 -8.1270 -8.1270 -8.1224 -8.1224 -5.5795 -5.5795 -5.3350 -5.3350 2.1080 2.1080 2.2234 2.2234 2.3519 2.3519 2.4006 2.4006 2.5244 2.5244 3.3813 3.3813 3.5087 3.5087 3.5439 3.5439 3.6702 3.6702 3.7077 3.7077 3.7951 3.7951 3.9019 3.9019 5.3657 5.3657 5.4275 5.4275 5.7385 5.7385 5.8581 5.8581 7.1872 7.1872 7.6694 7.6694 8.4797 8.4797 9.7762 9.7762 9.9731 9.9731 k = 0.0426 0.0737-0.0000 ( 6073 PWs) bands (ev): -24.7191 -24.7191 -24.7181 -24.7181 -8.4468 -8.4468 -8.3967 -8.3967 -8.2008 -8.2008 -8.1376 -8.1376 -8.1256 -8.1256 -8.1211 -8.1211 -5.5905 -5.5905 -5.3406 -5.3406 2.1132 2.1132 2.2405 2.2405 2.3548 2.3548 2.4006 2.4006 2.5182 2.5182 3.3925 3.3925 3.5065 3.5065 3.5566 3.5566 3.6697 3.6697 3.7043 3.7043 3.7938 3.7938 3.8703 3.8703 5.4581 5.4581 5.5294 5.5294 5.7797 5.7797 5.9047 5.9047 7.0984 7.0984 7.5644 7.5644 8.4406 8.4406 9.7569 9.7569 9.9020 9.9020 k = 0.0355 0.0614-0.0000 ( 6085 PWs) bands (ev): -24.7192 -24.7192 -24.7183 -24.7183 -8.4474 -8.4474 -8.3960 -8.3960 -8.2009 -8.2009 -8.1371 -8.1371 -8.1244 -8.1244 -8.1201 -8.1201 -5.5999 -5.5999 -5.3453 -5.3453 2.1165 2.1165 2.2538 2.2538 2.3578 2.3578 2.4018 2.4018 2.5132 2.5132 3.4012 3.4012 3.5044 3.5044 3.5724 3.5724 3.6692 3.6692 3.7014 3.7014 3.7928 3.7928 3.8393 3.8393 5.5435 5.5435 5.6280 5.6280 5.8190 5.8190 5.9485 5.9485 7.0078 7.0078 7.4632 7.4632 8.4063 8.4063 9.7407 9.7407 9.8418 9.8418 k = 0.0284 0.0491-0.0000 ( 6087 PWs) bands (ev): -24.7193 -24.7193 -24.7183 -24.7183 -8.4478 -8.4478 -8.3954 -8.3954 -8.2009 -8.2009 -8.1368 -8.1368 -8.1233 -8.1233 -8.1192 -8.1192 -5.6076 -5.6076 -5.3491 -5.3491 2.1186 2.1186 2.2637 2.2637 2.3605 2.3605 2.4039 2.4039 2.5093 2.5093 3.4078 3.4078 3.5025 3.5025 3.5911 3.5911 3.6689 3.6689 3.6990 3.6990 3.7920 3.7920 3.8090 3.8090 5.6176 5.6176 5.7192 5.7192 5.8577 5.8577 5.9908 5.9908 6.9173 6.9173 7.3693 7.3693 8.3774 8.3774 9.7271 9.7271 9.7931 9.7931 k = 0.0213 0.0369-0.0000 ( 6095 PWs) bands (ev): -24.7194 -24.7194 -24.7184 -24.7184 -8.4482 -8.4482 -8.3950 -8.3950 -8.2010 -8.2010 -8.1365 -8.1365 -8.1224 -8.1224 -8.1185 -8.1185 -5.6137 -5.6137 -5.3521 -5.3521 2.1198 2.1198 2.2707 2.2707 2.3628 2.3628 2.4064 2.4064 2.5065 2.5065 3.4124 3.4124 3.5009 3.5009 3.6118 3.6118 3.6686 3.6686 3.6972 3.6972 3.7795 3.7795 3.7916 3.7916 5.6759 5.6759 5.7969 5.7969 5.8962 5.8962 6.0342 6.0342 6.8302 6.8302 7.2867 7.2867 8.3545 8.3545 9.7156 9.7156 9.7566 9.7566 k = 0.0142 0.0246-0.0000 ( 6095 PWs) bands (ev): -24.7194 -24.7194 -24.7184 -24.7184 -8.4485 -8.4485 -8.3946 -8.3946 -8.2010 -8.2010 -8.1364 -8.1364 -8.1217 -8.1217 -8.1180 -8.1180 -5.6181 -5.6181 -5.3543 -5.3543 2.1204 2.1204 2.2751 2.2751 2.3646 2.3646 2.4086 2.4086 2.5046 2.5046 3.4155 3.4155 3.4997 3.4997 3.6339 3.6339 3.6684 3.6684 3.6959 3.6959 3.7515 3.7515 3.7912 3.7912 5.7161 5.7161 5.8543 5.8543 5.9315 5.9315 6.0790 6.0790 6.7527 6.7527 7.2210 7.2210 8.3379 8.3379 9.7052 9.7052 9.7330 9.7330 k = 0.0071 0.0123-0.0000 ( 6095 PWs) bands (ev): -24.7195 -24.7195 -24.7185 -24.7185 -8.4487 -8.4487 -8.3944 -8.3944 -8.2010 -8.2010 -8.1363 -8.1363 -8.1213 -8.1213 -8.1177 -8.1177 -5.6207 -5.6207 -5.3556 -5.3556 2.1207 2.1207 2.2777 2.2777 2.3656 2.3656 2.4102 2.4102 2.5035 2.5035 3.4172 3.4172 3.4990 3.4990 3.6553 3.6553 3.6683 3.6683 3.6951 3.6951 3.7266 3.7266 3.7910 3.7910 5.7388 5.7388 5.8878 5.8878 5.9574 5.9574 6.1176 6.1176 6.6956 6.6956 7.1781 7.1781 8.3278 8.3278 9.6965 9.6965 9.7214 9.7214 k = 0.0000 0.0000 0.0000 ( 6095 PWs) bands (ev): -24.7195 -24.7195 -24.7185 -24.7185 -8.4487 -8.4487 -8.3944 -8.3944 -8.2010 -8.2010 -8.1363 -8.1363 -8.1212 -8.1212 -8.1176 -8.1176 -5.6215 -5.6215 -5.3560 -5.3560 2.1208 2.1208 2.2785 2.2785 2.3659 2.3659 2.4107 2.4107 2.5032 2.5032 3.4178 3.4178 3.4987 3.4987 3.6664 3.6664 3.6692 3.6692 3.6949 3.6949 3.7135 3.7135 3.7909 3.7909 5.7461 5.7461 5.8986 5.8986 5.9669 5.9669 6.1337 6.1337 6.6738 6.6738 7.1631 7.1631 8.3244 8.3244 9.6930 9.6930 9.7182 9.7182 k = 0.0000 0.0000 0.0000 ( 6095 PWs) bands (ev): -24.7195 -24.7195 -24.7185 -24.7185 -8.4487 -8.4487 -8.3944 -8.3944 -8.2010 -8.2010 -8.1363 -8.1363 -8.1212 -8.1212 -8.1176 -8.1176 -5.6215 -5.6215 -5.3560 -5.3560 2.1208 2.1208 2.2785 2.2785 2.3659 2.3659 2.4107 2.4107 2.5032 2.5032 3.4178 3.4178 3.4987 3.4987 3.6664 3.6664 3.6692 3.6692 3.6949 3.6949 3.7135 3.7135 3.7909 3.7909 5.7461 5.7461 5.8986 5.8986 5.9669 5.9669 6.1337 6.1337 6.6738 6.6738 7.1631 7.1631 8.3244 8.3244 9.6930 9.6930 9.7182 9.7182 k = 0.0000 0.0000 0.0140 ( 6095 PWs) bands (ev): -24.7195 -24.7195 -24.7185 -24.7185 -8.4486 -8.4486 -8.3945 -8.3945 -8.2009 -8.2009 -8.1365 -8.1365 -8.1212 -8.1212 -8.1176 -8.1176 -5.6209 -5.6209 -5.3567 -5.3567 2.1216 2.1216 2.2783 2.2783 2.3660 2.3660 2.4106 2.4106 2.5046 2.5046 3.4166 3.4166 3.4987 3.4987 3.6609 3.6609 3.6665 3.6665 3.6948 3.6948 3.7193 3.7193 3.7909 3.7909 5.7464 5.7464 5.8980 5.8980 5.9673 5.9673 6.1332 6.1332 6.6775 6.6775 7.1630 7.1630 8.3265 8.3265 9.6943 9.6943 9.7196 9.7196 k = 0.0000 0.0000 0.0280 ( 6071 PWs) bands (ev): -24.7194 -24.7194 -24.7185 -24.7185 -8.4481 -8.4481 -8.3948 -8.3948 -8.2005 -8.2005 -8.1371 -8.1371 -8.1211 -8.1211 -8.1176 -8.1176 -5.6190 -5.6190 -5.3586 -5.3586 2.1241 2.1241 2.2777 2.2777 2.3664 2.3664 2.4103 2.4103 2.5088 2.5088 3.4130 3.4130 3.4988 3.4988 3.6427 3.6427 3.6668 3.6668 3.6947 3.6947 3.7305 3.7305 3.7911 3.7911 5.7473 5.7473 5.8963 5.8963 5.9684 5.9684 6.1319 6.1319 6.6882 6.6882 7.1629 7.1629 8.3327 8.3327 9.6981 9.6981 9.7237 9.7237 k = 0.0000 0.0000 0.0420 ( 6083 PWs) bands (ev): -24.7194 -24.7194 -24.7185 -24.7185 -8.4473 -8.4473 -8.3953 -8.3953 -8.2000 -8.2000 -8.1381 -8.1381 -8.1211 -8.1211 -8.1177 -8.1177 -5.6158 -5.6158 -5.3617 -5.3617 2.1280 2.1280 2.2767 2.2767 2.3669 2.3669 2.4098 2.4098 2.5160 2.5160 3.4061 3.4061 3.4987 3.4987 3.6206 3.6206 3.6670 3.6670 3.6943 3.6943 3.7416 3.7416 3.7911 3.7911 5.7487 5.7487 5.8935 5.8935 5.9702 5.9702 6.1297 6.1297 6.7055 6.7055 7.1627 7.1627 8.3432 8.3432 9.7044 9.7044 9.7306 9.7306 k = 0.0000 0.0000 0.0560 ( 6083 PWs) bands (ev): -24.7194 -24.7194 -24.7185 -24.7185 -8.4462 -8.4462 -8.3960 -8.3960 -8.1992 -8.1992 -8.1395 -8.1395 -8.1210 -8.1210 -8.1177 -8.1177 -5.6114 -5.6114 -5.3661 -5.3661 2.1332 2.1332 2.2752 2.2752 2.3676 2.3676 2.4090 2.4090 2.5261 2.5261 3.3954 3.3954 3.4986 3.4986 3.5974 3.5974 3.6675 3.6675 3.6938 3.6938 3.7515 3.7515 3.7913 3.7913 5.7508 5.7508 5.8898 5.8898 5.9728 5.9728 6.1267 6.1267 6.7287 6.7287 7.1622 7.1622 8.3584 8.3584 9.7131 9.7131 9.7402 9.7402 k = 0.0000 0.0000 0.0700 ( 6071 PWs) bands (ev): -24.7194 -24.7194 -24.7185 -24.7185 -8.4449 -8.4449 -8.3969 -8.3969 -8.1982 -8.1982 -8.1412 -8.1412 -8.1210 -8.1210 -8.1178 -8.1178 -5.6058 -5.6058 -5.3716 -5.3716 2.1397 2.1397 2.2734 2.2734 2.3686 2.3686 2.4081 2.4081 2.5394 2.5394 3.3793 3.3793 3.4986 3.4986 3.5751 3.5751 3.6680 3.6680 3.6933 3.6933 3.7598 3.7598 3.7915 3.7915 5.7534 5.7534 5.8853 5.8853 5.9760 5.9760 6.1229 6.1229 6.7568 6.7568 7.1615 7.1615 8.3784 8.3784 9.7238 9.7238 9.7526 9.7526 k = 0.0000 0.0000 0.0840 ( 6059 PWs) bands (ev): -24.7193 -24.7193 -24.7185 -24.7185 -8.4432 -8.4432 -8.3979 -8.3979 -8.1970 -8.1970 -8.1433 -8.1433 -8.1208 -8.1208 -8.1179 -8.1179 -5.5990 -5.5990 -5.3783 -5.3783 2.1470 2.1470 2.2713 2.2713 2.3697 2.3697 2.4070 2.4070 2.5559 2.5559 3.3568 3.3568 3.4986 3.4986 3.5555 3.5555 3.6687 3.6687 3.6926 3.6926 3.7667 3.7667 3.7916 3.7916 5.7566 5.7566 5.8801 5.8801 5.9799 5.9799 6.1184 6.1184 6.7886 6.7886 7.1605 7.1605 8.4037 8.4037 9.7358 9.7358 9.7676 9.7676 k = 0.0000 0.0000 0.0981 ( 6077 PWs) bands (ev): -24.7193 -24.7193 -24.7186 -24.7186 -8.4414 -8.4414 -8.3993 -8.3993 -8.1956 -8.1956 -8.1458 -8.1458 -8.1208 -8.1208 -8.1180 -8.1180 -5.5912 -5.5912 -5.3861 -5.3861 2.1550 2.1550 2.2687 2.2687 2.3709 2.3709 2.4057 2.4057 2.5757 2.5757 3.3271 3.3271 3.4985 3.4985 3.5396 3.5396 3.6695 3.6695 3.6918 3.6918 3.7722 3.7722 3.7918 3.7918 5.7602 5.7602 5.8743 5.8743 5.9844 5.9844 6.1131 6.1131 6.8230 6.8230 7.1590 7.1590 8.4348 8.4348 9.7467 9.7467 9.7853 9.7853 k = 0.0000 0.0000 0.1121 ( 6077 PWs) bands (ev): -24.7193 -24.7193 -24.7186 -24.7186 -8.4393 -8.4393 -8.4008 -8.4008 -8.1940 -8.1940 -8.1484 -8.1484 -8.1206 -8.1206 -8.1181 -8.1181 -5.5824 -5.5824 -5.3948 -5.3948 2.1635 2.1635 2.2657 2.2657 2.3724 2.3724 2.4042 2.4042 2.5990 2.5990 3.2909 3.2909 3.4984 3.4984 3.5276 3.5276 3.6705 3.6705 3.6908 3.6908 3.7768 3.7768 3.7919 3.7919 5.7644 5.7644 5.8681 5.8681 5.9895 5.9895 6.1073 6.1073 6.8588 6.8588 7.1568 7.1568 8.4722 8.4722 9.7438 9.7438 9.8056 9.8056 k = 0.0000 0.0000 0.1261 ( 6059 PWs) bands (ev): -24.7193 -24.7193 -24.7186 -24.7186 -8.4370 -8.4370 -8.4024 -8.4024 -8.1921 -8.1921 -8.1513 -8.1513 -8.1205 -8.1205 -8.1182 -8.1182 -5.5727 -5.5727 -5.4044 -5.4044 2.1722 2.1722 2.2623 2.2623 2.3741 2.3741 2.4026 2.4026 2.6259 2.6259 3.2492 3.2492 3.4983 3.4983 3.5190 3.5190 3.6716 3.6716 3.6898 3.6898 3.7805 3.7805 3.7920 3.7920 5.7691 5.7691 5.8615 5.8615 5.9952 5.9952 6.1008 6.1008 6.8948 6.8948 7.1538 7.1538 8.5161 8.5161 9.6919 9.6919 9.8284 9.8284 k = 0.0000 0.0000 0.1401 ( 6058 PWs) bands (ev): -24.7192 -24.7192 -24.7187 -24.7187 -8.4346 -8.4346 -8.4043 -8.4043 -8.1900 -8.1900 -8.1543 -8.1543 -8.1204 -8.1204 -8.1184 -8.1184 -5.5622 -5.5622 -5.4149 -5.4149 2.1809 2.1809 2.2585 2.2585 2.3758 2.3758 2.4008 2.4008 2.6562 2.6562 3.2035 3.2035 3.4983 3.4983 3.5128 3.5128 3.6727 3.6727 3.6887 3.6887 3.7834 3.7834 3.7922 3.7922 5.7742 5.7742 5.8547 5.8547 6.0015 6.0015 6.0939 6.0939 6.9301 6.9301 7.1498 7.1498 8.5669 8.5669 9.6044 9.6044 9.8435 9.8435 k = 0.0000 0.0000 0.1541 ( 6064 PWs) bands (ev): -24.7192 -24.7192 -24.7187 -24.7187 -8.4320 -8.4320 -8.4063 -8.4063 -8.1878 -8.1878 -8.1575 -8.1575 -8.1202 -8.1202 -8.1185 -8.1185 -5.5511 -5.5511 -5.4260 -5.4260 2.1895 2.1895 2.2543 2.2543 2.3777 2.3777 2.3989 2.3989 2.6899 2.6899 3.1549 3.1549 3.4982 3.4982 3.5084 3.5084 3.6739 3.6739 3.6874 3.6874 3.7857 3.7857 3.7922 3.7922 5.7797 5.7797 5.8477 5.8477 6.0081 6.0081 6.0865 6.0865 6.9636 6.9636 7.1445 7.1445 8.6248 8.6248 9.5072 9.5072 9.8666 9.8666 k = 0.0000 0.0000 0.1681 ( 6046 PWs) bands (ev): -24.7191 -24.7191 -24.7187 -24.7187 -8.4294 -8.4294 -8.4085 -8.4085 -8.1853 -8.1853 -8.1607 -8.1607 -8.1200 -8.1200 -8.1187 -8.1187 -5.5393 -5.5393 -5.4378 -5.4378 2.1978 2.1978 2.2497 2.2497 2.3797 2.3797 2.3969 2.3969 2.7269 2.7269 3.1047 3.1047 3.4983 3.4983 3.5053 3.5053 3.6753 3.6753 3.6862 3.6862 3.7875 3.7875 3.7922 3.7922 5.7856 5.7856 5.8406 5.8406 6.0152 6.0152 6.0789 6.0789 6.9947 6.9947 7.1377 7.1377 8.6897 8.6897 9.4068 9.4068 9.8941 9.8941 k = 0.0000 0.0000 0.1821 ( 6046 PWs) bands (ev): -24.7191 -24.7191 -24.7188 -24.7188 -8.4267 -8.4267 -8.4108 -8.4108 -8.1826 -8.1826 -8.1640 -8.1640 -8.1199 -8.1199 -8.1188 -8.1188 -5.5270 -5.5270 -5.4500 -5.4500 2.2058 2.2058 2.2447 2.2447 2.3818 2.3818 2.3948 2.3948 2.7670 2.7670 3.0537 3.0537 3.4984 3.4984 3.5030 3.5030 3.6766 3.6766 3.6849 3.6849 3.7889 3.7889 3.7922 3.7922 5.7918 5.7918 5.8334 5.8334 6.0227 6.0227 6.0709 6.0709 7.0231 7.0231 7.1290 7.1290 8.7616 8.7616 9.3058 9.3058 9.9246 9.9246 k = 0.0000 0.0000 0.1961 ( 6046 PWs) bands (ev): -24.7190 -24.7190 -24.7188 -24.7188 -8.4239 -8.4239 -8.4133 -8.4133 -8.1798 -8.1798 -8.1673 -8.1673 -8.1197 -8.1197 -8.1190 -8.1190 -5.5144 -5.5144 -5.4626 -5.4626 2.2133 2.2133 2.2393 2.2393 2.3839 2.3839 2.3927 2.3927 2.8100 2.8100 3.0026 3.0026 3.4986 3.4986 3.5014 3.5014 3.6779 3.6779 3.6836 3.6836 3.7900 3.7900 3.7921 3.7921 5.7983 5.7983 5.8262 5.8262 6.0304 6.0304 6.0629 6.0629 7.0483 7.0483 7.1183 7.1183 8.8400 8.8400 9.2059 9.2059 9.9576 9.9576 k = 0.0000 0.0000 0.2101 ( 6046 PWs) bands (ev): -24.7190 -24.7190 -24.7189 -24.7189 -8.4212 -8.4212 -8.4158 -8.4158 -8.1769 -8.1769 -8.1706 -8.1706 -8.1195 -8.1195 -8.1192 -8.1192 -5.5015 -5.5015 -5.4755 -5.4755 2.2205 2.2205 2.2335 2.2335 2.3861 2.3861 2.3905 2.3905 2.8554 2.8554 2.9522 2.9522 3.4990 3.4990 3.5002 3.5002 3.6793 3.6793 3.6822 3.6822 3.7908 3.7908 3.7918 3.7918 5.8050 5.8050 5.8190 5.8190 6.0384 6.0384 6.0547 6.0547 7.0703 7.0703 7.1051 7.1051 8.9245 8.9245 9.1083 9.1083 9.9927 9.9927 k = 0.0000 0.0000 0.2241 ( 6052 PWs) bands (ev): -24.7189 -24.7189 -24.7189 -24.7189 -8.4185 -8.4185 -8.4185 -8.4185 -8.1738 -8.1738 -8.1738 -8.1738 -8.1194 -8.1194 -8.1194 -8.1194 -5.4885 -5.4885 -5.4885 -5.4885 2.2272 2.2272 2.2272 2.2272 2.3883 2.3883 2.3883 2.3883 2.9030 2.9030 2.9030 2.9030 3.4995 3.4995 3.4995 3.4995 3.6807 3.6807 3.6807 3.6807 3.7914 3.7914 3.7914 3.7914 5.8119 5.8119 5.8119 5.8119 6.0465 6.0465 6.0465 6.0465 7.0891 7.0891 7.0891 7.0891 9.0142 9.0142 9.0142 9.0142 10.0296 10.0296 k = 0.0000 0.0000 0.2241 ( 6052 PWs) bands (ev): -24.7189 -24.7189 -24.7189 -24.7189 -8.4185 -8.4185 -8.4185 -8.4185 -8.1738 -8.1738 -8.1738 -8.1738 -8.1194 -8.1194 -8.1194 -8.1194 -5.4885 -5.4885 -5.4885 -5.4885 2.2272 2.2272 2.2272 2.2272 2.3883 2.3883 2.3883 2.3883 2.9030 2.9030 2.9030 2.9030 3.4995 3.4995 3.4995 3.4995 3.6807 3.6807 3.6807 3.6807 3.7914 3.7914 3.7914 3.7914 5.8119 5.8119 5.8119 5.8119 6.0465 6.0465 6.0465 6.0465 7.0891 7.0891 7.0891 7.0891 9.0142 9.0142 9.0142 9.0142 10.0296 10.0296 k = 0.0122 0.0070 0.2241 ( 6038 PWs) bands (ev): -24.7189 -24.7189 -24.7189 -24.7189 -8.4185 -8.4185 -8.4185 -8.4185 -8.1738 -8.1738 -8.1738 -8.1738 -8.1194 -8.1194 -8.1194 -8.1194 -5.4878 -5.4878 -5.4878 -5.4878 2.2265 2.2265 2.2265 2.2265 2.3878 2.3878 2.3878 2.3878 2.9031 2.9031 2.9031 2.9031 3.4997 3.4997 3.4997 3.4997 3.6810 3.6810 3.6810 3.6810 3.7919 3.7919 3.7919 3.7919 5.8041 5.8041 5.8041 5.8041 6.0359 6.0359 6.0359 6.0359 7.1049 7.1049 7.1049 7.1049 9.0142 9.0142 9.0142 9.0142 10.0297 10.0297 k = 0.0244 0.0141 0.2241 ( 6038 PWs) bands (ev): -24.7189 -24.7189 -24.7189 -24.7189 -8.4185 -8.4185 -8.4185 -8.4185 -8.1738 -8.1738 -8.1738 -8.1738 -8.1198 -8.1198 -8.1198 -8.1198 -5.4859 -5.4859 -5.4859 -5.4859 2.2243 2.2243 2.2243 2.2243 2.3865 2.3865 2.3865 2.3865 2.9036 2.9036 2.9036 2.9036 3.5005 3.5005 3.5005 3.5005 3.6818 3.6818 3.6818 3.6818 3.7935 3.7935 3.7935 3.7935 5.7796 5.7796 5.7796 5.7796 6.0076 6.0076 6.0076 6.0076 7.1496 7.1496 7.1496 7.1496 9.0143 9.0143 9.0143 9.0143 10.0252 10.0252 k = 0.0366 0.0211 0.2241 ( 6034 PWs) bands (ev): -24.7188 -24.7188 -24.7188 -24.7188 -8.4186 -8.4186 -8.4186 -8.4186 -8.1738 -8.1738 -8.1738 -8.1738 -8.1203 -8.1203 -8.1203 -8.1203 -5.4827 -5.4827 -5.4827 -5.4827 2.2205 2.2205 2.2205 2.2205 2.3845 2.3845 2.3845 2.3845 2.9043 2.9043 2.9043 2.9043 3.5016 3.5016 3.5016 3.5016 3.6831 3.6831 3.6831 3.6831 3.7963 3.7963 3.7963 3.7963 5.7369 5.7369 5.7369 5.7369 5.9694 5.9694 5.9694 5.9694 7.2169 7.2169 7.2169 7.2169 9.0143 9.0143 9.0143 9.0143 10.0130 10.0130 k = 0.0488 0.0282 0.2241 ( 6044 PWs) bands (ev): -24.7188 -24.7188 -24.7188 -24.7188 -8.4187 -8.4187 -8.4187 -8.4187 -8.1739 -8.1739 -8.1739 -8.1739 -8.1211 -8.1211 -8.1211 -8.1211 -5.4782 -5.4782 -5.4782 -5.4782 2.2145 2.2145 2.2145 2.2145 2.3822 2.3822 2.3822 2.3822 2.9052 2.9052 2.9052 2.9052 3.5031 3.5031 3.5031 3.5031 3.6848 3.6848 3.6848 3.6848 3.8002 3.8002 3.8002 3.8002 5.6756 5.6756 5.6756 5.6756 5.9284 5.9284 5.9284 5.9284 7.2999 7.2999 7.2999 7.2999 9.0142 9.0142 9.0142 9.0142 9.9951 9.9951 k = 0.0610 0.0352 0.2241 ( 6052 PWs) bands (ev): -24.7187 -24.7187 -24.7187 -24.7187 -8.4188 -8.4188 -8.4188 -8.4188 -8.1740 -8.1740 -8.1740 -8.1740 -8.1220 -8.1220 -8.1220 -8.1220 -5.4725 -5.4725 -5.4725 -5.4725 2.2062 2.2062 2.2062 2.2062 2.3800 2.3800 2.3800 2.3800 2.9064 2.9064 2.9064 2.9064 3.5050 3.5050 3.5050 3.5050 3.6868 3.6868 3.6868 3.6868 3.8054 3.8054 3.8054 3.8054 5.5986 5.5986 5.5986 5.5986 5.8876 5.8876 5.8876 5.8876 7.3926 7.3926 7.3926 7.3926 9.0136 9.0136 9.0136 9.0136 9.9733 9.9733 k = 0.0732 0.0422 0.2241 ( 6060 PWs) bands (ev): -24.7186 -24.7186 -24.7186 -24.7186 -8.4190 -8.4190 -8.4190 -8.4190 -8.1741 -8.1741 -8.1741 -8.1741 -8.1231 -8.1231 -8.1231 -8.1231 -5.4656 -5.4656 -5.4656 -5.4656 2.1949 2.1949 2.1949 2.1949 2.3785 2.3785 2.3785 2.3785 2.9076 2.9076 2.9076 2.9076 3.5072 3.5072 3.5072 3.5072 3.6892 3.6892 3.6892 3.6892 3.8122 3.8122 3.8122 3.8122 5.5105 5.5105 5.5105 5.5105 5.8468 5.8468 5.8468 5.8468 7.4903 7.4903 7.4903 7.4903 9.0122 9.0122 9.0122 9.0122 9.9493 9.9493 k = 0.0854 0.0493 0.2241 ( 6064 PWs) bands (ev): -24.7185 -24.7185 -24.7185 -24.7185 -8.4192 -8.4192 -8.4192 -8.4192 -8.1743 -8.1743 -8.1743 -8.1743 -8.1244 -8.1244 -8.1244 -8.1244 -5.4574 -5.4574 -5.4574 -5.4574 2.1805 2.1805 2.1805 2.1805 2.3780 2.3780 2.3780 2.3780 2.9090 2.9090 2.9090 2.9090 3.5096 3.5096 3.5096 3.5096 3.6917 3.6917 3.6917 3.6917 3.8205 3.8205 3.8205 3.8205 5.4155 5.4155 5.4155 5.4155 5.8049 5.8049 5.8049 5.8049 7.5893 7.5893 7.5893 7.5893 9.0095 9.0095 9.0095 9.0095 9.9253 9.9253 k = 0.0976 0.0563 0.2241 ( 6070 PWs) bands (ev): -24.7184 -24.7184 -24.7184 -24.7184 -8.4194 -8.4194 -8.4194 -8.4194 -8.1744 -8.1744 -8.1744 -8.1744 -8.1258 -8.1258 -8.1258 -8.1258 -5.4481 -5.4481 -5.4481 -5.4481 2.1625 2.1625 2.1625 2.1625 2.3789 2.3789 2.3789 2.3789 2.9103 2.9103 2.9103 2.9103 3.5121 3.5121 3.5121 3.5121 3.6943 3.6943 3.6943 3.6943 3.8306 3.8306 3.8306 3.8306 5.3168 5.3168 5.3168 5.3168 5.7612 5.7612 5.7612 5.7612 7.6867 7.6867 7.6867 7.6867 9.0046 9.0046 9.0046 9.0046 9.9036 9.9036 k = 0.1098 0.0634 0.2241 ( 6078 PWs) bands (ev): -24.7183 -24.7183 -24.7183 -24.7183 -8.4197 -8.4197 -8.4197 -8.4197 -8.1746 -8.1746 -8.1746 -8.1746 -8.1274 -8.1274 -8.1274 -8.1274 -5.4377 -5.4377 -5.4377 -5.4377 2.1410 2.1410 2.1410 2.1410 2.3812 2.3812 2.3812 2.3812 2.9116 2.9116 2.9116 2.9116 3.5147 3.5147 3.5147 3.5147 3.6970 3.6970 3.6970 3.6970 3.8425 3.8425 3.8425 3.8425 5.2167 5.2167 5.2167 5.2167 5.7153 5.7153 5.7153 5.7153 7.7799 7.7799 7.7799 7.7799 8.9965 8.9965 8.9965 8.9965 9.8868 9.8868 k = 0.1220 0.0704 0.2241 ( 6072 PWs) bands (ev): -24.7181 -24.7181 -24.7181 -24.7181 -8.4200 -8.4200 -8.4200 -8.4200 -8.1749 -8.1749 -8.1749 -8.1749 -8.1290 -8.1290 -8.1290 -8.1290 -5.4262 -5.4262 -5.4262 -5.4262 2.1161 2.1161 2.1161 2.1161 2.3850 2.3850 2.3850 2.3850 2.9129 2.9129 2.9129 2.9129 3.5173 3.5173 3.5173 3.5173 3.6995 3.6995 3.6995 3.6995 3.8564 3.8564 3.8564 3.8564 5.1167 5.1167 5.1167 5.1167 5.6671 5.6671 5.6671 5.6671 7.8668 7.8668 7.8668 7.8668 8.9843 8.9843 8.9843 8.9843 9.8778 9.8778 k = 0.1341 0.0774 0.2241 ( 6078 PWs) bands (ev): -24.7180 -24.7180 -24.7180 -24.7180 -8.4204 -8.4204 -8.4204 -8.4204 -8.1751 -8.1751 -8.1751 -8.1751 -8.1307 -8.1307 -8.1307 -8.1307 -5.4137 -5.4137 -5.4137 -5.4137 2.0877 2.0877 2.0877 2.0877 2.3902 2.3902 2.3902 2.3902 2.9140 2.9140 2.9140 2.9140 3.5199 3.5199 3.5199 3.5199 3.7019 3.7019 3.7019 3.7019 3.8723 3.8723 3.8723 3.8723 5.0178 5.0178 5.0178 5.0178 5.6168 5.6168 5.6168 5.6168 7.9455 7.9455 7.9455 7.9455 8.9667 8.9667 8.9667 8.9667 9.8789 9.8789 k = 0.1463 0.0845 0.2241 ( 6084 PWs) bands (ev): -24.7178 -24.7178 -24.7178 -24.7178 -8.4209 -8.4209 -8.4209 -8.4209 -8.1755 -8.1755 -8.1755 -8.1755 -8.1324 -8.1324 -8.1324 -8.1324 -5.4001 -5.4001 -5.4001 -5.4001 2.0561 2.0561 2.0561 2.0561 2.3968 2.3968 2.3968 2.3968 2.9149 2.9149 2.9149 2.9149 3.5224 3.5224 3.5224 3.5224 3.7042 3.7042 3.7042 3.7042 3.8902 3.8902 3.8902 3.8902 4.9210 4.9210 4.9210 4.9210 5.5646 5.5646 5.5646 5.5646 8.0146 8.0146 8.0146 8.0146 8.9429 8.9429 8.9429 8.9429 9.8920 9.8920 k = 0.1585 0.0915 0.2241 ( 6086 PWs) bands (ev): -24.7176 -24.7176 -24.7176 -24.7176 -8.4215 -8.4215 -8.4215 -8.4215 -8.1759 -8.1759 -8.1759 -8.1759 -8.1342 -8.1342 -8.1342 -8.1342 -5.3856 -5.3856 -5.3856 -5.3856 2.0215 2.0215 2.0215 2.0215 2.4046 2.4046 2.4046 2.4046 2.9157 2.9157 2.9157 2.9157 3.5247 3.5247 3.5247 3.5247 3.7063 3.7063 3.7063 3.7063 3.9101 3.9101 3.9101 3.9101 4.8269 4.8269 4.8269 4.8269 5.5107 5.5107 5.5107 5.5107 8.0731 8.0731 8.0731 8.0731 8.9125 8.9125 8.9125 8.9125 9.9178 9.9178 k = 0.1707 0.0986 0.2241 ( 6082 PWs) bands (ev): -24.7174 -24.7174 -24.7174 -24.7174 -8.4221 -8.4221 -8.4221 -8.4221 -8.1763 -8.1763 -8.1763 -8.1763 -8.1359 -8.1359 -8.1359 -8.1359 -5.3703 -5.3703 -5.3703 -5.3703 1.9842 1.9842 1.9842 1.9842 2.4136 2.4136 2.4136 2.4136 2.9163 2.9163 2.9163 2.9163 3.5269 3.5269 3.5269 3.5269 3.7082 3.7082 3.7082 3.7082 3.9318 3.9318 3.9318 3.9318 4.7360 4.7360 4.7360 4.7360 5.4556 5.4556 5.4556 5.4556 8.1206 8.1206 8.1206 8.1206 8.8758 8.8758 8.8758 8.8758 9.9559 9.9559 k = 0.1829 0.1056 0.2241 ( 6088 PWs) bands (ev): -24.7172 -24.7172 -24.7172 -24.7172 -8.4228 -8.4228 -8.4228 -8.4228 -8.1769 -8.1769 -8.1769 -8.1769 -8.1375 -8.1375 -8.1375 -8.1375 -5.3542 -5.3542 -5.3542 -5.3542 1.9442 1.9442 1.9442 1.9442 2.4236 2.4236 2.4236 2.4236 2.9166 2.9166 2.9166 2.9166 3.5290 3.5290 3.5290 3.5290 3.7098 3.7098 3.7098 3.7098 3.9552 3.9552 3.9552 3.9552 4.6487 4.6487 4.6487 4.6487 5.3995 5.3995 5.3995 5.3995 8.1573 8.1573 8.1573 8.1573 8.8336 8.8336 8.8336 8.8336 10.0046 10.0046 k = 0.1951 0.1127 0.2241 ( 6086 PWs) bands (ev): -24.7170 -24.7170 -24.7170 -24.7170 -8.4236 -8.4236 -8.4236 -8.4236 -8.1776 -8.1776 -8.1776 -8.1776 -8.1391 -8.1391 -8.1391 -8.1391 -5.3373 -5.3373 -5.3373 -5.3373 1.9020 1.9020 1.9020 1.9020 2.4345 2.4345 2.4345 2.4345 2.9168 2.9168 2.9168 2.9168 3.5309 3.5309 3.5309 3.5309 3.7113 3.7113 3.7113 3.7113 3.9800 3.9800 3.9800 3.9800 4.5654 4.5654 4.5654 4.5654 5.3427 5.3427 5.3427 5.3427 8.1836 8.1836 8.1836 8.1836 8.7866 8.7866 8.7866 8.7866 10.0616 10.0616 k = 0.2073 0.1197 0.2241 ( 6082 PWs) bands (ev): -24.7168 -24.7168 -24.7168 -24.7168 -8.4245 -8.4245 -8.4245 -8.4245 -8.1784 -8.1784 -8.1784 -8.1784 -8.1405 -8.1405 -8.1405 -8.1405 -5.3199 -5.3199 -5.3199 -5.3199 1.8576 1.8576 1.8576 1.8576 2.4463 2.4463 2.4463 2.4463 2.9168 2.9168 2.9168 2.9168 3.5326 3.5326 3.5326 3.5326 3.7125 3.7125 3.7125 3.7125 4.0058 4.0058 4.0058 4.0058 4.4866 4.4866 4.4866 4.4866 5.2855 5.2855 5.2855 5.2855 8.2003 8.2003 8.2003 8.2003 8.7362 8.7362 8.7362 8.7362 10.1242 10.1242 k = 0.2195 0.1267 0.2241 ( 6088 PWs) bands (ev): -24.7165 -24.7165 -24.7165 -24.7165 -8.4254 -8.4254 -8.4254 -8.4254 -8.1793 -8.1793 -8.1793 -8.1793 -8.1418 -8.1418 -8.1418 -8.1418 -5.3018 -5.3018 -5.3018 -5.3018 1.8115 1.8115 1.8115 1.8115 2.4589 2.4589 2.4589 2.4589 2.9165 2.9165 2.9165 2.9165 3.5341 3.5341 3.5341 3.5341 3.7136 3.7136 3.7136 3.7136 4.0321 4.0321 4.0321 4.0321 4.4129 4.4129 4.4129 4.4129 5.2282 5.2282 5.2282 5.2282 8.2085 8.2085 8.2085 8.2085 8.6833 8.6833 8.6833 8.6833 10.1897 10.1897 k = 0.2317 0.1338 0.2241 ( 6096 PWs) bands (ev): -24.7163 -24.7163 -24.7163 -24.7163 -8.4264 -8.4264 -8.4264 -8.4264 -8.1803 -8.1803 -8.1803 -8.1803 -8.1430 -8.1430 -8.1430 -8.1430 -5.2833 -5.2833 -5.2833 -5.2833 1.7638 1.7638 1.7638 1.7638 2.4722 2.4722 2.4722 2.4722 2.9161 2.9161 2.9161 2.9161 3.5354 3.5354 3.5354 3.5354 3.7144 3.7144 3.7144 3.7144 4.0576 4.0576 4.0576 4.0576 4.3455 4.3455 4.3455 4.3455 5.1711 5.1711 5.1711 5.1711 8.2089 8.2089 8.2089 8.2089 8.6289 8.6289 8.6289 8.6289 10.2561 10.2561 k = 0.2439 0.1408 0.2241 ( 6100 PWs) bands (ev): -24.7161 -24.7161 -24.7161 -24.7161 -8.4275 -8.4275 -8.4275 -8.4275 -8.1814 -8.1814 -8.1814 -8.1814 -8.1439 -8.1439 -8.1439 -8.1439 -5.2644 -5.2644 -5.2644 -5.2644 1.7148 1.7148 1.7148 1.7148 2.4860 2.4860 2.4860 2.4860 2.9156 2.9156 2.9156 2.9156 3.5366 3.5366 3.5366 3.5366 3.7149 3.7149 3.7149 3.7149 4.0793 4.0793 4.0793 4.0793 4.2873 4.2873 4.2873 4.2873 5.1143 5.1143 5.1143 5.1143 8.2027 8.2027 8.2027 8.2027 8.5740 8.5740 8.5740 8.5740 10.3216 10.3216 k = 0.2561 0.1479 0.2241 ( 6108 PWs) bands (ev): -24.7159 -24.7159 -24.7159 -24.7159 -8.4287 -8.4287 -8.4287 -8.4287 -8.1827 -8.1827 -8.1827 -8.1827 -8.1447 -8.1447 -8.1447 -8.1447 -5.2453 -5.2453 -5.2453 -5.2453 1.6650 1.6650 1.6650 1.6650 2.5005 2.5005 2.5005 2.5005 2.9149 2.9149 2.9149 2.9149 3.5376 3.5376 3.5376 3.5376 3.7152 3.7152 3.7152 3.7152 4.0898 4.0898 4.0898 4.0898 4.2455 4.2455 4.2455 4.2455 5.0583 5.0583 5.0583 5.0583 8.1904 8.1904 8.1904 8.1904 8.5194 8.5194 8.5194 8.5194 10.3855 10.3855 k = 0.2683 0.1549 0.2241 ( 6106 PWs) bands (ev): -24.7156 -24.7156 -24.7156 -24.7156 -8.4300 -8.4300 -8.4300 -8.4300 -8.1840 -8.1840 -8.1840 -8.1840 -8.1453 -8.1453 -8.1453 -8.1453 -5.2259 -5.2259 -5.2259 -5.2259 1.6145 1.6145 1.6145 1.6145 2.5154 2.5154 2.5154 2.5154 2.9142 2.9142 2.9142 2.9142 3.5385 3.5385 3.5385 3.5385 3.7152 3.7152 3.7152 3.7152 4.0771 4.0771 4.0771 4.0771 4.2320 4.2320 4.2320 4.2320 5.0032 5.0032 5.0032 5.0032 8.1727 8.1727 8.1727 8.1727 8.4660 8.4660 8.4660 8.4660 10.4475 10.4475 k = 0.2805 0.1619 0.2241 ( 6118 PWs) bands (ev): -24.7154 -24.7154 -24.7154 -24.7154 -8.4313 -8.4313 -8.4313 -8.4313 -8.1855 -8.1855 -8.1855 -8.1855 -8.1457 -8.1457 -8.1457 -8.1457 -5.2066 -5.2066 -5.2066 -5.2066 1.5639 1.5639 1.5639 1.5639 2.5306 2.5306 2.5306 2.5306 2.9133 2.9133 2.9133 2.9133 3.5392 3.5392 3.5392 3.5392 3.7146 3.7146 3.7146 3.7146 4.0433 4.0433 4.0433 4.0433 4.2444 4.2444 4.2444 4.2444 4.9494 4.9494 4.9494 4.9494 8.1500 8.1500 8.1500 8.1500 8.4145 8.4145 8.4145 8.4145 10.5077 10.5077 k = 0.2927 0.1690 0.2241 ( 6110 PWs) bands (ev): -24.7152 -24.7152 -24.7152 -24.7152 -8.4326 -8.4326 -8.4326 -8.4326 -8.1869 -8.1869 -8.1869 -8.1869 -8.1460 -8.1460 -8.1460 -8.1460 -5.1873 -5.1873 -5.1873 -5.1873 1.5133 1.5133 1.5133 1.5133 2.5462 2.5462 2.5462 2.5462 2.9125 2.9125 2.9125 2.9125 3.5399 3.5399 3.5399 3.5399 3.7136 3.7136 3.7136 3.7136 4.0019 4.0019 4.0019 4.0019 4.2690 4.2690 4.2690 4.2690 4.8971 4.8971 4.8971 4.8971 8.1228 8.1228 8.1228 8.1228 8.3657 8.3657 8.3657 8.3657 10.5665 10.5665 k = 0.3049 0.1760 0.2241 ( 6106 PWs) bands (ev): -24.7150 -24.7150 -24.7150 -24.7150 -8.4339 -8.4339 -8.4339 -8.4339 -8.1884 -8.1884 -8.1884 -8.1884 -8.1462 -8.1462 -8.1462 -8.1462 -5.1681 -5.1681 -5.1681 -5.1681 1.4632 1.4632 1.4632 1.4632 2.5620 2.5620 2.5620 2.5620 2.9116 2.9116 2.9116 2.9116 3.5403 3.5403 3.5403 3.5403 3.7119 3.7119 3.7119 3.7119 3.9602 3.9602 3.9602 3.9602 4.2983 4.2983 4.2983 4.2983 4.8466 4.8466 4.8466 4.8466 8.0913 8.0913 8.0913 8.0913 8.3202 8.3202 8.3202 8.3202 10.6244 10.6244 k = 0.3171 0.1831 0.2241 ( 6110 PWs) bands (ev): -24.7148 -24.7148 -24.7148 -24.7148 -8.4353 -8.4353 -8.4353 -8.4353 -8.1900 -8.1900 -8.1900 -8.1900 -8.1462 -8.1462 -8.1462 -8.1462 -5.1493 -5.1493 -5.1493 -5.1493 1.4139 1.4139 1.4139 1.4139 2.5779 2.5779 2.5779 2.5779 2.9107 2.9107 2.9107 2.9107 3.5407 3.5407 3.5407 3.5407 3.7091 3.7091 3.7091 3.7091 3.9210 3.9210 3.9210 3.9210 4.3291 4.3291 4.3291 4.3291 4.7984 4.7984 4.7984 4.7984 8.0561 8.0561 8.0561 8.0561 8.2785 8.2785 8.2785 8.2785 10.6819 10.6819 k = 0.3293 0.1901 0.2241 ( 6098 PWs) bands (ev): -24.7145 -24.7145 -24.7145 -24.7145 -8.4367 -8.4367 -8.4367 -8.4367 -8.1915 -8.1915 -8.1915 -8.1915 -8.1461 -8.1461 -8.1461 -8.1461 -5.1309 -5.1309 -5.1309 -5.1309 1.3659 1.3659 1.3659 1.3659 2.5937 2.5937 2.5937 2.5937 2.9099 2.9099 2.9099 2.9099 3.5409 3.5409 3.5409 3.5409 3.7050 3.7050 3.7050 3.7050 3.8856 3.8856 3.8856 3.8856 4.3598 4.3598 4.3598 4.3598 4.7530 4.7530 4.7530 4.7530 8.0178 8.0178 8.0178 8.0178 8.2407 8.2407 8.2407 8.2407 10.7392 10.7392 k = 0.3415 0.1971 0.2241 ( 6102 PWs) bands (ev): -24.7143 -24.7143 -24.7143 -24.7143 -8.4380 -8.4380 -8.4380 -8.4380 -8.1929 -8.1929 -8.1929 -8.1929 -8.1460 -8.1460 -8.1460 -8.1460 -5.1130 -5.1130 -5.1130 -5.1130 1.3193 1.3193 1.3193 1.3193 2.6094 2.6094 2.6094 2.6094 2.9091 2.9091 2.9091 2.9091 3.5410 3.5410 3.5410 3.5410 3.6990 3.6990 3.6990 3.6990 3.8549 3.8549 3.8549 3.8549 4.3891 4.3891 4.3891 4.3891 4.7113 4.7113 4.7113 4.7113 7.9774 7.9774 7.9774 7.9774 8.2066 8.2066 8.2066 8.2066 10.7966 10.7966 k = 0.3537 0.2042 0.2241 ( 6098 PWs) bands (ev): -24.7142 -24.7142 -24.7142 -24.7142 -8.4394 -8.4394 -8.4394 -8.4394 -8.1943 -8.1943 -8.1943 -8.1943 -8.1457 -8.1457 -8.1457 -8.1457 -5.0959 -5.0959 -5.0959 -5.0959 1.2747 1.2747 1.2747 1.2747 2.6248 2.6248 2.6248 2.6248 2.9085 2.9085 2.9085 2.9085 3.5409 3.5409 3.5409 3.5409 3.6907 3.6907 3.6907 3.6907 3.8295 3.8295 3.8295 3.8295 4.4153 4.4153 4.4153 4.4153 4.6745 4.6745 4.6745 4.6745 7.9358 7.9358 7.9358 7.9358 8.1759 8.1759 8.1759 8.1759 10.8542 10.8542 k = 0.3659 0.2112 0.2241 ( 6098 PWs) bands (ev): -24.7140 -24.7140 -24.7140 -24.7140 -8.4407 -8.4407 -8.4407 -8.4407 -8.1957 -8.1957 -8.1957 -8.1957 -8.1455 -8.1455 -8.1455 -8.1455 -5.0795 -5.0795 -5.0795 -5.0795 1.2323 1.2323 1.2323 1.2323 2.6397 2.6397 2.6397 2.6397 2.9079 2.9079 2.9079 2.9079 3.5407 3.5407 3.5407 3.5407 3.6798 3.6798 3.6798 3.6798 3.8097 3.8097 3.8097 3.8097 4.4360 4.4360 4.4360 4.4360 4.6448 4.6448 4.6448 4.6448 7.8941 7.8941 7.8941 7.8941 8.1483 8.1483 8.1483 8.1483 10.9120 10.9120 k = 0.3780 0.2183 0.2241 ( 6114 PWs) bands (ev): -24.7138 -24.7138 -24.7138 -24.7138 -8.4419 -8.4419 -8.4419 -8.4419 -8.1970 -8.1970 -8.1970 -8.1970 -8.1452 -8.1452 -8.1452 -8.1452 -5.0640 -5.0640 -5.0640 -5.0640 1.1924 1.1924 1.1924 1.1924 2.6540 2.6540 2.6540 2.6540 2.9075 2.9075 2.9075 2.9075 3.5403 3.5403 3.5403 3.5403 3.6667 3.6667 3.6667 3.6667 3.7951 3.7951 3.7951 3.7951 4.4476 4.4476 4.4476 4.4476 4.6257 4.6257 4.6257 4.6257 7.8532 7.8532 7.8532 7.8532 8.1235 8.1235 8.1235 8.1235 10.9697 10.9697 k = 0.3902 0.2253 0.2241 ( 6114 PWs) bands (ev): -24.7137 -24.7137 -24.7137 -24.7137 -8.4431 -8.4431 -8.4431 -8.4431 -8.1981 -8.1981 -8.1981 -8.1981 -8.1449 -8.1449 -8.1449 -8.1449 -5.0496 -5.0496 -5.0496 -5.0496 1.1554 1.1554 1.1554 1.1554 2.6676 2.6676 2.6676 2.6676 2.9072 2.9072 2.9072 2.9072 3.5397 3.5397 3.5397 3.5397 3.6523 3.6523 3.6523 3.6523 3.7849 3.7849 3.7849 3.7849 4.4471 4.4471 4.4471 4.4471 4.6199 4.6199 4.6199 4.6199 7.8139 7.8139 7.8139 7.8139 8.1012 8.1012 8.1012 8.1012 11.0271 11.0271 k = 0.4024 0.2323 0.2241 ( 6114 PWs) bands (ev): -24.7135 -24.7135 -24.7135 -24.7135 -8.4442 -8.4442 -8.4442 -8.4442 -8.1992 -8.1992 -8.1992 -8.1992 -8.1446 -8.1446 -8.1446 -8.1446 -5.0364 -5.0364 -5.0364 -5.0364 1.1214 1.1214 1.1214 1.1214 2.6802 2.6802 2.6802 2.6802 2.9071 2.9071 2.9071 2.9071 3.5389 3.5389 3.5389 3.5389 3.6377 3.6377 3.6377 3.6377 3.7778 3.7778 3.7778 3.7778 4.4360 4.4360 4.4360 4.4360 4.6260 4.6260 4.6260 4.6260 7.7769 7.7769 7.7769 7.7769 8.0814 8.0814 8.0814 8.0814 11.0838 11.0838 k = 0.4146 0.2394 0.2241 ( 6112 PWs) bands (ev): -24.7134 -24.7134 -24.7134 -24.7134 -8.4452 -8.4452 -8.4452 -8.4452 -8.2002 -8.2002 -8.2002 -8.2002 -8.1443 -8.1443 -8.1443 -8.1443 -5.0244 -5.0244 -5.0244 -5.0244 1.0909 1.0909 1.0909 1.0909 2.6919 2.6919 2.6919 2.6919 2.9071 2.9071 2.9071 2.9071 3.5378 3.5378 3.5378 3.5378 3.6240 3.6240 3.6240 3.6240 3.7730 3.7730 3.7730 3.7730 4.4189 4.4189 4.4189 4.4189 4.6389 4.6389 4.6389 4.6389 7.7428 7.7428 7.7428 7.7428 8.0639 8.0639 8.0639 8.0639 11.1389 11.1389 k = 0.4268 0.2464 0.2241 ( 6118 PWs) bands (ev): -24.7133 -24.7133 -24.7133 -24.7133 -8.4461 -8.4461 -8.4461 -8.4461 -8.2010 -8.2010 -8.2010 -8.2010 -8.1441 -8.1441 -8.1441 -8.1441 -5.0138 -5.0138 -5.0138 -5.0138 1.0639 1.0639 1.0639 1.0639 2.7022 2.7022 2.7022 2.7022 2.9072 2.9072 2.9072 2.9072 3.5364 3.5364 3.5364 3.5364 3.6117 3.6117 3.6117 3.6117 3.7697 3.7697 3.7697 3.7697 4.4001 4.4001 4.4001 4.4001 4.6545 4.6545 4.6545 4.6545 7.7121 7.7121 7.7121 7.7121 8.0487 8.0487 8.0487 8.0487 11.1918 11.1918 k = 0.4390 0.2535 0.2241 ( 6114 PWs) bands (ev): -24.7132 -24.7132 -24.7132 -24.7132 -8.4468 -8.4468 -8.4468 -8.4468 -8.2018 -8.2018 -8.2018 -8.2018 -8.1438 -8.1438 -8.1438 -8.1438 -5.0047 -5.0047 -5.0047 -5.0047 1.0408 1.0408 1.0408 1.0408 2.7112 2.7112 2.7112 2.7112 2.9074 2.9074 2.9074 2.9074 3.5348 3.5348 3.5348 3.5348 3.6013 3.6013 3.6013 3.6013 3.7674 3.7674 3.7674 3.7674 4.3821 4.3821 4.3821 4.3821 4.6700 4.6700 4.6700 4.6700 7.6854 7.6854 7.6854 7.6854 8.0359 8.0359 8.0359 8.0359 11.2413 11.2413 k = 0.4512 0.2605 0.2241 ( 6106 PWs) bands (ev): -24.7131 -24.7131 -24.7131 -24.7131 -8.4475 -8.4475 -8.4475 -8.4475 -8.2024 -8.2024 -8.2024 -8.2024 -8.1436 -8.1436 -8.1436 -8.1436 -4.9971 -4.9971 -4.9971 -4.9971 1.0216 1.0216 1.0216 1.0216 2.7188 2.7188 2.7188 2.7188 2.9077 2.9077 2.9077 2.9077 3.5330 3.5330 3.5330 3.5330 3.5930 3.5930 3.5930 3.5930 3.7658 3.7658 3.7658 3.7658 4.3663 4.3663 4.3663 4.3663 4.6840 4.6840 4.6840 4.6840 7.6629 7.6629 7.6629 7.6629 8.0253 8.0253 8.0253 8.0253 11.2859 11.2859 k = 0.4634 0.2676 0.2241 ( 6102 PWs) bands (ev): -24.7131 -24.7131 -24.7131 -24.7131 -8.4480 -8.4480 -8.4480 -8.4480 -8.2028 -8.2028 -8.2028 -8.2028 -8.1434 -8.1434 -8.1434 -8.1434 -4.9911 -4.9911 -4.9911 -4.9911 1.0065 1.0065 1.0065 1.0065 2.7247 2.7247 2.7247 2.7247 2.9080 2.9080 2.9080 2.9080 3.5312 3.5312 3.5312 3.5312 3.5869 3.5869 3.5869 3.5869 3.7647 3.7647 3.7647 3.7647 4.3534 4.3534 4.3534 4.3534 4.6956 4.6956 4.6956 4.6956 7.6451 7.6451 7.6451 7.6451 8.0171 8.0171 8.0171 8.0171 11.3238 11.3238 k = 0.4756 0.2746 0.2241 ( 6108 PWs) bands (ev): -24.7130 -24.7130 -24.7130 -24.7130 -8.4483 -8.4483 -8.4483 -8.4483 -8.2032 -8.2032 -8.2032 -8.2032 -8.1433 -8.1433 -8.1433 -8.1433 -4.9868 -4.9868 -4.9868 -4.9868 0.9956 0.9956 0.9956 0.9956 2.7290 2.7290 2.7290 2.7290 2.9082 2.9082 2.9082 2.9082 3.5296 3.5296 3.5296 3.5296 3.5827 3.5827 3.5827 3.5827 3.7640 3.7640 3.7640 3.7640 4.3439 4.3439 4.3439 4.3439 4.7042 4.7042 4.7042 4.7042 7.6321 7.6321 7.6321 7.6321 8.0113 8.0113 8.0113 8.0113 11.3532 11.3532 k = 0.4878 0.2816 0.2241 ( 6114 PWs) bands (ev): -24.7130 -24.7130 -24.7130 -24.7130 -8.4486 -8.4486 -8.4486 -8.4486 -8.2034 -8.2034 -8.2034 -8.2034 -8.1432 -8.1432 -8.1432 -8.1432 -4.9842 -4.9842 -4.9842 -4.9842 0.9891 0.9891 0.9891 0.9891 2.7316 2.7316 2.7316 2.7316 2.9084 2.9084 2.9084 2.9084 3.5286 3.5286 3.5286 3.5286 3.5803 3.5803 3.5803 3.5803 3.7636 3.7636 3.7636 3.7636 4.3381 4.3381 4.3381 4.3381 4.7094 4.7094 4.7094 4.7094 7.6243 7.6243 7.6243 7.6243 8.0077 8.0077 8.0077 8.0077 11.3718 11.3718 k = 0.5000 0.2887 0.2241 ( 6096 PWs) bands (ev): -24.7130 -24.7130 -24.7130 -24.7130 -8.4486 -8.4486 -8.4486 -8.4486 -8.2034 -8.2034 -8.2034 -8.2034 -8.1432 -8.1432 -8.1432 -8.1432 -4.9834 -4.9834 -4.9834 -4.9834 0.9869 0.9869 0.9869 0.9869 2.7325 2.7325 2.7325 2.7325 2.9085 2.9085 2.9085 2.9085 3.5282 3.5282 3.5282 3.5282 3.5796 3.5796 3.5796 3.5796 3.7634 3.7634 3.7634 3.7634 4.3362 4.3362 4.3362 4.3362 4.7112 4.7112 4.7112 4.7112 7.6217 7.6217 7.6217 7.6217 8.0065 8.0065 8.0065 8.0065 11.3783 11.3783 k = 0.5000 0.2887 0.2241 ( 6096 PWs) bands (ev): -24.7130 -24.7130 -24.7130 -24.7130 -8.4486 -8.4486 -8.4486 -8.4486 -8.2034 -8.2034 -8.2034 -8.2034 -8.1432 -8.1432 -8.1432 -8.1432 -4.9834 -4.9834 -4.9834 -4.9834 0.9869 0.9869 0.9869 0.9869 2.7325 2.7325 2.7325 2.7325 2.9085 2.9085 2.9085 2.9085 3.5282 3.5282 3.5282 3.5282 3.5796 3.5796 3.5796 3.5796 3.7634 3.7634 3.7634 3.7634 4.3362 4.3362 4.3362 4.3362 4.7112 4.7112 4.7112 4.7112 7.6217 7.6217 7.6217 7.6217 8.0065 8.0065 8.0065 8.0065 11.3783 11.3783 k = 0.4931 0.3007 0.2241 ( 6112 PWs) bands (ev): -24.7130 -24.7130 -24.7130 -24.7130 -8.4489 -8.4489 -8.4484 -8.4484 -8.2038 -8.2038 -8.2031 -8.2031 -8.1433 -8.1433 -8.1433 -8.1433 -4.9831 -4.9831 -4.9831 -4.9831 0.9824 0.9824 0.9929 0.9929 2.7257 2.7257 2.7371 2.7371 2.9070 2.9070 2.9099 2.9099 3.5235 3.5235 3.5324 3.5324 3.5745 3.5745 3.5840 3.5840 3.7623 3.7623 3.7643 3.7643 4.3315 4.3315 4.3329 4.3329 4.7080 4.7080 4.7149 4.7149 7.6216 7.6216 7.6232 7.6232 8.0112 8.0112 8.0196 8.0196 11.3773 11.3781 k = 0.4861 0.3127 0.2241 ( 6108 PWs) bands (ev): -24.7130 -24.7130 -24.7130 -24.7130 -8.4491 -8.4491 -8.4480 -8.4480 -8.2041 -8.2041 -8.2027 -8.2027 -8.1435 -8.1435 -8.1434 -8.1434 -4.9824 -4.9824 -4.9823 -4.9823 0.9794 0.9794 1.0006 1.0006 2.7167 2.7167 2.7399 2.7399 2.9056 2.9056 2.9114 2.9114 3.5183 3.5183 3.5361 3.5361 3.5689 3.5689 3.5879 3.5879 3.7610 3.7610 3.7650 3.7650 4.3189 4.3189 4.3221 4.3221 4.7053 4.7053 4.7189 4.7189 7.6232 7.6232 7.6261 7.6261 8.0334 8.0334 8.0504 8.0504 11.3749 11.3758 k = 0.4792 0.3248 0.2241 ( 6100 PWs) bands (ev): -24.7129 -24.7129 -24.7129 -24.7129 -8.4493 -8.4493 -8.4477 -8.4477 -8.2044 -8.2044 -8.2023 -8.2023 -8.1438 -8.1438 -8.1437 -8.1437 -4.9811 -4.9811 -4.9810 -4.9810 0.9780 0.9780 1.0099 1.0099 2.7054 2.7054 2.7409 2.7409 2.9041 2.9041 2.9129 2.9129 3.5126 3.5126 3.5392 3.5392 3.5626 3.5626 3.5913 3.5913 3.7594 3.7594 3.7655 3.7655 4.2984 4.2984 4.3046 4.3046 4.7035 4.7035 4.7233 4.7233 7.6260 7.6260 7.6300 7.6300 8.0728 8.0728 8.0986 8.0986 11.3712 11.3718 k = 0.4722 0.3368 0.2241 ( 6112 PWs) bands (ev): -24.7129 -24.7129 -24.7129 -24.7129 -8.4495 -8.4495 -8.4473 -8.4473 -8.2048 -8.2048 -8.2020 -8.2020 -8.1443 -8.1443 -8.1441 -8.1441 -4.9794 -4.9794 -4.9792 -4.9792 0.9779 0.9779 1.0208 1.0208 2.6915 2.6915 2.7401 2.7401 2.9025 2.9025 2.9146 2.9146 3.5062 3.5062 3.5417 3.5417 3.5557 3.5557 3.5943 3.5943 3.7575 3.7575 3.7658 3.7658 4.2706 4.2706 4.2812 4.2812 4.7028 4.7028 4.7282 4.7282 7.6299 7.6299 7.6345 7.6345 8.1288 8.1288 8.1633 8.1633 11.3663 11.3665 k = 0.4653 0.3488 0.2241 ( 6116 PWs) bands (ev): -24.7129 -24.7129 -24.7129 -24.7129 -8.4497 -8.4497 -8.4470 -8.4470 -8.2051 -8.2051 -8.2016 -8.2016 -8.1448 -8.1448 -8.1446 -8.1446 -4.9772 -4.9772 -4.9770 -4.9770 0.9792 0.9792 1.0333 1.0333 2.6749 2.6749 2.7376 2.7376 2.9007 2.9007 2.9163 2.9163 3.4993 3.4993 3.5436 3.5436 3.5483 3.5483 3.5967 3.5967 3.7554 3.7554 3.7660 3.7660 4.2365 4.2365 4.2531 4.2531 4.7034 4.7034 4.7338 4.7338 7.6344 7.6344 7.6393 7.6393 8.2002 8.2002 8.2437 8.2437 11.3603 11.3605 k = 0.4583 0.3608 0.2241 ( 6098 PWs) bands (ev): -24.7129 -24.7129 -24.7129 -24.7129 -8.4498 -8.4498 -8.4465 -8.4465 -8.2054 -8.2054 -8.2012 -8.2012 -8.1455 -8.1455 -8.1451 -8.1451 -4.9746 -4.9746 -4.9743 -4.9743 0.9817 0.9817 1.0474 1.0474 2.6556 2.6556 2.7336 2.7336 2.8989 2.8989 2.9180 2.9180 3.4918 3.4918 3.5405 3.5405 3.5451 3.5451 3.5988 3.5988 3.7531 3.7531 3.7662 3.7662 4.1972 4.1972 4.2216 4.2216 4.7054 4.7054 4.7402 4.7402 7.6394 7.6394 7.6444 7.6444 8.2858 8.2858 8.3382 8.3382 11.3532 11.3538 k = 0.4514 0.3729 0.2241 ( 6096 PWs) bands (ev): -24.7128 -24.7128 -24.7128 -24.7128 -8.4499 -8.4499 -8.4461 -8.4461 -8.2057 -8.2057 -8.2008 -8.2008 -8.1462 -8.1462 -8.1458 -8.1458 -4.9715 -4.9715 -4.9713 -4.9713 0.9854 0.9854 1.0629 1.0629 2.6333 2.6333 2.7280 2.7280 2.8968 2.8968 2.9198 2.9198 3.4835 3.4835 3.5325 3.5325 3.5459 3.5459 3.6005 3.6005 3.7504 3.7504 3.7661 3.7661 4.1542 4.1542 4.1879 4.1879 4.7087 4.7087 4.7475 4.7475 7.6445 7.6445 7.6496 7.6496 8.3842 8.3842 8.4455 8.4455 11.3446 11.3450 k = 0.4444 0.3849 0.2241 ( 6104 PWs) bands (ev): -24.7128 -24.7128 -24.7128 -24.7128 -8.4500 -8.4500 -8.4457 -8.4457 -8.2061 -8.2061 -8.2004 -8.2004 -8.1470 -8.1470 -8.1465 -8.1465 -4.9682 -4.9682 -4.9678 -4.9678 0.9900 0.9900 1.0799 1.0799 2.6080 2.6080 2.7208 2.7208 2.8944 2.8944 2.9216 2.9216 3.4742 3.4742 3.5245 3.5245 3.5462 3.5462 3.6016 3.6016 3.7475 3.7475 3.7660 3.7660 4.1089 4.1089 4.1533 4.1533 4.7133 4.7133 4.7555 4.7555 7.6498 7.6498 7.6548 7.6548 8.4938 8.4938 8.5640 8.5640 11.3335 11.3336 k = 0.4375 0.3969 0.2241 ( 6100 PWs) bands (ev): -24.7128 -24.7128 -24.7128 -24.7128 -8.4500 -8.4500 -8.4453 -8.4453 -8.2065 -8.2065 -8.2001 -8.2001 -8.1479 -8.1479 -8.1472 -8.1472 -4.9644 -4.9644 -4.9640 -4.9640 0.9955 0.9955 1.0983 1.0983 2.5797 2.5797 2.7121 2.7121 2.8919 2.8919 2.9234 2.9234 3.4641 3.4641 3.5167 3.5167 3.5460 3.5460 3.6023 3.6023 3.7443 3.7443 3.7659 3.7659 4.0628 4.0628 4.1190 4.1190 4.7191 4.7191 4.7643 4.7643 7.6549 7.6549 7.6599 7.6599 8.6129 8.6129 8.6922 8.6922 11.3150 11.3153 k = 0.4306 0.4090 0.2241 ( 6090 PWs) bands (ev): -24.7127 -24.7127 -24.7127 -24.7127 -8.4501 -8.4501 -8.4449 -8.4449 -8.2068 -8.2068 -8.1997 -8.1997 -8.1488 -8.1488 -8.1479 -8.1479 -4.9604 -4.9604 -4.9600 -4.9600 1.0017 1.0017 1.1179 1.1179 2.5485 2.5485 2.7019 2.7019 2.8892 2.8892 2.9252 2.9252 3.4532 3.4532 3.5094 3.5094 3.5452 3.5452 3.6025 3.6025 3.7408 3.7408 3.7657 3.7657 4.0173 4.0173 4.0858 4.0858 4.7258 4.7258 4.7738 4.7738 7.6599 7.6599 7.6648 7.6648 8.7398 8.7398 8.8285 8.8285 11.2681 11.2716 k = 0.4236 0.4210 0.2241 ( 6094 PWs) bands (ev): -24.7127 -24.7127 -24.7127 -24.7127 -8.4501 -8.4501 -8.4445 -8.4445 -8.2072 -8.2072 -8.1994 -8.1994 -8.1497 -8.1497 -8.1487 -8.1487 -4.9562 -4.9562 -4.9558 -4.9558 1.0084 1.0084 1.1386 1.1386 2.5146 2.5146 2.6903 2.6903 2.8864 2.8864 2.9268 2.9268 3.4416 3.4416 3.5026 3.5026 3.5440 3.5440 3.6018 3.6018 3.7371 3.7371 3.7654 3.7654 3.9735 3.9735 4.0545 4.0545 4.7333 4.7333 4.7837 4.7837 7.6646 7.6646 7.6695 7.6695 8.8728 8.8728 8.9714 8.9714 11.2104 11.2133 k = 0.4167 0.4330 0.2241 ( 6106 PWs) bands (ev): -24.7126 -24.7126 -24.7126 -24.7126 -8.4502 -8.4502 -8.4441 -8.4441 -8.2076 -8.2076 -8.1991 -8.1991 -8.1506 -8.1506 -8.1494 -8.1494 -4.9519 -4.9519 -4.9514 -4.9514 1.0154 1.0154 1.1602 1.1602 2.4783 2.4783 2.6775 2.6775 2.8834 2.8834 2.9284 2.9284 3.4296 3.4296 3.4963 3.4963 3.5423 3.5423 3.6003 3.6003 3.7331 3.7331 3.7651 3.7651 3.9327 3.9327 4.0255 4.0255 4.7415 4.7415 4.7940 4.7940 7.6689 7.6689 7.6737 7.6737 9.0102 9.0102 9.1194 9.1194 11.1546 11.1585 k = 0.4097 0.4450 0.2241 ( 6104 PWs) bands (ev): -24.7126 -24.7126 -24.7126 -24.7126 -8.4502 -8.4502 -8.4438 -8.4438 -8.2080 -8.2080 -8.1989 -8.1989 -8.1515 -8.1515 -8.1501 -8.1501 -4.9474 -4.9474 -4.9469 -4.9469 1.0226 1.0226 1.1824 1.1824 2.4402 2.4402 2.6635 2.6635 2.8804 2.8804 2.9299 2.9299 3.4176 3.4176 3.4907 3.4907 3.5404 3.5404 3.5979 3.5979 3.7290 3.7290 3.7649 3.7649 3.8957 3.8957 3.9992 3.9992 4.7501 4.7501 4.8046 4.8046 7.6726 7.6726 7.6774 7.6774 9.1501 9.1501 9.2709 9.2709 11.1090 11.1124 k = 0.4028 0.4571 0.2241 ( 6100 PWs) bands (ev): -24.7125 -24.7125 -24.7125 -24.7125 -8.4503 -8.4503 -8.4434 -8.4434 -8.2085 -8.2085 -8.1987 -8.1987 -8.1524 -8.1524 -8.1508 -8.1508 -4.9430 -4.9430 -4.9423 -4.9423 1.0297 1.0297 1.2051 1.2051 2.4008 2.4008 2.6488 2.6488 2.8774 2.8774 2.9313 2.9313 3.4058 3.4058 3.4856 3.4856 3.5380 3.5380 3.5943 3.5943 3.7249 3.7249 3.7646 3.7646 3.8633 3.8633 3.9756 3.9756 4.7590 4.7590 4.8152 4.8152 7.6758 7.6758 7.6805 7.6805 9.2904 9.2904 9.4240 9.4240 11.0550 11.0619 k = 0.3958 0.4691 0.2241 ( 6114 PWs) bands (ev): -24.7125 -24.7125 -24.7125 -24.7125 -8.4503 -8.4503 -8.4432 -8.4432 -8.2089 -8.2089 -8.1986 -8.1986 -8.1532 -8.1532 -8.1514 -8.1514 -4.9385 -4.9385 -4.9379 -4.9379 1.0365 1.0365 1.2278 1.2278 2.3608 2.3608 2.6336 2.6336 2.8745 2.8745 2.9326 2.9326 3.3945 3.3945 3.4810 3.4810 3.5354 3.5354 3.5895 3.5895 3.7207 3.7207 3.7644 3.7644 3.8357 3.8357 3.9548 3.9548 4.7680 4.7680 4.8257 4.8257 7.6782 7.6782 7.6829 7.6829 9.4289 9.4289 9.5768 9.5768 11.0127 11.0171 k = 0.3889 0.4811 0.2241 ( 6118 PWs) bands (ev): -24.7125 -24.7125 -24.7124 -24.7124 -8.4503 -8.4503 -8.4429 -8.4429 -8.2094 -8.2094 -8.1985 -8.1985 -8.1539 -8.1539 -8.1519 -8.1519 -4.9342 -4.9342 -4.9335 -4.9335 1.0429 1.0429 1.2503 1.2503 2.3212 2.3212 2.6184 2.6184 2.8717 2.8717 2.9337 2.9337 3.3839 3.3839 3.4770 3.4770 3.5325 3.5325 3.5836 3.5836 3.7168 3.7168 3.7642 3.7642 3.8130 3.8130 3.9366 3.9366 4.7768 4.7768 4.8360 4.8360 7.6800 7.6800 7.6846 7.6846 9.5629 9.5629 9.7269 9.7269 10.9763 10.9763 k = 0.3819 0.4932 0.2241 ( 6130 PWs) bands (ev): -24.7124 -24.7124 -24.7124 -24.7124 -8.4504 -8.4504 -8.4427 -8.4427 -8.2098 -8.2098 -8.1984 -8.1984 -8.1546 -8.1546 -8.1524 -8.1524 -4.9301 -4.9301 -4.9294 -4.9294 1.0486 1.0486 1.2719 1.2719 2.2828 2.2828 2.6035 2.6035 2.8691 2.8691 2.9346 2.9346 3.3743 3.3743 3.4734 3.4734 3.5295 3.5295 3.5770 3.5770 3.7133 3.7133 3.7639 3.7639 3.7949 3.7949 3.9210 3.9210 4.7854 4.7854 4.8457 4.8457 7.6810 7.6810 7.6855 7.6855 9.6895 9.6895 9.8715 9.8715 10.9406 10.9406 k = 0.3750 0.5052 0.2241 ( 6124 PWs) bands (ev): -24.7124 -24.7124 -24.7124 -24.7124 -8.4504 -8.4504 -8.4425 -8.4425 -8.2102 -8.2102 -8.1984 -8.1984 -8.1551 -8.1551 -8.1528 -8.1528 -4.9263 -4.9263 -4.9256 -4.9256 1.0536 1.0536 1.2923 1.2923 2.2468 2.2468 2.5897 2.5897 2.8667 2.8667 2.9354 2.9354 3.3659 3.3659 3.4705 3.4705 3.5264 3.5264 3.5702 3.5702 3.7104 3.7104 3.7638 3.7638 3.7808 3.7808 3.9078 3.9078 4.7935 4.7935 4.8548 4.8548 7.6813 7.6813 7.6858 7.6858 9.8055 9.8055 10.0072 10.0072 10.9104 10.9104 k = 0.3681 0.5172 0.2241 ( 6124 PWs) bands (ev): -24.7123 -24.7123 -24.7123 -24.7123 -8.4505 -8.4505 -8.4423 -8.4423 -8.2106 -8.2106 -8.1984 -8.1984 -8.1555 -8.1555 -8.1531 -8.1531 -4.9229 -4.9229 -4.9221 -4.9221 1.0577 1.0577 1.3108 1.3108 2.2141 2.2141 2.5771 2.5771 2.8646 2.8646 2.9361 2.9361 3.3586 3.3586 3.4680 3.4680 3.5233 3.5233 3.5636 3.5636 3.7081 3.7081 3.7636 3.7636 3.7699 3.7699 3.8969 3.8969 4.8009 4.8009 4.8630 4.8630 7.6810 7.6810 7.6855 7.6855 9.9075 9.9075 10.1299 10.1299 10.8860 10.8860 k = 0.3611 0.5292 0.2241 ( 6116 PWs) bands (ev): -24.7123 -24.7123 -24.7123 -24.7123 -8.4505 -8.4505 -8.4422 -8.4422 -8.2109 -8.2109 -8.1984 -8.1984 -8.1559 -8.1559 -8.1533 -8.1533 -4.9199 -4.9199 -4.9191 -4.9191 1.0609 1.0609 1.3267 1.3267 2.1857 2.1857 2.5664 2.5664 2.8628 2.8628 2.9367 2.9367 3.3525 3.3525 3.4660 3.4660 3.5204 3.5204 3.5578 3.5578 3.7066 3.7066 3.7617 3.7617 3.7635 3.7635 3.8881 3.8881 4.8074 4.8074 4.8702 4.8702 7.6803 7.6803 7.6847 7.6847 9.9925 9.9925 10.2353 10.2353 10.8678 10.8679 k = 0.3542 0.5413 0.2241 ( 6116 PWs) bands (ev): -24.7123 -24.7123 -24.7123 -24.7123 -8.4506 -8.4506 -8.4421 -8.4421 -8.2112 -8.2112 -8.1985 -8.1985 -8.1562 -8.1562 -8.1535 -8.1535 -4.9174 -4.9174 -4.9166 -4.9166 1.0631 1.0631 1.3396 1.3396 2.1628 2.1628 2.5579 2.5579 2.8613 2.8613 2.9371 2.9371 3.3477 3.3477 3.4645 3.4645 3.5177 3.5177 3.5531 3.5531 3.7056 3.7056 3.7557 3.7557 3.7635 3.7635 3.8813 3.8813 4.8128 4.8128 4.8760 4.8760 7.6792 7.6792 7.6836 7.6836 10.0583 10.0583 10.3191 10.3191 10.8562 10.8562 k = 0.3472 0.5533 0.2241 ( 6118 PWs) bands (ev): -24.7123 -24.7123 -24.7123 -24.7123 -8.4506 -8.4506 -8.4421 -8.4421 -8.2114 -8.2114 -8.1985 -8.1985 -8.1563 -8.1563 -8.1536 -8.1536 -4.9156 -4.9156 -4.9147 -4.9147 1.0645 1.0645 1.3489 1.3489 2.1460 2.1460 2.5517 2.5517 2.8602 2.8602 2.9373 2.9373 3.3442 3.3442 3.4634 3.4634 3.5156 3.5156 3.5496 3.5496 3.7050 3.7050 3.7515 3.7515 3.7634 3.7634 3.8765 3.8765 4.8169 4.8169 4.8805 4.8805 7.6781 7.6781 7.6825 7.6825 10.1038 10.1038 10.3782 10.3782 10.8507 10.8507 k = 0.3403 0.5653 0.2241 ( 6122 PWs) bands (ev): -24.7122 -24.7122 -24.7122 -24.7122 -8.4507 -8.4507 -8.4420 -8.4420 -8.2116 -8.2116 -8.1985 -8.1985 -8.1565 -8.1565 -8.1537 -8.1537 -4.9144 -4.9144 -4.9135 -4.9135 1.0652 1.0652 1.3545 1.3545 2.1358 2.1358 2.5480 2.5480 2.8595 2.8595 2.9375 2.9375 3.3421 3.3421 3.4628 3.4628 3.5142 3.5142 3.5475 3.5475 3.7047 3.7047 3.7490 3.7490 3.7633 3.7633 3.8737 3.8737 4.8195 4.8195 4.8833 4.8833 7.6773 7.6773 7.6816 7.6816 10.1298 10.1298 10.4120 10.4120 10.8494 10.8494 k = 0.3333 0.5774 0.2241 ( 6126 PWs) bands (ev): -24.7122 -24.7122 -24.7122 -24.7122 -8.4507 -8.4507 -8.4420 -8.4420 -8.2116 -8.2116 -8.1986 -8.1986 -8.1565 -8.1565 -8.1537 -8.1537 -4.9140 -4.9140 -4.9131 -4.9131 1.0654 1.0654 1.3563 1.3563 2.1324 2.1324 2.5468 2.5468 2.8592 2.8592 2.9375 2.9375 3.3414 3.3414 3.4625 3.4625 3.5137 3.5137 3.5468 3.5468 3.7047 3.7047 3.7482 3.7482 3.7633 3.7633 3.8727 3.8727 4.8204 4.8204 4.8842 4.8842 7.6769 7.6769 7.6812 7.6812 10.1379 10.1379 10.4224 10.4224 10.8496 10.8496 k = 0.3333 0.5774 0.2241 ( 6126 PWs) bands (ev): -24.7122 -24.7122 -24.7122 -24.7122 -8.4507 -8.4507 -8.4420 -8.4420 -8.2116 -8.2116 -8.1986 -8.1986 -8.1565 -8.1565 -8.1537 -8.1537 -4.9140 -4.9140 -4.9131 -4.9131 1.0654 1.0654 1.3563 1.3563 2.1324 2.1324 2.5468 2.5468 2.8592 2.8592 2.9375 2.9375 3.3414 3.3414 3.4625 3.4625 3.5137 3.5137 3.5468 3.5468 3.7047 3.7047 3.7482 3.7482 3.7633 3.7633 3.8727 3.8727 4.8204 4.8204 4.8842 4.8842 7.6769 7.6769 7.6812 7.6812 10.1379 10.1379 10.4224 10.4224 10.8496 10.8496 k = 0.3262 0.5651 0.2241 ( 6122 PWs) bands (ev): -24.7122 -24.7122 -24.7122 -24.7122 -8.4507 -8.4507 -8.4420 -8.4420 -8.2115 -8.2115 -8.1985 -8.1985 -8.1565 -8.1565 -8.1537 -8.1537 -4.9144 -4.9144 -4.9136 -4.9136 1.0653 1.0653 1.3546 1.3546 2.1358 2.1358 2.5480 2.5480 2.8595 2.8595 2.9375 2.9375 3.3421 3.3421 3.4628 3.4628 3.5142 3.5142 3.5476 3.5476 3.7047 3.7047 3.7491 3.7491 3.7634 3.7634 3.8737 3.8737 4.8194 4.8194 4.8832 4.8832 7.6774 7.6774 7.6817 7.6817 10.1303 10.1303 10.4129 10.4129 10.8488 10.8488 k = 0.3191 0.5528 0.2241 ( 6122 PWs) bands (ev): -24.7123 -24.7123 -24.7123 -24.7123 -8.4506 -8.4506 -8.4421 -8.4421 -8.2114 -8.2114 -8.1985 -8.1985 -8.1564 -8.1564 -8.1537 -8.1537 -4.9158 -4.9158 -4.9149 -4.9149 1.0653 1.0653 1.3500 1.3500 2.1454 2.1454 2.5513 2.5513 2.8603 2.8603 2.9373 2.9373 3.3446 3.3446 3.4634 3.4634 3.5159 3.5159 3.5498 3.5498 3.7049 3.7049 3.7517 3.7517 3.7634 3.7634 3.8768 3.8768 4.8163 4.8163 4.8799 4.8799 7.6791 7.6791 7.6835 7.6835 10.1093 10.1093 10.3871 10.3871 10.8461 10.8462 k = 0.3121 0.5405 0.2241 ( 6118 PWs) bands (ev): -24.7123 -24.7123 -24.7123 -24.7123 -8.4505 -8.4505 -8.4420 -8.4420 -8.2111 -8.2111 -8.1983 -8.1983 -8.1563 -8.1563 -8.1536 -8.1536 -4.9182 -4.9182 -4.9174 -4.9174 1.0656 1.0656 1.3435 1.3435 2.1604 2.1604 2.5564 2.5564 2.8616 2.8616 2.9371 2.9371 3.3487 3.3487 3.4644 3.4644 3.5186 3.5186 3.5537 3.5537 3.7052 3.7052 3.7563 3.7563 3.7635 3.7635 3.8819 3.8819 4.8109 4.8109 4.8742 4.8742 7.6824 7.6824 7.6868 7.6868 10.0774 10.0774 10.3485 10.3485 10.8424 10.8424 k = 0.3050 0.5282 0.2241 ( 6116 PWs) bands (ev): -24.7123 -24.7123 -24.7123 -24.7123 -8.4504 -8.4504 -8.4420 -8.4420 -8.2107 -8.2107 -8.1981 -8.1981 -8.1561 -8.1561 -8.1535 -8.1535 -4.9216 -4.9216 -4.9208 -4.9208 1.0668 1.0668 1.3358 1.3358 2.1797 2.1797 2.5628 2.5628 2.8635 2.8635 2.9368 2.9368 3.3547 3.3547 3.4658 3.4658 3.5224 3.5224 3.5591 3.5591 3.7057 3.7057 3.7628 3.7628 3.7636 3.7636 3.8891 3.8891 4.8032 4.8032 4.8660 4.8660 7.6876 7.6876 7.6922 7.6922 10.0368 10.0368 10.3001 10.3001 10.8384 10.8384 k = 0.2979 0.5159 0.2241 ( 6114 PWs) bands (ev): -24.7124 -24.7124 -24.7124 -24.7124 -8.4502 -8.4502 -8.4420 -8.4420 -8.2102 -8.2102 -8.1979 -8.1979 -8.1559 -8.1559 -8.1534 -8.1534 -4.9262 -4.9262 -4.9254 -4.9254 1.0691 1.0691 1.3281 1.3281 2.2022 2.2022 2.5699 2.5699 2.8660 2.8660 2.9364 2.9364 3.3627 3.3627 3.4676 3.4676 3.5270 3.5270 3.5663 3.5663 3.7065 3.7065 3.7639 3.7639 3.7717 3.7717 3.8986 3.8986 4.7930 4.7930 4.8552 4.8552 7.6951 7.6951 7.6998 7.6998 9.9894 9.9894 10.2443 10.2443 10.8349 10.8349 k = 0.2908 0.5036 0.2241 ( 6114 PWs) bands (ev): -24.7124 -24.7124 -24.7124 -24.7124 -8.4499 -8.4499 -8.4419 -8.4419 -8.2096 -8.2096 -8.1975 -8.1975 -8.1557 -8.1557 -8.1532 -8.1532 -4.9318 -4.9318 -4.9311 -4.9311 1.0729 1.0729 1.3210 1.3210 2.2269 2.2269 2.5773 2.5773 2.8689 2.8689 2.9360 2.9360 3.3728 3.3728 3.4699 3.4699 3.5323 3.5323 3.5751 3.5751 3.7077 3.7077 3.7642 3.7642 3.7832 3.7832 3.9104 3.9104 4.7803 4.7803 4.8418 4.8418 7.7051 7.7051 7.7100 7.7100 9.9367 9.9367 10.1832 10.1832 10.8319 10.8319 k = 0.2837 0.4914 0.2241 ( 6118 PWs) bands (ev): -24.7125 -24.7125 -24.7125 -24.7125 -8.4496 -8.4496 -8.4418 -8.4418 -8.2089 -8.2089 -8.1971 -8.1971 -8.1555 -8.1555 -8.1531 -8.1531 -4.9387 -4.9387 -4.9380 -4.9380 1.0784 1.0784 1.3154 1.3154 2.2529 2.2529 2.5846 2.5846 2.8722 2.8722 2.9354 2.9354 3.3850 3.3850 3.4726 3.4726 3.5379 3.5379 3.5856 3.5856 3.7094 3.7094 3.7646 3.7646 3.7979 3.7979 3.9246 3.9246 4.7650 4.7650 4.8258 4.8258 7.7180 7.7180 7.7231 7.7231 9.8802 9.8802 10.1183 10.1183 10.8289 10.8289 k = 0.2766 0.4791 0.2241 ( 6098 PWs) bands (ev): -24.7126 -24.7126 -24.7126 -24.7126 -8.4492 -8.4492 -8.4416 -8.4416 -8.2080 -8.2080 -8.1966 -8.1966 -8.1553 -8.1553 -8.1530 -8.1530 -4.9467 -4.9467 -4.9460 -4.9460 1.0861 1.0861 1.3117 1.3117 2.2792 2.2792 2.5912 2.5912 2.8759 2.8759 2.9349 2.9349 3.3994 3.3994 3.4761 3.4761 3.5437 3.5437 3.5978 3.5978 3.7117 3.7117 3.7652 3.7652 3.8163 3.8163 3.9415 3.9415 4.7473 4.7473 4.8073 4.8073 7.7338 7.7338 7.7392 7.7392 9.8208 9.8208 10.0509 10.0509 10.8249 10.8249 k = 0.2695 0.4668 0.2241 ( 6098 PWs) bands (ev): -24.7127 -24.7127 -24.7126 -24.7126 -8.4487 -8.4487 -8.4413 -8.4413 -8.2071 -8.2071 -8.1960 -8.1960 -8.1551 -8.1551 -8.1528 -8.1528 -4.9558 -4.9558 -4.9552 -4.9552 1.0962 1.0962 1.3106 1.3106 2.3051 2.3051 2.5968 2.5968 2.8797 2.8797 2.9342 2.9342 3.4156 3.4156 3.4806 3.4806 3.5493 3.5493 3.6114 3.6114 3.7147 3.7147 3.7660 3.7660 3.8388 3.8388 3.9610 3.9610 4.7272 4.7272 4.7863 4.7863 7.7529 7.7529 7.7586 7.7586 9.7595 9.7595 9.9819 9.9819 10.8179 10.8179 k = 0.2624 0.4545 0.2241 ( 6098 PWs) bands (ev): -24.7128 -24.7128 -24.7128 -24.7128 -8.4481 -8.4481 -8.4410 -8.4410 -8.2060 -8.2060 -8.1953 -8.1953 -8.1549 -8.1549 -8.1527 -8.1527 -4.9662 -4.9662 -4.9656 -4.9656 1.1088 1.1088 1.3122 1.3122 2.3299 2.3299 2.6012 2.6012 2.8836 2.8836 2.9334 2.9334 3.4328 3.4328 3.4870 3.4870 3.5545 3.5545 3.6260 3.6260 3.7186 3.7186 3.7671 3.7671 3.8659 3.8659 3.9834 3.9834 4.7048 4.7048 4.7629 4.7629 7.7753 7.7753 7.7813 7.7813 9.6970 9.6970 9.9122 9.9122 10.8047 10.8047 k = 0.2553 0.4422 0.2241 ( 6088 PWs) bands (ev): -24.7129 -24.7129 -24.7129 -24.7129 -8.4474 -8.4474 -8.4406 -8.4406 -8.2049 -8.2049 -8.1946 -8.1946 -8.1547 -8.1547 -8.1526 -8.1526 -4.9776 -4.9776 -4.9771 -4.9771 1.1242 1.1242 1.3169 1.3169 2.3531 2.3531 2.6042 2.6042 2.8874 2.8874 2.9326 2.9326 3.4491 3.4491 3.4972 3.4972 3.5591 3.5591 3.6413 3.6413 3.7240 3.7240 3.7686 3.7686 3.8981 3.8981 4.0088 4.0088 4.6802 4.6802 4.7373 4.7373 7.8010 7.8010 7.8074 7.8074 9.6339 9.6339 9.8421 9.8421 10.7811 10.7811 k = 0.2482 0.4299 0.2241 ( 6090 PWs) bands (ev): -24.7130 -24.7130 -24.7130 -24.7130 -8.4466 -8.4466 -8.4401 -8.4401 -8.2036 -8.2036 -8.1938 -8.1938 -8.1545 -8.1545 -8.1525 -8.1525 -4.9902 -4.9902 -4.9897 -4.9897 1.1423 1.1423 1.3249 1.3249 2.3743 2.3743 2.6058 2.6058 2.8909 2.8909 2.9316 2.9316 3.4617 3.4617 3.5136 3.5136 3.5629 3.5629 3.6561 3.6561 3.7315 3.7315 3.7706 3.7706 3.9353 3.9353 4.0373 4.0373 4.6537 4.6537 4.7098 4.7098 7.8302 7.8302 7.8370 7.8370 9.5705 9.5705 9.7722 9.7722 10.7430 10.7430 k = 0.2411 0.4177 0.2241 ( 6078 PWs) bands (ev): -24.7131 -24.7131 -24.7131 -24.7131 -8.4457 -8.4457 -8.4395 -8.4395 -8.2023 -8.2023 -8.1929 -8.1929 -8.1543 -8.1543 -8.1524 -8.1524 -5.0038 -5.0038 -5.0034 -5.0034 1.1634 1.1634 1.3361 1.3361 2.3931 2.3931 2.6058 2.6058 2.8941 2.8941 2.9307 2.9307 3.4702 3.4702 3.5364 3.5364 3.5660 3.5660 3.6696 3.6696 3.7424 3.7424 3.7735 3.7735 3.9775 3.9775 4.0691 4.0691 4.6255 4.6255 4.6806 4.6806 7.8627 7.8627 7.8701 7.8701 9.5072 9.5072 9.7027 9.7027 10.6895 10.6895 k = 0.2340 0.4054 0.2241 ( 6086 PWs) bands (ev): -24.7133 -24.7133 -24.7133 -24.7133 -8.4448 -8.4448 -8.4389 -8.4389 -8.2009 -8.2009 -8.1920 -8.1920 -8.1541 -8.1541 -8.1522 -8.1522 -5.0184 -5.0184 -5.0181 -5.0181 1.1874 1.1874 1.3507 1.3507 2.4094 2.4094 2.6044 2.6044 2.8970 2.8970 2.9297 2.9297 3.4761 3.4761 3.5633 3.5633 3.5683 3.5683 3.6805 3.6805 3.7576 3.7576 3.7777 3.7777 4.0244 4.0244 4.1040 4.1040 4.5960 4.5960 4.6501 4.6501 7.8986 7.8986 7.9064 7.9064 9.4444 9.4444 9.6338 9.6338 10.6241 10.6241 k = 0.2270 0.3931 0.2241 ( 6094 PWs) bands (ev): -24.7135 -24.7135 -24.7135 -24.7135 -8.4438 -8.4438 -8.4382 -8.4382 -8.1995 -8.1995 -8.1910 -8.1910 -8.1539 -8.1539 -8.1521 -8.1521 -5.0339 -5.0339 -5.0337 -5.0337 1.2143 1.2143 1.3686 1.3686 2.4231 2.4231 2.6015 2.6015 2.8995 2.8995 2.9287 2.9287 3.4807 3.4807 3.5700 3.5700 3.5922 3.5922 3.6886 3.6886 3.7773 3.7773 3.7839 3.7839 4.0755 4.0755 4.1420 4.1420 4.5656 4.5656 4.6188 4.6188 7.9378 7.9378 7.9461 7.9461 9.3821 9.3821 9.5656 9.5656 10.5513 10.5513 k = 0.2199 0.3808 0.2241 ( 6088 PWs) bands (ev): -24.7136 -24.7136 -24.7136 -24.7136 -8.4426 -8.4426 -8.4374 -8.4374 -8.1980 -8.1980 -8.1899 -8.1899 -8.1536 -8.1536 -8.1519 -8.1519 -5.0503 -5.0503 -5.0501 -5.0501 1.2440 1.2440 1.3896 1.3896 2.4342 2.4342 2.5973 2.5973 2.9016 2.9016 2.9277 2.9277 3.4847 3.4847 3.5711 3.5711 3.6211 3.6211 3.6945 3.6945 3.7933 3.7933 3.8013 3.8013 4.1299 4.1299 4.1827 4.1827 4.5352 4.5352 4.5874 4.5874 7.9800 7.9800 7.9889 7.9889 9.3204 9.3204 9.4983 9.4983 10.4751 10.4751 k = 0.2128 0.3685 0.2241 ( 6080 PWs) bands (ev): -24.7138 -24.7138 -24.7138 -24.7138 -8.4415 -8.4415 -8.4365 -8.4365 -8.1964 -8.1964 -8.1889 -8.1889 -8.1534 -8.1534 -8.1517 -8.1517 -5.0675 -5.0675 -5.0674 -5.0674 1.2764 1.2764 1.4138 1.4138 2.4428 2.4428 2.5919 2.5919 2.9036 2.9036 2.9268 2.9268 3.4882 3.4882 3.5716 3.5716 3.6477 3.6477 3.6988 3.6988 3.8074 3.8074 3.8288 3.8288 4.1862 4.1862 4.2253 4.2253 4.5060 4.5060 4.5572 4.5572 8.0251 8.0251 8.0346 8.0346 9.2596 9.2596 9.4318 9.4318 10.3979 10.3979 k = 0.2057 0.3562 0.2241 ( 6076 PWs) bands (ev): -24.7140 -24.7140 -24.7140 -24.7140 -8.4402 -8.4402 -8.4356 -8.4356 -8.1948 -8.1948 -8.1878 -8.1878 -8.1530 -8.1530 -8.1515 -8.1515 -5.0854 -5.0854 -5.0853 -5.0853 1.3113 1.3113 1.4409 1.4409 2.4490 2.4490 2.5853 2.5853 2.9052 2.9052 2.9260 2.9260 3.4915 3.4915 3.5716 3.5716 3.6699 3.6699 3.7021 3.7021 3.8281 3.8281 3.8593 3.8593 4.2413 4.2413 4.2675 4.2675 4.4810 4.4810 4.5305 4.5305 8.0729 8.0729 8.0831 8.0831 9.1996 9.1996 9.3660 9.3660 10.3212 10.3212 k = 0.1986 0.3440 0.2241 ( 6076 PWs) bands (ev): -24.7142 -24.7142 -24.7142 -24.7142 -8.4389 -8.4389 -8.4347 -8.4347 -8.1932 -8.1932 -8.1867 -8.1867 -8.1527 -8.1527 -8.1513 -8.1513 -5.1038 -5.1038 -5.1038 -5.1038 1.3487 1.3487 1.4707 1.4707 2.4530 2.4530 2.5777 2.5777 2.9067 2.9067 2.9252 2.9252 3.4946 3.4946 3.5713 3.5713 3.6866 3.6866 3.7045 3.7045 3.8563 3.8563 3.8926 3.8926 4.2873 4.2873 4.3044 4.3044 4.4679 4.4679 4.5125 4.5125 8.1232 8.1232 8.1340 8.1340 9.1405 9.1405 9.3011 9.3011 10.2462 10.2462 k = 0.1915 0.3317 0.2241 ( 6088 PWs) bands (ev): -24.7144 -24.7144 -24.7144 -24.7144 -8.4376 -8.4376 -8.4337 -8.4337 -8.1917 -8.1917 -8.1856 -8.1856 -8.1522 -8.1522 -8.1509 -8.1509 -5.1228 -5.1228 -5.1228 -5.1228 1.3882 1.3882 1.5030 1.5030 2.4549 2.4549 2.5690 2.5690 2.9079 2.9079 2.9245 2.9245 3.4975 3.4975 3.5705 3.5705 3.6981 3.6981 3.7065 3.7065 3.8913 3.8913 3.9285 3.9285 4.3089 4.3089 4.3262 4.3262 4.4820 4.4820 4.5131 4.5131 8.1755 8.1755 8.1872 8.1872 9.0823 9.0823 9.2368 9.2368 10.1735 10.1735 k = 0.1844 0.3194 0.2241 ( 6088 PWs) bands (ev): -24.7146 -24.7146 -24.7146 -24.7146 -8.4363 -8.4363 -8.4326 -8.4326 -8.1901 -8.1901 -8.1845 -8.1845 -8.1517 -8.1517 -8.1505 -8.1505 -5.1422 -5.1422 -5.1422 -5.1422 1.4297 1.4297 1.5375 1.5375 2.4551 2.4551 2.5596 2.5596 2.9091 2.9091 2.9238 2.9238 3.5002 3.5002 3.5694 3.5694 3.7056 3.7056 3.7080 3.7080 3.9317 3.9317 3.9668 3.9668 4.3017 4.3017 4.3256 4.3256 4.5277 4.5277 4.5400 4.5400 8.2295 8.2295 8.2423 8.2423 9.0249 9.0249 9.1731 9.1731 10.1037 10.1037 k = 0.1773 0.3071 0.2241 ( 6090 PWs) bands (ev): -24.7149 -24.7149 -24.7149 -24.7149 -8.4349 -8.4349 -8.4316 -8.4316 -8.1885 -8.1885 -8.1835 -8.1835 -8.1510 -8.1510 -8.1500 -8.1500 -5.1618 -5.1618 -5.1618 -5.1618 1.4729 1.4729 1.5739 1.5739 2.4537 2.4537 2.5495 2.5495 2.9101 2.9101 2.9233 2.9233 3.5027 3.5027 3.5680 3.5680 3.7092 3.7092 3.7105 3.7105 3.9757 3.9757 4.0070 4.0070 4.2803 4.2803 4.3087 4.3087 4.5875 4.5875 4.5908 4.5908 8.2848 8.2848 8.2987 8.2987 8.9685 8.9685 9.1098 9.1098 10.0375 10.0375 k = 0.1702 0.2948 0.2241 ( 6082 PWs) bands (ev): -24.7151 -24.7151 -24.7151 -24.7151 -8.4335 -8.4335 -8.4305 -8.4305 -8.1870 -8.1870 -8.1825 -8.1825 -8.1503 -8.1503 -8.1494 -8.1494 -5.1817 -5.1817 -5.1817 -5.1817 1.5174 1.5174 1.6119 1.6119 2.4509 2.4509 2.5388 2.5388 2.9111 2.9111 2.9228 2.9228 3.5051 3.5051 3.5664 3.5664 3.7101 3.7101 3.7135 3.7135 4.0214 4.0214 4.0478 4.0478 4.2555 4.2555 4.2857 4.2857 4.6463 4.6463 4.6618 4.6618 8.3404 8.3404 8.3561 8.3561 8.9132 8.9132 9.0470 9.0470 9.9752 9.9752 k = 0.1631 0.2825 0.2241 ( 6082 PWs) bands (ev): -24.7153 -24.7153 -24.7153 -24.7153 -8.4322 -8.4322 -8.4295 -8.4295 -8.1855 -8.1855 -8.1815 -8.1815 -8.1494 -8.1494 -8.1487 -8.1487 -5.2016 -5.2016 -5.2016 -5.2016 1.5631 1.5631 1.6513 1.6513 2.4470 2.4470 2.5276 2.5276 2.9121 2.9121 2.9224 2.9224 3.5073 3.5073 3.5645 3.5645 3.7107 3.7107 3.7153 3.7153 4.0652 4.0652 4.0852 4.0852 4.2351 4.2351 4.2645 4.2645 4.7114 4.7114 4.7366 4.7366 8.3953 8.3953 8.4135 8.4135 8.8595 8.8595 8.9846 8.9846 9.9174 9.9174 k = 0.1560 0.2702 0.2241 ( 6082 PWs) bands (ev): -24.7156 -24.7156 -24.7156 -24.7156 -8.4309 -8.4309 -8.4284 -8.4284 -8.1841 -8.1841 -8.1806 -8.1806 -8.1484 -8.1484 -8.1479 -8.1479 -5.2216 -5.2216 -5.2215 -5.2215 1.6095 1.6095 1.6916 1.6916 2.4421 2.4421 2.5161 2.5161 2.9129 2.9129 2.9220 2.9220 3.5093 3.5093 3.5623 3.5623 3.7111 3.7111 3.7163 3.7163 4.0989 4.0989 4.1080 4.1080 4.2321 4.2321 4.2555 4.2555 4.7804 4.7804 4.8134 4.8134 8.4472 8.4472 8.4699 8.4699 8.8090 8.8090 8.9230 8.9230 9.8645 9.8645 k = 0.1489 0.2580 0.2241 ( 6082 PWs) bands (ev): -24.7158 -24.7158 -24.7158 -24.7158 -8.4296 -8.4296 -8.4274 -8.4274 -8.1828 -8.1828 -8.1797 -8.1797 -8.1473 -8.1473 -8.1469 -8.1469 -5.2414 -5.2414 -5.2413 -5.2413 1.6563 1.6563 1.7325 1.7325 2.4365 2.4365 2.5043 2.5043 2.9137 2.9137 2.9217 2.9217 3.5110 3.5110 3.5599 3.5599 3.7113 3.7113 3.7166 3.7166 4.1043 4.1043 4.1091 4.1091 4.2593 4.2593 4.2728 4.2728 4.8520 4.8520 4.8914 4.8914 8.4916 8.4916 8.5228 8.5228 8.7652 8.7652 8.8637 8.8637 9.8172 9.8172 k = 0.1418 0.2457 0.2241 ( 6078 PWs) bands (ev): -24.7160 -24.7160 -24.7160 -24.7160 -8.4283 -8.4283 -8.4264 -8.4264 -8.1816 -8.1816 -8.1790 -8.1790 -8.1460 -8.1460 -8.1457 -8.1457 -5.2609 -5.2609 -5.2609 -5.2609 1.7033 1.7033 1.7737 1.7737 2.4303 2.4303 2.4925 2.4925 2.9145 2.9145 2.9213 2.9213 3.5126 3.5126 3.5573 3.5573 3.7113 3.7113 3.7165 3.7165 4.0839 4.0839 4.0964 4.0964 4.3075 4.3075 4.3168 4.3168 4.9251 4.9251 4.9697 4.9697 8.5181 8.5181 8.5671 8.5671 8.7374 8.7374 8.8108 8.8108 9.7760 9.7760 k = 0.1348 0.2334 0.2241 ( 6078 PWs) bands (ev): -24.7163 -24.7163 -24.7163 -24.7163 -8.4272 -8.4272 -8.4255 -8.4255 -8.1805 -8.1805 -8.1783 -8.1783 -8.1447 -8.1447 -8.1445 -8.1445 -5.2802 -5.2802 -5.2801 -5.2801 1.7500 1.7500 1.8149 1.8149 2.4238 2.4238 2.4806 2.4806 2.9150 2.9150 2.9209 2.9209 3.5138 3.5138 3.5544 3.5544 3.7111 3.7111 3.7160 3.7160 4.0578 4.0578 4.0731 4.0731 4.3662 4.3662 4.3755 4.3755 4.9992 4.9992 5.0478 5.0478 8.5130 8.5130 8.5888 8.5888 8.7384 8.7384 8.7771 8.7771 9.7415 9.7415 k = 0.1277 0.2211 0.2241 ( 6086 PWs) bands (ev): -24.7165 -24.7165 -24.7165 -24.7165 -8.4261 -8.4261 -8.4246 -8.4246 -8.1795 -8.1795 -8.1776 -8.1776 -8.1432 -8.1432 -8.1431 -8.1431 -5.2991 -5.2991 -5.2990 -5.2990 1.7960 1.7960 1.8555 1.8555 2.4170 2.4170 2.4688 2.4688 2.9155 2.9155 2.9205 2.9205 3.5149 3.5149 3.5514 3.5514 3.7106 3.7106 3.7152 3.7152 4.0304 4.0304 4.0462 4.0462 4.4312 4.4312 4.4423 4.4423 5.0735 5.0735 5.1253 5.1253 8.4775 8.4775 8.5691 8.5691 8.7655 8.7655 8.7800 8.7800 9.7144 9.7144 k = 0.1206 0.2088 0.2241 ( 6086 PWs) bands (ev): -24.7167 -24.7167 -24.7167 -24.7167 -8.4251 -8.4251 -8.4238 -8.4238 -8.1786 -8.1786 -8.1771 -8.1771 -8.1416 -8.1416 -8.1415 -8.1415 -5.3174 -5.3174 -5.3173 -5.3173 1.8412 1.8412 1.8955 1.8955 2.4101 2.4101 2.4573 2.4573 2.9158 2.9158 2.9200 2.9200 3.5156 3.5156 3.5482 3.5482 3.7099 3.7099 3.7141 3.7141 4.0032 4.0032 4.0185 4.0185 4.5015 4.5015 4.5148 4.5148 5.1476 5.1476 5.2015 5.2015 8.4248 8.4248 8.5167 8.5167 8.8039 8.8039 8.8096 8.8096 9.6955 9.6955 k = 0.1135 0.1965 0.2241 ( 6086 PWs) bands (ev): -24.7170 -24.7170 -24.7170 -24.7170 -8.4241 -8.4241 -8.4231 -8.4231 -8.1778 -8.1778 -8.1766 -8.1766 -8.1399 -8.1399 -8.1399 -8.1399 -5.3352 -5.3352 -5.3351 -5.3351 1.8851 1.8851 1.9343 1.9343 2.4033 2.4033 2.4461 2.4461 2.9159 2.9159 2.9194 2.9194 3.5161 3.5161 3.5448 3.5448 3.7090 3.7090 3.7128 3.7128 3.9770 3.9770 3.9913 3.9913 4.5763 4.5763 4.5920 4.5920 5.2209 5.2209 5.2762 5.2762 8.3628 8.3628 8.4490 8.4490 8.8445 8.8445 8.8468 8.8468 9.6853 9.6853 k = 0.1064 0.1843 0.2241 ( 6080 PWs) bands (ev): -24.7172 -24.7172 -24.7172 -24.7172 -8.4233 -8.4233 -8.4224 -8.4224 -8.1772 -8.1772 -8.1762 -8.1762 -8.1382 -8.1382 -8.1381 -8.1381 -5.3523 -5.3523 -5.3522 -5.3522 1.9274 1.9274 1.9717 1.9717 2.3969 2.3969 2.4354 2.4354 2.9159 2.9159 2.9187 2.9187 3.5163 3.5163 3.5412 3.5412 3.7079 3.7079 3.7113 3.7113 3.9522 3.9522 3.9651 3.9651 4.6555 4.6555 4.6733 4.6733 5.2929 5.2929 5.3488 5.3488 8.2945 8.2945 8.3733 8.3733 8.8826 8.8826 8.8832 8.8832 9.6843 9.6843 k = 0.0993 0.1720 0.2241 ( 6076 PWs) bands (ev): -24.7174 -24.7174 -24.7174 -24.7174 -8.4225 -8.4225 -8.4218 -8.4218 -8.1766 -8.1766 -8.1758 -8.1758 -8.1364 -8.1364 -8.1363 -8.1363 -5.3687 -5.3687 -5.3686 -5.3686 1.9679 1.9679 2.0073 2.0073 2.3908 2.3908 2.4253 2.4253 2.9157 2.9157 2.9179 2.9179 3.5162 3.5162 3.5375 3.5375 3.7065 3.7065 3.7095 3.7095 3.9289 3.9289 3.9404 3.9404 4.7388 4.7388 4.7585 4.7585 5.3633 5.3633 5.4190 5.4190 8.2211 8.2211 8.2919 8.2919 8.9156 8.9156 8.9162 8.9162 9.6925 9.6925 k = 0.0922 0.1597 0.2241 ( 6076 PWs) bands (ev): -24.7176 -24.7176 -24.7176 -24.7176 -8.4218 -8.4218 -8.4212 -8.4212 -8.1761 -8.1761 -8.1755 -8.1755 -8.1346 -8.1346 -8.1345 -8.1345 -5.3842 -5.3842 -5.3842 -5.3842 2.0062 2.0062 2.0409 2.0409 2.3854 2.3854 2.4159 2.4159 2.9152 2.9152 2.9169 2.9169 3.5158 3.5158 3.5337 3.5337 3.7050 3.7050 3.7076 3.7076 3.9075 3.9075 3.9174 3.9174 4.8260 4.8260 4.8472 4.8472 5.4315 5.4315 5.4864 5.4864 8.1428 8.1428 8.2055 8.2055 8.9426 8.9426 8.9441 8.9441 9.7072 9.7072 k = 0.0851 0.1474 0.2241 ( 6084 PWs) bands (ev): -24.7178 -24.7178 -24.7178 -24.7178 -8.4212 -8.4212 -8.4207 -8.4207 -8.1756 -8.1756 -8.1752 -8.1752 -8.1327 -8.1327 -8.1326 -8.1326 -5.3989 -5.3989 -5.3988 -5.3988 2.0420 2.0420 2.0722 2.0722 2.3806 2.3806 2.4073 2.4073 2.9145 2.9145 2.9159 2.9159 3.5150 3.5150 3.5299 3.5299 3.7031 3.7031 3.7054 3.7054 3.8880 3.8880 3.8963 3.8963 4.9167 4.9167 4.9391 4.9391 5.4972 5.4972 5.5505 5.5505 8.0599 8.0599 8.1147 8.1147 8.9641 8.9641 8.9661 8.9661 9.7277 9.7277 k = 0.0780 0.1351 0.2241 ( 6080 PWs) bands (ev): -24.7179 -24.7179 -24.7179 -24.7179 -8.4207 -8.4207 -8.4203 -8.4203 -8.1753 -8.1753 -8.1749 -8.1749 -8.1309 -8.1309 -8.1309 -8.1309 -5.4126 -5.4126 -5.4126 -5.4126 2.0751 2.0751 2.1008 2.1008 2.3768 2.3768 2.3997 2.3997 2.9137 2.9137 2.9147 2.9147 3.5141 3.5141 3.5260 3.5260 3.7011 3.7011 3.7030 3.7030 3.8705 3.8705 3.8772 3.8772 5.0106 5.0106 5.0337 5.0337 5.5601 5.5601 5.6112 5.6112 7.9727 7.9727 8.0197 8.0197 8.9804 8.9804 8.9827 8.9827 9.7552 9.7552 k = 0.0709 0.1228 0.2241 ( 6076 PWs) bands (ev): -24.7181 -24.7181 -24.7181 -24.7181 -8.4202 -8.4202 -8.4199 -8.4199 -8.1750 -8.1750 -8.1747 -8.1747 -8.1292 -8.1292 -8.1291 -8.1291 -5.4253 -5.4253 -5.4253 -5.4253 2.1052 2.1052 2.1265 2.1265 2.3741 2.3741 2.3932 2.3932 2.9127 2.9127 2.9134 2.9134 3.5128 3.5128 3.5221 3.5221 3.6988 3.6988 3.7004 3.7004 3.8550 3.8550 3.8603 3.8603 5.1071 5.1071 5.1306 5.1306 5.6199 5.6199 5.6680 5.6680 7.8813 7.8813 7.9209 7.9209 8.9924 8.9924 8.9945 8.9945 9.7877 9.7877 k = 0.0638 0.1106 0.2241 ( 6076 PWs) bands (ev): -24.7183 -24.7183 -24.7183 -24.7183 -8.4198 -8.4198 -8.4196 -8.4196 -8.1747 -8.1747 -8.1745 -8.1745 -8.1275 -8.1275 -8.1274 -8.1274 -5.4370 -5.4370 -5.4370 -5.4370 2.1320 2.1320 2.1492 2.1492 2.3726 2.3726 2.3881 2.3881 2.9115 2.9115 2.9120 2.9120 3.5113 3.5113 3.5184 3.5184 3.6964 3.6964 3.6977 3.6977 3.8414 3.8414 3.8454 3.8454 5.2054 5.2054 5.2288 5.2288 5.6763 5.6763 5.7210 5.7210 7.7863 7.7863 7.8188 7.8188 9.0007 9.0007 9.0027 9.0027 9.8234 9.8234 k = 0.0567 0.0983 0.2241 ( 6074 PWs) bands (ev): -24.7184 -24.7184 -24.7184 -24.7184 -8.4195 -8.4195 -8.4193 -8.4193 -8.1745 -8.1745 -8.1744 -8.1744 -8.1259 -8.1259 -8.1259 -8.1259 -5.4476 -5.4476 -5.4476 -5.4476 2.1554 2.1554 2.1686 2.1686 2.3724 2.3724 2.3843 2.3843 2.9103 2.9103 2.9106 2.9106 3.5097 3.5097 3.5148 3.5148 3.6939 3.6939 3.6950 3.6950 3.8298 3.8298 3.8327 3.8327 5.3046 5.3046 5.3273 5.3273 5.7295 5.7295 5.7699 5.7699 7.6885 7.6885 7.7144 7.7144 9.0064 9.0064 9.0080 9.0080 9.8602 9.8602 k = 0.0496 0.0860 0.2241 ( 6062 PWs) bands (ev): -24.7185 -24.7185 -24.7185 -24.7185 -8.4192 -8.4192 -8.4191 -8.4191 -8.1743 -8.1743 -8.1742 -8.1742 -8.1245 -8.1245 -8.1244 -8.1244 -5.4570 -5.4570 -5.4570 -5.4570 2.1752 2.1752 2.1847 2.1847 2.3734 2.3734 2.3820 2.3820 2.9089 2.9089 2.9091 2.9091 3.5079 3.5079 3.5115 3.5115 3.6914 3.6914 3.6922 3.6922 3.8200 3.8200 3.8219 3.8219 5.4032 5.4032 5.4245 5.4245 5.7796 5.7796 5.8150 5.8150 7.5891 7.5891 7.6089 7.6089 9.0101 9.0101 9.0112 9.0112 9.8964 9.8964 k = 0.0426 0.0737 0.2241 ( 6054 PWs) bands (ev): -24.7186 -24.7186 -24.7186 -24.7186 -8.4190 -8.4190 -8.4189 -8.4189 -8.1741 -8.1741 -8.1741 -8.1741 -8.1232 -8.1232 -8.1231 -8.1231 -5.4653 -5.4653 -5.4652 -5.4652 2.1913 2.1913 2.1977 2.1977 2.3754 2.3754 2.3812 2.3812 2.9076 2.9076 2.9077 2.9077 3.5061 3.5061 3.5084 3.5084 3.6890 3.6890 3.6895 3.6895 3.8119 3.8119 3.8131 3.8131 5.4990 5.4990 5.5179 5.5179 5.8271 5.8271 5.8568 5.8568 7.4895 7.4895 7.5039 7.5039 9.0123 9.0123 9.0131 9.0131 9.9304 9.9304 k = 0.0355 0.0614 0.2241 ( 6050 PWs) bands (ev): -24.7187 -24.7187 -24.7187 -24.7187 -8.4188 -8.4188 -8.4188 -8.4188 -8.1740 -8.1740 -8.1740 -8.1740 -8.1220 -8.1220 -8.1220 -8.1220 -5.4723 -5.4723 -5.4723 -5.4723 2.2039 2.2039 2.2078 2.2078 2.3781 2.3781 2.3817 2.3817 2.9064 2.9064 2.9064 2.9064 3.5044 3.5044 3.5058 3.5058 3.6867 3.6867 3.6870 3.6870 3.8053 3.8053 3.8060 3.8060 5.5890 5.5890 5.6044 5.6044 5.8732 5.8732 5.8961 5.8961 7.3921 7.3921 7.4017 7.4017 9.0135 9.0135 9.0140 9.0140 9.9610 9.9610 k = 0.0284 0.0491 0.2241 ( 6030 PWs) bands (ev): -24.7188 -24.7188 -24.7188 -24.7188 -8.4187 -8.4187 -8.4187 -8.4187 -8.1739 -8.1739 -8.1739 -8.1739 -8.1211 -8.1211 -8.1211 -8.1211 -5.4781 -5.4781 -5.4781 -5.4781 2.2133 2.2133 2.2154 2.2154 2.3812 2.3812 2.3830 2.3830 2.9053 2.9053 2.9053 2.9053 3.5029 3.5029 3.5036 3.5036 3.6847 3.6847 3.6849 3.6849 3.8002 3.8002 3.8005 3.8005 5.6687 5.6687 5.6794 5.6794 5.9189 5.9189 5.9344 5.9344 7.2999 7.2999 7.3057 7.3057 9.0141 9.0141 9.0144 9.0144 9.9872 9.9872 k = 0.0213 0.0369 0.2241 ( 6030 PWs) bands (ev): -24.7188 -24.7188 -24.7188 -24.7188 -8.4186 -8.4186 -8.4186 -8.4186 -8.1738 -8.1738 -8.1738 -8.1738 -8.1203 -8.1203 -8.1203 -8.1203 -5.4826 -5.4826 -5.4826 -5.4826 2.2199 2.2199 2.2208 2.2208 2.3840 2.3840 2.3848 2.3848 2.9043 2.9043 2.9043 2.9043 3.5015 3.5015 3.5018 3.5018 3.6831 3.6831 3.6832 3.6832 3.7963 3.7963 3.7964 3.7964 5.7330 5.7330 5.7388 5.7388 5.9643 5.9643 5.9724 5.9724 7.2172 7.2172 7.2201 7.2201 9.0143 9.0143 9.0144 9.0144 10.0082 10.0082 k = 0.0142 0.0246 0.2241 ( 6036 PWs) bands (ev): -24.7189 -24.7189 -24.7189 -24.7189 -8.4185 -8.4185 -8.4185 -8.4185 -8.1738 -8.1738 -8.1738 -8.1738 -8.1198 -8.1198 -8.1198 -8.1198 -5.4859 -5.4859 -5.4859 -5.4859 2.2242 2.2242 2.2244 2.2244 2.3863 2.3863 2.3866 2.3866 2.9036 2.9036 2.9036 2.9036 3.5004 3.5004 3.5005 3.5005 3.6818 3.6818 3.6818 3.6818 3.7935 3.7935 3.7936 3.7936 5.7782 5.7782 5.7801 5.7801 6.0056 6.0056 6.0084 6.0084 7.1500 7.1500 7.1509 7.1509 9.0143 9.0143 9.0143 9.0143 10.0228 10.0228 k = 0.0071 0.0123 0.2241 ( 6044 PWs) bands (ev): -24.7189 -24.7189 -24.7189 -24.7189 -8.4185 -8.4185 -8.4185 -8.4185 -8.1738 -8.1738 -8.1738 -8.1738 -8.1195 -8.1195 -8.1195 -8.1195 -5.4878 -5.4878 -5.4878 -5.4878 2.2265 2.2265 2.2265 2.2265 2.3878 2.3878 2.3878 2.3878 2.9031 2.9031 2.9031 2.9031 3.4997 3.4997 3.4997 3.4997 3.6810 3.6810 3.6810 3.6810 3.7919 3.7919 3.7919 3.7919 5.8038 5.8038 5.8041 5.8041 6.0356 6.0356 6.0359 6.0359 7.1051 7.1051 7.1052 7.1052 9.0142 9.0142 9.0142 9.0142 10.0293 10.0295 k = 0.0000 0.0000 0.2241 ( 6052 PWs) bands (ev): -24.7189 -24.7189 -24.7189 -24.7189 -8.4185 -8.4185 -8.4185 -8.4185 -8.1738 -8.1738 -8.1738 -8.1738 -8.1194 -8.1194 -8.1194 -8.1194 -5.4885 -5.4885 -5.4885 -5.4885 2.2272 2.2272 2.2272 2.2272 2.3883 2.3883 2.3883 2.3883 2.9030 2.9030 2.9030 2.9030 3.4995 3.4995 3.4995 3.4995 3.6807 3.6807 3.6807 3.6807 3.7914 3.7914 3.7914 3.7914 5.8119 5.8119 5.8119 5.8119 6.0465 6.0465 6.0465 6.0465 7.0891 7.0891 7.0891 7.0891 9.0142 9.0142 9.0142 9.0142 10.0296 10.0296 k = 0.5000 0.2887 0.2241 ( 6096 PWs) bands (ev): -24.7130 -24.7130 -24.7130 -24.7130 -8.4486 -8.4486 -8.4486 -8.4486 -8.2034 -8.2034 -8.2034 -8.2034 -8.1432 -8.1432 -8.1432 -8.1432 -4.9834 -4.9834 -4.9834 -4.9834 0.9869 0.9869 0.9869 0.9869 2.7325 2.7325 2.7325 2.7325 2.9085 2.9085 2.9085 2.9085 3.5282 3.5282 3.5282 3.5282 3.5796 3.5796 3.5796 3.5796 3.7634 3.7634 3.7634 3.7634 4.3362 4.3362 4.3362 4.3362 4.7112 4.7112 4.7112 4.7112 7.6217 7.6217 7.6217 7.6217 8.0065 8.0065 8.0065 8.0065 11.3783 11.3783 k = 0.5000 0.2887 0.2101 ( 6110 PWs) bands (ev): -24.7130 -24.7130 -24.7130 -24.7130 -8.4493 -8.4493 -8.4480 -8.4480 -8.2041 -8.2041 -8.2028 -8.2028 -8.1442 -8.1442 -8.1422 -8.1422 -4.9880 -4.9880 -4.9787 -4.9787 0.9749 0.9749 0.9990 0.9990 2.7303 2.7303 2.7345 2.7345 2.9049 2.9049 2.9119 2.9119 3.5278 3.5278 3.5286 3.5286 3.5777 3.5777 3.5814 3.5814 3.7633 3.7633 3.7635 3.7635 4.3323 4.3323 4.3400 4.3400 4.7049 4.7049 4.7170 4.7170 7.5829 7.5829 7.6596 7.6596 7.9943 7.9943 8.0254 8.0254 11.2960 11.2960 k = 0.5000 0.2887 0.1961 ( 6112 PWs) bands (ev): -24.7130 -24.7130 -24.7129 -24.7129 -8.4499 -8.4499 -8.4474 -8.4474 -8.2047 -8.2047 -8.2022 -8.2022 -8.1451 -8.1451 -8.1412 -8.1412 -4.9926 -4.9926 -4.9741 -4.9741 0.9631 0.9631 1.0111 1.0111 2.7282 2.7282 2.7365 2.7365 2.9014 2.9014 2.9153 2.9153 3.5274 3.5274 3.5289 3.5289 3.5758 3.5758 3.5832 3.5832 3.7632 3.7632 3.7635 3.7635 4.3284 4.3284 4.3438 4.3438 4.6982 4.6982 4.7223 4.7223 7.5457 7.5457 7.6928 7.6928 7.9926 7.9926 8.0482 8.0482 11.2077 11.2077 k = 0.5000 0.2887 0.1821 ( 6112 PWs) bands (ev): -24.7131 -24.7131 -24.7129 -24.7129 -8.4506 -8.4506 -8.4468 -8.4468 -8.2053 -8.2053 -8.2016 -8.2016 -8.1460 -8.1460 -8.1402 -8.1402 -4.9971 -4.9971 -4.9696 -4.9696 0.9518 0.9518 1.0232 1.0232 2.7261 2.7261 2.7384 2.7384 2.8980 2.8980 2.9187 2.9187 3.5270 3.5270 3.5293 3.5293 3.5739 3.5739 3.5850 3.5850 3.7631 3.7631 3.7634 3.7634 4.3246 4.3246 4.3474 4.3474 4.6913 4.6913 4.7270 4.7270 7.5114 7.5114 7.7164 7.7164 8.0064 8.0064 8.0734 8.0734 11.1193 11.1193 k = 0.5000 0.2887 0.1681 ( 6112 PWs) bands (ev): -24.7131 -24.7131 -24.7128 -24.7128 -8.4513 -8.4513 -8.4463 -8.4463 -8.2059 -8.2059 -8.2011 -8.2011 -8.1468 -8.1468 -8.1391 -8.1391 -5.0015 -5.0015 -4.9653 -4.9653 0.9408 0.9408 1.0350 1.0350 2.7240 2.7240 2.7402 2.7402 2.8946 2.8946 2.9219 2.9219 3.5266 3.5266 3.5296 3.5296 3.5721 3.5721 3.5867 3.5867 3.7629 3.7629 3.7634 3.7634 4.3210 4.3210 4.3510 4.3510 4.6842 4.6842 4.7309 4.7309 7.4808 7.4808 7.7277 7.7277 8.0380 8.0380 8.1000 8.1000 11.0337 11.0337 k = 0.5000 0.2887 0.1541 ( 6104 PWs) bands (ev): -24.7131 -24.7131 -24.7128 -24.7128 -8.4519 -8.4519 -8.4458 -8.4458 -8.2065 -8.2065 -8.2005 -8.2005 -8.1475 -8.1475 -8.1381 -8.1381 -5.0057 -5.0057 -4.9611 -4.9611 0.9304 0.9304 1.0464 1.0464 2.7220 2.7220 2.7419 2.7419 2.8912 2.8912 2.9250 2.9250 3.5262 3.5262 3.5299 3.5299 3.5703 3.5703 3.5884 3.5884 3.7628 3.7628 3.7633 3.7633 4.3175 4.3175 4.3544 4.3544 4.6771 4.6771 4.7342 4.7342 7.4541 7.4541 7.7279 7.7279 8.0848 8.0848 8.1284 8.1284 10.9525 10.9525 k = 0.5000 0.2887 0.1401 ( 6110 PWs) bands (ev): -24.7132 -24.7132 -24.7128 -24.7128 -8.4526 -8.4526 -8.4453 -8.4453 -8.2071 -8.2071 -8.2001 -8.2001 -8.1482 -8.1482 -8.1372 -8.1372 -5.0098 -5.0098 -4.9571 -4.9571 0.9206 0.9206 1.0575 1.0575 2.7199 2.7199 2.7436 2.7436 2.8880 2.8880 2.9279 2.9279 3.5258 3.5258 3.5302 3.5302 3.5685 3.5685 3.5899 3.5899 3.7626 3.7626 3.7632 3.7632 4.3141 4.3141 4.3576 4.3576 4.6701 4.6701 4.7368 4.7368 7.4313 7.4313 7.7210 7.7210 8.1347 8.1347 8.1657 8.1657 10.8767 10.8767 k = 0.5000 0.2887 0.1261 ( 6110 PWs) bands (ev): -24.7132 -24.7132 -24.7127 -24.7127 -8.4532 -8.4532 -8.4449 -8.4449 -8.2076 -8.2076 -8.1996 -8.1996 -8.1488 -8.1488 -8.1362 -8.1362 -5.0135 -5.0135 -4.9534 -4.9534 0.9115 0.9115 1.0679 1.0679 2.7180 2.7180 2.7451 2.7451 2.8850 2.8850 2.9306 2.9306 3.5254 3.5254 3.5304 3.5304 3.5669 3.5669 3.5913 3.5913 3.7624 3.7624 3.7631 3.7631 4.3110 4.3110 4.3605 4.3605 4.6633 4.6633 4.7388 4.7388 7.4123 7.4123 7.7103 7.7103 8.1677 8.1677 8.2276 8.2276 10.8068 10.8068 k = 0.5000 0.2887 0.1121 ( 6108 PWs) bands (ev): -24.7132 -24.7132 -24.7127 -24.7127 -8.4537 -8.4537 -8.4445 -8.4445 -8.2081 -8.2081 -8.1992 -8.1992 -8.1493 -8.1493 -8.1354 -8.1354 -5.0170 -5.0170 -4.9499 -4.9499 0.9031 0.9031 1.0776 1.0776 2.7162 2.7162 2.7465 2.7465 2.8822 2.8822 2.9331 2.9331 3.5251 3.5251 3.5306 3.5306 3.5654 3.5654 3.5927 3.5927 3.7622 3.7622 3.7629 3.7629 4.3081 4.3081 4.3632 4.3632 4.6570 4.6570 4.7403 4.7403 7.3970 7.3970 7.6981 7.6981 8.1924 8.1924 8.3020 8.3020 10.7404 10.7404 k = 0.5000 0.2887 0.0981 ( 6098 PWs) bands (ev): -24.7133 -24.7133 -24.7127 -24.7127 -8.4542 -8.4542 -8.4441 -8.4441 -8.2086 -8.2086 -8.1988 -8.1988 -8.1498 -8.1498 -8.1345 -8.1345 -5.0201 -5.0201 -4.9468 -4.9468 0.8956 0.8956 1.0865 1.0865 2.7144 2.7144 2.7477 2.7477 2.8796 2.8796 2.9353 2.9353 3.5248 3.5248 3.5309 3.5309 3.5640 3.5640 3.5939 3.5939 3.7620 3.7620 3.7628 3.7628 4.3054 4.3054 4.3656 4.3656 4.6511 4.6511 4.7413 4.7413 7.3848 7.3848 7.6858 7.6858 8.2138 8.2138 8.3811 8.3811 10.6352 10.6352 k = 0.5000 0.2887 0.0840 ( 6112 PWs) bands (ev): -24.7133 -24.7133 -24.7127 -24.7127 -8.4547 -8.4547 -8.4438 -8.4438 -8.2090 -8.2090 -8.1985 -8.1985 -8.1502 -8.1502 -8.1338 -8.1338 -5.0229 -5.0229 -4.9441 -4.9441 0.8890 0.8890 1.0944 1.0944 2.7129 2.7129 2.7489 2.7489 2.8773 2.8773 2.9373 2.9373 3.5244 3.5244 3.5310 3.5310 3.5627 3.5627 3.5950 3.5950 3.7619 3.7619 3.7626 3.7626 4.3031 4.3031 4.3677 4.3677 4.6458 4.6458 4.7419 4.7419 7.3755 7.3755 7.6741 7.6741 8.2326 8.2326 8.4618 8.4618 10.5121 10.5121 k = 0.5000 0.2887 0.0700 ( 6110 PWs) bands (ev): -24.7133 -24.7133 -24.7127 -24.7127 -8.4551 -8.4551 -8.4436 -8.4436 -8.2093 -8.2093 -8.1983 -8.1983 -8.1506 -8.1506 -8.1332 -8.1332 -5.0253 -5.0253 -4.9417 -4.9417 0.8833 0.8833 1.1013 1.1013 2.7115 2.7115 2.7498 2.7498 2.8753 2.8753 2.9391 2.9391 3.5242 3.5242 3.5311 3.5311 3.5616 3.5616 3.5959 3.5959 3.7617 3.7617 3.7624 3.7624 4.3011 4.3011 4.3695 4.3695 4.6412 4.6412 4.7422 4.7422 7.3685 7.3685 7.6637 7.6637 8.2486 8.2486 8.5414 8.5414 10.3957 10.3957 k = 0.5000 0.2887 0.0560 ( 6110 PWs) bands (ev): -24.7133 -24.7133 -24.7126 -24.7126 -8.4555 -8.4555 -8.4434 -8.4434 -8.2096 -8.2096 -8.1981 -8.1981 -8.1508 -8.1508 -8.1327 -8.1327 -5.0273 -5.0273 -4.9397 -4.9397 0.8786 0.8786 1.1071 1.1071 2.7104 2.7104 2.7506 2.7506 2.8736 2.8736 2.9405 2.9405 3.5240 3.5240 3.5313 3.5313 3.5606 3.5606 3.5966 3.5966 3.7616 3.7616 3.7623 3.7623 4.2994 4.2994 4.3709 4.3709 4.6373 4.6373 4.7423 4.7423 7.3636 7.3636 7.6549 7.6549 8.2618 8.2618 8.6167 8.6167 10.2900 10.2900 k = 0.5000 0.2887 0.0420 ( 6106 PWs) bands (ev): -24.7133 -24.7133 -24.7126 -24.7126 -8.4557 -8.4557 -8.4432 -8.4432 -8.2099 -8.2099 -8.1979 -8.1979 -8.1510 -8.1510 -8.1322 -8.1322 -5.0289 -5.0289 -4.9382 -4.9382 0.8749 0.8749 1.1117 1.1117 2.7094 2.7094 2.7513 2.7513 2.8722 2.8722 2.9416 2.9416 3.5238 3.5238 3.5314 3.5314 3.5599 3.5599 3.5972 3.5972 3.7615 3.7615 3.7622 3.7622 4.2981 4.2981 4.3721 4.3721 4.6342 4.6342 4.7423 4.7423 7.3602 7.3602 7.6478 7.6478 8.2720 8.2720 8.6839 8.6839 10.1992 10.1992 k = 0.5000 0.2887 0.0280 ( 6108 PWs) bands (ev): -24.7133 -24.7133 -24.7126 -24.7126 -8.4559 -8.4559 -8.4431 -8.4431 -8.2100 -8.2100 -8.1978 -8.1978 -8.1512 -8.1512 -8.1319 -8.1319 -5.0300 -5.0300 -4.9370 -4.9370 0.8723 0.8723 1.1150 1.1150 2.7088 2.7088 2.7517 2.7517 2.8713 2.8713 2.9424 2.9424 3.5237 3.5237 3.5314 3.5314 3.5594 3.5594 3.5977 3.5977 3.7614 3.7614 3.7620 3.7620 4.2971 4.2971 4.3729 4.3729 4.6320 4.6320 4.7422 4.7422 7.3581 7.3581 7.6427 7.6427 8.2794 8.2794 8.7381 8.7381 10.1281 10.1281 k = 0.5000 0.2887 0.0140 ( 6110 PWs) bands (ev): -24.7134 -24.7134 -24.7126 -24.7126 -8.4560 -8.4560 -8.4431 -8.4431 -8.2101 -8.2101 -8.1977 -8.1977 -8.1512 -8.1512 -8.1317 -8.1317 -5.0307 -5.0307 -4.9364 -4.9364 0.8707 0.8707 1.1170 1.1170 2.7083 2.7083 2.7520 2.7520 2.8706 2.8706 2.9430 2.9430 3.5236 3.5236 3.5315 3.5315 3.5590 3.5590 3.5980 3.5980 3.7613 3.7613 3.7620 3.7620 4.2965 4.2965 4.3734 4.3734 4.6306 4.6306 4.7421 4.7421 7.3569 7.3569 7.6395 7.6395 8.2838 8.2838 8.7737 8.7737 10.0824 10.0824 k = 0.5000 0.2887-0.0000 ( 6110 PWs) bands (ev): -24.7134 -24.7134 -24.7126 -24.7126 -8.4561 -8.4561 -8.4430 -8.4430 -8.2102 -8.2102 -8.1977 -8.1977 -8.1513 -8.1513 -8.1317 -8.1317 -5.0309 -5.0309 -4.9361 -4.9361 0.8701 0.8701 1.1177 1.1177 2.7082 2.7082 2.7521 2.7521 2.8704 2.8704 2.9431 2.9431 3.5236 3.5236 3.5315 3.5315 3.5589 3.5589 3.5980 3.5980 3.7613 3.7613 3.7620 3.7620 4.2963 4.2963 4.3736 4.3736 4.6302 4.6302 4.7421 4.7421 7.3565 7.3565 7.6385 7.6385 8.2853 8.2853 8.7862 8.7862 10.0665 10.0665 k = 0.3333 0.5774-0.0000 ( 6123 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4509 -8.4509 -8.4427 -8.4427 -8.2171 -8.2171 -8.1930 -8.1930 -8.1660 -8.1660 -8.1432 -8.1432 -4.9141 -4.9141 -4.9132 -4.9132 1.0655 1.0655 1.3566 1.3566 2.0830 2.0830 2.6033 2.6033 2.8626 2.8626 2.9435 2.9435 3.3526 3.3526 3.4442 3.4442 3.5326 3.5326 3.5390 3.5390 3.7050 3.7050 3.7387 3.7387 3.7691 3.7691 3.8729 3.8729 4.7887 4.7887 4.8515 4.8515 7.9131 7.9131 7.9146 7.9146 9.5905 9.5905 9.7521 9.7521 10.0671 10.0671 k = 0.3333 0.5774 0.0140 ( 6126 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4509 -8.4509 -8.4427 -8.4427 -8.2170 -8.2170 -8.1931 -8.1931 -8.1659 -8.1659 -8.1432 -8.1432 -4.9141 -4.9141 -4.9132 -4.9132 1.0655 1.0655 1.3566 1.3566 2.0835 2.0835 2.6028 2.6028 2.8626 2.8626 2.9434 2.9434 3.3525 3.3525 3.4444 3.4444 3.5322 3.5322 3.5392 3.5392 3.7050 3.7050 3.7388 3.7388 3.7690 3.7690 3.8729 3.8729 4.7890 4.7890 4.8518 4.8518 7.9105 7.9105 7.9119 7.9119 9.5954 9.5954 9.7575 9.7575 10.0705 10.0705 k = 0.3333 0.5774 0.0280 ( 6114 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4509 -8.4509 -8.4427 -8.4427 -8.2169 -8.2169 -8.1932 -8.1932 -8.1658 -8.1658 -8.1434 -8.1434 -4.9141 -4.9141 -4.9132 -4.9132 1.0655 1.0655 1.3566 1.3566 2.0847 2.0847 2.6014 2.6014 2.8625 2.8625 2.9433 2.9433 3.3521 3.3521 3.4449 3.4449 3.5313 3.5313 3.5399 3.5399 3.7050 3.7050 3.7391 3.7391 3.7689 3.7689 3.8729 3.8729 4.7899 4.7899 4.8527 4.8527 7.9028 7.9028 7.9040 7.9040 9.6099 9.6099 9.7736 9.7736 10.0805 10.0805 k = 0.3333 0.5774 0.0420 ( 6111 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4509 -8.4509 -8.4427 -8.4427 -8.2167 -8.2167 -8.1934 -8.1934 -8.1655 -8.1655 -8.1437 -8.1437 -4.9141 -4.9141 -4.9132 -4.9132 1.0655 1.0655 1.3566 1.3566 2.0868 2.0868 2.5990 2.5990 2.8624 2.8624 2.9430 2.9430 3.3515 3.3515 3.4458 3.4458 3.5301 3.5301 3.5407 3.5407 3.7049 3.7049 3.7394 3.7394 3.7687 3.7687 3.8729 3.8729 4.7913 4.7913 4.8542 4.8542 7.8904 7.8904 7.8914 7.8914 9.6334 9.6334 9.7999 9.7999 10.0971 10.0971 k = 0.3333 0.5774 0.0560 ( 6114 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4508 -8.4508 -8.4426 -8.4426 -8.2164 -8.2164 -8.1937 -8.1937 -8.1652 -8.1652 -8.1441 -8.1441 -4.9141 -4.9141 -4.9132 -4.9132 1.0655 1.0655 1.3565 1.3565 2.0896 2.0896 2.5958 2.5958 2.8621 2.8621 2.9426 2.9426 3.3507 3.3507 3.4469 3.4469 3.5286 3.5286 3.5416 3.5416 3.7049 3.7049 3.7399 3.7399 3.7684 3.7684 3.8729 3.8729 4.7933 4.7933 4.8562 4.8562 7.8741 7.8741 7.8748 7.8748 9.6650 9.6650 9.8354 9.8354 10.1202 10.1202 k = 0.3333 0.5774 0.0700 ( 6126 PWs) bands (ev): -24.7126 -24.7126 -24.7119 -24.7119 -8.4508 -8.4508 -8.4426 -8.4426 -8.2161 -8.2161 -8.1940 -8.1940 -8.1648 -8.1648 -8.1446 -8.1446 -4.9141 -4.9141 -4.9132 -4.9132 1.0655 1.0655 1.3565 1.3565 2.0930 2.0930 2.5918 2.5918 2.8619 2.8619 2.9421 2.9421 3.3498 3.3498 3.4482 3.4482 3.5270 3.5270 3.5424 3.5424 3.7049 3.7049 3.7405 3.7405 3.7681 3.7681 3.8728 3.8728 4.7956 4.7956 4.8586 4.8586 7.8547 7.8547 7.8550 7.8550 9.7036 9.7036 9.8791 9.8791 10.1499 10.1499 k = 0.3333 0.5774 0.0840 ( 6123 PWs) bands (ev): -24.7125 -24.7125 -24.7120 -24.7120 -8.4508 -8.4508 -8.4425 -8.4425 -8.2156 -8.2156 -8.1945 -8.1945 -8.1643 -8.1643 -8.1452 -8.1452 -4.9141 -4.9141 -4.9132 -4.9132 1.0654 1.0654 1.3565 1.3565 2.0971 2.0971 2.5872 2.5872 2.8615 2.8615 2.9416 2.9416 3.3487 3.3487 3.4498 3.4498 3.5254 3.5254 3.5432 3.5432 3.7049 3.7049 3.7413 3.7413 3.7677 3.7677 3.8728 3.8728 4.7983 4.7983 4.8614 4.8614 7.8332 7.8332 7.8333 7.8333 9.7479 9.7479 9.9298 9.9298 10.1859 10.1859 k = 0.3333 0.5774 0.0981 ( 6126 PWs) bands (ev): -24.7125 -24.7125 -24.7120 -24.7120 -8.4508 -8.4508 -8.4425 -8.4425 -8.2152 -8.2152 -8.1949 -8.1949 -8.1637 -8.1637 -8.1459 -8.1459 -4.9141 -4.9141 -4.9132 -4.9132 1.0654 1.0654 1.3565 1.3565 2.1015 2.1015 2.5821 2.5821 2.8612 2.8612 2.9410 2.9410 3.3477 3.3477 3.4515 3.4515 3.5237 3.5237 3.5439 3.5439 3.7048 3.7048 3.7421 3.7421 3.7672 3.7672 3.8728 3.8728 4.8013 4.8013 4.8645 4.8645 7.8101 7.8101 7.8108 7.8108 9.7964 9.7964 9.9860 9.9860 10.2283 10.2283 k = 0.3333 0.5774 0.1121 ( 6099 PWs) bands (ev): -24.7125 -24.7125 -24.7120 -24.7120 -8.4507 -8.4507 -8.4424 -8.4424 -8.2147 -8.2147 -8.1954 -8.1954 -8.1629 -8.1629 -8.1467 -8.1467 -4.9140 -4.9140 -4.9131 -4.9131 1.0654 1.0654 1.3564 1.3564 2.1062 2.1062 2.5766 2.5766 2.8610 2.8610 2.9405 2.9405 3.3466 3.3466 3.4533 3.4533 3.5221 3.5221 3.5445 3.5445 3.7049 3.7049 3.7430 3.7430 3.7668 3.7668 3.8728 3.8728 4.8044 4.8044 4.8677 4.8677 7.7868 7.7868 7.7881 7.7881 9.8477 9.8477 10.0463 10.0463 10.2768 10.2768 k = 0.3333 0.5774 0.1261 ( 6105 PWs) bands (ev): -24.7125 -24.7125 -24.7120 -24.7120 -8.4507 -8.4507 -8.4423 -8.4423 -8.2142 -8.2142 -8.1959 -8.1959 -8.1622 -8.1622 -8.1475 -8.1475 -4.9140 -4.9140 -4.9131 -4.9131 1.0654 1.0654 1.3564 1.3564 2.1111 2.1111 2.5711 2.5711 2.8606 2.8606 2.9399 2.9399 3.3455 3.3455 3.4550 3.4550 3.5205 3.5205 3.5451 3.5451 3.7049 3.7049 3.7439 3.7439 3.7663 3.7663 3.8728 3.8728 4.8075 4.8075 4.8709 4.8709 7.7642 7.7642 7.7661 7.7661 9.9001 9.9001 10.1091 10.1091 10.3313 10.3313 k = 0.3333 0.5774 0.1401 ( 6111 PWs) bands (ev): -24.7124 -24.7124 -24.7120 -24.7120 -8.4507 -8.4507 -8.4423 -8.4423 -8.2136 -8.2136 -8.1965 -8.1965 -8.1614 -8.1614 -8.1485 -8.1485 -4.9140 -4.9140 -4.9131 -4.9131 1.0654 1.0654 1.3564 1.3564 2.1158 2.1158 2.5657 2.5657 2.8603 2.8603 2.9393 2.9393 3.3445 3.3445 3.4567 3.4567 3.5189 3.5189 3.5455 3.5455 3.7048 3.7048 3.7448 3.7448 3.7657 3.7657 3.8728 3.8728 4.8105 4.8105 4.8740 4.8740 7.7431 7.7431 7.7455 7.7455 9.9518 9.9518 10.1726 10.1726 10.3916 10.3916 k = 0.3333 0.5774 0.1541 ( 6111 PWs) bands (ev): -24.7124 -24.7124 -24.7121 -24.7121 -8.4507 -8.4507 -8.4422 -8.4422 -8.2131 -8.2131 -8.1970 -8.1970 -8.1605 -8.1605 -8.1494 -8.1494 -4.9140 -4.9140 -4.9131 -4.9131 1.0654 1.0654 1.3563 1.3563 2.1203 2.1203 2.5605 2.5605 2.8600 2.8600 2.9388 2.9388 3.3436 3.3436 3.4583 3.4583 3.5175 3.5175 3.5459 3.5459 3.7048 3.7048 3.7457 3.7457 3.7651 3.7651 3.8728 3.8728 4.8132 4.8132 4.8768 4.8768 7.7240 7.7240 7.7270 7.7270 10.0011 10.0011 10.2348 10.2348 10.4576 10.4576 k = 0.3333 0.5774 0.1681 ( 6117 PWs) bands (ev): -24.7124 -24.7124 -24.7121 -24.7121 -8.4507 -8.4507 -8.4421 -8.4421 -8.2126 -8.2126 -8.1975 -8.1975 -8.1596 -8.1596 -8.1504 -8.1504 -4.9140 -4.9140 -4.9131 -4.9131 1.0654 1.0654 1.3563 1.3563 2.1244 2.1244 2.5560 2.5560 2.8597 2.8597 2.9384 2.9384 3.3428 3.3428 3.4597 3.4597 3.5162 3.5162 3.5462 3.5462 3.7047 3.7047 3.7465 3.7465 3.7645 3.7645 3.8727 3.8727 4.8157 4.8157 4.8793 4.8793 7.7077 7.7077 7.7111 7.7111 10.0458 10.0458 10.2932 10.2932 10.5291 10.5291 k = 0.3333 0.5774 0.1821 ( 6114 PWs) bands (ev): -24.7123 -24.7123 -24.7121 -24.7121 -8.4507 -8.4507 -8.4421 -8.4421 -8.2122 -8.2122 -8.1979 -8.1979 -8.1586 -8.1586 -8.1515 -8.1515 -4.9140 -4.9140 -4.9131 -4.9131 1.0654 1.0654 1.3563 1.3563 2.1278 2.1278 2.5521 2.5521 2.8595 2.8595 2.9380 2.9380 3.3422 3.3422 3.4609 3.4609 3.5151 3.5151 3.5465 3.5465 3.7047 3.7047 3.7472 3.7472 3.7641 3.7641 3.8727 3.8727 4.8177 4.8177 4.8814 4.8814 7.6945 7.6945 7.6983 7.6983 10.0839 10.0839 10.3448 10.3448 10.6058 10.6058 k = 0.3333 0.5774 0.1961 ( 6117 PWs) bands (ev): -24.7123 -24.7123 -24.7121 -24.7121 -8.4507 -8.4507 -8.4421 -8.4421 -8.2119 -8.2119 -8.1983 -8.1983 -8.1577 -8.1577 -8.1525 -8.1525 -4.9140 -4.9140 -4.9131 -4.9131 1.0654 1.0654 1.3563 1.3563 2.1303 2.1303 2.5492 2.5492 2.8594 2.8594 2.9377 2.9377 3.3417 3.3417 3.4618 3.4618 3.5143 3.5143 3.5467 3.5467 3.7047 3.7047 3.7478 3.7478 3.7637 3.7637 3.8727 3.8727 4.8192 4.8192 4.8830 4.8830 7.6848 7.6848 7.6889 7.6889 10.1131 10.1131 10.3861 10.3861 10.6875 10.6875 k = 0.3333 0.5774 0.2101 ( 6108 PWs) bands (ev): -24.7123 -24.7123 -24.7122 -24.7122 -8.4507 -8.4507 -8.4420 -8.4420 -8.2117 -8.2117 -8.1985 -8.1985 -8.1568 -8.1568 -8.1533 -8.1533 -4.9140 -4.9140 -4.9131 -4.9131 1.0654 1.0654 1.3563 1.3563 2.1319 2.1319 2.5474 2.5474 2.8593 2.8593 2.9376 2.9376 3.3415 3.3415 3.4624 3.4624 3.5139 3.5139 3.5468 3.5468 3.7047 3.7047 3.7481 3.7481 3.7635 3.7635 3.8727 3.8727 4.8201 4.8201 4.8839 4.8839 7.6789 7.6789 7.6831 7.6831 10.1316 10.1316 10.4130 10.4130 10.7736 10.7736 k = 0.3333 0.5774 0.2241 ( 6126 PWs) bands (ev): -24.7122 -24.7122 -24.7122 -24.7122 -8.4507 -8.4507 -8.4420 -8.4420 -8.2116 -8.2116 -8.1986 -8.1986 -8.1565 -8.1565 -8.1537 -8.1537 -4.9140 -4.9140 -4.9131 -4.9131 1.0654 1.0654 1.3563 1.3563 2.1324 2.1324 2.5468 2.5468 2.8592 2.8592 2.9375 2.9375 3.3414 3.3414 3.4625 3.4625 3.5137 3.5137 3.5468 3.5468 3.7047 3.7047 3.7482 3.7482 3.7633 3.7633 3.8727 3.8727 4.8204 4.8204 4.8842 4.8842 7.6769 7.6769 7.6812 7.6812 10.1379 10.1379 10.4224 10.4224 10.8496 10.8496 Writing output data file KCuTe.save init_run : 0.59s CPU 0.91s WALL ( 1 calls) electrons : 235.62s CPU 239.03s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.05s WALL ( 1 calls) potinit : 0.02s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 235.61s CPU 239.02s 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 0.00s WALL ( 1 calls) newd : 0.12s CPU 0.16s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.09s CPU 0.12s WALL ( 281 calls) cegterg : 215.81s CPU 218.30s WALL ( 441 calls) Called by sum_band: Called by *egterg: h_psi : 116.49s CPU 117.74s WALL ( 7505 calls) s_psi : 9.98s CPU 9.99s WALL ( 7505 calls) g_psi : 0.38s CPU 0.37s WALL ( 6783 calls) cdiaghg : 76.61s CPU 77.65s WALL ( 7064 calls) cegterg:over : 10.38s CPU 10.38s WALL ( 6783 calls) cegterg:upda : 9.55s CPU 9.99s WALL ( 6783 calls) cegterg:last : 4.29s CPU 4.21s WALL ( 1019 calls) cdiaghg:chol : 4.34s CPU 4.48s WALL ( 7064 calls) cdiaghg:inve : 3.20s CPU 3.24s WALL ( 7064 calls) cdiaghg:para : 4.89s CPU 5.38s WALL ( 14128 calls) Called by h_psi: h_psi:vloc : 94.92s CPU 96.44s WALL ( 7505 calls) h_psi:vnl : 21.17s CPU 20.93s WALL ( 7505 calls) add_vuspsi : 11.64s CPU 11.46s WALL ( 7505 calls) General routines calbec : 9.50s CPU 9.45s WALL ( 7505 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 89.04s CPU 90.50s WALL ( 849116 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.20s CPU 0.30s WALL ( 562 calls) Parallel routines fft_scatter : 28.75s CPU 29.07s WALL ( 849139 calls) PWSCF : 4m16.38s CPU 4m33.52s WALL This run was terminated on: 17:51: 6 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=