Program PWSCF v.5.3.0 (svn rev. 11974) starts on 1Feb2017 at 9:46:33 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Zr5Sb4.save/ file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 61 50 14 2255 1686 248 Max 62 51 15 2258 1705 251 Sum 4417 3643 1015 162427 122097 17913 bravais-lattice index = 14 lattice parameter (alat) = 16.2573 a.u. unit-cell volume = 2557.1807 (a.u.)^3 number of atoms/cell = 18 number of atomic types = 2 number of electrons = 80.00 number of Kohn-Sham states= 96 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 242.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 16.257313 celldm(2)= 1.000000 celldm(3)= 0.687202 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 0.687202 ) 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 1.455176 ) PseudoPot. # 1 for Zr read from file: /users/gautes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for Sb read from file: /users/gautes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 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 Zr 4.00 91.22400 Zr( 1.00) Sb 5.00 121.76000 Sb( 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 ) ( 0.3436011 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3436011 ) 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 ) ( 0.3436011 ) 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 ) ( 0.3436011 ) 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 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 9) = ( 0.5000000 -0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(10) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(11) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3436011 ) isym = 12 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(12) = ( -0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3436011 ) 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 ) ( 0.3436011 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(16) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.3436011 ) 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 ) ( 0.3436011 ) 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 ) ( 0.3436011 ) 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 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(21) = ( -0.5000000 0.8660254 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 22 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(22) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s(22) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 23 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(23) = ( 1 1 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(23) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.3436011 ) isym = 24 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(24) = ( 0 -1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(24) = ( 0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.3436011 ) 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= 210 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0227273 0.0131216 -0.0000000), wk = 0.0047619 k( 3) = ( 0.0454546 0.0262432 -0.0000000), wk = 0.0047619 k( 4) = ( 0.0681818 0.0393648 -0.0000000), wk = 0.0047619 k( 5) = ( 0.0909091 0.0524864 -0.0000000), wk = 0.0047619 k( 6) = ( 0.1136364 0.0656080 -0.0000000), wk = 0.0047619 k( 7) = ( 0.1363636 0.0787296 -0.0000000), wk = 0.0047619 k( 8) = ( 0.1590909 0.0918512 -0.0000000), wk = 0.0047619 k( 9) = ( 0.1818182 0.1049728 -0.0000000), wk = 0.0047619 k( 10) = ( 0.2045454 0.1180944 -0.0000000), wk = 0.0047619 k( 11) = ( 0.2272727 0.1312160 -0.0000000), wk = 0.0047619 k( 12) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0047619 k( 13) = ( 0.2727273 0.1574592 -0.0000000), wk = 0.0047619 k( 14) = ( 0.2954545 0.1705808 -0.0000000), wk = 0.0047619 k( 15) = ( 0.3181818 0.1837024 -0.0000000), wk = 0.0047619 k( 16) = ( 0.3409091 0.1968240 -0.0000000), wk = 0.0047619 k( 17) = ( 0.3636364 0.2099456 -0.0000000), wk = 0.0047619 k( 18) = ( 0.3863636 0.2230672 -0.0000000), wk = 0.0047619 k( 19) = ( 0.4090909 0.2361887 -0.0000000), wk = 0.0047619 k( 20) = ( 0.4318182 0.2493103 -0.0000000), wk = 0.0047619 k( 21) = ( 0.4545455 0.2624319 -0.0000000), wk = 0.0047619 k( 22) = ( 0.4772727 0.2755535 -0.0000000), wk = 0.0047619 k( 23) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0047619 k( 24) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0047619 k( 25) = ( 0.4871795 0.3108809 -0.0000000), wk = 0.0047619 k( 26) = ( 0.4743590 0.3330867 -0.0000000), wk = 0.0047619 k( 27) = ( 0.4615385 0.3552925 -0.0000000), wk = 0.0047619 k( 28) = ( 0.4487179 0.3774983 -0.0000000), wk = 0.0047619 k( 29) = ( 0.4358974 0.3997040 -0.0000000), wk = 0.0047619 k( 30) = ( 0.4230769 0.4219098 -0.0000000), wk = 0.0047619 k( 31) = ( 0.4102564 0.4441156 -0.0000000), wk = 0.0047619 k( 32) = ( 0.3974359 0.4663214 -0.0000000), wk = 0.0047619 k( 33) = ( 0.3846154 0.4885271 -0.0000000), wk = 0.0047619 k( 34) = ( 0.3717949 0.5107329 -0.0000000), wk = 0.0047619 k( 35) = ( 0.3589744 0.5329387 -0.0000000), wk = 0.0047619 k( 36) = ( 0.3461538 0.5551445 -0.0000000), wk = 0.0047619 k( 37) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0047619 k( 38) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0047619 k( 39) = ( 0.3200000 0.5542563 -0.0000000), wk = 0.0047619 k( 40) = ( 0.3066667 0.5311623 -0.0000000), wk = 0.0047619 k( 41) = ( 0.2933333 0.5080682 -0.0000000), wk = 0.0047619 k( 42) = ( 0.2800000 0.4849742 -0.0000000), wk = 0.0047619 k( 43) = ( 0.2666667 0.4618802 -0.0000000), wk = 0.0047619 k( 44) = ( 0.2533333 0.4387862 -0.0000000), wk = 0.0047619 k( 45) = ( 0.2400000 0.4156922 -0.0000000), wk = 0.0047619 k( 46) = ( 0.2266667 0.3925982 -0.0000000), wk = 0.0047619 k( 47) = ( 0.2133333 0.3695042 -0.0000000), wk = 0.0047619 k( 48) = ( 0.2000000 0.3464102 -0.0000000), wk = 0.0047619 k( 49) = ( 0.1866667 0.3233162 -0.0000000), wk = 0.0047619 k( 50) = ( 0.1733333 0.3002221 -0.0000000), wk = 0.0047619 k( 51) = ( 0.1600000 0.2771281 -0.0000000), wk = 0.0047619 k( 52) = ( 0.1466667 0.2540341 -0.0000000), wk = 0.0047619 k( 53) = ( 0.1333333 0.2309401 -0.0000000), wk = 0.0047619 k( 54) = ( 0.1200000 0.2078461 -0.0000000), wk = 0.0047619 k( 55) = ( 0.1066667 0.1847521 -0.0000000), wk = 0.0047619 k( 56) = ( 0.0933333 0.1616581 -0.0000000), wk = 0.0047619 k( 57) = ( 0.0800000 0.1385641 -0.0000000), wk = 0.0047619 k( 58) = ( 0.0666667 0.1154701 -0.0000000), wk = 0.0047619 k( 59) = ( 0.0533333 0.0923760 -0.0000000), wk = 0.0047619 k( 60) = ( 0.0400000 0.0692820 -0.0000000), wk = 0.0047619 k( 61) = ( 0.0266667 0.0461880 -0.0000000), wk = 0.0047619 k( 62) = ( 0.0133333 0.0230940 -0.0000000), wk = 0.0047619 k( 63) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 64) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 65) = ( 0.0000000 0.0000000 0.0269477), wk = 0.0047619 k( 66) = ( 0.0000000 0.0000000 0.0538954), wk = 0.0047619 k( 67) = ( 0.0000000 0.0000000 0.0808431), wk = 0.0047619 k( 68) = ( 0.0000000 0.0000000 0.1077908), wk = 0.0047619 k( 69) = ( 0.0000000 0.0000000 0.1347385), wk = 0.0047619 k( 70) = ( 0.0000000 0.0000000 0.1616862), wk = 0.0047619 k( 71) = ( 0.0000000 0.0000000 0.1886339), wk = 0.0047619 k( 72) = ( 0.0000000 0.0000000 0.2155816), wk = 0.0047619 k( 73) = ( 0.0000000 0.0000000 0.2425293), wk = 0.0047619 k( 74) = ( 0.0000000 0.0000000 0.2694770), wk = 0.0047619 k( 75) = ( 0.0000000 0.0000000 0.2964247), wk = 0.0047619 k( 76) = ( 0.0000000 0.0000000 0.3233724), wk = 0.0047619 k( 77) = ( 0.0000000 0.0000000 0.3503201), wk = 0.0047619 k( 78) = ( 0.0000000 0.0000000 0.3772678), wk = 0.0047619 k( 79) = ( 0.0000000 0.0000000 0.4042155), wk = 0.0047619 k( 80) = ( 0.0000000 0.0000000 0.4311632), wk = 0.0047619 k( 81) = ( 0.0000000 0.0000000 0.4581109), wk = 0.0047619 k( 82) = ( 0.0000000 0.0000000 0.4850586), wk = 0.0047619 k( 83) = ( 0.0000000 0.0000000 0.5120063), wk = 0.0047619 k( 84) = ( 0.0000000 0.0000000 0.5389540), wk = 0.0047619 k( 85) = ( 0.0000000 0.0000000 0.5659017), wk = 0.0047619 k( 86) = ( 0.0000000 0.0000000 0.5928494), wk = 0.0047619 k( 87) = ( 0.0000000 0.0000000 0.6197972), wk = 0.0047619 k( 88) = ( 0.0000000 0.0000000 0.6467448), wk = 0.0047619 k( 89) = ( 0.0000000 0.0000000 0.6736925), wk = 0.0047619 k( 90) = ( 0.0000000 0.0000000 0.7006403), wk = 0.0047619 k( 91) = ( 0.0000000 0.0000000 0.7275880), wk = 0.0047619 k( 92) = ( 0.0000000 0.0000000 0.7275880), wk = 0.0047619 k( 93) = ( 0.0227273 0.0131216 0.7275880), wk = 0.0047619 k( 94) = ( 0.0454546 0.0262432 0.7275880), wk = 0.0047619 k( 95) = ( 0.0681818 0.0393648 0.7275880), wk = 0.0047619 k( 96) = ( 0.0909091 0.0524864 0.7275880), wk = 0.0047619 k( 97) = ( 0.1136364 0.0656080 0.7275880), wk = 0.0047619 k( 98) = ( 0.1363636 0.0787296 0.7275880), wk = 0.0047619 k( 99) = ( 0.1590909 0.0918512 0.7275880), wk = 0.0047619 k( 100) = ( 0.1818182 0.1049728 0.7275880), wk = 0.0047619 k( 101) = ( 0.2045454 0.1180944 0.7275880), wk = 0.0047619 k( 102) = ( 0.2272727 0.1312160 0.7275880), wk = 0.0047619 k( 103) = ( 0.2500000 0.1443376 0.7275880), wk = 0.0047619 k( 104) = ( 0.2727273 0.1574592 0.7275880), wk = 0.0047619 k( 105) = ( 0.2954545 0.1705808 0.7275880), wk = 0.0047619 k( 106) = ( 0.3181818 0.1837024 0.7275880), wk = 0.0047619 k( 107) = ( 0.3409091 0.1968240 0.7275880), wk = 0.0047619 k( 108) = ( 0.3636364 0.2099456 0.7275880), wk = 0.0047619 k( 109) = ( 0.3863636 0.2230672 0.7275880), wk = 0.0047619 k( 110) = ( 0.4090909 0.2361887 0.7275880), wk = 0.0047619 k( 111) = ( 0.4318182 0.2493103 0.7275880), wk = 0.0047619 k( 112) = ( 0.4545455 0.2624319 0.7275880), wk = 0.0047619 k( 113) = ( 0.4772727 0.2755535 0.7275880), wk = 0.0047619 k( 114) = ( 0.5000000 0.2886751 0.7275880), wk = 0.0047619 k( 115) = ( 0.5000000 0.2886751 0.7275880), wk = 0.0047619 k( 116) = ( 0.4871795 0.3108809 0.7275880), wk = 0.0047619 k( 117) = ( 0.4743590 0.3330867 0.7275880), wk = 0.0047619 k( 118) = ( 0.4615385 0.3552925 0.7275880), wk = 0.0047619 k( 119) = ( 0.4487179 0.3774983 0.7275880), wk = 0.0047619 k( 120) = ( 0.4358974 0.3997040 0.7275880), wk = 0.0047619 k( 121) = ( 0.4230769 0.4219098 0.7275880), wk = 0.0047619 k( 122) = ( 0.4102564 0.4441156 0.7275880), wk = 0.0047619 k( 123) = ( 0.3974359 0.4663214 0.7275880), wk = 0.0047619 k( 124) = ( 0.3846154 0.4885271 0.7275880), wk = 0.0047619 k( 125) = ( 0.3717949 0.5107329 0.7275880), wk = 0.0047619 k( 126) = ( 0.3589744 0.5329387 0.7275880), wk = 0.0047619 k( 127) = ( 0.3461538 0.5551445 0.7275880), wk = 0.0047619 k( 128) = ( 0.3333333 0.5773503 0.7275880), wk = 0.0047619 k( 129) = ( 0.3333333 0.5773503 0.7275880), wk = 0.0047619 k( 130) = ( 0.3200000 0.5542563 0.7275880), wk = 0.0047619 k( 131) = ( 0.3066667 0.5311623 0.7275880), wk = 0.0047619 k( 132) = ( 0.2933333 0.5080682 0.7275880), wk = 0.0047619 k( 133) = ( 0.2800000 0.4849742 0.7275880), wk = 0.0047619 k( 134) = ( 0.2666667 0.4618802 0.7275880), wk = 0.0047619 k( 135) = ( 0.2533333 0.4387862 0.7275880), wk = 0.0047619 k( 136) = ( 0.2400000 0.4156922 0.7275880), wk = 0.0047619 k( 137) = ( 0.2266667 0.3925982 0.7275880), wk = 0.0047619 k( 138) = ( 0.2133333 0.3695042 0.7275880), wk = 0.0047619 k( 139) = ( 0.2000000 0.3464102 0.7275880), wk = 0.0047619 k( 140) = ( 0.1866667 0.3233162 0.7275880), wk = 0.0047619 k( 141) = ( 0.1733333 0.3002221 0.7275880), wk = 0.0047619 k( 142) = ( 0.1600000 0.2771281 0.7275880), wk = 0.0047619 k( 143) = ( 0.1466667 0.2540341 0.7275880), wk = 0.0047619 k( 144) = ( 0.1333333 0.2309401 0.7275880), wk = 0.0047619 k( 145) = ( 0.1200000 0.2078461 0.7275880), wk = 0.0047619 k( 146) = ( 0.1066667 0.1847521 0.7275880), wk = 0.0047619 k( 147) = ( 0.0933333 0.1616581 0.7275880), wk = 0.0047619 k( 148) = ( 0.0800000 0.1385641 0.7275880), wk = 0.0047619 k( 149) = ( 0.0666667 0.1154701 0.7275880), wk = 0.0047619 k( 150) = ( 0.0533333 0.0923760 0.7275880), wk = 0.0047619 k( 151) = ( 0.0400000 0.0692820 0.7275880), wk = 0.0047619 k( 152) = ( 0.0266667 0.0461880 0.7275880), wk = 0.0047619 k( 153) = ( 0.0133333 0.0230940 0.7275880), wk = 0.0047619 k( 154) = ( 0.0000000 0.0000000 0.7275880), wk = 0.0047619 k( 155) = ( 0.5000000 0.2886751 0.7275880), wk = 0.0047619 k( 156) = ( 0.5000000 0.2886751 0.7006403), wk = 0.0047619 k( 157) = ( 0.5000000 0.2886751 0.6736925), wk = 0.0047619 k( 158) = ( 0.5000000 0.2886751 0.6467448), wk = 0.0047619 k( 159) = ( 0.5000000 0.2886751 0.6197972), wk = 0.0047619 k( 160) = ( 0.5000000 0.2886751 0.5928494), wk = 0.0047619 k( 161) = ( 0.5000000 0.2886751 0.5659017), wk = 0.0047619 k( 162) = ( 0.5000000 0.2886751 0.5389540), wk = 0.0047619 k( 163) = ( 0.5000000 0.2886751 0.5120063), wk = 0.0047619 k( 164) = ( 0.5000000 0.2886751 0.4850586), wk = 0.0047619 k( 165) = ( 0.5000000 0.2886751 0.4581109), wk = 0.0047619 k( 166) = ( 0.5000000 0.2886751 0.4311632), wk = 0.0047619 k( 167) = ( 0.5000000 0.2886751 0.4042155), wk = 0.0047619 k( 168) = ( 0.5000000 0.2886751 0.3772678), wk = 0.0047619 k( 169) = ( 0.5000000 0.2886751 0.3503201), wk = 0.0047619 k( 170) = ( 0.5000000 0.2886751 0.3233724), wk = 0.0047619 k( 171) = ( 0.5000000 0.2886751 0.2964247), wk = 0.0047619 k( 172) = ( 0.5000000 0.2886751 0.2694770), wk = 0.0047619 k( 173) = ( 0.5000000 0.2886751 0.2425293), wk = 0.0047619 k( 174) = ( 0.5000000 0.2886751 0.2155816), wk = 0.0047619 k( 175) = ( 0.5000000 0.2886751 0.1886339), wk = 0.0047619 k( 176) = ( 0.5000000 0.2886751 0.1616862), wk = 0.0047619 k( 177) = ( 0.5000000 0.2886751 0.1347385), wk = 0.0047619 k( 178) = ( 0.5000000 0.2886751 0.1077908), wk = 0.0047619 k( 179) = ( 0.5000000 0.2886751 0.0808431), wk = 0.0047619 k( 180) = ( 0.5000000 0.2886751 0.0538954), wk = 0.0047619 k( 181) = ( 0.5000000 0.2886751 0.0269477), wk = 0.0047619 k( 182) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0047619 k( 183) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0047619 k( 184) = ( 0.3333333 0.5773503 0.0269477), wk = 0.0047619 k( 185) = ( 0.3333333 0.5773503 0.0538954), wk = 0.0047619 k( 186) = ( 0.3333333 0.5773503 0.0808431), wk = 0.0047619 k( 187) = ( 0.3333333 0.5773503 0.1077908), wk = 0.0047619 k( 188) = ( 0.3333333 0.5773503 0.1347385), wk = 0.0047619 k( 189) = ( 0.3333333 0.5773503 0.1616862), wk = 0.0047619 k( 190) = ( 0.3333333 0.5773503 0.1886339), wk = 0.0047619 k( 191) = ( 0.3333333 0.5773503 0.2155816), wk = 0.0047619 k( 192) = ( 0.3333333 0.5773503 0.2425293), wk = 0.0047619 k( 193) = ( 0.3333333 0.5773503 0.2694770), wk = 0.0047619 k( 194) = ( 0.3333333 0.5773503 0.2964247), wk = 0.0047619 k( 195) = ( 0.3333333 0.5773503 0.3233724), wk = 0.0047619 k( 196) = ( 0.3333333 0.5773503 0.3503201), wk = 0.0047619 k( 197) = ( 0.3333333 0.5773503 0.3772678), wk = 0.0047619 k( 198) = ( 0.3333333 0.5773503 0.4042155), wk = 0.0047619 k( 199) = ( 0.3333333 0.5773503 0.4311632), wk = 0.0047619 k( 200) = ( 0.3333333 0.5773503 0.4581109), wk = 0.0047619 k( 201) = ( 0.3333333 0.5773503 0.4850586), wk = 0.0047619 k( 202) = ( 0.3333333 0.5773503 0.5120063), wk = 0.0047619 k( 203) = ( 0.3333333 0.5773503 0.5389540), wk = 0.0047619 k( 204) = ( 0.3333333 0.5773503 0.5659017), wk = 0.0047619 k( 205) = ( 0.3333333 0.5773503 0.5928494), wk = 0.0047619 k( 206) = ( 0.3333333 0.5773503 0.6197972), wk = 0.0047619 k( 207) = ( 0.3333333 0.5773503 0.6467448), wk = 0.0047619 k( 208) = ( 0.3333333 0.5773503 0.6736925), wk = 0.0047619 k( 209) = ( 0.3333333 0.5773503 0.7006403), wk = 0.0047619 k( 210) = ( 0.3333333 0.5773503 0.7275880), wk = 0.0047619 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0227273 0.0000000 0.0000000), wk = 0.0047619 k( 3) = ( 0.0454546 0.0000000 0.0000000), wk = 0.0047619 k( 4) = ( 0.0681818 0.0000000 0.0000000), wk = 0.0047619 k( 5) = ( 0.0909091 0.0000000 0.0000000), wk = 0.0047619 k( 6) = ( 0.1136364 -0.0000000 -0.0000000), wk = 0.0047619 k( 7) = ( 0.1363636 0.0000000 0.0000000), wk = 0.0047619 k( 8) = ( 0.1590909 0.0000000 0.0000000), wk = 0.0047619 k( 9) = ( 0.1818182 0.0000000 0.0000000), wk = 0.0047619 k( 10) = ( 0.2045454 -0.0000000 0.0000000), wk = 0.0047619 k( 11) = ( 0.2272727 0.0000000 0.0000000), wk = 0.0047619 k( 12) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0047619 k( 13) = ( 0.2727273 0.0000000 0.0000000), wk = 0.0047619 k( 14) = ( 0.2954545 0.0000000 0.0000000), wk = 0.0047619 k( 15) = ( 0.3181818 0.0000000 0.0000000), wk = 0.0047619 k( 16) = ( 0.3409091 0.0000000 0.0000000), wk = 0.0047619 k( 17) = ( 0.3636364 0.0000000 0.0000000), wk = 0.0047619 k( 18) = ( 0.3863636 0.0000000 0.0000000), wk = 0.0047619 k( 19) = ( 0.4090909 0.0000000 0.0000000), wk = 0.0047619 k( 20) = ( 0.4318182 -0.0000000 -0.0000000), wk = 0.0047619 k( 21) = ( 0.4545455 0.0000000 0.0000000), wk = 0.0047619 k( 22) = ( 0.4772727 0.0000000 0.0000000), wk = 0.0047619 k( 23) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0047619 k( 24) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0047619 k( 25) = ( 0.4871795 0.0256410 0.0000000), wk = 0.0047619 k( 26) = ( 0.4743590 0.0512820 -0.0000000), wk = 0.0047619 k( 27) = ( 0.4615385 0.0769231 0.0000000), wk = 0.0047619 k( 28) = ( 0.4487179 0.1025641 0.0000000), wk = 0.0047619 k( 29) = ( 0.4358974 0.1282051 -0.0000000), wk = 0.0047619 k( 30) = ( 0.4230769 0.1538461 -0.0000000), wk = 0.0047619 k( 31) = ( 0.4102564 0.1794872 0.0000000), wk = 0.0047619 k( 32) = ( 0.3974359 0.2051282 -0.0000000), wk = 0.0047619 k( 33) = ( 0.3846154 0.2307692 -0.0000000), wk = 0.0047619 k( 34) = ( 0.3717949 0.2564103 0.0000000), wk = 0.0047619 k( 35) = ( 0.3589744 0.2820513 0.0000000), wk = 0.0047619 k( 36) = ( 0.3461538 0.3076923 -0.0000000), wk = 0.0047619 k( 37) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0047619 k( 38) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0047619 k( 39) = ( 0.3200000 0.3200000 0.0000000), wk = 0.0047619 k( 40) = ( 0.3066667 0.3066667 0.0000000), wk = 0.0047619 k( 41) = ( 0.2933333 0.2933333 0.0000000), wk = 0.0047619 k( 42) = ( 0.2800000 0.2800000 0.0000000), wk = 0.0047619 k( 43) = ( 0.2666667 0.2666667 -0.0000000), wk = 0.0047619 k( 44) = ( 0.2533333 0.2533333 -0.0000000), wk = 0.0047619 k( 45) = ( 0.2400000 0.2400000 -0.0000000), wk = 0.0047619 k( 46) = ( 0.2266667 0.2266667 0.0000000), wk = 0.0047619 k( 47) = ( 0.2133333 0.2133333 0.0000000), wk = 0.0047619 k( 48) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0047619 k( 49) = ( 0.1866667 0.1866667 -0.0000000), wk = 0.0047619 k( 50) = ( 0.1733333 0.1733333 0.0000000), wk = 0.0047619 k( 51) = ( 0.1600000 0.1600000 0.0000000), wk = 0.0047619 k( 52) = ( 0.1466667 0.1466667 0.0000000), wk = 0.0047619 k( 53) = ( 0.1333333 0.1333333 -0.0000000), wk = 0.0047619 k( 54) = ( 0.1200000 0.1200000 -0.0000000), wk = 0.0047619 k( 55) = ( 0.1066667 0.1066667 0.0000000), wk = 0.0047619 k( 56) = ( 0.0933333 0.0933333 -0.0000000), wk = 0.0047619 k( 57) = ( 0.0800000 0.0800000 0.0000000), wk = 0.0047619 k( 58) = ( 0.0666667 0.0666667 -0.0000000), wk = 0.0047619 k( 59) = ( 0.0533333 0.0533333 0.0000000), wk = 0.0047619 k( 60) = ( 0.0400000 0.0400000 0.0000000), wk = 0.0047619 k( 61) = ( 0.0266667 0.0266667 0.0000000), wk = 0.0047619 k( 62) = ( 0.0133333 0.0133333 -0.0000000), wk = 0.0047619 k( 63) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 64) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 65) = ( 0.0000000 0.0000000 0.0185185), wk = 0.0047619 k( 66) = ( 0.0000000 0.0000000 0.0370370), wk = 0.0047619 k( 67) = ( 0.0000000 0.0000000 0.0555556), wk = 0.0047619 k( 68) = ( 0.0000000 0.0000000 0.0740741), wk = 0.0047619 k( 69) = ( 0.0000000 0.0000000 0.0925926), wk = 0.0047619 k( 70) = ( 0.0000000 0.0000000 0.1111111), wk = 0.0047619 k( 71) = ( 0.0000000 0.0000000 0.1296296), wk = 0.0047619 k( 72) = ( 0.0000000 0.0000000 0.1481482), wk = 0.0047619 k( 73) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0047619 k( 74) = ( 0.0000000 0.0000000 0.1851852), wk = 0.0047619 k( 75) = ( 0.0000000 0.0000000 0.2037037), wk = 0.0047619 k( 76) = ( 0.0000000 0.0000000 0.2222222), wk = 0.0047619 k( 77) = ( 0.0000000 0.0000000 0.2407407), wk = 0.0047619 k( 78) = ( 0.0000000 0.0000000 0.2592593), wk = 0.0047619 k( 79) = ( 0.0000000 0.0000000 0.2777778), wk = 0.0047619 k( 80) = ( 0.0000000 0.0000000 0.2962963), wk = 0.0047619 k( 81) = ( 0.0000000 0.0000000 0.3148148), wk = 0.0047619 k( 82) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0047619 k( 83) = ( 0.0000000 0.0000000 0.3518518), wk = 0.0047619 k( 84) = ( 0.0000000 0.0000000 0.3703704), wk = 0.0047619 k( 85) = ( 0.0000000 0.0000000 0.3888889), wk = 0.0047619 k( 86) = ( 0.0000000 0.0000000 0.4074074), wk = 0.0047619 k( 87) = ( 0.0000000 0.0000000 0.4259259), wk = 0.0047619 k( 88) = ( 0.0000000 0.0000000 0.4444444), wk = 0.0047619 k( 89) = ( 0.0000000 0.0000000 0.4629630), wk = 0.0047619 k( 90) = ( 0.0000000 0.0000000 0.4814815), wk = 0.0047619 k( 91) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0047619 k( 92) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0047619 k( 93) = ( 0.0227273 0.0000000 0.5000000), wk = 0.0047619 k( 94) = ( 0.0454546 0.0000000 0.5000000), wk = 0.0047619 k( 95) = ( 0.0681818 0.0000000 0.5000000), wk = 0.0047619 k( 96) = ( 0.0909091 0.0000000 0.5000000), wk = 0.0047619 k( 97) = ( 0.1136364 -0.0000000 0.5000000), wk = 0.0047619 k( 98) = ( 0.1363636 0.0000000 0.5000000), wk = 0.0047619 k( 99) = ( 0.1590909 0.0000000 0.5000000), wk = 0.0047619 k( 100) = ( 0.1818182 0.0000000 0.5000000), wk = 0.0047619 k( 101) = ( 0.2045454 -0.0000000 0.5000000), wk = 0.0047619 k( 102) = ( 0.2272727 0.0000000 0.5000000), wk = 0.0047619 k( 103) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0047619 k( 104) = ( 0.2727273 0.0000000 0.5000000), wk = 0.0047619 k( 105) = ( 0.2954545 0.0000000 0.5000000), wk = 0.0047619 k( 106) = ( 0.3181818 0.0000000 0.5000000), wk = 0.0047619 k( 107) = ( 0.3409091 0.0000000 0.5000000), wk = 0.0047619 k( 108) = ( 0.3636364 0.0000000 0.5000000), wk = 0.0047619 k( 109) = ( 0.3863636 0.0000000 0.5000000), wk = 0.0047619 k( 110) = ( 0.4090909 0.0000000 0.5000000), wk = 0.0047619 k( 111) = ( 0.4318182 -0.0000000 0.5000000), wk = 0.0047619 k( 112) = ( 0.4545455 0.0000000 0.5000000), wk = 0.0047619 k( 113) = ( 0.4772727 0.0000000 0.5000000), wk = 0.0047619 k( 114) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0047619 k( 115) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0047619 k( 116) = ( 0.4871795 0.0256410 0.5000000), wk = 0.0047619 k( 117) = ( 0.4743590 0.0512820 0.5000000), wk = 0.0047619 k( 118) = ( 0.4615385 0.0769231 0.5000000), wk = 0.0047619 k( 119) = ( 0.4487179 0.1025641 0.5000000), wk = 0.0047619 k( 120) = ( 0.4358974 0.1282051 0.5000000), wk = 0.0047619 k( 121) = ( 0.4230769 0.1538461 0.5000000), wk = 0.0047619 k( 122) = ( 0.4102564 0.1794872 0.5000000), wk = 0.0047619 k( 123) = ( 0.3974359 0.2051282 0.5000000), wk = 0.0047619 k( 124) = ( 0.3846154 0.2307692 0.5000000), wk = 0.0047619 k( 125) = ( 0.3717949 0.2564103 0.5000000), wk = 0.0047619 k( 126) = ( 0.3589744 0.2820513 0.5000000), wk = 0.0047619 k( 127) = ( 0.3461538 0.3076923 0.5000000), wk = 0.0047619 k( 128) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0047619 k( 129) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0047619 k( 130) = ( 0.3200000 0.3200000 0.5000000), wk = 0.0047619 k( 131) = ( 0.3066667 0.3066667 0.5000000), wk = 0.0047619 k( 132) = ( 0.2933333 0.2933333 0.5000000), wk = 0.0047619 k( 133) = ( 0.2800000 0.2800000 0.5000000), wk = 0.0047619 k( 134) = ( 0.2666667 0.2666667 0.5000000), wk = 0.0047619 k( 135) = ( 0.2533333 0.2533333 0.5000000), wk = 0.0047619 k( 136) = ( 0.2400000 0.2400000 0.5000000), wk = 0.0047619 k( 137) = ( 0.2266667 0.2266667 0.5000000), wk = 0.0047619 k( 138) = ( 0.2133333 0.2133333 0.5000000), wk = 0.0047619 k( 139) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0047619 k( 140) = ( 0.1866667 0.1866667 0.5000000), wk = 0.0047619 k( 141) = ( 0.1733333 0.1733333 0.5000000), wk = 0.0047619 k( 142) = ( 0.1600000 0.1600000 0.5000000), wk = 0.0047619 k( 143) = ( 0.1466667 0.1466667 0.5000000), wk = 0.0047619 k( 144) = ( 0.1333333 0.1333333 0.5000000), wk = 0.0047619 k( 145) = ( 0.1200000 0.1200000 0.5000000), wk = 0.0047619 k( 146) = ( 0.1066667 0.1066667 0.5000000), wk = 0.0047619 k( 147) = ( 0.0933333 0.0933333 0.5000000), wk = 0.0047619 k( 148) = ( 0.0800000 0.0800000 0.5000000), wk = 0.0047619 k( 149) = ( 0.0666667 0.0666667 0.5000000), wk = 0.0047619 k( 150) = ( 0.0533333 0.0533333 0.5000000), wk = 0.0047619 k( 151) = ( 0.0400000 0.0400000 0.5000000), wk = 0.0047619 k( 152) = ( 0.0266667 0.0266667 0.5000000), wk = 0.0047619 k( 153) = ( 0.0133333 0.0133333 0.5000000), wk = 0.0047619 k( 154) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0047619 k( 155) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0047619 k( 156) = ( 0.5000000 0.0000000 0.4814815), wk = 0.0047619 k( 157) = ( 0.5000000 0.0000000 0.4629630), wk = 0.0047619 k( 158) = ( 0.5000000 0.0000000 0.4444444), wk = 0.0047619 k( 159) = ( 0.5000000 0.0000000 0.4259259), wk = 0.0047619 k( 160) = ( 0.5000000 0.0000000 0.4074074), wk = 0.0047619 k( 161) = ( 0.5000000 0.0000000 0.3888889), wk = 0.0047619 k( 162) = ( 0.5000000 0.0000000 0.3703704), wk = 0.0047619 k( 163) = ( 0.5000000 0.0000000 0.3518519), wk = 0.0047619 k( 164) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0047619 k( 165) = ( 0.5000000 0.0000000 0.3148148), wk = 0.0047619 k( 166) = ( 0.5000000 0.0000000 0.2962963), wk = 0.0047619 k( 167) = ( 0.5000000 0.0000000 0.2777778), wk = 0.0047619 k( 168) = ( 0.5000000 0.0000000 0.2592593), wk = 0.0047619 k( 169) = ( 0.5000000 0.0000000 0.2407407), wk = 0.0047619 k( 170) = ( 0.5000000 0.0000000 0.2222222), wk = 0.0047619 k( 171) = ( 0.5000000 0.0000000 0.2037037), wk = 0.0047619 k( 172) = ( 0.5000000 0.0000000 0.1851852), wk = 0.0047619 k( 173) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0047619 k( 174) = ( 0.5000000 0.0000000 0.1481482), wk = 0.0047619 k( 175) = ( 0.5000000 0.0000000 0.1296296), wk = 0.0047619 k( 176) = ( 0.5000000 0.0000000 0.1111111), wk = 0.0047619 k( 177) = ( 0.5000000 0.0000000 0.0925926), wk = 0.0047619 k( 178) = ( 0.5000000 0.0000000 0.0740741), wk = 0.0047619 k( 179) = ( 0.5000000 0.0000000 0.0555556), wk = 0.0047619 k( 180) = ( 0.5000000 0.0000000 0.0370370), wk = 0.0047619 k( 181) = ( 0.5000000 0.0000000 0.0185185), wk = 0.0047619 k( 182) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0047619 k( 183) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0047619 k( 184) = ( 0.3333333 0.3333333 0.0185185), wk = 0.0047619 k( 185) = ( 0.3333333 0.3333333 0.0370370), wk = 0.0047619 k( 186) = ( 0.3333333 0.3333333 0.0555556), wk = 0.0047619 k( 187) = ( 0.3333333 0.3333333 0.0740741), wk = 0.0047619 k( 188) = ( 0.3333333 0.3333333 0.0925926), wk = 0.0047619 k( 189) = ( 0.3333333 0.3333333 0.1111111), wk = 0.0047619 k( 190) = ( 0.3333333 0.3333333 0.1296296), wk = 0.0047619 k( 191) = ( 0.3333333 0.3333333 0.1481482), wk = 0.0047619 k( 192) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0047619 k( 193) = ( 0.3333333 0.3333333 0.1851852), wk = 0.0047619 k( 194) = ( 0.3333333 0.3333333 0.2037037), wk = 0.0047619 k( 195) = ( 0.3333333 0.3333333 0.2222222), wk = 0.0047619 k( 196) = ( 0.3333333 0.3333333 0.2407407), wk = 0.0047619 k( 197) = ( 0.3333333 0.3333333 0.2592593), wk = 0.0047619 k( 198) = ( 0.3333333 0.3333333 0.2777778), wk = 0.0047619 k( 199) = ( 0.3333333 0.3333333 0.2962963), wk = 0.0047619 k( 200) = ( 0.3333333 0.3333333 0.3148148), wk = 0.0047619 k( 201) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0047619 k( 202) = ( 0.3333333 0.3333333 0.3518519), wk = 0.0047619 k( 203) = ( 0.3333333 0.3333333 0.3703704), wk = 0.0047619 k( 204) = ( 0.3333333 0.3333333 0.3888889), wk = 0.0047619 k( 205) = ( 0.3333333 0.3333333 0.4074074), wk = 0.0047619 k( 206) = ( 0.3333333 0.3333333 0.4259259), wk = 0.0047619 k( 207) = ( 0.3333333 0.3333333 0.4444444), wk = 0.0047619 k( 208) = ( 0.3333333 0.3333333 0.4629630), wk = 0.0047619 k( 209) = ( 0.3333333 0.3333333 0.4814815), wk = 0.0047619 k( 210) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0047619 Dense grid: 162427 G-vectors FFT dimensions: ( 81, 81, 60) Smooth grid: 122097 G-vectors FFT dimensions: ( 75, 75, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.64 Mb ( 438, 96) NL pseudopotentials 1.44 Mb ( 219, 432) Each V/rho on FFT grid 0.10 Mb ( 6561) Each G-vector array 0.02 Mb ( 2257) G-vector shells 0.01 Mb ( 1080) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.57 Mb ( 438, 384) Each subspace H/S matrix 0.06 Mb ( 64, 64) Each matrix 1.27 Mb ( 432, 2, 96) The potential is recalculated from file : ./Zr5Sb4.save/charge-density.dat negative rho (up, down): 3.875E-04 0.000E+00 Starting wfc are 244 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 9.7 secs Computing kpt #: 2 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 17.9 secs Computing kpt #: 3 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 26.6 secs Computing kpt #: 4 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 34.8 secs Computing kpt #: 5 total cpu time spent up to now is 42.2 secs Computing kpt #: 6 total cpu time spent up to now is 47.8 secs Computing kpt #: 7 total cpu time spent up to now is 52.7 secs Computing kpt #: 8 total cpu time spent up to now is 57.4 secs Computing kpt #: 9 total cpu time spent up to now is 62.1 secs Computing kpt #: 10 total cpu time spent up to now is 66.8 secs Computing kpt #: 11 total cpu time spent up to now is 71.5 secs Computing kpt #: 12 total cpu time spent up to now is 76.2 secs Computing kpt #: 13 total cpu time spent up to now is 80.9 secs Computing kpt #: 14 total cpu time spent up to now is 85.5 secs Computing kpt #: 15 total cpu time spent up to now is 90.2 secs Computing kpt #: 16 total cpu time spent up to now is 94.8 secs Computing kpt #: 17 total cpu time spent up to now is 99.5 secs Computing kpt #: 18 total cpu time spent up to now is 104.1 secs Computing kpt #: 19 total cpu time spent up to now is 110.3 secs Computing kpt #: 20 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 117.7 secs Computing kpt #: 21 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 125.2 secs Computing kpt #: 22 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 132.8 secs Computing kpt #: 23 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 140.4 secs Computing kpt #: 24 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 148.0 secs Computing kpt #: 25 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 155.8 secs Computing kpt #: 26 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 163.8 secs Computing kpt #: 27 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 172.2 secs Computing kpt #: 28 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 180.3 secs Computing kpt #: 29 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 188.5 secs Computing kpt #: 30 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 196.8 secs Computing kpt #: 31 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 205.1 secs Computing kpt #: 32 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 213.2 secs Computing kpt #: 33 total cpu time spent up to now is 221.1 secs Computing kpt #: 34 total cpu time spent up to now is 228.5 secs Computing kpt #: 35 total cpu time spent up to now is 236.0 secs Computing kpt #: 36 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 243.8 secs Computing kpt #: 37 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 251.4 secs Computing kpt #: 38 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 259.0 secs Computing kpt #: 39 total cpu time spent up to now is 266.3 secs Computing kpt #: 40 total cpu time spent up to now is 272.2 secs Computing kpt #: 41 total cpu time spent up to now is 278.1 secs Computing kpt #: 42 total cpu time spent up to now is 283.9 secs Computing kpt #: 43 total cpu time spent up to now is 289.8 secs Computing kpt #: 44 total cpu time spent up to now is 296.2 secs Computing kpt #: 45 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 303.8 secs Computing kpt #: 46 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 311.4 secs Computing kpt #: 47 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 318.9 secs Computing kpt #: 48 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 327.0 secs Computing kpt #: 49 total cpu time spent up to now is 333.8 secs Computing kpt #: 50 total cpu time spent up to now is 339.5 secs Computing kpt #: 51 total cpu time spent up to now is 344.7 secs Computing kpt #: 52 total cpu time spent up to now is 349.7 secs Computing kpt #: 53 total cpu time spent up to now is 354.4 secs Computing kpt #: 54 total cpu time spent up to now is 359.1 secs Computing kpt #: 55 total cpu time spent up to now is 363.9 secs Computing kpt #: 56 total cpu time spent up to now is 368.6 secs Computing kpt #: 57 total cpu time spent up to now is 373.3 secs Computing kpt #: 58 total cpu time spent up to now is 378.1 secs Computing kpt #: 59 total cpu time spent up to now is 383.5 secs Computing kpt #: 60 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 391.3 secs Computing kpt #: 61 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 399.4 secs Computing kpt #: 62 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 407.7 secs Computing kpt #: 63 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 415.9 secs Computing kpt #: 64 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 424.0 secs Computing kpt #: 65 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 432.2 secs Computing kpt #: 66 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 440.4 secs Computing kpt #: 67 total cpu time spent up to now is 448.1 secs Computing kpt #: 68 total cpu time spent up to now is 455.6 secs Computing kpt #: 69 total cpu time spent up to now is 462.5 secs Computing kpt #: 70 total cpu time spent up to now is 469.5 secs Computing kpt #: 71 total cpu time spent up to now is 476.1 secs Computing kpt #: 72 total cpu time spent up to now is 482.7 secs Computing kpt #: 73 total cpu time spent up to now is 489.4 secs Computing kpt #: 74 total cpu time spent up to now is 495.7 secs Computing kpt #: 75 total cpu time spent up to now is 502.4 secs Computing kpt #: 76 total cpu time spent up to now is 509.2 secs Computing kpt #: 77 total cpu time spent up to now is 517.2 secs Computing kpt #: 78 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 525.7 secs Computing kpt #: 79 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 534.2 secs Computing kpt #: 80 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 542.6 secs Computing kpt #: 81 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 550.9 secs Computing kpt #: 82 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 559.1 secs Computing kpt #: 83 total cpu time spent up to now is 567.0 secs Computing kpt #: 84 total cpu time spent up to now is 573.9 secs Computing kpt #: 85 total cpu time spent up to now is 582.1 secs Computing kpt #: 86 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 590.3 secs Computing kpt #: 87 total cpu time spent up to now is 598.3 secs Computing kpt #: 88 total cpu time spent up to now is 606.0 secs Computing kpt #: 89 total cpu time spent up to now is 614.2 secs Computing kpt #: 90 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 622.9 secs Computing kpt #: 91 total cpu time spent up to now is 629.7 secs Computing kpt #: 92 total cpu time spent up to now is 636.8 secs Computing kpt #: 93 total cpu time spent up to now is 643.7 secs Computing kpt #: 94 total cpu time spent up to now is 649.6 secs Computing kpt #: 95 total cpu time spent up to now is 655.3 secs Computing kpt #: 96 total cpu time spent up to now is 660.9 secs Computing kpt #: 97 total cpu time spent up to now is 666.7 secs Computing kpt #: 98 total cpu time spent up to now is 672.3 secs Computing kpt #: 99 total cpu time spent up to now is 678.0 secs Computing kpt #: 100 total cpu time spent up to now is 683.6 secs Computing kpt #: 101 total cpu time spent up to now is 688.9 secs Computing kpt #: 102 total cpu time spent up to now is 694.4 secs Computing kpt #: 103 total cpu time spent up to now is 700.2 secs Computing kpt #: 104 total cpu time spent up to now is 706.3 secs Computing kpt #: 105 total cpu time spent up to now is 712.8 secs Computing kpt #: 106 total cpu time spent up to now is 718.7 secs Computing kpt #: 107 total cpu time spent up to now is 724.4 secs Computing kpt #: 108 total cpu time spent up to now is 730.0 secs Computing kpt #: 109 total cpu time spent up to now is 735.7 secs Computing kpt #: 110 total cpu time spent up to now is 740.8 secs Computing kpt #: 111 total cpu time spent up to now is 745.8 secs Computing kpt #: 112 total cpu time spent up to now is 750.7 secs Computing kpt #: 113 total cpu time spent up to now is 755.5 secs Computing kpt #: 114 total cpu time spent up to now is 760.3 secs Computing kpt #: 115 total cpu time spent up to now is 765.4 secs Computing kpt #: 116 total cpu time spent up to now is 770.3 secs Computing kpt #: 117 total cpu time spent up to now is 775.2 secs Computing kpt #: 118 total cpu time spent up to now is 780.3 secs Computing kpt #: 119 total cpu time spent up to now is 785.5 secs Computing kpt #: 120 total cpu time spent up to now is 791.5 secs Computing kpt #: 121 total cpu time spent up to now is 797.4 secs Computing kpt #: 122 total cpu time spent up to now is 803.5 secs Computing kpt #: 123 total cpu time spent up to now is 809.6 secs Computing kpt #: 124 total cpu time spent up to now is 816.2 secs Computing kpt #: 125 total cpu time spent up to now is 822.9 secs Computing kpt #: 126 total cpu time spent up to now is 829.4 secs Computing kpt #: 127 total cpu time spent up to now is 835.8 secs Computing kpt #: 128 total cpu time spent up to now is 842.5 secs Computing kpt #: 129 total cpu time spent up to now is 850.1 secs Computing kpt #: 130 total cpu time spent up to now is 856.5 secs Computing kpt #: 131 total cpu time spent up to now is 862.9 secs Computing kpt #: 132 total cpu time spent up to now is 869.3 secs Computing kpt #: 133 total cpu time spent up to now is 877.1 secs Computing kpt #: 134 total cpu time spent up to now is 885.2 secs Computing kpt #: 135 total cpu time spent up to now is 893.4 secs Computing kpt #: 136 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 901.8 secs Computing kpt #: 137 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 910.0 secs Computing kpt #: 138 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 918.3 secs Computing kpt #: 139 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 927.2 secs Computing kpt #: 140 total cpu time spent up to now is 935.2 secs Computing kpt #: 141 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 943.4 secs Computing kpt #: 142 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 951.6 secs Computing kpt #: 143 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 959.8 secs Computing kpt #: 144 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 967.7 secs Computing kpt #: 145 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 975.7 secs Computing kpt #: 146 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 983.6 secs Computing kpt #: 147 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 991.5 secs Computing kpt #: 148 total cpu time spent up to now is 997.9 secs Computing kpt #: 149 total cpu time spent up to now is 1003.8 secs Computing kpt #: 150 total cpu time spent up to now is 1009.4 secs Computing kpt #: 151 total cpu time spent up to now is 1015.1 secs Computing kpt #: 152 total cpu time spent up to now is 1020.9 secs Computing kpt #: 153 total cpu time spent up to now is 1027.9 secs Computing kpt #: 154 total cpu time spent up to now is 1035.9 secs Computing kpt #: 155 total cpu time spent up to now is 1040.7 secs Computing kpt #: 156 total cpu time spent up to now is 1045.7 secs Computing kpt #: 157 total cpu time spent up to now is 1051.9 secs Computing kpt #: 158 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1059.4 secs Computing kpt #: 159 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1067.1 secs Computing kpt #: 160 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1074.7 secs Computing kpt #: 161 total cpu time spent up to now is 1080.3 secs Computing kpt #: 162 total cpu time spent up to now is 1085.4 secs Computing kpt #: 163 total cpu time spent up to now is 1090.7 secs Computing kpt #: 164 total cpu time spent up to now is 1096.4 secs Computing kpt #: 165 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1103.9 secs Computing kpt #: 166 total cpu time spent up to now is 1109.5 secs Computing kpt #: 167 total cpu time spent up to now is 1114.6 secs Computing kpt #: 168 total cpu time spent up to now is 1119.5 secs Computing kpt #: 169 total cpu time spent up to now is 1124.3 secs Computing kpt #: 170 total cpu time spent up to now is 1129.2 secs Computing kpt #: 171 total cpu time spent up to now is 1134.2 secs Computing kpt #: 172 total cpu time spent up to now is 1139.1 secs Computing kpt #: 173 total cpu time spent up to now is 1144.1 secs Computing kpt #: 174 total cpu time spent up to now is 1149.1 secs Computing kpt #: 175 total cpu time spent up to now is 1154.0 secs Computing kpt #: 176 total cpu time spent up to now is 1159.0 secs Computing kpt #: 177 total cpu time spent up to now is 1164.4 secs Computing kpt #: 178 total cpu time spent up to now is 1170.6 secs Computing kpt #: 179 total cpu time spent up to now is 1177.0 secs Computing kpt #: 180 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1184.8 secs Computing kpt #: 181 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1192.5 secs Computing kpt #: 182 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1200.0 secs Computing kpt #: 183 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1207.7 secs Computing kpt #: 184 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1215.4 secs Computing kpt #: 185 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1223.4 secs Computing kpt #: 186 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1231.2 secs Computing kpt #: 187 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1238.8 secs Computing kpt #: 188 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1246.3 secs Computing kpt #: 189 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1253.7 secs Computing kpt #: 190 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1261.1 secs Computing kpt #: 191 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1268.6 secs Computing kpt #: 192 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1275.9 secs Computing kpt #: 193 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1283.2 secs Computing kpt #: 194 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1290.6 secs Computing kpt #: 195 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1297.9 secs Computing kpt #: 196 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1305.2 secs Computing kpt #: 197 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1312.5 secs Computing kpt #: 198 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1319.9 secs Computing kpt #: 199 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1327.2 secs Computing kpt #: 200 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1334.4 secs Computing kpt #: 201 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1341.7 secs Computing kpt #: 202 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1349.2 secs Computing kpt #: 203 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1356.7 secs Computing kpt #: 204 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1364.3 secs Computing kpt #: 205 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1372.0 secs Computing kpt #: 206 total cpu time spent up to now is 1377.1 secs Computing kpt #: 207 total cpu time spent up to now is 1383.1 secs Computing kpt #: 208 total cpu time spent up to now is 1389.7 secs Computing kpt #: 209 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1397.6 secs Computing kpt #: 210 total cpu time spent up to now is 1404.3 secs ethr = 1.25E-08, avg # of iterations = 89.3 total cpu time spent up to now is 1404.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 15313 PWs) bands (ev): -2.1399 -2.1399 -0.3022 -0.3022 -0.0683 -0.0683 -0.0674 -0.0674 0.6341 0.6341 0.6368 0.6368 0.8893 0.8893 1.4983 1.4983 4.3172 4.3172 4.7593 4.7593 4.8029 4.8029 4.8643 4.8643 5.1864 5.1864 5.9470 5.9470 6.1290 6.1290 6.2485 6.2485 6.3058 6.3058 6.3203 6.3203 6.5101 6.5101 6.6094 6.6094 6.6698 6.6698 6.8014 6.8014 6.8349 6.8349 6.9600 6.9600 8.0101 8.0101 8.2338 8.2338 8.3789 8.3789 8.5221 8.5221 8.5646 8.5646 8.6632 8.6632 8.8553 8.8553 8.8652 8.8652 8.8746 8.8746 9.0410 9.0410 9.0434 9.0434 9.0879 9.0879 9.4264 9.4264 9.7490 9.7490 10.6432 10.6432 10.7277 10.7277 11.2706 11.2706 11.4550 11.4550 11.4833 11.4833 11.5714 11.5714 11.8061 11.8061 11.9062 11.9062 11.9236 11.9270 11.9392 11.9402 k = 0.0227 0.0131-0.0000 ( 15311 PWs) bands (ev): -2.1390 -2.1390 -0.3042 -0.3042 -0.0696 -0.0696 -0.0684 -0.0684 0.6353 0.6353 0.6382 0.6382 0.8897 0.8897 1.4982 1.4982 4.3141 4.3141 4.7601 4.7601 4.8041 4.8041 4.8655 4.8655 5.1870 5.1870 5.9490 5.9490 6.1279 6.1279 6.2521 6.2521 6.3076 6.3076 6.3205 6.3205 6.5119 6.5119 6.6014 6.6014 6.6708 6.6708 6.8040 6.8040 6.8376 6.8376 6.9609 6.9609 8.0085 8.0085 8.2302 8.2302 8.3822 8.3822 8.5209 8.5209 8.5632 8.5632 8.6584 8.6584 8.8383 8.8383 8.8513 8.8513 8.9026 8.9026 9.0378 9.0378 9.0439 9.0439 9.0913 9.0913 9.4260 9.4260 9.7559 9.7559 10.6417 10.6417 10.7262 10.7262 11.2698 11.2698 11.4518 11.4518 11.4772 11.4772 11.5672 11.5672 11.7947 11.7947 11.8880 11.8880 11.9341 11.9342 11.9414 11.9415 k = 0.0455 0.0262-0.0000 ( 15299 PWs) bands (ev): -2.1362 -2.1362 -0.3100 -0.3100 -0.0741 -0.0741 -0.0708 -0.0708 0.6381 0.6381 0.6432 0.6432 0.8908 0.8908 1.4982 1.4982 4.3049 4.3049 4.7621 4.7621 4.8080 4.8080 4.8693 4.8693 5.1887 5.1887 5.9547 5.9547 6.1245 6.1245 6.2629 6.2629 6.3129 6.3129 6.3212 6.3212 6.5172 6.5172 6.5796 6.5796 6.6736 6.6736 6.8104 6.8104 6.8454 6.8454 6.9635 6.9635 8.0037 8.0037 8.2195 8.2195 8.3921 8.3921 8.5173 8.5173 8.5593 8.5593 8.6440 8.6440 8.8097 8.8097 8.8405 8.8405 8.9336 8.9336 9.0264 9.0264 9.0482 9.0482 9.1012 9.1012 9.4248 9.4248 9.7760 9.7760 10.6374 10.6374 10.7217 10.7217 11.2671 11.2671 11.4423 11.4423 11.4589 11.4589 11.5548 11.5548 11.7706 11.7706 11.8719 11.8719 11.9170 11.9186 11.9217 11.9260 k = 0.0682 0.0394-0.0000 ( 15285 PWs) bands (ev): -2.1316 -2.1316 -0.3199 -0.3199 -0.0810 -0.0810 -0.0744 -0.0744 0.6420 0.6420 0.6517 0.6517 0.8927 0.8927 1.4981 1.4981 4.2897 4.2897 4.7645 4.7645 4.8151 4.8151 4.8762 4.8762 5.1916 5.1916 5.9632 5.9632 6.1191 6.1191 6.2797 6.2797 6.3204 6.3204 6.3245 6.3245 6.5249 6.5249 6.5497 6.5497 6.6782 6.6782 6.8183 6.8183 6.8569 6.8569 6.9676 6.9676 7.9956 7.9956 8.2019 8.2019 8.4080 8.4080 8.5110 8.5110 8.5531 8.5531 8.6206 8.6206 8.7826 8.7826 8.8266 8.8266 8.9585 8.9585 9.0124 9.0124 9.0552 9.0552 9.1163 9.1163 9.4228 9.4228 9.8076 9.8076 10.6303 10.6303 10.7142 10.7142 11.2616 11.2616 11.4250 11.4250 11.4312 11.4312 11.5355 11.5355 11.7480 11.7480 11.8498 11.8498 11.8926 11.8927 11.9136 11.9145 k = 0.0909 0.0525-0.0000 ( 15299 PWs) bands (ev): -2.1252 -2.1252 -0.3338 -0.3338 -0.0898 -0.0898 -0.0792 -0.0792 0.6469 0.6469 0.6632 0.6632 0.8954 0.8954 1.4979 1.4979 4.2689 4.2689 4.7668 4.7668 4.8256 4.8256 4.8872 4.8872 5.1957 5.1957 5.9727 5.9727 6.1123 6.1123 6.2997 6.2997 6.3265 6.3265 6.3357 6.3357 6.5073 6.5073 6.5433 6.5433 6.6845 6.6845 6.8271 6.8271 6.8699 6.8699 6.9724 6.9724 7.9844 7.9844 8.1776 8.1776 8.4293 8.4293 8.5024 8.5024 8.5447 8.5447 8.5901 8.5901 8.7543 8.7543 8.8137 8.8137 8.9618 8.9618 9.0122 9.0122 9.0645 9.0645 9.1357 9.1357 9.4200 9.4200 9.8484 9.8484 10.6202 10.6202 10.7036 10.7036 11.2520 11.2520 11.3871 11.3871 11.4100 11.4100 11.5122 11.5122 11.7322 11.7322 11.8287 11.8287 11.8584 11.8584 11.8959 11.8959 k = 0.1136 0.0656-0.0000 ( 15287 PWs) bands (ev): -2.1172 -2.1172 -0.3519 -0.3519 -0.0995 -0.0995 -0.0851 -0.0851 0.6528 0.6528 0.6769 0.6769 0.8990 0.8990 1.4977 1.4977 4.2430 4.2430 4.7690 4.7690 4.8392 4.8392 4.9028 4.9028 5.2008 5.2008 5.9809 5.9809 6.1055 6.1055 6.3138 6.3138 6.3410 6.3410 6.3525 6.3525 6.4690 6.4690 6.5599 6.5599 6.6924 6.6924 6.8371 6.8371 6.8829 6.8829 6.9776 6.9776 7.9701 7.9701 8.1471 8.1471 8.4528 8.4528 8.4938 8.4938 8.5319 8.5319 8.5573 8.5573 8.7226 8.7226 8.8045 8.8045 8.9419 8.9419 9.0288 9.0288 9.0756 9.0756 9.1586 9.1586 9.4163 9.4163 9.8964 9.8964 10.6071 10.6071 10.6900 10.6900 11.2355 11.2355 11.3401 11.3401 11.3896 11.3896 11.4883 11.4883 11.7228 11.7228 11.8126 11.8126 11.8178 11.8178 11.8739 11.8739 k = 0.1364 0.0787-0.0000 ( 15269 PWs) bands (ev): -2.1075 -2.1075 -0.3740 -0.3740 -0.1096 -0.1096 -0.0920 -0.0920 0.6593 0.6593 0.6922 0.6922 0.9035 0.9035 1.4975 1.4975 4.2127 4.2127 4.7713 4.7713 4.8552 4.8552 4.9236 4.9236 5.2071 5.2071 5.9846 5.9846 6.1008 6.1008 6.3167 6.3167 6.3627 6.3627 6.3748 6.3748 6.4350 6.4350 6.5818 6.5818 6.7019 6.7019 6.8481 6.8481 6.8951 6.8951 6.9826 6.9826 7.9528 7.9528 8.1109 8.1109 8.4606 8.4606 8.5018 8.5018 8.5043 8.5043 8.5353 8.5353 8.6871 8.6871 8.7991 8.7991 8.9165 8.9165 9.0467 9.0467 9.0881 9.0881 9.1839 9.1839 9.4118 9.4118 9.9495 9.9495 10.5910 10.5910 10.6733 10.6733 11.2094 11.2094 11.2900 11.2900 11.3703 11.3703 11.4672 11.4672 11.7180 11.7180 11.7705 11.7705 11.8035 11.8035 11.8502 11.8502 k = 0.1591 0.0919-0.0000 ( 15276 PWs) bands (ev): -2.0963 -2.0963 -0.3997 -0.3997 -0.1194 -0.1194 -0.0995 -0.0995 0.6663 0.6663 0.7085 0.7085 0.9090 0.9090 1.4972 1.4972 4.1789 4.1789 4.7743 4.7743 4.8732 4.8732 4.9492 4.9492 5.2145 5.2145 5.9808 5.9808 6.1001 6.1001 6.3069 6.3069 6.3778 6.3778 6.3958 6.3958 6.4279 6.4279 6.6081 6.6081 6.7129 6.7129 6.8602 6.8602 6.9061 6.9061 6.9875 6.9875 7.9325 7.9325 8.0697 8.0697 8.4443 8.4443 8.4667 8.4667 8.5160 8.5160 8.5391 8.5391 8.6489 8.6489 8.7967 8.7967 8.8911 8.8911 9.0623 9.0623 9.1015 9.1015 9.2104 9.2104 9.4064 9.4064 10.0062 10.0062 10.5718 10.5718 10.6538 10.6538 11.1721 11.1721 11.2407 11.2407 11.3529 11.3529 11.4516 11.4516 11.7158 11.7158 11.7204 11.7204 11.7984 11.7984 11.8259 11.8259 k = 0.1818 0.1050-0.0000 ( 15266 PWs) bands (ev): -2.0837 -2.0837 -0.4285 -0.4285 -0.1287 -0.1287 -0.1076 -0.1076 0.6733 0.6733 0.7254 0.7254 0.9154 0.9154 1.4970 1.4970 4.1423 4.1423 4.7785 4.7785 4.8931 4.8931 4.9789 4.9789 5.2230 5.2230 5.9691 5.9691 6.1033 6.1033 6.2784 6.2784 6.3834 6.3834 6.4167 6.4167 6.4552 6.4552 6.6381 6.6381 6.7261 6.7261 6.8727 6.8727 6.9160 6.9160 6.9925 6.9925 7.9092 7.9092 8.0245 8.0245 8.4113 8.4113 8.4368 8.4368 8.5034 8.5034 8.5768 8.5768 8.6089 8.6089 8.7963 8.7963 8.8681 8.8681 9.0758 9.0758 9.1155 9.1155 9.2372 9.2372 9.4000 9.4000 10.0649 10.0649 10.5495 10.5495 10.6317 10.6317 11.1249 11.1249 11.1946 11.1946 11.3364 11.3364 11.4434 11.4434 11.6661 11.6661 11.7165 11.7165 11.7969 11.7969 11.8023 11.8023 k = 0.2045 0.1181-0.0000 ( 15268 PWs) bands (ev): -2.0699 -2.0699 -0.4599 -0.4599 -0.1373 -0.1373 -0.1160 -0.1160 0.6802 0.6802 0.7422 0.7422 0.9228 0.9228 1.4967 1.4967 4.1040 4.1040 4.7843 4.7843 4.9147 4.9147 5.0115 5.0115 5.2326 5.2326 5.9510 5.9510 6.1083 6.1083 6.2388 6.2388 6.3947 6.3947 6.4414 6.4414 6.4898 6.4898 6.6697 6.6697 6.7425 6.7425 6.8847 6.8847 6.9255 6.9255 6.9984 6.9984 7.8825 7.8825 7.9764 7.9764 8.3675 8.3675 8.4141 8.4141 8.4873 8.4873 8.5678 8.5678 8.6200 8.6200 8.7968 8.7968 8.8495 8.8495 9.0877 9.0877 9.1298 9.1298 9.2632 9.2632 9.3926 9.3926 10.1242 10.1242 10.5244 10.5244 10.6075 10.6075 11.0719 11.0719 11.1519 11.1519 11.3195 11.3195 11.4433 11.4433 11.6104 11.6104 11.7173 11.7173 11.7800 11.7800 11.7984 11.7984 k = 0.2273 0.1312-0.0000 ( 15256 PWs) bands (ev): -2.0551 -2.0551 -0.4931 -0.4931 -0.1452 -0.1452 -0.1246 -0.1246 0.6868 0.6868 0.7588 0.7588 0.9310 0.9310 1.4964 1.4964 4.0649 4.0649 4.7921 4.7921 4.9380 4.9380 5.0456 5.0456 5.2434 5.2434 5.9286 5.9286 6.1119 6.1119 6.1978 6.1978 6.4115 6.4115 6.4672 6.4672 6.5250 6.5250 6.6993 6.6993 6.7648 6.7648 6.8947 6.8947 6.9363 6.9363 7.0058 7.0058 7.8512 7.8512 7.9277 7.9277 8.3214 8.3214 8.3920 8.3920 8.4691 8.4691 8.5268 8.5268 8.6655 8.6655 8.7958 8.7958 8.8379 8.8379 9.0983 9.0983 9.1442 9.1442 9.2876 9.2876 9.3844 9.3844 10.1826 10.1826 10.4973 10.4973 10.5817 10.5817 11.0168 11.0168 11.1122 11.1122 11.3023 11.3023 11.4505 11.4505 11.5536 11.5536 11.7178 11.7178 11.7606 11.7606 11.8020 11.8020 k = 0.2500 0.1443-0.0000 ( 15266 PWs) bands (ev): -2.0394 -2.0394 -0.5275 -0.5275 -0.1524 -0.1524 -0.1331 -0.1331 0.6928 0.6928 0.7748 0.7748 0.9400 0.9400 1.4961 1.4961 4.0257 4.0257 4.8023 4.8023 4.9624 4.9624 5.0798 5.0798 5.2554 5.2554 5.9039 5.9039 6.1080 6.1080 6.1644 6.1644 6.4310 6.4310 6.4927 6.4927 6.5597 6.5597 6.7227 6.7227 6.7953 6.7953 6.9022 6.9022 6.9499 6.9499 7.0150 7.0150 7.8130 7.8130 7.8819 7.8819 8.2747 8.2747 8.3698 8.3698 8.4491 8.4491 8.4865 8.4865 8.7123 8.7123 8.7911 8.7911 8.8353 8.8353 9.1081 9.1081 9.1584 9.1584 9.3092 9.3092 9.3761 9.3761 10.2375 10.2375 10.4700 10.4700 10.5549 10.5549 10.9623 10.9623 11.0755 11.0755 11.2854 11.2854 11.4636 11.4636 11.4966 11.4966 11.7166 11.7166 11.7455 11.7455 11.8071 11.8071 k = 0.2727 0.1575-0.0000 ( 15258 PWs) bands (ev): -2.0232 -2.0232 -0.5621 -0.5621 -0.1589 -0.1589 -0.1414 -0.1414 0.6982 0.6982 0.7899 0.7899 0.9495 0.9495 1.4957 1.4957 3.9873 3.9873 4.8149 4.8149 4.9877 4.9877 5.1124 5.1124 5.2685 5.2685 5.8779 5.8779 6.0871 6.0871 6.1499 6.1499 6.4509 6.4509 6.5172 6.5172 6.5935 6.5935 6.7401 6.7401 6.8315 6.8315 6.9084 6.9084 6.9669 6.9669 7.0261 7.0261 7.7656 7.7656 7.8418 7.8418 8.2284 8.2284 8.3478 8.3478 8.4278 8.4278 8.4479 8.4479 8.7588 8.7588 8.7845 8.7845 8.8402 8.8402 9.1173 9.1173 9.1723 9.1723 9.3248 9.3248 9.3704 9.3704 10.2840 10.2840 10.4472 10.4472 10.5275 10.5275 10.9098 10.9098 11.0420 11.0420 11.2694 11.2694 11.4395 11.4395 11.4821 11.4821 11.7121 11.7121 11.7365 11.7365 11.8133 11.8133 k = 0.2955 0.1706-0.0000 ( 15264 PWs) bands (ev): -2.0067 -2.0067 -0.5964 -0.5964 -0.1648 -0.1648 -0.1493 -0.1493 0.7030 0.7030 0.8040 0.8040 0.9593 0.9593 1.4954 1.4954 3.9504 3.9504 4.8302 4.8302 5.0132 5.0132 5.1417 5.1417 5.2824 5.2824 5.8517 5.8517 6.0570 6.0570 6.1483 6.1483 6.4676 6.4676 6.5409 6.5409 6.6272 6.6272 6.7538 6.7538 6.8677 6.8677 6.9157 6.9157 6.9874 6.9874 7.0395 7.0395 7.7108 7.7108 7.8069 7.8069 8.1833 8.1833 8.3262 8.3262 8.4044 8.4044 8.4130 8.4130 8.7761 8.7761 8.8064 8.8064 8.8494 8.8494 9.1261 9.1261 9.1861 9.1861 9.3275 9.3275 9.3740 9.3740 10.3106 10.3106 10.4398 10.4398 10.5006 10.5006 10.8606 10.8606 11.0117 11.0117 11.2546 11.2546 11.3843 11.3843 11.5038 11.5038 11.7059 11.7059 11.7326 11.7326 11.8202 11.8202 k = 0.3182 0.1837-0.0000 ( 15286 PWs) bands (ev): -1.9903 -1.9903 -0.6297 -0.6297 -0.1700 -0.1700 -0.1567 -0.1567 0.7070 0.7070 0.8169 0.8169 0.9691 0.9691 1.4951 1.4951 3.9156 3.9156 4.8481 4.8481 5.0383 5.0383 5.1662 5.1662 5.2969 5.2969 5.8258 5.8258 6.0293 6.0293 6.1498 6.1498 6.4770 6.4770 6.5652 6.5652 6.6614 6.6614 6.7652 6.7652 6.8985 6.8985 6.9261 6.9261 7.0111 7.0111 7.0561 7.0561 7.6516 7.6516 7.7745 7.7745 8.1401 8.1401 8.3053 8.3053 8.3750 8.3750 8.3873 8.3873 8.7709 8.7709 8.8495 8.8495 8.8621 8.8621 9.1345 9.1345 9.1995 9.1995 9.3178 9.3178 9.3863 9.3863 10.3073 10.3073 10.4511 10.4511 10.4818 10.4818 10.8153 10.8153 10.9848 10.9848 11.2413 11.2413 11.3311 11.3311 11.5284 11.5284 11.7012 11.7012 11.7310 11.7310 11.8273 11.8273 k = 0.3409 0.1968-0.0000 ( 15294 PWs) bands (ev): -1.9743 -1.9743 -0.6611 -0.6611 -0.1746 -0.1746 -0.1635 -0.1635 0.7104 0.7104 0.8284 0.8284 0.9788 0.9788 1.4949 1.4949 3.8835 3.8835 4.8687 4.8687 5.0621 5.0621 5.1844 5.1844 5.3113 5.3113 5.8009 5.8009 6.0086 6.0086 6.1518 6.1518 6.4766 6.4766 6.5917 6.5917 6.6963 6.6963 6.7749 6.7749 6.9191 6.9191 6.9417 6.9417 7.0355 7.0355 7.0788 7.0788 7.5904 7.5904 7.7431 7.7431 8.0998 8.0998 8.2856 8.2856 8.3456 8.3456 8.3662 8.3662 8.7667 8.7667 8.8733 8.8733 8.8930 8.8930 9.1424 9.1424 9.2128 9.2128 9.3026 9.3026 9.4005 9.4005 10.2863 10.2863 10.4371 10.4371 10.5035 10.5035 10.7747 10.7747 10.9613 10.9613 11.2294 11.2294 11.2813 11.2813 11.5548 11.5548 11.6994 11.6994 11.7309 11.7309 11.8344 11.8344 k = 0.3636 0.2099-0.0000 ( 15296 PWs) bands (ev): -1.9591 -1.9591 -0.6902 -0.6902 -0.1786 -0.1786 -0.1697 -0.1697 0.7132 0.7132 0.8386 0.8386 0.9878 0.9878 1.4946 1.4946 3.8546 3.8546 4.8918 4.8918 5.0836 5.0836 5.1957 5.1957 5.3252 5.3252 5.7769 5.7769 5.9967 5.9967 6.1537 6.1537 6.4668 6.4668 6.6200 6.6200 6.7315 6.7315 6.7834 6.7834 6.9322 6.9322 6.9595 6.9595 7.0560 7.0560 7.1099 7.1099 7.5288 7.5288 7.7118 7.7118 8.0633 8.0633 8.2674 8.2674 8.3200 8.3200 8.3471 8.3471 8.7636 8.7636 8.8883 8.8883 8.9300 8.9300 9.1497 9.1497 9.2256 9.2256 9.2849 9.2849 9.4139 9.4139 10.2605 10.2605 10.4125 10.4125 10.5392 10.5392 10.7391 10.7391 10.9412 10.9412 11.2177 11.2177 11.2368 11.2368 11.5820 11.5820 11.6999 11.6999 11.7334 11.7334 11.8410 11.8410 k = 0.3864 0.2231-0.0000 ( 15308 PWs) bands (ev): -1.9453 -1.9453 -0.7162 -0.7162 -0.1821 -0.1821 -0.1750 -0.1750 0.7155 0.7155 0.8472 0.8472 0.9960 0.9960 1.4944 1.4944 3.8293 3.8293 4.9171 4.9171 5.1014 5.1014 5.2001 5.2001 5.3382 5.3382 5.7544 5.7544 5.9942 5.9942 6.1553 6.1553 6.4499 6.4499 6.6485 6.6485 6.7658 6.7658 6.7910 6.7910 6.9420 6.9420 6.9765 6.9765 7.0719 7.0719 7.1469 7.1469 7.4678 7.4678 7.6805 7.6805 8.0314 8.0314 8.2511 8.2511 8.2987 8.2987 8.3302 8.3302 8.7615 8.7615 8.9035 8.9035 8.9623 8.9623 9.1562 9.1562 9.2374 9.2374 9.2667 9.2667 9.4258 9.4258 10.2354 10.2354 10.3886 10.3886 10.5731 10.5731 10.7087 10.7087 10.9243 10.9243 11.1904 11.1904 11.2144 11.2144 11.6087 11.6087 11.7007 11.7007 11.7410 11.7410 11.8470 11.8470 k = 0.4091 0.2362-0.0000 ( 15288 PWs) bands (ev): -1.9331 -1.9331 -0.7385 -0.7385 -0.1849 -0.1849 -0.1794 -0.1794 0.7172 0.7172 0.8544 0.8544 1.0032 1.0032 1.4942 1.4942 3.8081 3.8081 4.9443 4.9443 5.1133 5.1133 5.1994 5.1994 5.3500 5.3500 5.7337 5.7337 5.9998 5.9998 6.1565 6.1565 6.4288 6.4288 6.6752 6.6752 6.7931 6.7931 6.8026 6.8026 6.9484 6.9484 6.9945 6.9945 7.0845 7.0845 7.1847 7.1847 7.4091 7.4091 7.6494 7.6494 8.0049 8.0049 8.2371 8.2371 8.2820 8.2820 8.3157 8.3157 8.7602 8.7602 8.9187 8.9187 8.9891 8.9891 9.1619 9.1619 9.2404 9.2404 9.2563 9.2563 9.4358 9.4358 10.2131 10.2131 10.3673 10.3673 10.6023 10.6023 10.6837 10.6837 10.9106 10.9106 11.1559 11.1559 11.2067 11.2067 11.6337 11.6337 11.7004 11.7004 11.7550 11.7550 11.8519 11.8519 k = 0.4318 0.2493-0.0000 ( 15306 PWs) bands (ev): -1.9231 -1.9231 -0.7565 -0.7565 -0.1871 -0.1871 -0.1829 -0.1829 0.7185 0.7185 0.8600 0.8600 1.0090 1.0090 1.4941 1.4941 3.7913 3.7913 4.9729 4.9729 5.1163 5.1163 5.1971 5.1971 5.3604 5.3604 5.7160 5.7160 6.0110 6.0110 6.1575 6.1575 6.4064 6.4064 6.6982 6.6982 6.8001 6.8001 6.8304 6.8304 6.9495 6.9495 7.0169 7.0169 7.0945 7.0945 7.2179 7.2179 7.3558 7.3558 7.6196 7.6196 7.9842 7.9842 8.2257 8.2257 8.2696 8.2696 8.3041 8.3041 8.7593 8.7593 8.9328 8.9328 9.0100 9.0100 9.1666 9.1666 9.2256 9.2256 9.2635 9.2635 9.4437 9.4437 10.1948 10.1948 10.3496 10.3496 10.6255 10.6255 10.6642 10.6642 10.9001 10.9001 11.1272 11.1272 11.2015 11.2015 11.6555 11.6555 11.6991 11.6991 11.7751 11.7751 11.8554 11.8554 k = 0.4545 0.2624-0.0000 ( 15290 PWs) bands (ev): -1.9157 -1.9157 -0.7697 -0.7697 -0.1887 -0.1887 -0.1855 -0.1855 0.7194 0.7194 0.8640 0.8640 1.0133 1.0133 1.4940 1.4940 3.7791 3.7791 5.0018 5.0018 5.1083 5.1083 5.1962 5.1962 5.3687 5.3687 5.7021 5.7021 6.0239 6.0239 6.1582 6.1582 6.3863 6.3863 6.7156 6.7156 6.8037 6.8037 6.8566 6.8566 6.9444 6.9444 7.0445 7.0445 7.1017 7.1017 7.2354 7.2354 7.3177 7.3177 7.5932 7.5932 7.9695 7.9695 8.2174 8.2174 8.2612 8.2612 8.2957 8.2957 8.7588 8.7588 8.9448 8.9448 9.0247 9.0247 9.1700 9.1700 9.2110 9.2110 9.2715 9.2715 9.4494 9.4494 10.1814 10.1814 10.3363 10.3363 10.6424 10.6424 10.6502 10.6502 10.8927 10.8927 11.1059 11.1059 11.1978 11.1978 11.6726 11.6726 11.6976 11.6976 11.7994 11.7994 11.8574 11.8574 k = 0.4773 0.2756-0.0000 ( 15294 PWs) bands (ev): -1.9111 -1.9111 -0.7779 -0.7779 -0.1896 -0.1896 -0.1870 -0.1870 0.7200 0.7200 0.8664 0.8664 1.0159 1.0159 1.4939 1.4939 3.7717 3.7717 5.0293 5.0293 5.0919 5.0919 5.1970 5.1970 5.3741 5.3741 5.6932 5.6932 6.0342 6.0342 6.1586 6.1586 6.3720 6.3720 6.7264 6.7264 6.8058 6.8058 6.8782 6.8782 6.9350 6.9350 7.0727 7.0727 7.1059 7.1059 7.2227 7.2227 7.3103 7.3103 7.5741 7.5741 7.9607 7.9607 8.2123 8.2123 8.2563 8.2563 8.2905 8.2905 8.7585 8.7585 8.9529 8.9529 9.0334 9.0334 9.1720 9.1720 9.2009 9.2009 9.2768 9.2768 9.4529 9.4529 10.1732 10.1732 10.3281 10.3281 10.6418 10.6418 10.6525 10.6525 10.8882 10.8882 11.0929 11.0929 11.1957 11.1957 11.6835 11.6835 11.6966 11.6966 11.8248 11.8248 11.8569 11.8570 k = 0.5000 0.2887-0.0000 ( 15278 PWs) bands (ev): -1.9095 -1.9095 -0.7806 -0.7806 -0.1899 -0.1899 -0.1875 -0.1875 0.7201 0.7201 0.8672 0.8672 1.0168 1.0168 1.4939 1.4939 3.7693 3.7693 5.0456 5.0456 5.0790 5.0790 5.1975 5.1975 5.3760 5.3760 5.6902 5.6902 6.0382 6.0382 6.1587 6.1587 6.3668 6.3668 6.7300 6.7300 6.8065 6.8065 6.8885 6.8885 6.9286 6.9286 7.0871 7.0871 7.1072 7.1072 7.2093 7.2093 7.3130 7.3130 7.5670 7.5670 7.9578 7.9578 8.2105 8.2105 8.2547 8.2547 8.2888 8.2888 8.7585 8.7585 8.9559 8.9559 9.0363 9.0363 9.1727 9.1727 9.1973 9.1973 9.2786 9.2786 9.4540 9.4540 10.1704 10.1704 10.3254 10.3254 10.6391 10.6391 10.6559 10.6559 10.8868 10.8868 11.0884 11.0884 11.1950 11.1950 11.6873 11.6873 11.6961 11.6961 11.8409 11.8409 11.8530 11.8530 k = 0.5000 0.2887-0.0000 ( 15278 PWs) bands (ev): -1.9095 -1.9095 -0.7806 -0.7806 -0.1899 -0.1899 -0.1875 -0.1875 0.7201 0.7201 0.8672 0.8672 1.0168 1.0168 1.4939 1.4939 3.7693 3.7693 5.0456 5.0456 5.0790 5.0790 5.1975 5.1975 5.3760 5.3760 5.6902 5.6902 6.0382 6.0382 6.1587 6.1587 6.3668 6.3668 6.7300 6.7300 6.8065 6.8065 6.8885 6.8885 6.9286 6.9286 7.0871 7.0871 7.1072 7.1072 7.2093 7.2093 7.3130 7.3130 7.5670 7.5670 7.9578 7.9578 8.2105 8.2105 8.2547 8.2547 8.2888 8.2888 8.7585 8.7585 8.9559 8.9559 9.0363 9.0363 9.1727 9.1727 9.1973 9.1973 9.2786 9.2786 9.4540 9.4540 10.1704 10.1704 10.3254 10.3254 10.6391 10.6391 10.6559 10.6559 10.8868 10.8868 11.0884 11.0884 11.1950 11.1950 11.6873 11.6873 11.6961 11.6961 11.8409 11.8409 11.8530 11.8530 k = 0.4872 0.3109-0.0000 ( 15286 PWs) bands (ev): -1.9091 -1.9091 -0.7797 -0.7797 -0.2216 -0.2216 -0.1581 -0.1581 0.7216 0.7216 0.8672 0.8672 1.0162 1.0162 1.4939 1.4939 3.7692 3.7692 5.0290 5.0290 5.0882 5.0882 5.2060 5.2060 5.3769 5.3769 5.6887 5.6887 6.0367 6.0367 6.1591 6.1591 6.3688 6.3688 6.7308 6.7308 6.8068 6.8068 6.8877 6.8877 6.9289 6.9289 7.0882 7.0882 7.1068 7.1068 7.2084 7.2084 7.3156 7.3156 7.5651 7.5651 7.9570 7.9570 8.2114 8.2114 8.2499 8.2499 8.2898 8.2898 8.7533 8.7533 8.9573 8.9573 9.0363 9.0363 9.1721 9.1721 9.1985 9.1985 9.2853 9.2853 9.4577 9.4577 10.1722 10.1722 10.3254 10.3254 10.6304 10.6304 10.6443 10.6443 10.8876 10.8876 11.1005 11.1005 11.1968 11.1968 11.6893 11.6893 11.6970 11.6970 11.8404 11.8404 11.8520 11.8520 k = 0.4744 0.3331-0.0000 ( 15282 PWs) bands (ev): -1.9079 -1.9079 -0.7768 -0.7768 -0.2564 -0.2564 -0.1300 -0.1300 0.7261 0.7261 0.8672 0.8672 1.0143 1.0143 1.4938 1.4938 3.7691 3.7691 5.0005 5.0005 5.0962 5.0962 5.2302 5.2302 5.3799 5.3799 5.6844 5.6844 6.0324 6.0324 6.1604 6.1604 6.3748 6.3748 6.7331 6.7331 6.8080 6.8080 6.8858 6.8858 6.9298 6.9298 7.0915 7.0915 7.1054 7.1054 7.2056 7.2056 7.3228 7.3228 7.5599 7.5599 7.9543 7.9543 8.2141 8.2141 8.2357 8.2357 8.2926 8.2926 8.7384 8.7384 8.9616 8.9616 9.0361 9.0361 9.1703 9.1703 9.2017 9.2017 9.3046 9.3046 9.4684 9.4684 10.1775 10.1775 10.3257 10.3257 10.6049 10.6049 10.6134 10.6134 10.8898 10.8898 11.1331 11.1331 11.2023 11.2023 11.6895 11.6895 11.7040 11.7040 11.8386 11.8386 11.8490 11.8491 k = 0.4615 0.3553-0.0000 ( 15292 PWs) bands (ev): -1.9060 -1.9060 -0.7721 -0.7721 -0.2926 -0.2926 -0.1047 -0.1047 0.7332 0.7332 0.8672 0.8672 1.0112 1.0112 1.4938 1.4938 3.7689 3.7689 4.9714 4.9714 5.0965 5.0965 5.2651 5.2651 5.3851 5.3851 5.6774 5.6774 6.0250 6.0250 6.1625 6.1625 6.3840 6.3840 6.7366 6.7366 6.8099 6.8099 6.8836 6.8836 6.9307 6.9307 7.0966 7.0966 7.1035 7.1035 7.2010 7.2010 7.3338 7.3338 7.5529 7.5529 7.9491 7.9491 8.2125 8.2125 8.2192 8.2192 8.2972 8.2972 8.7155 8.7155 8.9691 8.9691 9.0359 9.0359 9.1673 9.1673 9.2066 9.2066 9.3348 9.3348 9.4859 9.4859 10.1859 10.1859 10.3262 10.3262 10.5626 10.5626 10.5724 10.5724 10.8921 10.8921 11.1789 11.1789 11.2122 11.2122 11.6807 11.6807 11.7187 11.7187 11.8345 11.8345 11.8449 11.8450 k = 0.4487 0.3775-0.0000 ( 15286 PWs) bands (ev): -1.9034 -1.9034 -0.7655 -0.7655 -0.3299 -0.3299 -0.0823 -0.0823 0.7428 0.7428 0.8674 0.8674 1.0069 1.0069 1.4938 1.4938 3.7684 3.7684 4.9443 4.9443 5.0912 5.0912 5.3052 5.3052 5.3933 5.3933 5.6677 5.6677 6.0146 6.0146 6.1654 6.1654 6.3959 6.3959 6.7413 6.7413 6.8125 6.8125 6.8819 6.8819 6.9323 6.9323 7.0990 7.0990 7.1048 7.1048 7.1947 7.1947 7.3469 7.3469 7.5466 7.5466 7.9405 7.9405 8.1832 8.1832 8.2250 8.2250 8.3032 8.3032 8.6867 8.6867 8.9800 8.9800 9.0357 9.0357 9.1636 9.1636 9.2121 9.2121 9.3738 9.3738 9.5094 9.5094 10.1964 10.1964 10.3270 10.3270 10.5088 10.5088 10.5246 10.5246 10.8935 10.8935 11.2182 11.2182 11.2403 11.2403 11.6549 11.6549 11.7378 11.7378 11.8268 11.8268 11.8325 11.8336 k = 0.4359 0.3997-0.0000 ( 15272 PWs) bands (ev): -1.9002 -1.9002 -0.7570 -0.7570 -0.3677 -0.3677 -0.0629 -0.0629 0.7544 0.7544 0.8678 0.8678 1.0015 1.0015 1.4937 1.4937 3.7677 3.7677 4.9208 4.9208 5.0821 5.0821 5.3453 5.3453 5.4071 5.4071 5.6558 5.6558 6.0010 6.0010 6.1690 6.1690 6.4093 6.4093 6.7472 6.7472 6.8159 6.8159 6.8805 6.8805 6.9356 6.9356 7.0958 7.0958 7.1105 7.1105 7.1873 7.1873 7.3601 7.3601 7.5438 7.5438 7.9277 7.9277 8.1480 8.1480 8.2330 8.2330 8.3104 8.3104 8.6539 8.6539 8.9941 8.9941 9.0355 9.0355 9.1593 9.1593 9.2175 9.2175 9.4195 9.4195 9.5384 9.5384 10.2079 10.2079 10.3284 10.3284 10.4495 10.4495 10.4707 10.4707 10.8936 10.8936 11.2357 11.2357 11.2982 11.2982 11.6054 11.6054 11.7586 11.7586 11.8067 11.8071 11.8161 11.8164 k = 0.4231 0.4219-0.0000 ( 15282 PWs) bands (ev): -1.8966 -1.8966 -0.7468 -0.7468 -0.4055 -0.4055 -0.0464 -0.0464 0.7673 0.7673 0.8687 0.8687 0.9949 0.9949 1.4936 1.4936 3.7666 3.7666 4.9016 4.9016 5.0702 5.0702 5.3775 5.3775 5.4328 5.4328 5.6417 5.6417 5.9842 5.9842 6.1729 6.1729 6.4232 6.4232 6.7547 6.7547 6.8198 6.8198 6.8794 6.8794 6.9417 6.9417 7.0917 7.0917 7.1134 7.1134 7.1799 7.1799 7.3720 7.3720 7.5478 7.5478 7.9102 7.9102 8.1090 8.1090 8.2427 8.2427 8.3186 8.3186 8.6185 8.6185 9.0111 9.0111 9.0354 9.0354 9.1550 9.1550 9.2217 9.2217 9.4706 9.4706 9.5723 9.5723 10.2178 10.2178 10.3304 10.3304 10.3875 10.3875 10.4134 10.4134 10.8925 10.8925 11.2537 11.2537 11.3608 11.3608 11.5410 11.5410 11.7756 11.7756 11.8008 11.8009 11.8037 11.8037 k = 0.4103 0.4441-0.0000 ( 15262 PWs) bands (ev): -1.8927 -1.8927 -0.7348 -0.7348 -0.4429 -0.4429 -0.0327 -0.0327 0.7806 0.7806 0.8704 0.8704 0.9873 0.9873 1.4936 1.4936 3.7651 3.7651 4.8872 4.8872 5.0562 5.0562 5.3985 5.3985 5.4727 5.4727 5.6259 5.6259 5.9641 5.9641 6.1770 6.1770 6.4363 6.4363 6.7641 6.7641 6.8244 6.8244 6.8786 6.8786 6.9510 6.9510 7.0870 7.0870 7.1098 7.1098 7.1740 7.1740 7.3822 7.3822 7.5604 7.5604 7.8878 7.8878 8.0678 8.0678 8.2541 8.2541 8.3276 8.3276 8.5818 8.5818 9.0306 9.0306 9.0354 9.0354 9.1508 9.1508 9.2240 9.2240 9.5259 9.5259 9.6107 9.6107 10.2214 10.2214 10.3205 10.3205 10.3372 10.3372 10.3580 10.3580 10.8903 10.8903 11.2732 11.2732 11.4231 11.4231 11.4758 11.4758 11.7789 11.7789 11.7889 11.7889 11.8123 11.8125 k = 0.3974 0.4663-0.0000 ( 15278 PWs) bands (ev): -1.8887 -1.8887 -0.7210 -0.7210 -0.4793 -0.4793 -0.0217 -0.0217 0.7935 0.7935 0.8736 0.8736 0.9786 0.9786 1.4935 1.4935 3.7633 3.7633 4.8778 4.8778 5.0406 5.0406 5.4148 5.4148 5.5191 5.5191 5.6090 5.6090 5.9405 5.9405 6.1808 6.1808 6.4477 6.4477 6.7755 6.7755 6.8300 6.8300 6.8789 6.8789 6.9631 6.9631 7.0816 7.0816 7.0987 7.0987 7.1691 7.1691 7.3925 7.3925 7.5812 7.5812 7.8611 7.8611 8.0257 8.0257 8.2671 8.2671 8.3371 8.3371 8.5445 8.5445 9.0355 9.0355 9.0517 9.0517 9.1470 9.1470 9.2237 9.2237 9.5845 9.5845 9.6532 9.6532 10.2069 10.2069 10.2588 10.2588 10.3149 10.3149 10.3409 10.3409 10.8875 10.8875 11.2931 11.2931 11.4078 11.4078 11.4934 11.4934 11.7687 11.7687 11.7819 11.7819 11.8164 11.8164 k = 0.3846 0.4885-0.0000 ( 15280 PWs) bands (ev): -1.8849 -1.8849 -0.7056 -0.7056 -0.5141 -0.5141 -0.0132 -0.0132 0.8046 0.8046 0.8789 0.8789 0.9691 0.9691 1.4934 1.4934 3.7612 3.7612 4.8736 4.8736 5.0242 5.0242 5.4307 5.4307 5.5641 5.5641 5.5943 5.5943 5.9135 5.9135 6.1842 6.1842 6.4568 6.4568 6.7873 6.7873 6.8378 6.8378 6.8812 6.8812 6.9772 6.9772 7.0724 7.0724 7.0847 7.0847 7.1630 7.1630 7.4048 7.4048 7.6084 7.6084 7.8313 7.8313 7.9840 7.9840 8.2816 8.2816 8.3470 8.3470 8.5075 8.5075 9.0359 9.0359 9.0738 9.0738 9.1437 9.1437 9.2204 9.2204 9.6456 9.6456 9.6991 9.6991 10.1638 10.1638 10.1954 10.1954 10.2974 10.2974 10.3466 10.3466 10.8844 10.8844 11.3090 11.3090 11.3580 11.3580 11.5565 11.5565 11.7542 11.7542 11.7768 11.7768 11.8127 11.8127 k = 0.3718 0.5107-0.0000 ( 15288 PWs) bands (ev): -1.8814 -1.8814 -0.6886 -0.6886 -0.5470 -0.5470 -0.0069 -0.0069 0.8129 0.8129 0.8870 0.8870 0.9586 0.9586 1.4934 1.4934 3.7590 3.7590 4.8740 4.8740 5.0077 5.0077 5.4474 5.4474 5.5661 5.5661 5.6217 5.6217 5.8833 5.8833 6.1870 6.1870 6.4631 6.4631 6.7972 6.7972 6.8483 6.8483 6.8873 6.8873 6.9920 6.9920 7.0525 7.0525 7.0768 7.0768 7.1545 7.1545 7.4195 7.4195 7.6394 7.6394 7.8007 7.8007 7.9439 7.9439 8.2974 8.2974 8.3570 8.3570 8.4714 8.4714 9.0364 9.0364 9.0957 9.0957 9.1415 9.1415 9.2139 9.2139 9.7088 9.7088 9.7476 9.7476 10.1045 10.1045 10.1325 10.1325 10.2937 10.2937 10.3525 10.3525 10.8815 10.8815 11.2959 11.2959 11.3449 11.3449 11.6180 11.6180 11.7419 11.7419 11.7699 11.7699 11.8074 11.8074 k = 0.3590 0.5329-0.0000 ( 15300 PWs) bands (ev): -1.8787 -1.8787 -0.6700 -0.6700 -0.5773 -0.5773 -0.0027 -0.0027 0.8181 0.8181 0.8976 0.8976 0.9474 0.9474 1.4933 1.4933 3.7569 3.7569 4.8780 4.8780 4.9923 4.9923 5.4653 5.4653 5.5470 5.5470 5.6676 5.6676 5.8503 5.8503 6.1891 6.1891 6.4669 6.4669 6.8036 6.8036 6.8586 6.8586 6.9007 6.9007 7.0031 7.0031 7.0308 7.0308 7.0711 7.0711 7.1443 7.1443 7.4350 7.4350 7.6714 7.6714 7.7722 7.7722 7.9072 7.9072 8.3140 8.3140 8.3670 8.3670 8.4372 8.4372 9.0369 9.0369 9.1150 9.1150 9.1421 9.1421 9.2039 9.2039 9.7733 9.7733 9.7970 9.7970 10.0403 10.0403 10.0721 10.0721 10.2938 10.2938 10.3570 10.3570 10.8790 10.8790 11.2666 11.2666 11.3563 11.3563 11.6733 11.6733 11.7342 11.7342 11.7613 11.7613 11.8049 11.8049 k = 0.3462 0.5551-0.0000 ( 15280 PWs) bands (ev): -1.8768 -1.8768 -0.6500 -0.6500 -0.6047 -0.6047 -0.0003 -0.0003 0.8207 0.8207 0.9098 0.9098 0.9354 0.9354 1.4933 1.4933 3.7554 3.7554 4.8835 4.8835 4.9802 4.9802 5.4845 5.4845 5.5263 5.5263 5.7096 5.7096 5.8172 5.8172 6.1903 6.1903 6.4686 6.4686 6.8069 6.8069 6.8645 6.8645 6.9231 6.9231 6.9884 6.9884 7.0313 7.0313 7.0648 7.0648 7.1352 7.1352 7.4476 7.4476 7.6995 7.6995 7.7501 7.7501 7.8782 7.8782 8.3301 8.3301 8.3767 8.3767 8.4067 8.4067 9.0374 9.0374 9.1253 9.1253 9.1510 9.1510 9.1910 9.1910 9.8377 9.8377 9.8426 9.8426 9.9755 9.9755 10.0199 10.0199 10.2945 10.2945 10.3594 10.3594 10.8773 10.8773 11.2473 11.2473 11.3654 11.3654 11.7118 11.7118 11.7333 11.7333 11.7520 11.7520 11.8145 11.8145 k = 0.3333 0.5774-0.0000 ( 15312 PWs) bands (ev): -1.8761 -1.8761 -0.6287 -0.6287 -0.6284 -0.6284 0.0004 0.0004 0.8215 0.8215 0.9217 0.9217 0.9239 0.9239 1.4933 1.4933 3.7548 3.7548 4.8864 4.8864 4.9752 4.9752 5.5044 5.5044 5.5059 5.5059 5.7323 5.7323 5.7976 5.7976 6.1907 6.1907 6.4690 6.4690 6.8080 6.8080 6.8662 6.8662 6.9437 6.9437 6.9675 6.9675 7.0384 7.0384 7.0601 7.0601 7.1313 7.1313 7.4526 7.4526 7.7128 7.7128 7.7405 7.7405 7.8661 7.8661 8.3392 8.3392 8.3842 8.3842 8.3884 8.3884 9.0377 9.0377 9.1269 9.1269 9.1620 9.1620 9.1804 9.1804 9.8651 9.8651 9.8882 9.8882 9.9253 9.9253 9.9948 9.9948 10.2949 10.2949 10.3599 10.3599 10.8767 10.8767 11.2408 11.2408 11.3686 11.3686 11.7224 11.7224 11.7379 11.7379 11.7451 11.7451 11.8365 11.8367 k = 0.3333 0.5774-0.0000 ( 15312 PWs) bands (ev): -1.8761 -1.8761 -0.6287 -0.6287 -0.6284 -0.6284 0.0004 0.0004 0.8215 0.8215 0.9217 0.9217 0.9239 0.9239 1.4933 1.4933 3.7548 3.7548 4.8864 4.8864 4.9752 4.9752 5.5044 5.5044 5.5059 5.5059 5.7323 5.7323 5.7976 5.7976 6.1907 6.1907 6.4690 6.4690 6.8080 6.8080 6.8662 6.8662 6.9437 6.9437 6.9675 6.9675 7.0384 7.0384 7.0601 7.0601 7.1313 7.1313 7.4526 7.4526 7.7128 7.7128 7.7405 7.7405 7.8661 7.8661 8.3392 8.3392 8.3842 8.3842 8.3884 8.3884 9.0377 9.0377 9.1269 9.1269 9.1620 9.1620 9.1804 9.1804 9.8651 9.8651 9.8882 9.8882 9.9253 9.9253 9.9948 9.9948 10.2949 10.2949 10.3599 10.3599 10.8767 10.8767 11.2408 11.2408 11.3686 11.3686 11.7224 11.7224 11.7379 11.7379 11.7451 11.7451 11.8365 11.8382 k = 0.3200 0.5543-0.0000 ( 15294 PWs) bands (ev): -1.8769 -1.8769 -0.6494 -0.6494 -0.6050 -0.6050 -0.0003 -0.0003 0.8209 0.8209 0.9091 0.9091 0.9359 0.9359 1.4933 1.4933 3.7556 3.7556 4.8824 4.8824 4.9813 4.9813 5.4830 5.4830 5.5280 5.5280 5.7086 5.7086 5.8177 5.8177 6.1903 6.1903 6.4690 6.4690 6.8068 6.8068 6.8643 6.8643 6.9196 6.9196 6.9916 6.9916 7.0297 7.0297 7.0656 7.0656 7.1362 7.1362 7.4468 7.4468 7.6996 7.6996 7.7498 7.7498 7.8796 7.8796 8.3269 8.3269 8.3906 8.3906 8.3962 8.3962 9.0373 9.0373 9.1264 9.1264 9.1473 9.1473 9.1934 9.1934 9.8356 9.8356 9.8413 9.8413 9.9776 9.9776 10.0212 10.0212 10.2943 10.2943 10.3601 10.3601 10.8774 10.8774 11.2476 11.2476 11.3655 11.3655 11.7166 11.7166 11.7308 11.7308 11.7531 11.7531 11.8003 11.8003 k = 0.3067 0.5312-0.0000 ( 15296 PWs) bands (ev): -1.8795 -1.8795 -0.6656 -0.6656 -0.5801 -0.5801 -0.0024 -0.0024 0.8193 0.8193 0.8949 0.8949 0.9479 0.9479 1.4934 1.4934 3.7583 3.7583 4.8716 4.8716 4.9979 4.9979 5.4608 5.4608 5.5519 5.5519 5.6659 5.6659 5.8490 5.8490 6.1890 6.1890 6.4701 6.4701 6.8030 6.8030 6.8570 6.8570 6.8888 6.8888 7.0017 7.0017 7.0348 7.0348 7.0726 7.0726 7.1504 7.1504 7.4311 7.4311 7.6716 7.6716 7.7730 7.7730 7.9127 7.9127 8.3047 8.3047 8.4046 8.4046 8.4104 8.4104 9.0359 9.0359 9.1221 9.1221 9.1261 9.1261 9.2121 9.2121 9.7691 9.7691 9.7952 9.7952 10.0433 10.0433 10.0744 10.0744 10.2924 10.2924 10.3625 10.3625 10.8798 10.8798 11.2667 11.2667 11.3577 11.3577 11.7041 11.7041 11.7215 11.7215 11.7367 11.7367 11.7769 11.7769 k = 0.2933 0.5081-0.0000 ( 15300 PWs) bands (ev): -1.8841 -1.8841 -0.6771 -0.6771 -0.5540 -0.5540 -0.0056 -0.0056 0.8171 0.8171 0.8803 0.8803 0.9583 0.9583 1.4934 1.4934 3.7634 3.7634 4.8574 4.8574 5.0208 5.0208 5.4387 5.4387 5.5749 5.5749 5.6208 5.6208 5.8766 5.8766 6.1870 6.1870 6.4738 6.4738 6.7949 6.7949 6.8378 6.8378 6.8686 6.8686 6.9797 6.9797 7.0655 7.0655 7.0786 7.0786 7.1704 7.1704 7.4112 7.4112 7.6390 7.6390 7.8068 7.8068 7.9546 7.9546 8.2836 8.2836 8.4130 8.4130 8.4335 8.4335 9.0329 9.0329 9.0942 9.0942 9.1249 9.1249 9.2305 9.2305 9.7029 9.7029 9.7463 9.7463 10.1062 10.1062 10.1345 10.1345 10.2906 10.2906 10.3693 10.3693 10.8839 10.8839 11.2949 11.2949 11.3488 11.3488 11.6787 11.6787 11.6929 11.6929 11.7125 11.7125 11.7875 11.7875 k = 0.2800 0.4850-0.0000 ( 15296 PWs) bands (ev): -1.8907 -1.8907 -0.6836 -0.6836 -0.5270 -0.5270 -0.0098 -0.0098 0.8144 0.8144 0.8654 0.8654 0.9667 0.9667 1.4935 1.4935 3.7712 3.7712 4.8422 4.8422 5.0463 5.0463 5.4167 5.4167 5.5617 5.5617 5.6110 5.6110 5.8979 5.8979 6.1842 6.1842 6.4810 6.4810 6.7783 6.7783 6.8137 6.8137 6.8573 6.8573 6.9538 6.9538 7.0760 7.0760 7.0982 7.0982 7.1919 7.1919 7.3946 7.3946 7.6080 7.6080 7.8479 7.8479 8.0004 8.0004 8.2662 8.2662 8.4208 8.4208 8.4584 8.4584 9.0276 9.0276 9.0632 9.0632 9.1243 9.1243 9.2479 9.2479 9.6382 9.6382 9.6990 9.6990 10.1621 10.1621 10.1959 10.1959 10.2921 10.2921 10.3821 10.3821 10.8900 10.8900 11.3163 11.3163 11.3549 11.3549 11.6232 11.6232 11.6774 11.6774 11.7031 11.7031 11.7952 11.7952 k = 0.2667 0.4619-0.0000 ( 15304 PWs) bands (ev): -1.8994 -1.8994 -0.6851 -0.6851 -0.4991 -0.4991 -0.0148 -0.0148 0.8113 0.8113 0.8503 0.8503 0.9729 0.9729 1.4937 1.4937 3.7821 3.7821 4.8272 4.8272 5.0718 5.0718 5.3948 5.3948 5.5135 5.5135 5.6365 5.6365 5.9129 5.9129 6.1808 6.1808 6.4922 6.4922 6.7499 6.7499 6.7967 6.7967 6.8470 6.8470 6.9268 6.9268 7.0756 7.0756 7.1146 7.1146 7.2100 7.2100 7.3896 7.3896 7.5830 7.5830 7.8935 7.8935 8.0478 8.0478 8.2533 8.2533 8.4281 8.4281 8.4845 8.4845 9.0194 9.0194 9.0304 9.0304 9.1238 9.1238 9.2642 9.2642 9.5758 9.5758 9.6545 9.6545 10.2048 10.2048 10.2556 10.2556 10.3029 10.3029 10.4027 10.4027 10.8980 10.8980 11.3114 11.3114 11.3949 11.3949 11.5689 11.5689 11.6647 11.6647 11.6926 11.6926 11.7978 11.7979 k = 0.2533 0.4388-0.0000 ( 15308 PWs) bands (ev): -1.9101 -1.9101 -0.6816 -0.6816 -0.4705 -0.4705 -0.0204 -0.0204 0.8077 0.8077 0.8350 0.8350 0.9768 0.9768 1.4938 1.4938 3.7962 3.7962 4.8132 4.8132 5.0950 5.0950 5.3724 5.3724 5.4639 5.4639 5.6648 5.6648 5.9234 5.9234 6.1770 6.1770 6.5064 6.5064 6.7162 6.7162 6.7826 6.7826 6.8359 6.8359 6.8996 6.8996 7.0720 7.0720 7.1153 7.1153 7.2189 7.2189 7.4034 7.4034 7.5686 7.5686 7.9416 7.9416 8.0957 8.0957 8.2454 8.2454 8.4351 8.4351 8.5116 8.5116 8.9967 8.9967 9.0074 9.0074 9.1233 9.1233 9.2795 9.2795 9.5163 9.5163 9.6129 9.6129 10.2304 10.2304 10.3100 10.3100 10.3259 10.3259 10.4344 10.4344 10.9081 10.9081 11.3012 11.3012 11.4452 11.4452 11.5215 11.5215 11.6545 11.6545 11.6800 11.6800 11.7967 11.7967 k = 0.2400 0.4157-0.0000 ( 15296 PWs) bands (ev): -1.9226 -1.9226 -0.6733 -0.6733 -0.4414 -0.4414 -0.0265 -0.0265 0.8038 0.8038 0.8197 0.8197 0.9785 0.9785 1.4940 1.4940 3.8138 3.8138 4.8004 4.8004 5.1137 5.1137 5.3479 5.3479 5.4167 5.4167 5.6939 5.6939 5.9320 5.9320 6.1728 6.1728 6.5218 6.5218 6.6816 6.6816 6.7677 6.7677 6.8236 6.8236 6.8736 6.8736 7.0646 7.0646 7.1017 7.1017 7.2149 7.2149 7.4357 7.4357 7.5685 7.5685 7.9907 7.9907 8.1435 8.1435 8.2429 8.2429 8.4417 8.4417 8.5393 8.5393 8.9632 8.9632 8.9907 8.9907 9.1227 9.1227 9.2938 9.2938 9.4605 9.4605 9.5738 9.5738 10.2458 10.2458 10.3534 10.3534 10.3559 10.3559 10.4791 10.4791 10.9203 10.9203 11.2919 11.2919 11.4660 11.4660 11.5162 11.5162 11.6475 11.6475 11.6642 11.6642 11.7933 11.7934 k = 0.2267 0.3926-0.0000 ( 15282 PWs) bands (ev): -1.9367 -1.9367 -0.6606 -0.6606 -0.4119 -0.4119 -0.0329 -0.0329 0.7993 0.7993 0.8045 0.8045 0.9779 0.9779 1.4942 1.4942 3.8348 3.8348 4.7891 4.7891 5.1259 5.1259 5.3176 5.3176 5.3763 5.3763 5.7233 5.7233 5.9422 5.9422 6.1683 6.1683 6.5352 6.5352 6.6479 6.6479 6.7504 6.7504 6.8096 6.8096 6.8510 6.8510 7.0514 7.0514 7.0809 7.0809 7.1979 7.1979 7.4807 7.4807 7.5834 7.5834 8.0399 8.0399 8.1907 8.1907 8.2457 8.2457 8.4483 8.4483 8.5676 8.5676 8.9306 8.9306 8.9686 8.9686 9.1220 9.1220 9.3069 9.3069 9.4095 9.4095 9.5370 9.5370 10.2592 10.2592 10.3784 10.3784 10.3918 10.3918 10.5347 10.5347 10.9347 10.9347 11.2847 11.2847 11.4392 11.4392 11.5691 11.5691 11.6443 11.6443 11.6457 11.6457 11.7899 11.7924 k = 0.2133 0.3695-0.0000 ( 15268 PWs) bands (ev): -1.9520 -1.9520 -0.6438 -0.6438 -0.3822 -0.3822 -0.0395 -0.0395 0.7890 0.7890 0.7946 0.7946 0.9752 0.9752 1.4945 1.4945 3.8593 3.8593 4.7795 4.7795 5.1300 5.1300 5.2789 5.2789 5.3461 5.3461 5.7525 5.7525 5.9568 5.9568 6.1636 6.1636 6.5425 6.5425 6.6167 6.6167 6.7293 6.7293 6.7935 6.7935 6.8349 6.8349 7.0292 7.0292 7.0611 7.0611 7.1711 7.1711 7.5330 7.5330 7.6110 7.6110 8.0882 8.0882 8.2366 8.2366 8.2545 8.2545 8.4548 8.4548 8.5964 8.5964 8.8999 8.8999 8.9406 8.9406 9.1209 9.1209 9.3181 9.3181 9.3647 9.3647 9.5020 9.5020 10.2736 10.2736 10.3982 10.3982 10.4194 10.4194 10.5965 10.5965 10.9514 10.9514 11.2801 11.2801 11.4208 11.4208 11.6053 11.6053 11.6394 11.6394 11.6483 11.6483 11.7863 11.7899 k = 0.2000 0.3464-0.0000 ( 15268 PWs) bands (ev): -1.9683 -1.9683 -0.6234 -0.6234 -0.3526 -0.3526 -0.0461 -0.0461 0.7741 0.7741 0.7890 0.7890 0.9707 0.9707 1.4947 1.4947 3.8870 3.8870 4.7717 4.7717 5.1253 5.1253 5.2348 5.2348 5.3234 5.3234 5.7814 5.7814 5.9780 5.9780 6.1587 6.1587 6.5389 6.5389 6.5905 6.5905 6.7030 6.7030 6.7773 6.7773 6.8261 6.8261 6.9999 6.9999 7.0433 7.0433 7.1391 7.1391 7.5887 7.5887 7.6482 7.6482 8.1350 8.1350 8.2636 8.2636 8.2865 8.2865 8.4613 8.4613 8.6256 8.6256 8.8718 8.8718 8.9069 8.9069 9.1194 9.1194 9.3134 9.3134 9.3402 9.3402 9.4683 9.4683 10.2880 10.2880 10.4102 10.4102 10.4436 10.4436 10.6614 10.6614 10.9704 10.9704 11.2783 11.2783 11.4160 11.4160 11.5869 11.5869 11.6484 11.6484 11.6848 11.6848 11.7793 11.7803 k = 0.1867 0.3233-0.0000 ( 15274 PWs) bands (ev): -1.9852 -1.9852 -0.5998 -0.5998 -0.3232 -0.3232 -0.0526 -0.0526 0.7595 0.7595 0.7826 0.7826 0.9645 0.9645 1.4950 1.4950 3.9178 3.9178 4.7656 4.7656 5.1117 5.1117 5.1900 5.1900 5.3044 5.3044 5.8103 5.8103 6.0062 6.0062 6.1536 6.1536 6.5219 6.5219 6.5703 6.5703 6.6714 6.6714 6.7625 6.7625 6.8227 6.8227 6.9685 6.9685 7.0243 7.0243 7.1063 7.1063 7.6447 7.6447 7.6926 7.6926 8.1798 8.1798 8.2808 8.2808 8.3323 8.3323 8.4680 8.4680 8.6551 8.6551 8.8467 8.8467 8.8684 8.8684 9.1172 9.1172 9.2815 9.2815 9.3471 9.3471 9.4356 9.4356 10.2972 10.2972 10.4160 10.4160 10.4682 10.4682 10.7277 10.7277 10.9919 10.9919 11.2795 11.2795 11.4256 11.4256 11.5600 11.5600 11.6577 11.6577 11.7150 11.7150 11.7730 11.7730 k = 0.1733 0.3002-0.0000 ( 15276 PWs) bands (ev): -2.0024 -2.0024 -0.5738 -0.5738 -0.2942 -0.2942 -0.0588 -0.0588 0.7451 0.7451 0.7753 0.7753 0.9572 0.9572 1.4953 1.4953 3.9511 3.9511 4.7613 4.7613 5.0895 5.0895 5.1471 5.1471 5.2874 5.2874 5.8392 5.8392 6.0404 6.0404 6.1486 6.1486 6.4971 6.4971 6.5514 6.5514 6.6361 6.6361 6.7486 6.7486 6.8205 6.8205 6.9390 6.9390 7.0029 7.0029 7.0765 7.0765 7.6982 7.6982 7.7429 7.7429 8.2225 8.2225 8.3009 8.3009 8.3787 8.3787 8.4748 8.4748 8.6848 8.6848 8.8197 8.8197 8.8317 8.8317 9.1142 9.1142 9.2501 9.2501 9.3570 9.3570 9.4035 9.4035 10.2926 10.2926 10.4246 10.4246 10.4941 10.4941 10.7944 10.7944 11.0162 11.0162 11.2836 11.2836 11.4481 11.4481 11.5329 11.5329 11.6710 11.6710 11.7292 11.7292 11.7673 11.7673 k = 0.1600 0.2771-0.0000 ( 15280 PWs) bands (ev): -2.0195 -2.0195 -0.5457 -0.5457 -0.2659 -0.2659 -0.0645 -0.0645 0.7313 0.7313 0.7668 0.7668 0.9490 0.9490 1.4957 1.4957 3.9868 3.9868 4.7586 4.7586 5.0602 5.0602 5.1074 5.1074 5.2720 5.2720 5.8680 5.8680 6.0781 6.0781 6.1450 6.1450 6.4705 6.4705 6.5295 6.5295 6.5990 6.5990 6.7343 6.7343 6.8127 6.8127 6.9166 6.9166 6.9795 6.9795 7.0516 7.0516 7.7473 7.7473 7.7976 7.7976 8.2633 8.2633 8.3236 8.3236 8.4250 8.4250 8.4818 8.4818 8.7144 8.7144 8.7766 8.7766 8.8128 8.8128 9.1103 9.1103 9.2216 9.2216 9.3654 9.3654 9.3732 9.3732 10.2690 10.2690 10.4422 10.4422 10.5208 10.5208 10.8611 10.8611 11.0436 11.0436 11.2906 11.2906 11.4813 11.4813 11.5075 11.5075 11.6881 11.6881 11.7350 11.7350 11.7613 11.7613 k = 0.1467 0.2540-0.0000 ( 15277 PWs) bands (ev): -2.0363 -2.0363 -0.5164 -0.5164 -0.2386 -0.2386 -0.0696 -0.0696 0.7179 0.7179 0.7571 0.7571 0.9405 0.9405 1.4960 1.4960 4.0240 4.0240 4.7574 4.7574 5.0260 5.0260 5.0707 5.0707 5.2581 5.2581 5.8962 5.8962 6.1095 6.1095 6.1511 6.1511 6.4447 6.4447 6.5044 6.5044 6.5618 6.5618 6.7178 6.7178 6.7943 6.7943 6.9054 6.9054 6.9561 6.9561 7.0317 7.0317 7.7919 7.7919 7.8543 7.8543 8.3029 8.3029 8.3482 8.3482 8.4701 8.4701 8.4901 8.4901 8.7271 8.7271 8.7458 8.7458 8.8016 8.8016 9.1051 9.1051 9.1958 9.1958 9.3397 9.3397 9.3765 9.3765 10.2300 10.2300 10.4669 10.4669 10.5482 10.5482 10.9271 10.9271 11.0744 11.0744 11.3002 11.3002 11.4847 11.4847 11.5228 11.5228 11.7086 11.7086 11.7378 11.7378 11.7553 11.7553 k = 0.1333 0.2309-0.0000 ( 15257 PWs) bands (ev): -2.0524 -2.0524 -0.4864 -0.4864 -0.2123 -0.2123 -0.0740 -0.0740 0.7052 0.7052 0.7461 0.7461 0.9319 0.9319 1.4963 1.4963 4.0624 4.0624 4.7575 4.7575 4.9903 4.9903 5.0363 5.0363 5.2455 5.2455 5.9230 5.9230 6.1153 6.1153 6.1846 6.1846 6.4209 6.4209 6.4770 6.4770 6.5253 6.5253 6.6972 6.6972 6.7696 6.7696 6.9007 6.9007 6.9355 6.9355 7.0160 7.0160 7.8323 7.8323 7.9106 7.9106 8.3420 8.3420 8.3739 8.3739 8.4931 8.4931 8.5198 8.5198 8.6808 8.6808 8.7696 8.7696 8.7994 8.7994 9.0985 9.0985 9.1720 9.1720 9.3083 9.3083 9.3850 9.3850 10.1812 10.1812 10.4943 10.4943 10.5755 10.5755 10.9920 10.9920 11.1086 11.1086 11.3124 11.3124 11.4666 11.4666 11.5695 11.5695 11.7311 11.7311 11.7404 11.7404 11.7497 11.7497 k = 0.1200 0.2078-0.0000 ( 15257 PWs) bands (ev): -2.0677 -2.0677 -0.4565 -0.4565 -0.1875 -0.1875 -0.0774 -0.0774 0.6932 0.6932 0.7338 0.7338 0.9238 0.9238 1.4966 1.4966 4.1010 4.1010 4.7587 4.7587 4.9553 4.9553 5.0038 5.0038 5.2342 5.2342 5.9471 5.9471 6.1102 6.1102 6.2292 6.2292 6.4003 6.4003 6.4491 6.4491 6.4899 6.4899 6.6711 6.6711 6.7468 6.7468 6.8933 6.8933 6.9211 6.9211 7.0039 7.0039 7.8683 7.8683 7.9651 7.9651 8.3813 8.3813 8.3997 8.3997 8.5003 8.5003 8.5641 8.5641 8.6348 8.6348 8.7787 8.7787 8.8173 8.8173 9.0900 9.0900 9.1500 9.1500 9.2771 9.2771 9.3928 9.3928 10.1267 10.1267 10.5214 10.5214 10.6022 10.6022 11.0548 11.0548 11.1463 11.1463 11.3268 11.3268 11.4539 11.4539 11.6193 11.6193 11.7387 11.7387 11.7460 11.7460 11.7593 11.7593 k = 0.1067 0.1848-0.0000 ( 15253 PWs) bands (ev): -2.0820 -2.0820 -0.4274 -0.4274 -0.1644 -0.1644 -0.0797 -0.0797 0.6821 0.6821 0.7202 0.7202 0.9163 0.9163 1.4969 1.4969 4.1391 4.1391 4.7605 4.7605 4.9225 4.9225 4.9735 4.9735 5.2242 5.2242 5.9669 5.9669 6.1041 6.1041 6.2731 6.2731 6.3842 6.3842 6.4226 6.4226 6.4564 6.4564 6.6412 6.6412 6.7288 6.7288 6.8800 6.8800 6.9127 6.9127 6.9951 6.9951 7.8998 7.8998 8.0166 8.0166 8.4200 8.4200 8.4257 8.4257 8.5055 8.5055 8.5922 8.5922 8.6079 8.6079 8.7804 8.7804 8.8463 8.8463 9.0795 9.0795 9.1297 9.1297 9.2462 9.2462 9.3998 9.3998 10.0693 10.0693 10.5468 10.5468 10.6276 10.6276 11.1136 11.1136 11.1872 11.1872 11.3431 11.3431 11.4482 11.4482 11.6701 11.6701 11.7362 11.7362 11.7481 11.7481 11.7864 11.7864 k = 0.0933 0.1617-0.0000 ( 15257 PWs) bands (ev): -2.0949 -2.0949 -0.4000 -0.4000 -0.1432 -0.1432 -0.0808 -0.0808 0.6719 0.6719 0.7059 0.7059 0.9097 0.9097 1.4972 1.4972 4.1758 4.1758 4.7627 4.7627 4.8928 4.8928 4.9462 4.9462 5.2154 5.2154 5.9800 5.9800 6.1000 6.1000 6.3074 6.3074 6.3726 6.3726 6.4005 6.4005 6.4296 6.4296 6.6113 6.6113 6.7146 6.7146 6.8651 6.8651 6.9048 6.9048 6.9886 6.9886 7.9267 7.9267 8.0641 8.0641 8.4469 8.4469 8.4613 8.4613 8.5061 8.5061 8.5585 8.5585 8.6496 8.6496 8.7833 8.7833 8.8774 8.8774 9.0663 9.0663 9.1110 9.1110 9.2160 9.2160 9.4061 9.4061 10.0111 10.0111 10.5696 10.5696 10.6508 10.6508 11.1655 11.1655 11.2316 11.2316 11.3606 11.3606 11.4511 11.4511 11.7186 11.7186 11.7347 11.7347 11.7545 11.7545 11.8146 11.8146 k = 0.0800 0.1386-0.0000 ( 15277 PWs) bands (ev): -2.1065 -2.1065 -0.3749 -0.3749 -0.1242 -0.1242 -0.0805 -0.0805 0.6627 0.6627 0.6912 0.6912 0.9040 0.9040 1.4975 1.4975 4.2101 4.2101 4.7646 4.7646 4.8668 4.8668 4.9224 4.9224 5.2077 5.2077 5.9848 5.9848 6.1002 6.1002 6.3211 6.3211 6.3568 6.3568 6.3791 6.3791 6.4332 6.4332 6.5843 6.5843 6.7029 6.7029 6.8511 6.8511 6.8950 6.8950 6.9831 6.9831 7.9495 7.9495 8.1069 8.1069 8.4663 8.4663 8.4848 8.4848 8.5067 8.5067 8.5461 8.5461 8.6887 8.6887 8.7886 8.7886 8.9084 8.9084 9.0503 9.0503 9.0940 9.0940 9.1873 9.1873 9.4115 9.4115 9.9541 9.9541 10.5893 10.5893 10.6712 10.6712 11.2061 11.2061 11.2798 11.2798 11.3788 11.3788 11.4636 11.4636 11.7293 11.7293 11.7639 11.7639 11.7722 11.7722 11.8426 11.8426 k = 0.0667 0.1155-0.0000 ( 15301 PWs) bands (ev): -2.1165 -2.1165 -0.3530 -0.3530 -0.1076 -0.1076 -0.0790 -0.0790 0.6546 0.6546 0.6768 0.6768 0.8994 0.8994 1.4977 1.4977 4.2409 4.2409 4.7658 4.7658 4.8451 4.8451 4.9028 4.9028 5.2013 5.2013 5.9816 5.9816 6.1048 6.1048 6.3188 6.3188 6.3362 6.3362 6.3560 6.3560 6.4660 6.4660 6.5616 6.5616 6.6931 6.6931 6.8388 6.8388 6.8834 6.8834 6.9780 6.9780 7.9683 7.9683 8.1443 8.1443 8.4567 8.4567 8.4877 8.4877 8.5329 8.5329 8.5579 8.5579 8.7241 8.7241 8.7970 8.7970 8.9376 8.9376 9.0315 9.0315 9.0790 9.0790 9.1607 9.1607 9.4161 9.4161 9.9002 9.9002 10.6059 10.6059 10.6886 10.6886 11.2339 11.2339 11.3302 11.3302 11.3975 11.3975 11.4844 11.4844 11.7308 11.7308 11.7807 11.7807 11.8166 11.8166 11.8693 11.8693 k = 0.0533 0.0924-0.0000 ( 15295 PWs) bands (ev): -2.1248 -2.1248 -0.3347 -0.3347 -0.0936 -0.0936 -0.0765 -0.0765 0.6478 0.6478 0.6635 0.6635 0.8956 0.8956 1.4979 1.4979 4.2674 4.2674 4.7657 4.7657 4.8281 4.8281 4.8875 4.8875 5.1960 5.1960 5.9734 5.9734 6.1118 6.1118 6.3023 6.3023 6.3248 6.3248 6.3377 6.3377 6.5048 6.5048 6.5442 6.5442 6.6850 6.6850 6.8281 6.8281 6.8706 6.8706 6.9727 6.9727 7.9834 7.9834 8.1758 8.1758 8.4311 8.4311 8.5006 8.5006 8.5450 8.5450 8.5885 8.5885 8.7551 8.7551 8.8091 8.8091 8.9606 8.9606 9.0131 9.0131 9.0663 9.0663 9.1371 9.1371 9.4198 9.4198 9.8512 9.8512 10.6194 10.6194 10.7028 10.7028 11.2512 11.2512 11.3787 11.3787 11.4161 11.4161 11.5095 11.5095 11.7369 11.7369 11.8034 11.8034 11.8573 11.8573 11.8935 11.8936 k = 0.0400 0.0693-0.0000 ( 15293 PWs) bands (ev): -2.1313 -2.1313 -0.3204 -0.3204 -0.0825 -0.0825 -0.0735 -0.0735 0.6424 0.6424 0.6521 0.6521 0.8928 0.8928 1.4981 1.4981 4.2888 4.2888 4.7644 4.7644 4.8159 4.8159 4.8766 4.8766 5.1918 5.1918 5.9637 5.9637 6.1187 6.1187 6.2808 6.2808 6.3202 6.3202 6.3252 6.3252 6.5251 6.5251 6.5482 6.5482 6.6785 6.6785 6.8188 6.8188 6.8575 6.8575 6.9678 6.9678 7.9951 7.9951 8.2008 8.2008 8.4090 8.4090 8.5105 8.5105 8.5530 8.5530 8.6193 8.6193 8.7824 8.7824 8.8243 8.8243 8.9597 8.9597 9.0115 9.0115 9.0560 9.0560 9.1171 9.1171 9.4227 9.4227 9.8093 9.8093 10.6299 10.6299 10.7137 10.7137 11.2613 11.2613 11.4192 11.4192 11.4349 11.4349 11.5342 11.5342 11.7497 11.7497 11.8328 11.8328 11.8918 11.8918 11.9143 11.9143 k = 0.0267 0.0462-0.0000 ( 15309 PWs) bands (ev): -2.1361 -2.1361 -0.3103 -0.3103 -0.0745 -0.0745 -0.0706 -0.0706 0.6382 0.6382 0.6434 0.6434 0.8908 0.8908 1.4982 1.4982 4.3045 4.3045 4.7621 4.7621 4.8082 4.8082 4.8694 4.8694 5.1888 5.1888 5.9550 5.9550 6.1243 6.1243 6.2633 6.2633 6.3131 6.3131 6.3213 6.3213 6.5175 6.5175 6.5787 6.5787 6.6737 6.6737 6.8107 6.8107 6.8457 6.8457 6.9636 6.9636 8.0034 8.0034 8.2190 8.2190 8.3925 8.3925 8.5171 8.5171 8.5592 8.5592 8.6434 8.6434 8.8090 8.8090 8.8397 8.8397 8.9346 8.9346 9.0259 9.0259 9.0484 9.0484 9.1016 9.1016 9.4248 9.4248 9.7769 9.7769 10.6373 10.6373 10.7215 10.7215 11.2669 11.2669 11.4416 11.4416 11.4585 11.4585 11.5542 11.5542 11.7705 11.7705 11.8646 11.8646 11.9182 11.9184 11.9297 11.9304 k = 0.0133 0.0231-0.0000 ( 15309 PWs) bands (ev): -2.1389 -2.1389 -0.3042 -0.3042 -0.0697 -0.0697 -0.0684 -0.0684 0.6353 0.6353 0.6383 0.6383 0.8897 0.8897 1.4982 1.4982 4.3140 4.3140 4.7601 4.7601 4.8041 4.8041 4.8655 4.8655 5.1870 5.1870 5.9491 5.9491 6.1278 6.1278 6.2523 6.2523 6.3076 6.3076 6.3205 6.3205 6.5120 6.5120 6.6012 6.6012 6.6708 6.6708 6.8041 6.8041 6.8377 6.8377 6.9609 6.9609 8.0084 8.0084 8.2301 8.2301 8.3823 8.3823 8.5209 8.5209 8.5632 8.5632 8.6582 8.6582 8.8379 8.8379 8.8511 8.8511 8.9032 8.9032 9.0376 9.0376 9.0440 9.0440 9.0914 9.0914 9.4260 9.4260 9.7562 9.7562 10.6417 10.6417 10.7261 10.7261 11.2698 11.2698 11.4517 11.4517 11.4770 11.4770 11.5670 11.5670 11.7944 11.7944 11.8873 11.8873 11.9341 11.9342 11.9413 11.9414 k = 0.0000 0.0000 0.0000 ( 15313 PWs) bands (ev): -2.1399 -2.1399 -0.3022 -0.3022 -0.0683 -0.0683 -0.0674 -0.0674 0.6341 0.6341 0.6368 0.6368 0.8893 0.8893 1.4983 1.4983 4.3172 4.3172 4.7593 4.7593 4.8029 4.8029 4.8643 4.8643 5.1864 5.1864 5.9470 5.9470 6.1290 6.1290 6.2485 6.2485 6.3058 6.3058 6.3203 6.3203 6.5101 6.5101 6.6094 6.6094 6.6698 6.6698 6.8014 6.8014 6.8349 6.8349 6.9600 6.9600 8.0101 8.0101 8.2338 8.2338 8.3789 8.3789 8.5221 8.5221 8.5646 8.5646 8.6632 8.6632 8.8553 8.8553 8.8652 8.8652 8.8746 8.8746 9.0410 9.0410 9.0434 9.0434 9.0879 9.0879 9.4264 9.4264 9.7490 9.7490 10.6432 10.6432 10.7277 10.7277 11.2706 11.2706 11.4550 11.4550 11.4833 11.4833 11.5714 11.5714 11.8061 11.8061 11.9062 11.9062 11.9251 11.9300 11.9392 11.9411 k = 0.0000 0.0000 0.0000 ( 15313 PWs) bands (ev): -2.1399 -2.1399 -0.3022 -0.3022 -0.0683 -0.0683 -0.0674 -0.0674 0.6341 0.6341 0.6368 0.6368 0.8893 0.8893 1.4983 1.4983 4.3172 4.3172 4.7593 4.7593 4.8029 4.8029 4.8643 4.8643 5.1864 5.1864 5.9470 5.9470 6.1290 6.1290 6.2485 6.2485 6.3058 6.3058 6.3203 6.3203 6.5101 6.5101 6.6094 6.6094 6.6698 6.6698 6.8014 6.8014 6.8349 6.8349 6.9600 6.9600 8.0101 8.0101 8.2338 8.2338 8.3789 8.3789 8.5221 8.5221 8.5646 8.5646 8.6632 8.6632 8.8553 8.8553 8.8652 8.8652 8.8746 8.8746 9.0410 9.0410 9.0434 9.0434 9.0879 9.0879 9.4264 9.4264 9.7490 9.7490 10.6432 10.6432 10.7277 10.7277 11.2706 11.2706 11.4550 11.4550 11.4833 11.4833 11.5714 11.5714 11.8061 11.8061 11.9062 11.9063 11.9244 11.9308 11.9392 11.9419 k = 0.0000 0.0000 0.0269 ( 15313 PWs) bands (ev): -2.1383 -2.1383 -0.3011 -0.3011 -0.0674 -0.0674 -0.0665 -0.0665 0.6341 0.6341 0.6369 0.6369 0.8835 0.8835 1.4957 1.4957 4.3247 4.3247 4.7610 4.7610 4.7983 4.7983 4.8596 4.8596 5.1893 5.1893 5.9465 5.9465 6.1352 6.1352 6.2390 6.2390 6.3053 6.3053 6.3224 6.3224 6.5089 6.5089 6.6111 6.6111 6.6787 6.6787 6.8042 6.8042 6.8342 6.8342 6.9612 6.9612 8.0114 8.0114 8.1865 8.1865 8.4258 8.4258 8.5203 8.5203 8.5629 8.5629 8.6650 8.6650 8.8568 8.8568 8.8625 8.8625 8.8761 8.8761 9.0378 9.0378 9.0442 9.0442 9.0939 9.0939 9.4286 9.4286 9.7374 9.7374 10.6423 10.6423 10.7269 10.7269 11.2775 11.2775 11.4542 11.4542 11.4825 11.4825 11.5688 11.5688 11.8056 11.8056 11.9036 11.9036 11.9179 11.9180 11.9343 11.9343 k = 0.0000 0.0000 0.0539 ( 15313 PWs) bands (ev): -2.1337 -2.1337 -0.2978 -0.2978 -0.0648 -0.0648 -0.0639 -0.0639 0.6343 0.6343 0.6371 0.6371 0.8664 0.8664 1.4880 1.4880 4.3471 4.3471 4.7662 4.7662 4.7849 4.7849 4.8459 4.8459 5.1979 5.1979 5.9440 5.9440 6.1533 6.1533 6.2115 6.2115 6.3049 6.3049 6.3296 6.3296 6.5059 6.5059 6.6159 6.6159 6.7031 6.7031 6.8118 6.8118 6.8323 6.8323 6.9650 6.9650 8.0153 8.0153 8.1020 8.1020 8.5089 8.5089 8.5151 8.5151 8.5579 8.5579 8.6705 8.6705 8.8550 8.8550 8.8611 8.8611 8.8806 8.8806 9.0257 9.0257 9.0530 9.0530 9.1073 9.1073 9.4350 9.4350 9.7036 9.7036 10.6396 10.6396 10.7247 10.7247 11.2970 11.2970 11.4517 11.4517 11.4802 11.4802 11.5614 11.5614 11.8043 11.8043 11.8961 11.8961 11.9071 11.9071 11.9237 11.9237 k = 0.0000 0.0000 0.0808 ( 15229 PWs) bands (ev): -2.1260 -2.1260 -0.2923 -0.2923 -0.0603 -0.0603 -0.0594 -0.0594 0.6346 0.6346 0.6374 0.6374 0.8384 0.8384 1.4754 1.4754 4.3836 4.3836 4.7636 4.7636 4.7748 4.7748 4.8243 4.8243 5.2126 5.2126 5.9370 5.9370 6.1696 6.1696 6.1823 6.1823 6.3060 6.3060 6.3435 6.3435 6.5021 6.5021 6.6240 6.6240 6.7383 6.7383 6.8221 6.8221 6.8292 6.8292 6.9724 6.9724 8.0107 8.0107 8.0215 8.0215 8.5068 8.5068 8.5498 8.5498 8.5971 8.5971 8.6801 8.6801 8.8439 8.8439 8.8681 8.8681 8.8880 8.8880 9.0116 9.0116 9.0663 9.0663 9.1233 9.1233 9.4456 9.4456 9.6504 9.6505 10.6355 10.6355 10.7210 10.7210 11.3262 11.3262 11.4476 11.4476 11.4772 11.4772 11.5502 11.5502 11.8021 11.8021 11.8838 11.8838 11.8946 11.8946 11.9111 11.9111 k = 0.0000 0.0000 0.1078 ( 15271 PWs) bands (ev): -2.1152 -2.1152 -0.2845 -0.2845 -0.0541 -0.0541 -0.0532 -0.0532 0.6349 0.6349 0.6377 0.6377 0.8001 0.8001 1.4582 1.4582 4.4331 4.4331 4.7358 4.7358 4.7868 4.7868 4.7960 4.7960 5.2333 5.2333 5.9227 5.9227 6.1177 6.1177 6.2208 6.2208 6.3083 6.3083 6.3657 6.3657 6.4992 6.4992 6.6354 6.6354 6.7802 6.7802 6.8248 6.8248 6.8324 6.8324 6.9845 6.9845 7.9174 7.9174 8.0299 8.0299 8.4956 8.4956 8.5391 8.5391 8.6718 8.6718 8.7059 8.7059 8.8308 8.8308 8.8777 8.8777 8.8980 8.8980 8.9970 8.9970 9.0825 9.0825 9.1404 9.1404 9.4604 9.4604 9.5820 9.5820 10.6301 10.6301 10.7160 10.7160 11.3604 11.3604 11.4421 11.4421 11.4748 11.4748 11.5363 11.5363 11.7991 11.7991 11.8673 11.8673 11.8815 11.8815 11.8976 11.8976 k = 0.0000 0.0000 0.1347 ( 15271 PWs) bands (ev): -2.1013 -2.1013 -0.2746 -0.2746 -0.0461 -0.0461 -0.0453 -0.0453 0.6351 0.6351 0.6381 0.6381 0.7522 0.7522 1.4367 1.4367 4.4940 4.4940 4.7030 4.7030 4.7627 4.7627 4.8022 4.8022 5.2606 5.2606 5.8993 5.8993 6.0589 6.0589 6.2669 6.2669 6.3117 6.3117 6.3964 6.3964 6.4986 6.4986 6.6501 6.6501 6.8195 6.8195 6.8258 6.8258 6.8402 6.8402 7.0020 7.0020 7.8236 7.8236 8.0401 8.0401 8.4822 8.4822 8.5262 8.5262 8.6921 8.6921 8.7855 8.7855 8.8175 8.8175 8.8896 8.8896 8.9105 8.9105 8.9822 8.9822 9.1007 9.1007 9.1581 9.1581 9.4793 9.4793 9.5030 9.5030 10.6238 10.6238 10.7099 10.7099 11.3926 11.3926 11.4354 11.4354 11.4765 11.4765 11.5212 11.5212 11.7956 11.7956 11.8473 11.8473 11.8682 11.8682 11.8839 11.8839 k = 0.0000 0.0000 0.1617 ( 15223 PWs) bands (ev): -2.0843 -2.0843 -0.2624 -0.2624 -0.0365 -0.0365 -0.0357 -0.0357 0.6353 0.6353 0.6383 0.6383 0.6959 0.6959 1.4114 1.4114 4.5648 4.5648 4.6668 4.6668 4.7260 4.7260 4.8210 4.8210 5.2949 5.2949 5.8663 5.8663 5.9953 5.9953 6.3160 6.3160 6.3186 6.3186 6.4322 6.4322 6.5040 6.5040 6.6683 6.6683 6.8133 6.8133 6.8447 6.8447 6.8736 6.8736 7.0252 7.0252 7.7299 7.7299 8.0516 8.0516 8.4670 8.4670 8.5116 8.5116 8.6991 8.6991 8.8037 8.8037 8.8751 8.8751 8.9038 8.9038 8.9252 8.9252 8.9674 8.9674 9.1199 9.1199 9.1759 9.1759 9.4190 9.4190 9.5020 9.5020 10.6169 10.6169 10.7029 10.7029 11.4128 11.4128 11.4276 11.4276 11.4880 11.4880 11.5060 11.5060 11.7916 11.7916 11.8251 11.8251 11.8552 11.8552 11.8702 11.8702 k = 0.0000 0.0000 0.1886 ( 15259 PWs) bands (ev): -2.0643 -2.0643 -0.2481 -0.2481 -0.0252 -0.0252 -0.0245 -0.0245 0.6322 0.6322 0.6353 0.6353 0.6384 0.6384 1.3824 1.3824 4.6285 4.6285 4.6433 4.6433 4.6873 4.6873 4.8430 4.8430 5.3367 5.3367 5.8247 5.8247 5.9282 5.9282 6.3213 6.3213 6.3740 6.3740 6.4613 6.4613 6.5257 6.5257 6.6900 6.6900 6.8067 6.8067 6.8457 6.8457 6.9226 6.9226 7.0530 7.0530 7.6366 7.6366 8.0640 8.0640 8.4505 8.4505 8.4959 8.4959 8.6965 8.6965 8.7929 8.7929 8.9199 8.9199 8.9418 8.9418 8.9525 8.9525 8.9635 8.9635 9.1393 9.1393 9.1936 9.1936 9.3369 9.3369 9.5285 9.5285 10.6097 10.6097 10.6953 10.6953 11.4176 11.4176 11.4193 11.4193 11.4917 11.4917 11.5074 11.5074 11.7866 11.7866 11.8039 11.8039 11.8427 11.8427 11.8568 11.8568 k = 0.0000 0.0000 0.2156 ( 15265 PWs) bands (ev): -2.0413 -2.0413 -0.2317 -0.2317 -0.0122 -0.0122 -0.0116 -0.0116 0.5620 0.5620 0.6349 0.6349 0.6381 0.6381 1.3502 1.3502 4.5894 4.5894 4.6478 4.6478 4.7275 4.7275 4.8683 4.8683 5.3868 5.3868 5.7757 5.7757 5.8586 5.8586 6.3274 6.3274 6.4308 6.4308 6.4746 6.4746 6.5709 6.5709 6.7145 6.7145 6.8008 6.8008 6.8441 6.8441 6.9722 6.9722 7.0845 7.0845 7.5440 7.5440 8.0766 8.0766 8.4335 8.4335 8.4795 8.4795 8.6801 8.6801 8.7821 8.7821 8.9372 8.9372 8.9377 8.9377 8.9604 8.9604 9.0507 9.0507 9.1583 9.1583 9.2111 9.2111 9.2658 9.2658 9.5584 9.5584 10.6025 10.6025 10.6873 10.6873 11.4105 11.4105 11.4131 11.4131 11.4792 11.4792 11.5210 11.5210 11.7782 11.7782 11.7906 11.7906 11.8311 11.8311 11.8441 11.8441 k = 0.0000 0.0000 0.2425 ( 15295 PWs) bands (ev): -2.0152 -2.0152 -0.2131 -0.2131 0.0023 0.0023 0.0029 0.0029 0.4865 0.4865 0.6341 0.6341 0.6374 0.6374 1.3150 1.3150 4.5507 4.5507 4.6088 4.6088 4.8150 4.8150 4.8968 4.8968 5.4457 5.4457 5.7207 5.7207 5.7875 5.7875 6.3343 6.3343 6.4811 6.4811 6.4869 6.4869 6.6286 6.6286 6.7386 6.7386 6.7999 6.7999 6.8406 6.8406 7.0220 7.0220 7.1185 7.1185 7.4525 7.4525 8.0888 8.0888 8.4164 8.4164 8.4628 8.4628 8.6464 8.6464 8.7665 8.7665 8.9216 8.9216 8.9572 8.9572 8.9804 8.9804 9.1359 9.1359 9.1745 9.1745 9.2180 9.2180 9.2281 9.2281 9.5916 9.5916 10.5958 10.5958 10.6795 10.6795 11.4018 11.4018 11.4018 11.4018 11.4689 11.4689 11.5182 11.5182 11.7709 11.7709 11.7860 11.7860 11.8205 11.8205 11.8321 11.8321 k = 0.0000 0.0000 0.2695 ( 15295 PWs) bands (ev): -1.9862 -1.9862 -0.1924 -0.1924 0.0183 0.0183 0.0188 0.0188 0.4066 0.4066 0.6327 0.6327 0.6361 0.6361 1.2771 1.2771 4.5133 4.5133 4.5711 4.5711 4.9036 4.9036 4.9286 4.9286 5.5133 5.5133 5.6608 5.6608 5.7167 5.7167 6.3419 6.3419 6.4862 6.4862 6.5397 6.5397 6.6909 6.6909 6.7513 6.7513 6.8157 6.8157 6.8365 6.8365 7.0718 7.0718 7.1542 7.1542 7.3626 7.3626 8.1000 8.1000 8.3998 8.3998 8.4464 8.4464 8.5914 8.5914 8.7441 8.7441 8.9054 8.9054 8.9780 8.9780 9.0019 9.0019 9.1775 9.1775 9.2087 9.2087 9.2205 9.2205 9.2445 9.2445 9.6276 9.6276 10.5898 10.5898 10.6723 10.6723 11.3796 11.3796 11.3936 11.3936 11.4613 11.4613 11.5009 11.5009 11.7696 11.7696 11.7844 11.7844 11.8110 11.8110 11.8206 11.8206 k = 0.0000 0.0000 0.2964 ( 15253 PWs) bands (ev): -1.9541 -1.9541 -0.1696 -0.1696 0.0358 0.0358 0.0362 0.0362 0.3233 0.3233 0.6306 0.6306 0.6341 0.6341 1.2367 1.2367 4.4780 4.4780 4.5356 4.5356 4.9628 4.9628 4.9919 4.9919 5.5788 5.5788 5.5971 5.5971 5.6584 5.6584 6.3504 6.3504 6.4914 6.4914 6.5871 6.5871 6.7491 6.7491 6.7517 6.7517 6.8357 6.8357 6.8522 6.8522 7.1216 7.1216 7.1911 7.1911 7.2750 7.2750 8.1096 8.1096 8.3843 8.3843 8.4306 8.4306 8.5139 8.5139 8.7183 8.7183 8.8884 8.8884 9.0000 9.0000 9.0246 9.0246 9.1838 9.1838 9.2225 9.2225 9.2602 9.2602 9.3013 9.3013 9.6661 9.6661 10.5851 10.5851 10.6660 10.6660 11.3381 11.3381 11.3862 11.3862 11.4568 11.4568 11.4822 11.4822 11.7700 11.7700 11.7830 11.7830 11.8028 11.8028 11.8096 11.8096 k = 0.0000 0.0000 0.3234 ( 15235 PWs) bands (ev): -1.9190 -1.9190 -0.1448 -0.1448 0.0546 0.0546 0.0549 0.0549 0.2372 0.2372 0.6276 0.6276 0.6312 0.6312 1.1940 1.1940 4.4456 4.4456 4.5029 4.5029 5.0005 5.0005 5.0766 5.0766 5.5305 5.5305 5.5536 5.5536 5.7025 5.7025 6.3597 6.3597 6.4970 6.4970 6.6266 6.6266 6.7417 6.7417 6.7904 6.7904 6.8572 6.8572 6.8998 6.8998 7.1710 7.1710 7.1911 7.1911 7.2285 7.2285 8.1168 8.1168 8.3703 8.3703 8.4158 8.4158 8.4180 8.4180 8.6919 8.6919 8.8705 8.8705 9.0230 9.0230 9.0483 9.0483 9.2044 9.2044 9.2395 9.2395 9.2751 9.2751 9.3798 9.3798 9.7065 9.7065 10.5820 10.5820 10.6612 10.6612 11.2747 11.2747 11.3802 11.3802 11.4555 11.4555 11.4718 11.4718 11.7702 11.7702 11.7785 11.7785 11.7957 11.7957 11.7978 11.7978 k = 0.0000 0.0000 0.3503 ( 15271 PWs) bands (ev): -1.8811 -1.8811 -0.1179 -0.1179 0.0747 0.0747 0.0749 0.0749 0.1491 0.1491 0.6236 0.6236 0.6273 0.6273 1.1494 1.1494 4.4165 4.4165 4.4735 4.4735 5.0408 5.0408 5.1558 5.1558 5.4617 5.4617 5.4881 5.4881 5.8006 5.8006 6.3698 6.3698 6.5032 6.5032 6.6554 6.6554 6.7339 6.7339 6.7939 6.7939 6.9134 6.9134 6.9517 6.9517 7.1147 7.1147 7.2201 7.2201 7.2662 7.2662 8.1214 8.1214 8.3103 8.3103 8.3583 8.3583 8.4022 8.4022 8.6655 8.6655 8.8513 8.8513 9.0468 9.0468 9.0728 9.0728 9.2325 9.2325 9.2592 9.2592 9.2889 9.2889 9.4554 9.4554 9.7484 9.7484 10.5809 10.5809 10.6584 10.6584 11.1953 11.1953 11.3761 11.3761 11.4577 11.4577 11.4693 11.4693 11.7686 11.7686 11.7722 11.7722 11.7813 11.7813 11.7896 11.7897 k = 0.0000 0.0000 0.3773 ( 15235 PWs) bands (ev): -1.8402 -1.8402 -0.0891 -0.0891 0.0596 0.0596 0.0960 0.0960 0.0960 0.0960 0.6185 0.6185 0.6222 0.6222 1.1030 1.1030 4.3914 4.3914 4.4481 4.4481 5.0838 5.0838 5.2221 5.2221 5.3914 5.3914 5.4302 5.4302 5.9115 5.9115 6.3808 6.3808 6.5099 6.5099 6.6690 6.6690 6.7282 6.7282 6.7870 6.7870 6.9785 6.9785 6.9892 6.9892 7.0656 7.0656 7.2686 7.2686 7.3037 7.3037 8.1231 8.1231 8.1960 8.1960 8.3486 8.3486 8.3902 8.3902 8.6387 8.6387 8.8308 8.8308 9.0711 9.0711 9.0978 9.0978 9.2559 9.2559 9.2878 9.2878 9.3018 9.3018 9.5279 9.5279 9.7911 9.7911 10.5821 10.5821 10.6579 10.6579 11.1069 11.1069 11.3743 11.3743 11.4636 11.4636 11.4726 11.4726 11.7474 11.7474 11.7592 11.7592 11.7722 11.7722 11.7810 11.7811 k = 0.0000 0.0000 0.4042 ( 15265 PWs) bands (ev): -1.7964 -1.7964 -0.0583 -0.0583 -0.0307 -0.0307 0.1183 0.1183 0.1184 0.1184 0.6121 0.6121 0.6159 0.6159 1.0551 1.0551 4.3705 4.3705 4.4270 4.4270 5.1284 5.1284 5.2473 5.2473 5.3203 5.3203 5.4123 5.4123 6.0310 6.0310 6.3928 6.3928 6.5172 6.5172 6.6662 6.6662 6.7195 6.7195 6.7775 6.7775 6.9655 6.9655 7.0444 7.0444 7.0957 7.0957 7.3163 7.3163 7.3407 7.3407 8.0788 8.0788 8.1220 8.1220 8.3413 8.3413 8.3800 8.3800 8.6110 8.6110 8.8089 8.8089 9.0958 9.0958 9.1231 9.1231 9.2712 9.2712 9.3137 9.3137 9.3240 9.3240 9.5968 9.5968 9.8339 9.8339 10.5860 10.5860 10.6602 10.6602 11.0151 11.0151 11.3753 11.3753 11.4732 11.4732 11.4803 11.4803 11.6979 11.6979 11.7406 11.7406 11.7488 11.7488 11.7631 11.7725 k = 0.0000 0.0000 0.4312 ( 15247 PWs) bands (ev): -1.7497 -1.7497 -0.1215 -0.1215 -0.0257 -0.0257 0.1415 0.1415 0.1417 0.1417 0.6044 0.6044 0.6082 0.6082 1.0060 1.0060 4.3544 4.3544 4.4106 4.4106 5.1673 5.1673 5.2181 5.2181 5.2488 5.2488 5.4566 5.4566 6.1560 6.1560 6.4064 6.4064 6.5249 6.5249 6.6496 6.6496 6.6968 6.6968 6.7668 6.7668 6.9389 6.9389 7.1088 7.1088 7.1534 7.1534 7.3631 7.3631 7.3767 7.3767 7.9615 7.9615 8.1187 8.1187 8.3364 8.3364 8.3719 8.3719 8.5821 8.5821 8.7855 8.7855 9.1204 9.1204 9.1484 9.1484 9.2825 9.2825 9.3244 9.3244 9.3590 9.3590 9.6622 9.6622 9.8759 9.8759 10.5929 10.5929 10.6657 10.6657 10.9254 10.9254 11.3798 11.3798 11.4867 11.4867 11.4919 11.4919 11.6412 11.6412 11.6915 11.6915 11.7357 11.7357 11.7393 11.7393 k = 0.0000 0.0000 0.4581 ( 15253 PWs) bands (ev): -1.7002 -1.7002 -0.2122 -0.2122 0.0089 0.0089 0.1655 0.1655 0.1659 0.1659 0.5952 0.5952 0.5990 0.5990 0.9557 0.9557 4.3432 4.3432 4.3990 4.3990 5.1349 5.1349 5.1776 5.1776 5.2382 5.2382 5.5262 5.5262 6.2822 6.2822 6.4240 6.4240 6.5332 6.5332 6.6132 6.6132 6.6672 6.6672 6.7555 6.7555 6.9319 6.9319 7.1708 7.1708 7.2139 7.2139 7.4084 7.4084 7.4112 7.4112 7.8463 7.8463 8.1136 8.1136 8.3341 8.3341 8.3660 8.3660 8.5518 8.5518 8.7605 8.7605 9.1449 9.1449 9.1735 9.1735 9.2908 9.2908 9.3341 9.3341 9.3869 9.3869 9.7235 9.7235 9.9164 9.9164 10.6030 10.6030 10.6747 10.6747 10.8432 10.8432 11.3882 11.3882 11.5041 11.5041 11.5073 11.5073 11.5799 11.5799 11.6368 11.6368 11.7026 11.7026 11.7313 11.7313 k = 0.0000 0.0000 0.4851 ( 15253 PWs) bands (ev): -1.6480 -1.6480 -0.3026 -0.3026 0.0451 0.0451 0.1903 0.1903 0.1908 0.1908 0.5845 0.5845 0.5883 0.5883 0.9047 0.9047 4.3372 4.3372 4.3926 4.3926 5.0685 5.0685 5.1071 5.1071 5.2893 5.2893 5.6030 5.6030 6.3887 6.3887 6.4639 6.4639 6.5418 6.5418 6.5533 6.5533 6.6443 6.6443 6.7438 6.7438 6.9357 6.9357 7.2298 7.2298 7.2735 7.2735 7.4437 7.4437 7.4518 7.4518 7.7357 7.7357 8.1078 8.1078 8.3347 8.3347 8.3628 8.3628 8.5200 8.5200 8.7340 8.7340 9.1689 9.1689 9.1980 9.1980 9.2958 9.2958 9.3426 9.3426 9.4025 9.4025 9.7808 9.7808 9.9546 9.9546 10.6165 10.6165 10.6876 10.6876 10.7748 10.7748 11.4009 11.4009 11.5152 11.5152 11.5250 11.5250 11.5262 11.5262 11.5779 11.5779 11.6649 11.6649 11.7252 11.7252 k = 0.0000 0.0000 0.5120 ( 15253 PWs) bands (ev): -1.5930 -1.5930 -0.3923 -0.3923 0.0832 0.0832 0.2156 0.2156 0.2164 0.2164 0.5722 0.5722 0.5759 0.5759 0.8530 0.8530 4.3366 4.3366 4.3916 4.3916 4.9993 4.9993 5.0377 5.0377 5.3448 5.3448 5.6831 5.6831 6.4295 6.4295 6.4817 6.4817 6.5509 6.5509 6.5699 6.5699 6.6244 6.6244 6.7319 6.7319 6.9405 6.9405 7.2852 7.2852 7.3308 7.3308 7.4738 7.4738 7.4927 7.4927 7.6327 7.6327 8.1021 8.1021 8.3389 8.3389 8.3622 8.3622 8.4866 8.4866 8.7062 8.7062 9.1921 9.1921 9.2217 9.2217 9.2957 9.2957 9.3500 9.3500 9.4024 9.4024 9.8338 9.8338 9.9894 9.9894 10.6335 10.6335 10.7045 10.7045 10.7266 10.7266 11.4179 11.4179 11.4485 11.4485 11.5122 11.5122 11.5483 11.5483 11.5530 11.5530 11.6226 11.6226 11.7214 11.7214 k = 0.0000 0.0000 0.5390 ( 15283 PWs) bands (ev): -1.5353 -1.5353 -0.4810 -0.4810 0.1229 0.1229 0.2414 0.2414 0.2423 0.2423 0.5583 0.5583 0.5620 0.5620 0.8010 0.8010 4.3414 4.3414 4.3959 4.3959 4.9306 4.9306 4.9700 4.9700 5.4031 5.4031 5.7656 5.7656 6.4055 6.4055 6.4494 6.4494 6.5604 6.5604 6.6046 6.6046 6.6950 6.6950 6.7197 6.7197 6.9387 6.9387 7.3366 7.3366 7.3849 7.3849 7.5006 7.5006 7.5304 7.5304 7.5411 7.5411 8.0978 8.0978 8.3478 8.3478 8.3647 8.3647 8.4517 8.4517 8.6772 8.6772 9.2144 9.2144 9.2443 9.2443 9.2852 9.2852 9.3561 9.3561 9.3878 9.3878 9.8823 9.8823 10.0202 10.0202 10.6535 10.6535 10.7037 10.7037 10.7258 10.7258 11.3797 11.3797 11.4400 11.4400 11.4478 11.4478 11.5733 11.5733 11.5750 11.5751 11.5813 11.5813 11.7203 11.7203 k = 0.0000 0.0000 0.5659 ( 15319 PWs) bands (ev): -1.4749 -1.4749 -0.5687 -0.5687 0.1642 0.1642 0.2674 0.2674 0.2686 0.2686 0.5428 0.5428 0.5464 0.5464 0.7487 0.7487 4.3517 4.3517 4.4057 4.4057 4.8636 4.8636 4.9043 4.9043 5.4638 5.4638 5.8499 5.8499 6.3277 6.3277 6.4670 6.4670 6.5702 6.5702 6.5838 6.5838 6.7075 6.7075 6.8175 6.8175 6.9241 6.9241 7.3835 7.3835 7.4351 7.4351 7.4653 7.4653 7.5238 7.5238 7.5639 7.5639 8.0959 8.0959 8.3631 8.3631 8.3702 8.3702 8.4155 8.4155 8.6473 8.6473 9.2354 9.2354 9.2531 9.2531 9.2655 9.2655 9.3608 9.3608 9.3693 9.3693 9.9261 9.9261 10.0463 10.0463 10.6763 10.6763 10.7082 10.7082 10.7516 10.7516 11.3110 11.3110 11.3813 11.3813 11.4650 11.4650 11.5223 11.5223 11.5999 11.5999 11.6138 11.6138 11.7228 11.7229 k = 0.0000 0.0000 0.5928 ( 15319 PWs) bands (ev): -1.4120 -1.4120 -0.6549 -0.6549 0.2070 0.2070 0.2936 0.2936 0.2950 0.2950 0.5258 0.5258 0.5293 0.5293 0.6964 0.6964 4.3676 4.3676 4.4209 4.4209 4.7989 4.7989 4.8412 4.8412 5.5267 5.5267 5.9357 5.9357 6.2495 6.2495 6.4850 6.4850 6.5612 6.5612 6.5803 6.5803 6.6952 6.6952 6.8924 6.8924 6.9321 6.9321 7.4087 7.4087 7.4257 7.4257 7.4809 7.4809 7.5426 7.5426 7.5922 7.5922 8.0978 8.0978 8.3782 8.3782 8.3791 8.3791 8.3868 8.3868 8.6168 8.6168 9.1913 9.1913 9.2549 9.2549 9.2852 9.2852 9.3573 9.3573 9.3641 9.3641 9.9652 9.9652 10.0672 10.0672 10.7054 10.7054 10.7351 10.7351 10.7820 10.7820 11.2426 11.2426 11.3143 11.3143 11.4558 11.4558 11.5008 11.5008 11.6261 11.6261 11.6488 11.6488 11.7190 11.7191 k = 0.0000 0.0000 0.6198 ( 15319 PWs) bands (ev): -1.3464 -1.3464 -0.7396 -0.7396 0.2512 0.2512 0.3197 0.3197 0.3213 0.3213 0.5073 0.5073 0.5106 0.5106 0.6443 0.6443 4.3890 4.3890 4.4415 4.4415 4.7371 4.7371 4.7808 4.7808 5.5916 5.5916 6.0225 6.0225 6.1716 6.1716 6.5042 6.5042 6.5355 6.5355 6.5908 6.5908 6.6830 6.6830 6.8438 6.8438 7.0349 7.0349 7.3710 7.3710 7.4629 7.4629 7.5218 7.5218 7.5566 7.5566 7.6141 7.6141 8.1048 8.1048 8.3401 8.3401 8.3913 8.3913 8.4213 8.4213 8.5862 8.5862 9.1062 9.1062 9.2728 9.2728 9.3030 9.3030 9.3506 9.3506 9.3657 9.3657 9.9994 9.9994 10.0824 10.0824 10.7423 10.7423 10.7789 10.7789 10.8171 10.8171 11.1754 11.1754 11.2478 11.2478 11.3900 11.3900 11.5323 11.5323 11.6488 11.6488 11.6826 11.6826 11.7133 11.7133 k = 0.0000 0.0000 0.6467 ( 15320 PWs) bands (ev): -1.2785 -1.2785 -0.8227 -0.8227 0.2968 0.2968 0.3457 0.3457 0.3475 0.3475 0.4874 0.4874 0.4905 0.4905 0.5925 0.5925 4.4157 4.4157 4.4675 4.4675 4.6786 4.6786 4.7238 4.7238 5.6585 5.6585 6.0945 6.0945 6.1094 6.1094 6.5047 6.5047 6.5254 6.5254 6.6015 6.6015 6.6709 6.6709 6.7838 6.7838 7.1226 7.1226 7.3469 7.3469 7.4948 7.4948 7.5572 7.5572 7.5653 7.5653 7.6289 7.6289 8.1178 8.1178 8.3018 8.3018 8.4068 8.4068 8.4689 8.4689 8.5559 8.5559 9.0072 9.0072 9.2889 9.2889 9.3187 9.3187 9.3455 9.3455 9.3655 9.3655 10.0286 10.0286 10.0918 10.0918 10.7838 10.7838 10.8381 10.8381 10.8569 10.8569 11.1100 11.1100 11.1828 11.1828 11.3162 11.3162 11.5673 11.5673 11.6654 11.6654 11.7023 11.7023 11.7104 11.7104 k = 0.0000 0.0000 0.6737 ( 15314 PWs) bands (ev): -1.2080 -1.2080 -0.9039 -0.9039 0.3436 0.3436 0.3712 0.3712 0.3732 0.3732 0.4662 0.4662 0.4692 0.4692 0.5412 0.5412 4.4476 4.4476 4.4985 4.4985 4.6238 4.6238 4.6703 4.6703 5.7272 5.7272 6.0183 6.0183 6.1950 6.1950 6.4660 6.4660 6.5497 6.5497 6.6125 6.6125 6.6589 6.6589 6.7208 6.7208 7.1933 7.1933 7.3291 7.3291 7.5212 7.5212 7.5683 7.5683 7.5868 7.5868 7.6359 7.6359 8.1372 8.1372 8.2639 8.2639 8.4255 8.4255 8.5263 8.5263 8.5309 8.5309 8.9020 8.9020 9.3030 9.3030 9.3322 9.3322 9.3401 9.3401 9.3633 9.3633 10.0527 10.0527 10.0953 10.0953 10.8288 10.8288 10.9013 10.9013 10.9092 10.9092 11.0470 11.0470 11.1199 11.1199 11.2371 11.2371 11.6030 11.6030 11.6762 11.6762 11.7043 11.7043 11.7096 11.7096 k = 0.0000 0.0000 0.7006 ( 15314 PWs) bands (ev): -1.1353 -1.1353 -0.9831 -0.9831 0.3915 0.3915 0.3962 0.3962 0.3984 0.3984 0.4439 0.4439 0.4466 0.4466 0.4905 0.4905 4.4847 4.4847 4.5346 4.5346 4.5730 4.5730 4.6207 4.6207 5.7977 5.7977 5.9433 5.9433 6.2770 6.2770 6.4156 6.4156 6.5790 6.5790 6.6238 6.6238 6.6470 6.6470 6.6632 6.6632 7.2467 7.2467 7.3103 7.3103 7.5418 7.5418 7.5654 7.5654 7.6099 7.6099 7.6349 7.6349 8.1627 8.1627 8.2274 8.2274 8.4472 8.4472 8.4980 8.4980 8.6076 8.6076 8.7969 8.7969 9.3151 9.3151 9.3335 9.3335 9.3435 9.3435 9.3590 9.3590 10.0716 10.0716 10.0931 10.0931 10.8777 10.8777 10.9501 10.9501 10.9871 10.9871 10.9879 10.9879 11.0598 11.0598 11.1545 11.1545 11.6373 11.6373 11.6804 11.6804 11.7043 11.7045 11.7074 11.7075 k = 0.0000 0.0000 0.7276 ( 15290 PWs) bands (ev): -1.0603 -1.0603 -1.0603 -1.0603 0.4205 0.4205 0.4205 0.4205 0.4228 0.4228 0.4228 0.4228 0.4408 0.4408 0.4408 0.4408 4.5265 4.5265 4.5265 4.5265 4.5754 4.5754 4.5754 4.5754 5.8698 5.8698 5.8698 5.8698 6.3519 6.3519 6.3519 6.3519 6.6159 6.6159 6.6159 6.6159 6.6353 6.6353 6.6353 6.6353 7.2845 7.2845 7.2845 7.2845 7.5566 7.5566 7.5566 7.5566 7.6261 7.6261 7.6261 7.6261 8.1932 8.1932 8.1932 8.1932 8.4715 8.4715 8.4715 8.4715 8.6973 8.6973 8.6973 8.6973 9.3253 9.3253 9.3253 9.3253 9.3524 9.3524 9.3524 9.3524 10.0851 10.0851 10.0851 10.0851 10.9305 10.9305 10.9305 10.9305 11.0031 11.0031 11.0031 11.0031 11.0706 11.0706 11.0706 11.0706 11.6665 11.6665 11.6665 11.6665 11.7053 11.7053 11.7055 11.7056 k = 0.0000 0.0000 0.7276 ( 15290 PWs) bands (ev): -1.0603 -1.0603 -1.0603 -1.0603 0.4205 0.4205 0.4205 0.4205 0.4228 0.4228 0.4228 0.4228 0.4408 0.4408 0.4408 0.4408 4.5265 4.5265 4.5265 4.5265 4.5754 4.5754 4.5754 4.5754 5.8698 5.8698 5.8698 5.8698 6.3519 6.3519 6.3519 6.3519 6.6159 6.6159 6.6159 6.6159 6.6353 6.6353 6.6353 6.6353 7.2845 7.2845 7.2845 7.2845 7.5566 7.5566 7.5566 7.5566 7.6261 7.6261 7.6261 7.6261 8.1932 8.1932 8.1932 8.1932 8.4715 8.4715 8.4715 8.4715 8.6973 8.6973 8.6973 8.6973 9.3253 9.3253 9.3253 9.3253 9.3524 9.3524 9.3524 9.3524 10.0851 10.0851 10.0851 10.0851 10.9305 10.9305 10.9305 10.9305 11.0031 11.0031 11.0031 11.0031 11.0706 11.0706 11.0706 11.0706 11.6665 11.6665 11.6665 11.6665 11.7053 11.7053 11.7054 11.7056 k = 0.0227 0.0131 0.7276 ( 15290 PWs) bands (ev): -1.0595 -1.0595 -1.0595 -1.0595 0.4168 0.4168 0.4170 0.4170 0.4213 0.4213 0.4215 0.4215 0.4439 0.4439 0.4440 0.4440 4.5281 4.5281 4.5282 4.5282 4.5771 4.5771 4.5771 4.5771 5.8715 5.8715 5.8715 5.8715 6.3459 6.3459 6.3460 6.3460 6.6066 6.6066 6.6070 6.6070 6.6504 6.6504 6.6507 6.6507 7.2771 7.2771 7.2773 7.2773 7.5577 7.5577 7.5585 7.5585 7.6294 7.6294 7.6300 7.6300 8.1889 8.1889 8.1895 8.1895 8.4667 8.4667 8.4674 8.4674 8.7042 8.7042 8.7045 8.7045 9.3253 9.3253 9.3253 9.3253 9.3523 9.3523 9.3524 9.3524 10.0860 10.0860 10.0860 10.0860 10.9286 10.9286 10.9287 10.9287 11.0008 11.0008 11.0010 11.0010 11.0751 11.0751 11.0754 11.0754 11.6208 11.6208 11.6243 11.6243 11.6949 11.6949 11.7058 11.7058 k = 0.0455 0.0262 0.7276 ( 15290 PWs) bands (ev): -1.0572 -1.0572 -1.0572 -1.0572 0.4074 0.4074 0.4077 0.4077 0.4192 0.4192 0.4197 0.4197 0.4499 0.4499 0.4500 0.4500 4.5319 4.5319 4.5325 4.5325 4.5825 4.5825 4.5832 4.5832 5.8765 5.8765 5.8767 5.8767 6.3287 6.3287 6.3295 6.3295 6.5974 6.5974 6.5993 6.5993 6.6760 6.6760 6.6771 6.6771 7.2565 7.2565 7.2577 7.2577 7.5574 7.5574 7.5627 7.5627 7.6390 7.6390 7.6423 7.6423 8.1754 8.1754 8.1795 8.1795 8.4536 8.4536 8.4592 8.4592 8.7218 8.7218 8.7239 8.7239 9.3251 9.3251 9.3255 9.3255 9.3519 9.3519 9.3524 9.3524 10.0888 10.0888 10.0888 10.0888 10.9228 10.9228 10.9232 10.9232 10.9945 10.9945 10.9954 10.9954 11.0875 11.0875 11.0891 11.0891 11.5592 11.5592 11.5666 11.5666 11.6830 11.6830 11.7043 11.7043 k = 0.0682 0.0394 0.7276 ( 15290 PWs) bands (ev): -1.0534 -1.0534 -1.0534 -1.0534 0.3953 0.3953 0.3958 0.3958 0.4162 0.4162 0.4169 0.4169 0.4560 0.4560 0.4562 0.4562 4.5362 4.5362 4.5379 4.5379 4.5935 4.5935 4.5954 4.5954 5.8845 5.8845 5.8851 5.8851 6.3023 6.3023 6.3047 6.3047 6.5938 6.5938 6.5981 6.5981 6.7047 6.7047 6.7069 6.7069 7.2263 7.2263 7.2295 7.2295 7.5520 7.5520 7.5653 7.5653 7.6545 7.6545 7.6620 7.6620 8.1527 8.1527 8.1653 8.1653 8.4369 8.4369 8.4525 8.4525 8.7454 8.7454 8.7508 8.7508 9.3247 9.3247 9.3261 9.3261 9.3510 9.3510 9.3528 9.3528 10.0932 10.0932 10.0932 10.0932 10.9128 10.9128 10.9144 10.9144 10.9852 10.9852 10.9865 10.9865 11.1058 11.1058 11.1099 11.1099 11.5001 11.5001 11.5107 11.5107 11.6684 11.6684 11.6969 11.6969 k = 0.0909 0.0525 0.7276 ( 15282 PWs) bands (ev): -1.0481 -1.0481 -1.0481 -1.0481 0.3812 0.3812 0.3819 0.3819 0.4123 0.4123 0.4132 0.4132 0.4617 0.4617 0.4620 0.4620 4.5394 4.5394 4.5426 4.5426 4.6117 4.6117 4.6151 4.6151 5.8950 5.8950 5.8966 5.8966 6.2693 6.2693 6.2743 6.2743 6.5953 6.5953 6.6028 6.6028 6.7345 6.7345 6.7378 6.7378 7.1900 7.1900 7.1960 7.1960 7.5404 7.5404 7.5636 7.5636 7.6736 7.6736 7.6845 7.6845 8.1229 8.1229 8.1491 8.1491 8.4207 8.4207 8.4510 8.4510 8.7714 8.7714 8.7809 8.7809 9.3240 9.3240 9.3272 9.3272 9.3496 9.3496 9.3537 9.3537 10.0991 10.0991 10.0992 10.0992 10.8978 10.8978 10.9022 10.9022 10.9734 10.9734 10.9735 10.9735 11.1283 11.1283 11.1356 11.1356 11.4473 11.4473 11.4611 11.4611 11.6515 11.6515 11.6834 11.6834 k = 0.1136 0.0656 0.7276 ( 15278 PWs) bands (ev): -1.0414 -1.0414 -1.0414 -1.0414 0.3653 0.3653 0.3661 0.3661 0.4077 0.4077 0.4088 0.4088 0.4669 0.4669 0.4673 0.4673 4.5415 4.5415 4.5459 4.5459 4.6376 4.6376 4.6425 4.6425 5.9074 5.9074 5.9106 5.9106 6.2321 6.2321 6.2407 6.2407 6.6011 6.6011 6.6123 6.6123 6.7641 6.7641 6.7684 6.7684 7.1500 7.1500 7.1593 7.1593 7.5224 7.5224 7.5564 7.5564 7.6928 7.6928 7.7056 7.7056 8.0904 8.0904 8.1337 8.1337 8.4079 8.4079 8.4555 8.4555 8.7974 8.7974 8.8116 8.8116 9.3230 9.3230 9.3291 9.3291 9.3477 9.3477 9.3555 9.3555 10.1060 10.1060 10.1063 10.1063 10.8777 10.8777 10.8868 10.8868 10.9554 10.9554 10.9585 10.9585 11.1522 11.1522 11.1637 11.1637 11.4049 11.4049 11.4224 11.4224 11.6325 11.6325 11.6640 11.6640 k = 0.1364 0.0787 0.7276 ( 15254 PWs) bands (ev): -1.0333 -1.0333 -1.0333 -1.0333 0.3476 0.3476 0.3485 0.3485 0.4027 0.4027 0.4039 0.4039 0.4717 0.4717 0.4720 0.4720 4.5429 4.5429 4.5483 4.5483 4.6708 4.6708 4.6770 4.6770 5.9204 5.9204 5.9265 5.9265 6.1928 6.1928 6.2063 6.2063 6.6103 6.6103 6.6257 6.6257 6.7924 6.7924 6.7978 6.7978 7.1079 7.1079 7.1210 7.1210 7.4974 7.4974 7.5429 7.5429 7.7088 7.7088 7.7223 7.7223 8.0601 8.0601 8.1218 8.1218 8.4003 8.4003 8.4654 8.4654 8.8225 8.8225 8.8415 8.8415 9.3217 9.3217 9.3319 9.3319 9.3454 9.3454 9.3583 9.3583 10.1135 10.1135 10.1140 10.1140 10.8529 10.8529 10.8681 10.8681 10.9309 10.9309 10.9392 10.9392 11.1742 11.1742 11.1905 11.1905 11.3781 11.3781 11.3996 11.3996 11.6111 11.6111 11.6387 11.6387 k = 0.1591 0.0919 0.7276 ( 15246 PWs) bands (ev): -1.0240 -1.0240 -1.0240 -1.0240 0.3283 0.3283 0.3292 0.3292 0.3973 0.3973 0.3986 0.3986 0.4759 0.4759 0.4763 0.4763 4.5441 4.5441 4.5502 4.5502 4.7106 4.7106 4.7180 4.7180 5.9324 5.9324 5.9433 5.9433 6.1532 6.1532 6.1736 6.1736 6.6218 6.6218 6.6422 6.6422 6.8186 6.8186 6.8252 6.8252 7.0646 7.0646 7.0818 7.0818 7.4650 7.4650 7.5221 7.5221 7.7195 7.7195 7.7333 7.7333 8.0364 8.0364 8.1148 8.1148 8.3988 8.3988 8.4800 8.4800 8.8461 8.8461 8.8700 8.8700 9.3203 9.3203 9.3357 9.3357 9.3429 9.3429 9.3623 9.3623 10.1208 10.1208 10.1218 10.1218 10.8241 10.8241 10.8464 10.8464 10.8999 10.8999 10.9143 10.9143 11.1909 11.1909 11.2111 11.2111 11.3721 11.3721 11.3965 11.3965 11.5869 11.5869 11.6082 11.6082 k = 0.1818 0.1050 0.7276 ( 15256 PWs) bands (ev): -1.0136 -1.0136 -1.0136 -1.0136 0.3076 0.3076 0.3085 0.3085 0.3917 0.3917 0.3931 0.3931 0.4797 0.4797 0.4801 0.4801 4.5454 4.5454 4.5520 4.5520 4.7565 4.7565 4.7650 4.7650 5.9404 5.9404 5.9587 5.9587 6.1159 6.1159 6.1460 6.1460 6.6345 6.6345 6.6611 6.6611 6.8413 6.8413 6.8495 6.8495 7.0214 7.0214 7.0426 7.0426 7.4255 7.4255 7.4932 7.4932 7.7244 7.7244 7.7390 7.7390 8.0217 8.0217 8.1125 8.1125 8.4040 8.4040 8.4987 8.4987 8.8683 8.8683 8.8967 8.8967 9.3187 9.3187 9.3378 9.3378 9.3432 9.3432 9.3679 9.3679 10.1270 10.1270 10.1287 10.1287 10.7925 10.7925 10.8214 10.8214 10.8639 10.8639 10.8842 10.8842 11.2020 11.2020 11.2237 11.2237 11.3871 11.3871 11.4118 11.4118 11.5595 11.5595 11.5738 11.5738 k = 0.2045 0.1181 0.7276 ( 15252 PWs) bands (ev): -1.0022 -1.0022 -1.0021 -1.0021 0.2856 0.2856 0.2866 0.2866 0.3861 0.3861 0.3874 0.3874 0.4831 0.4831 0.4835 0.4835 4.5471 4.5471 4.5540 4.5540 4.8081 4.8081 4.8175 4.8175 5.9406 5.9406 5.9682 5.9682 6.0857 6.0857 6.1276 6.1276 6.6468 6.6468 6.6815 6.6815 6.8585 6.8585 6.8688 6.8688 6.9808 6.9808 7.0054 7.0054 7.3799 7.3799 7.4568 7.4568 7.7250 7.7250 7.7410 7.7410 8.0158 8.0158 8.1128 8.1128 8.4161 8.4161 8.5204 8.5204 8.8893 8.8893 8.9218 8.9218 9.3169 9.3169 9.3354 9.3354 9.3495 9.3495 9.3751 9.3751 10.1308 10.1308 10.1336 10.1336 10.7598 10.7598 10.7918 10.7918 10.8278 10.8278 10.8508 10.8508 11.2099 11.2099 11.2316 11.2316 11.4142 11.4142 11.4382 11.4382 11.5304 11.5304 11.5389 11.5389 k = 0.2273 0.1312 0.7276 ( 15248 PWs) bands (ev): -0.9899 -0.9899 -0.9899 -0.9899 0.2628 0.2628 0.2637 0.2637 0.3805 0.3805 0.3818 0.3818 0.4862 0.4862 0.4865 0.4865 4.5492 4.5492 4.5563 4.5563 4.8649 4.8649 4.8752 4.8752 5.9300 5.9300 5.9630 5.9630 6.0715 6.0715 6.1215 6.1215 6.6561 6.6561 6.7023 6.7023 6.8647 6.8647 6.8765 6.8765 6.9507 6.9507 6.9753 6.9753 7.3306 7.3306 7.4145 7.4145 7.7234 7.7234 7.7407 7.7407 8.0163 8.0163 8.1138 8.1138 8.4346 8.4346 8.5442 8.5442 8.9095 8.9095 8.9455 8.9455 9.3151 9.3151 9.3322 9.3322 9.3583 9.3583 9.3843 9.3843 10.1304 10.1304 10.1351 10.1351 10.7281 10.7281 10.7559 10.7559 10.7974 10.7974 10.8162 10.8162 11.2165 11.2165 11.2377 11.2377 11.4350 11.4350 11.4578 11.4578 11.5115 11.5115 11.5163 11.5163 k = 0.2500 0.1443 0.7276 ( 15238 PWs) bands (ev): -0.9770 -0.9770 -0.9770 -0.9770 0.2394 0.2394 0.2403 0.2403 0.3750 0.3750 0.3764 0.3764 0.4888 0.4888 0.4892 0.4892 4.5519 4.5519 4.5589 4.5589 4.9266 4.9266 4.9377 4.9377 5.9094 5.9094 5.9402 5.9402 6.0760 6.0760 6.1271 6.1271 6.6574 6.6574 6.7205 6.7205 6.8525 6.8525 6.8636 6.8636 6.9438 6.9438 6.9611 6.9611 7.2802 7.2802 7.3691 7.3691 7.7212 7.7212 7.7395 7.7395 8.0206 8.0206 8.1141 8.1141 8.4582 8.4582 8.5690 8.5690 8.9296 8.9296 8.9683 8.9683 9.3133 9.3133 9.3290 9.3290 9.3693 9.3693 9.3957 9.3957 10.1241 10.1241 10.1314 10.1314 10.7001 10.7001 10.7172 10.7172 10.7738 10.7738 10.7826 10.7826 11.2212 11.2212 11.2414 11.2414 11.4229 11.4229 11.4397 11.4397 11.5296 11.5296 11.5301 11.5301 k = 0.2727 0.1575 0.7276 ( 15252 PWs) bands (ev): -0.9637 -0.9637 -0.9636 -0.9636 0.2158 0.2158 0.2166 0.2166 0.3698 0.3698 0.3711 0.3711 0.4911 0.4911 0.4915 0.4915 4.5551 4.5551 4.5619 4.5619 4.9928 4.9928 5.0047 5.0047 5.8827 5.8827 5.9086 5.9086 6.0901 6.0901 6.1403 6.1403 6.6429 6.6429 6.7274 6.7274 6.8295 6.8295 6.8452 6.8452 6.9516 6.9516 6.9624 6.9624 7.2314 7.2314 7.3234 7.3234 7.7192 7.7192 7.7378 7.7378 8.0266 8.0266 8.1131 8.1131 8.4852 8.4852 8.5936 8.5936 8.9502 8.9502 8.9904 8.9904 9.3114 9.3114 9.3258 9.3258 9.3824 9.3824 9.4094 9.4094 10.1103 10.1103 10.1209 10.1209 10.6783 10.6783 10.6808 10.6808 10.7512 10.7512 10.7558 10.7558 11.2211 11.2211 11.2382 11.2382 11.3960 11.3960 11.4084 11.4084 11.5556 11.5556 11.5613 11.5613 k = 0.2955 0.1706 0.7276 ( 15258 PWs) bands (ev): -0.9502 -0.9502 -0.9501 -0.9501 0.1924 0.1924 0.1932 0.1932 0.3649 0.3649 0.3661 0.3661 0.4931 0.4931 0.4935 0.4935 4.5587 4.5587 4.5653 4.5653 5.0631 5.0631 5.0756 5.0756 5.8535 5.8535 5.8749 5.8749 6.1069 6.1069 6.1577 6.1577 6.6073 6.6073 6.7050 6.7050 6.8221 6.8221 6.8379 6.8379 6.9620 6.9620 6.9700 6.9700 7.1867 7.1867 7.2798 7.2798 7.7177 7.7177 7.7362 7.7362 8.0331 8.0331 8.1108 8.1108 8.5137 8.5137 8.6166 8.6166 8.9717 8.9717 9.0123 9.0123 9.3095 9.3095 9.3227 9.3227 9.3980 9.3980 9.4256 9.4256 10.0878 10.0878 10.1024 10.1024 10.6497 10.6497 10.6645 10.6645 10.7234 10.7234 10.7433 10.7433 11.2121 11.2121 11.2222 11.2222 11.3757 11.3757 11.3806 11.3806 11.5649 11.5649 11.5821 11.5821 k = 0.3182 0.1837 0.7276 ( 15254 PWs) bands (ev): -0.9367 -0.9367 -0.9367 -0.9367 0.1697 0.1697 0.1704 0.1704 0.3603 0.3603 0.3614 0.3614 0.4949 0.4949 0.4952 0.4952 4.5628 4.5628 4.5689 4.5689 5.1371 5.1371 5.1500 5.1500 5.8243 5.8243 5.8420 5.8420 6.1228 6.1228 6.1767 6.1767 6.5532 6.5532 6.6544 6.6544 6.8338 6.8338 6.8420 6.8420 6.9716 6.9716 6.9786 6.9786 7.1479 7.1479 7.2400 7.2400 7.7168 7.7168 7.7345 7.7345 8.0395 8.0395 8.1075 8.1075 8.5421 8.5421 8.6370 8.6370 8.9946 8.9946 9.0340 9.0340 9.3075 9.3075 9.3196 9.3196 9.4162 9.4162 9.4444 9.4444 10.0569 10.0569 10.0754 10.0754 10.6248 10.6248 10.6574 10.6574 10.7013 10.7013 10.7372 10.7372 11.1910 11.1910 11.1925 11.1925 11.3598 11.3598 11.3652 11.3652 11.5535 11.5535 11.5742 11.5742 k = 0.3409 0.1968 0.7276 ( 15252 PWs) bands (ev): -0.9237 -0.9237 -0.9237 -0.9237 0.1481 0.1481 0.1488 0.1488 0.3561 0.3561 0.3571 0.3571 0.4963 0.4963 0.4966 0.4966 4.5671 4.5671 4.5727 4.5727 5.2143 5.2143 5.2275 5.2275 5.7965 5.7965 5.8113 5.8113 6.1356 6.1356 6.1955 6.1955 6.4869 6.4869 6.5915 6.5915 6.8513 6.8513 6.8524 6.8524 6.9792 6.9792 6.9864 6.9864 7.1161 7.1161 7.2052 7.2052 7.7163 7.7163 7.7329 7.7329 8.0453 8.0453 8.1036 8.1036 8.5691 8.5691 8.6540 8.6540 9.0187 9.0187 9.0556 9.0556 9.3053 9.3053 9.3165 9.3165 9.4373 9.4373 9.4661 9.4661 10.0188 10.0188 10.0408 10.0408 10.6059 10.6059 10.6508 10.6508 10.6908 10.6908 10.7377 10.7377 11.1547 11.1547 11.1601 11.1601 11.3421 11.3421 11.3572 11.3572 11.5361 11.5361 11.5525 11.5525 k = 0.3636 0.2099 0.7276 ( 15232 PWs) bands (ev): -0.9114 -0.9114 -0.9114 -0.9114 0.1281 0.1281 0.1287 0.1287 0.3524 0.3524 0.3533 0.3533 0.4975 0.4975 0.4978 0.4978 4.5714 4.5714 4.5764 4.5764 5.2941 5.2941 5.3074 5.3074 5.7713 5.7713 5.7838 5.7838 6.1423 6.1423 6.2123 6.2123 6.4138 6.4138 6.5247 6.5247 6.8651 6.8651 6.8687 6.8687 6.9845 6.9845 6.9926 6.9926 7.0922 7.0922 7.1759 7.1759 7.7162 7.7162 7.7313 7.7313 8.0506 8.0506 8.0993 8.0993 8.5937 8.5937 8.6674 8.6674 9.0435 9.0435 9.0769 9.0769 9.3029 9.3029 9.3133 9.3133 9.4612 9.4612 9.4907 9.4907 9.9753 9.9753 10.0001 10.0001 10.5922 10.5922 10.6388 10.6388 10.6965 10.6965 10.7444 10.7444 11.1149 11.1149 11.1246 11.1246 11.3208 11.3208 11.3431 11.3431 11.5236 11.5236 11.5346 11.5346 k = 0.3864 0.2231 0.7276 ( 15242 PWs) bands (ev): -0.9002 -0.9002 -0.9002 -0.9002 0.1101 0.1101 0.1106 0.1106 0.3492 0.3492 0.3500 0.3500 0.4985 0.4985 0.4988 0.4988 4.5757 4.5757 4.5800 4.5800 5.3756 5.3756 5.3888 5.3888 5.7498 5.7498 5.7602 5.7602 6.1391 6.1391 6.2220 6.2220 6.3410 6.3410 6.4604 6.4604 6.8776 6.8776 6.8836 6.8836 6.9876 6.9876 6.9961 6.9961 7.0769 7.0769 7.1522 7.1522 7.7165 7.7165 7.7297 7.7297 8.0553 8.0553 8.0949 8.0949 8.6155 8.6155 8.6771 8.6771 9.0682 9.0682 9.0971 9.0971 9.3003 9.3003 9.3098 9.3098 9.4882 9.4882 9.5182 9.5182 9.9285 9.9285 9.9554 9.9554 10.5828 10.5828 10.6253 10.6253 10.7121 10.7121 10.7558 10.7558 11.0774 11.0774 11.0895 11.0895 11.2927 11.2927 11.3189 11.3189 11.5194 11.5194 11.5262 11.5262 k = 0.4091 0.2362 0.7276 ( 15236 PWs) bands (ev): -0.8905 -0.8905 -0.8904 -0.8904 0.0947 0.0947 0.0951 0.0951 0.3465 0.3465 0.3472 0.3472 0.4993 0.4993 0.4995 0.4995 4.5796 4.5796 4.5831 4.5831 5.4575 5.4575 5.4701 5.4701 5.7334 5.7334 5.7421 5.7421 6.1205 6.1205 6.2021 6.2021 6.2928 6.2928 6.4056 6.4056 6.8887 6.8887 6.8951 6.8951 6.9886 6.9886 6.9962 6.9962 7.0704 7.0704 7.1337 7.1337 7.7170 7.7170 7.7281 7.7281 8.0596 8.0596 8.0905 8.0905 8.6342 8.6342 8.6833 8.6833 9.0917 9.0917 9.1156 9.1156 9.2976 9.2976 9.3061 9.3061 9.5183 9.5183 9.5484 9.5484 9.8804 9.8804 9.9086 9.9086 10.5773 10.5773 10.6133 10.6133 10.7321 10.7321 10.7695 10.7695 11.0454 11.0454 11.0585 11.0585 11.2597 11.2597 11.2864 11.2864 11.5218 11.5218 11.5261 11.5261 k = 0.4318 0.2493 0.7276 ( 15224 PWs) bands (ev): -0.8824 -0.8824 -0.8824 -0.8824 0.0822 0.0822 0.0825 0.0825 0.3445 0.3445 0.3450 0.3450 0.4999 0.4999 0.5001 0.5001 4.5830 4.5830 4.5857 4.5857 5.5363 5.5363 5.5476 5.5476 5.7251 5.7251 5.7321 5.7321 6.0822 6.0822 6.1350 6.1350 6.2883 6.2883 6.3661 6.3661 6.8977 6.8977 6.9031 6.9031 6.9881 6.9881 6.9938 6.9938 7.0713 7.0713 7.1197 7.1197 7.7179 7.7179 7.7265 7.7265 8.0635 8.0635 8.0862 8.0862 8.6497 8.6497 8.6864 8.6864 9.1126 9.1126 9.1313 9.1313 9.2950 9.2950 9.3021 9.3021 9.5510 9.5510 9.5809 9.5809 9.8327 9.8327 9.8613 9.8613 10.5751 10.5751 10.6034 10.6034 10.7526 10.7526 10.7825 10.7825 11.0215 11.0215 11.0346 11.0346 11.2262 11.2262 11.2508 11.2508 11.5273 11.5273 11.5302 11.5302 k = 0.4545 0.2624 0.7276 ( 15226 PWs) bands (ev): -0.8765 -0.8765 -0.8765 -0.8765 0.0730 0.0730 0.0732 0.0732 0.3430 0.3430 0.3433 0.3433 0.5004 0.5004 0.5005 0.5005 4.5858 4.5858 4.5876 4.5876 5.6026 5.6026 5.6107 5.6107 5.7337 5.7337 5.7380 5.7380 6.0266 6.0266 6.0542 6.0542 6.2964 6.2964 6.3416 6.3416 6.9043 6.9043 6.9079 6.9079 6.9869 6.9869 6.9905 6.9905 7.0765 7.0765 7.1088 7.1088 7.7189 7.7189 7.7248 7.7248 8.0673 8.0673 8.0822 8.0822 8.6623 8.6623 8.6867 8.6867 9.1299 9.1299 9.1428 9.1428 9.2930 9.2930 9.2983 9.2983 9.5859 9.5859 9.6141 9.6141 9.7881 9.7881 9.8155 9.8155 10.5758 10.5758 10.5953 10.5953 10.7707 10.7707 10.7917 10.7917 11.0076 11.0076 11.0191 11.0191 11.1973 11.1973 11.2170 11.2170 11.5332 11.5332 11.5351 11.5351 k = 0.4773 0.2756 0.7276 ( 15232 PWs) bands (ev): -0.8728 -0.8728 -0.8728 -0.8728 0.0673 0.0673 0.0675 0.0675 0.3421 0.3421 0.3423 0.3423 0.5006 0.5006 0.5007 0.5007 4.5876 4.5876 4.5886 4.5886 5.6390 5.6390 5.6420 5.6420 5.7708 5.7708 5.7719 5.7719 5.9651 5.9651 5.9768 5.9768 6.3060 6.3060 6.3266 6.3266 6.9085 6.9085 6.9103 6.9103 6.9861 6.9861 6.9878 6.9878 7.0837 7.0837 7.0998 7.0998 7.7202 7.7202 7.7232 7.7232 8.0709 8.0709 8.0783 8.0783 8.6722 8.6722 8.6843 8.6843 9.1423 9.1423 9.1489 9.1489 9.2921 9.2921 9.2950 9.2950 9.6205 9.6205 9.6423 9.6423 9.7526 9.7526 9.7741 9.7741 10.5786 10.5786 10.5886 10.5886 10.7842 10.7842 10.7950 10.7950 11.0033 11.0033 11.0105 11.0105 11.1789 11.1789 11.1903 11.1903 11.5376 11.5376 11.5386 11.5386 k = 0.5000 0.2887 0.7276 ( 15220 PWs) bands (ev): -0.8715 -0.8715 -0.8715 -0.8715 0.0655 0.0655 0.0655 0.0655 0.3419 0.3419 0.3419 0.3419 0.5007 0.5007 0.5007 0.5007 4.5886 4.5886 4.5886 4.5886 5.6481 5.6481 5.6481 5.6481 5.8026 5.8026 5.8026 5.8026 5.9317 5.9317 5.9317 5.9317 6.3157 6.3157 6.3157 6.3157 6.9105 6.9105 6.9105 6.9105 6.9863 6.9863 6.9863 6.9863 7.0916 7.0916 7.0916 7.0916 7.7216 7.7216 7.7216 7.7216 8.0745 8.0745 8.0745 8.0745 8.6795 8.6795 8.6795 8.6795 9.1489 9.1489 9.1489 9.1489 9.2928 9.2928 9.2928 9.2928 9.6464 9.6464 9.6464 9.6464 9.7460 9.7460 9.7460 9.7460 10.5831 10.5831 10.5831 10.5831 10.7924 10.7924 10.7924 10.7924 11.0054 11.0054 11.0054 11.0054 11.1763 11.1763 11.1763 11.1763 11.5395 11.5395 11.5395 11.5395 k = 0.5000 0.2887 0.7276 ( 15220 PWs) bands (ev): -0.8715 -0.8715 -0.8715 -0.8715 0.0655 0.0655 0.0655 0.0655 0.3419 0.3419 0.3419 0.3419 0.5007 0.5007 0.5007 0.5007 4.5886 4.5886 4.5886 4.5886 5.6481 5.6481 5.6481 5.6481 5.8026 5.8026 5.8026 5.8026 5.9317 5.9317 5.9317 5.9317 6.3157 6.3157 6.3157 6.3157 6.9105 6.9105 6.9105 6.9105 6.9863 6.9863 6.9863 6.9863 7.0916 7.0916 7.0916 7.0916 7.7216 7.7216 7.7216 7.7216 8.0745 8.0745 8.0745 8.0745 8.6795 8.6795 8.6795 8.6795 9.1489 9.1489 9.1489 9.1489 9.2928 9.2928 9.2928 9.2928 9.6464 9.6464 9.6464 9.6464 9.7460 9.7460 9.7460 9.7460 10.5831 10.5831 10.5831 10.5831 10.7924 10.7924 10.7924 10.7924 11.0054 11.0054 11.0054 11.0054 11.1763 11.1763 11.1763 11.1763 11.5395 11.5395 11.5395 11.5395 k = 0.4872 0.3109 0.7276 ( 15232 PWs) bands (ev): -0.8712 -0.8712 -0.8712 -0.8712 0.0660 0.0660 0.0660 0.0660 0.3394 0.3394 0.3394 0.3394 0.5020 0.5020 0.5020 0.5020 4.5914 4.5914 4.5914 4.5914 5.6286 5.6286 5.6286 5.6286 5.8159 5.8159 5.8159 5.8159 5.9373 5.9373 5.9373 5.9373 6.3170 6.3170 6.3170 6.3170 6.9098 6.9098 6.9098 6.9098 6.9868 6.9868 6.9868 6.9868 7.0922 7.0922 7.0922 7.0922 7.7072 7.7072 7.7072 7.7072 8.0878 8.0878 8.0878 8.0878 8.6789 8.6789 8.6789 8.6789 9.1482 9.1482 9.1482 9.1482 9.2936 9.2936 9.2936 9.2936 9.6436 9.6436 9.6436 9.6436 9.7433 9.7433 9.7433 9.7433 10.5870 10.5870 10.5870 10.5870 10.7959 10.7959 10.7959 10.7959 11.0064 11.0064 11.0064 11.0064 11.1767 11.1767 11.1767 11.1767 11.5371 11.5371 11.5371 11.5371 k = 0.4744 0.3331 0.7276 ( 15228 PWs) bands (ev): -0.8702 -0.8702 -0.8702 -0.8702 0.0677 0.0677 0.0677 0.0677 0.3322 0.3322 0.3322 0.3322 0.5056 0.5056 0.5056 0.5056 4.5998 4.5998 4.5998 4.5998 5.5841 5.5841 5.5841 5.5841 5.8396 5.8396 5.8396 5.8396 5.9558 5.9558 5.9558 5.9558 6.3209 6.3209 6.3209 6.3209 6.9079 6.9079 6.9079 6.9079 6.9882 6.9882 6.9882 6.9882 7.0939 7.0939 7.0939 7.0939 7.6692 7.6692 7.6692 7.6692 8.1224 8.1224 8.1224 8.1224 8.6773 8.6773 8.6773 8.6773 9.1461 9.1461 9.1461 9.1461 9.2960 9.2960 9.2960 9.2960 9.6352 9.6352 9.6352 9.6352 9.7356 9.7356 9.7356 9.7356 10.5986 10.5986 10.5986 10.5986 10.8064 10.8064 10.8064 10.8064 11.0093 11.0093 11.0093 11.0093 11.1781 11.1781 11.1781 11.1781 11.5297 11.5297 11.5297 11.5297 k = 0.4615 0.3553 0.7276 ( 15232 PWs) bands (ev): -0.8686 -0.8686 -0.8686 -0.8686 0.0705 0.0705 0.0705 0.0705 0.3210 0.3210 0.3210 0.3210 0.5108 0.5108 0.5108 0.5108 4.6137 4.6137 4.6137 4.6137 5.5301 5.5301 5.5301 5.5301 5.8572 5.8572 5.8572 5.8572 5.9882 5.9882 5.9882 5.9882 6.3271 6.3271 6.3271 6.3271 6.9052 6.9052 6.9052 6.9052 6.9903 6.9903 6.9903 6.9903 7.0967 7.0967 7.0967 7.0967 7.6171 7.6171 7.6171 7.6171 8.1690 8.1690 8.1690 8.1690 8.6745 8.6745 8.6745 8.6745 9.1429 9.1429 9.1429 9.1429 9.3000 9.3000 9.3000 9.3000 9.6221 9.6221 9.6221 9.6221 9.7232 9.7232 9.7232 9.7232 10.6169 10.6169 10.6169 10.6169 10.8231 10.8231 10.8231 10.8231 11.0138 11.0138 11.0138 11.0138 11.1803 11.1803 11.1803 11.1803 11.5174 11.5174 11.5174 11.5174 k = 0.4487 0.3775 0.7276 ( 15242 PWs) bands (ev): -0.8664 -0.8664 -0.8664 -0.8664 0.0744 0.0744 0.0744 0.0744 0.3068 0.3068 0.3068 0.3068 0.5169 0.5169 0.5169 0.5169 4.6329 4.6329 4.6329 4.6329 5.4726 5.4726 5.4726 5.4726 5.8676 5.8676 5.8676 5.8676 6.0296 6.0296 6.0296 6.0296 6.3353 6.3353 6.3353 6.3353 6.9024 6.9024 6.9024 6.9024 6.9926 6.9926 6.9926 6.9926 7.1002 7.1002 7.1002 7.1002 7.5576 7.5576 7.5576 7.5576 8.2207 8.2207 8.2207 8.2207 8.6707 8.6707 8.6708 8.6708 9.1385 9.1385 9.1385 9.1385 9.3058 9.3058 9.3058 9.3058 9.6051 9.6051 9.6051 9.6051 9.7071 9.7071 9.7071 9.7071 10.6407 10.6407 10.6407 10.6407 10.8454 10.8454 10.8454 10.8454 11.0197 11.0197 11.0197 11.0197 11.1835 11.1835 11.1835 11.1835 11.5005 11.5005 11.5005 11.5005 k = 0.4359 0.3997 0.7276 ( 15258 PWs) bands (ev): -0.8638 -0.8638 -0.8638 -0.8638 0.0794 0.0794 0.0794 0.0794 0.2904 0.2904 0.2904 0.2904 0.5231 0.5231 0.5231 0.5231 4.6571 4.6571 4.6571 4.6571 5.4137 5.4137 5.4137 5.4137 5.8742 5.8742 5.8742 5.8742 6.0738 6.0738 6.0738 6.0738 6.3453 6.3453 6.3453 6.3453 6.9002 6.9002 6.9002 6.9002 6.9951 6.9951 6.9951 6.9951 7.1043 7.1043 7.1043 7.1043 7.4948 7.4948 7.4948 7.4948 8.2737 8.2737 8.2737 8.2737 8.6661 8.6661 8.6661 8.6661 9.1333 9.1333 9.1333 9.1333 9.3134 9.3134 9.3134 9.3134 9.5854 9.5854 9.5854 9.5854 9.6880 9.6880 9.6880 9.6880 10.6684 10.6684 10.6684 10.6684 10.8722 10.8722 10.8722 10.8722 11.0264 11.0264 11.0264 11.0264 11.1876 11.1876 11.1876 11.1876 11.4791 11.4791 11.4791 11.4791 k = 0.4231 0.4219 0.7276 ( 15278 PWs) bands (ev): -0.8608 -0.8608 -0.8608 -0.8608 0.0854 0.0854 0.0854 0.0854 0.2726 0.2726 0.2726 0.2726 0.5292 0.5292 0.5292 0.5292 4.6861 4.6861 4.6861 4.6861 5.3548 5.3548 5.3548 5.3548 5.8794 5.8794 5.8794 5.8794 6.1167 6.1167 6.1167 6.1167 6.3564 6.3564 6.3564 6.3564 6.8993 6.8993 6.8993 6.8993 6.9975 6.9975 6.9975 6.9975 7.1085 7.1085 7.1085 7.1085 7.4314 7.4314 7.4314 7.4314 8.3255 8.3255 8.3255 8.3255 8.6608 8.6608 8.6608 8.6608 9.1277 9.1277 9.1277 9.1277 9.3229 9.3229 9.3229 9.3229 9.5641 9.5641 9.5641 9.5641 9.6669 9.6669 9.6669 9.6669 10.6985 10.6985 10.6985 10.6985 10.9023 10.9023 10.9023 10.9023 11.0334 11.0334 11.0334 11.0334 11.1925 11.1925 11.1925 11.1925 11.4539 11.4539 11.4539 11.4539 k = 0.4103 0.4441 0.7276 ( 15274 PWs) bands (ev): -0.8576 -0.8576 -0.8576 -0.8576 0.0924 0.0924 0.0924 0.0924 0.2540 0.2540 0.2540 0.2540 0.5347 0.5347 0.5347 0.5347 4.7193 4.7193 4.7193 4.7193 5.2965 5.2965 5.2965 5.2965 5.8844 5.8844 5.8844 5.8844 6.1559 6.1559 6.1559 6.1559 6.3681 6.3681 6.3681 6.3681 6.9003 6.9003 6.9003 6.9003 6.9997 6.9997 6.9997 6.9997 7.1124 7.1124 7.1124 7.1124 7.3694 7.3694 7.3694 7.3694 8.3744 8.3744 8.3744 8.3744 8.6550 8.6550 8.6550 8.6550 9.1220 9.1220 9.1220 9.1220 9.3344 9.3344 9.3344 9.3344 9.5423 9.5423 9.5423 9.5423 9.6445 9.6445 9.6445 9.6445 10.7295 10.7295 10.7295 10.7295 10.9344 10.9344 10.9344 10.9344 11.0404 11.0404 11.0404 11.0404 11.1979 11.1979 11.1979 11.1979 11.4254 11.4254 11.4254 11.4254 k = 0.3974 0.4663 0.7276 ( 15262 PWs) bands (ev): -0.8544 -0.8544 -0.8544 -0.8544 0.1003 0.1003 0.1003 0.1003 0.2351 0.2351 0.2351 0.2351 0.5394 0.5394 0.5394 0.5394 4.7564 4.7564 4.7564 4.7564 5.2393 5.2393 5.2393 5.2393 5.8896 5.8896 5.8896 5.8896 6.1898 6.1898 6.1898 6.1898 6.3797 6.3797 6.3797 6.3797 6.9039 6.9039 6.9039 6.9039 7.0014 7.0014 7.0014 7.0014 7.1151 7.1151 7.1151 7.1151 7.3113 7.3113 7.3113 7.3113 8.4186 8.4186 8.4186 8.4186 8.6492 8.6492 8.6492 8.6492 9.1166 9.1166 9.1166 9.1166 9.3480 9.3480 9.3480 9.3480 9.5207 9.5207 9.5207 9.5207 9.6217 9.6217 9.6217 9.6217 10.7596 10.7596 10.7596 10.7596 10.9671 10.9671 10.9671 10.9671 11.0472 11.0472 11.0472 11.0472 11.2033 11.2033 11.2033 11.2033 11.3949 11.3949 11.3949 11.3949 k = 0.3846 0.4885 0.7276 ( 15258 PWs) bands (ev): -0.8513 -0.8513 -0.8513 -0.8513 0.1092 0.1092 0.1092 0.1092 0.2164 0.2164 0.2164 0.2164 0.5433 0.5433 0.5433 0.5433 4.7969 4.7969 4.7969 4.7969 5.1835 5.1835 5.1835 5.1835 5.8953 5.8953 5.8953 5.8953 6.2171 6.2171 6.2171 6.2171 6.3903 6.3903 6.3903 6.3903 6.9104 6.9104 6.9104 6.9104 7.0022 7.0022 7.0022 7.0022 7.1155 7.1155 7.1155 7.1155 7.2600 7.2600 7.2600 7.2600 8.4566 8.4566 8.4566 8.4566 8.6439 8.6439 8.6439 8.6439 9.1121 9.1121 9.1121 9.1121 9.3637 9.3637 9.3637 9.3637 9.5001 9.5001 9.5001 9.5001 9.5992 9.5992 9.5992 9.5992 10.7871 10.7871 10.7871 10.7871 10.9987 10.9987 10.9987 10.9987 11.0545 11.0545 11.0545 11.0545 11.2071 11.2071 11.2071 11.2071 11.3645 11.3645 11.3645 11.3645 k = 0.3718 0.5107 0.7276 ( 15266 PWs) bands (ev): -0.8485 -0.8485 -0.8485 -0.8485 0.1190 0.1190 0.1190 0.1190 0.1984 0.1984 0.1984 0.1984 0.5463 0.5463 0.5463 0.5463 4.8400 4.8400 4.8400 4.8400 5.1294 5.1294 5.1294 5.1294 5.9013 5.9013 5.9013 5.9013 6.2375 6.2375 6.2375 6.2375 6.3991 6.3991 6.3991 6.3991 6.9199 6.9199 6.9199 6.9199 7.0014 7.0014 7.0014 7.0014 7.1118 7.1118 7.1118 7.1118 7.2198 7.2198 7.2198 7.2198 8.4869 8.4869 8.4869 8.4869 8.6398 8.6398 8.6398 8.6398 9.1088 9.1088 9.1088 9.1088 9.3814 9.3814 9.3814 9.3814 9.4810 9.4810 9.4810 9.4810 9.5777 9.5777 9.5777 9.5777 10.8102 10.8102 10.8102 10.8102 11.0269 11.0269 11.0269 11.0269 11.0641 11.0641 11.0641 11.0641 11.2060 11.2060 11.2060 11.2060 11.3382 11.3382 11.3382 11.3382 k = 0.3590 0.5329 0.7276 ( 15266 PWs) bands (ev): -0.8462 -0.8462 -0.8462 -0.8462 0.1296 0.1296 0.1296 0.1296 0.1815 0.1815 0.1815 0.1815 0.5485 0.5485 0.5485 0.5485 4.8852 4.8852 4.8852 4.8852 5.0772 5.0772 5.0772 5.0772 5.9070 5.9070 5.9070 5.9070 6.2508 6.2508 6.2508 6.2508 6.4054 6.4054 6.4054 6.4054 6.9316 6.9316 6.9316 6.9316 6.9978 6.9978 6.9978 6.9978 7.1034 7.1034 7.1034 7.1034 7.1945 7.1945 7.1945 7.1945 8.5080 8.5080 8.5080 8.5080 8.6376 8.6376 8.6376 8.6376 9.1069 9.1069 9.1069 9.1069 9.4004 9.4004 9.4004 9.4004 9.4639 9.4639 9.4639 9.4639 9.5585 9.5585 9.5585 9.5585 10.8272 10.8272 10.8272 10.8272 11.0493 11.0493 11.0493 11.0493 11.0782 11.0782 11.0782 11.0782 11.1952 11.1952 11.1952 11.1952 11.3215 11.3215 11.3215 11.3215 k = 0.3462 0.5551 0.7276 ( 15250 PWs) bands (ev): -0.8447 -0.8447 -0.8447 -0.8447 0.1409 0.1409 0.1409 0.1409 0.1662 0.1662 0.1662 0.1662 0.5497 0.5497 0.5497 0.5497 4.9314 4.9314 4.9314 4.9314 5.0272 5.0272 5.0272 5.0272 5.9116 5.9116 5.9116 5.9116 6.2576 6.2576 6.2576 6.2576 6.4088 6.4088 6.4088 6.4088 6.9436 6.9436 6.9436 6.9436 6.9909 6.9909 6.9909 6.9909 7.0944 7.0944 7.0944 7.0944 7.1829 7.1829 7.1829 7.1829 8.5198 8.5198 8.5198 8.5198 8.6373 8.6373 8.6373 8.6373 9.1061 9.1061 9.1061 9.1061 9.4188 9.4188 9.4188 9.4188 9.4498 9.4498 9.4498 9.4498 9.5436 9.5436 9.5436 9.5436 10.8369 10.8369 10.8369 10.8369 11.0666 11.0666 11.0666 11.0666 11.0926 11.0926 11.0926 11.0926 11.1758 11.1758 11.1758 11.1758 11.3162 11.3162 11.3162 11.3162 k = 0.3333 0.5774 0.7276 ( 15240 PWs) bands (ev): -0.8441 -0.8441 -0.8441 -0.8441 0.1525 0.1525 0.1525 0.1525 0.1532 0.1532 0.1532 0.1532 0.5501 0.5501 0.5501 0.5501 4.9724 4.9724 4.9724 4.9724 4.9852 4.9852 4.9852 4.9852 5.9135 5.9135 5.9135 5.9135 6.2595 6.2595 6.2595 6.2595 6.4098 6.4098 6.4098 6.4098 6.9498 6.9498 6.9498 6.9498 6.9862 6.9862 6.9862 6.9862 7.0909 7.0909 7.0909 7.0909 7.1800 7.1800 7.1800 7.1800 8.5232 8.5232 8.5232 8.5232 8.6376 8.6376 8.6376 8.6376 9.1060 9.1060 9.1060 9.1060 9.4288 9.4288 9.4288 9.4288 9.4425 9.4425 9.4425 9.4425 9.5371 9.5371 9.5371 9.5371 10.8399 10.8399 10.8399 10.8399 11.0788 11.0788 11.0788 11.0788 11.0948 11.0948 11.0948 11.0948 11.1646 11.1646 11.1646 11.1646 11.3160 11.3160 11.3160 11.3160 k = 0.3333 0.5774 0.7276 ( 15240 PWs) bands (ev): -0.8441 -0.8441 -0.8441 -0.8441 0.1525 0.1525 0.1525 0.1525 0.1532 0.1532 0.1532 0.1532 0.5501 0.5501 0.5501 0.5501 4.9724 4.9724 4.9724 4.9724 4.9852 4.9852 4.9852 4.9852 5.9135 5.9135 5.9135 5.9135 6.2595 6.2595 6.2595 6.2595 6.4098 6.4098 6.4098 6.4098 6.9498 6.9498 6.9498 6.9498 6.9862 6.9862 6.9862 6.9862 7.0909 7.0909 7.0909 7.0909 7.1800 7.1800 7.1800 7.1800 8.5232 8.5232 8.5232 8.5232 8.6376 8.6376 8.6376 8.6376 9.1060 9.1060 9.1060 9.1060 9.4288 9.4288 9.4288 9.4288 9.4425 9.4425 9.4425 9.4425 9.5371 9.5371 9.5371 9.5371 10.8399 10.8399 10.8399 10.8399 11.0788 11.0788 11.0788 11.0788 11.0948 11.0948 11.0948 11.0948 11.1646 11.1646 11.1646 11.1646 11.3160 11.3160 11.3160 11.3160 k = 0.3200 0.5543 0.7276 ( 15256 PWs) bands (ev): -0.8448 -0.8448 -0.8448 -0.8448 0.1414 0.1414 0.1414 0.1414 0.1660 0.1660 0.1660 0.1660 0.5497 0.5497 0.5497 0.5497 4.9310 4.9310 4.9310 4.9310 5.0274 5.0274 5.0274 5.0274 5.9107 5.9107 5.9107 5.9107 6.2583 6.2583 6.2583 6.2583 6.4092 6.4092 6.4092 6.4092 6.9433 6.9433 6.9433 6.9433 6.9917 6.9917 6.9917 6.9917 7.0944 7.0944 7.0944 7.0944 7.1825 7.1825 7.1825 7.1825 8.5203 8.5203 8.5203 8.5203 8.6366 8.6366 8.6366 8.6366 9.1058 9.1058 9.1058 9.1058 9.4228 9.4228 9.4228 9.4228 9.4437 9.4437 9.4437 9.4437 9.5460 9.5460 9.5460 9.5460 10.8374 10.8374 10.8374 10.8374 11.0542 11.0542 11.0542 11.0542 11.1074 11.1074 11.1074 11.1074 11.1742 11.1742 11.1742 11.1742 11.3156 11.3156 11.3156 11.3156 k = 0.3067 0.5312 0.7276 ( 15252 PWs) bands (ev): -0.8469 -0.8469 -0.8469 -0.8469 0.1326 0.1326 0.1326 0.1326 0.1796 0.1796 0.1796 0.1796 0.5485 0.5485 0.5485 0.5485 4.8865 4.8865 4.8865 4.8865 5.0734 5.0734 5.0734 5.0734 5.9011 5.9011 5.9011 5.9011 6.2567 6.2567 6.2567 6.2567 6.4086 6.4086 6.4086 6.4086 6.9316 6.9316 6.9316 6.9316 7.0009 7.0009 7.0009 7.0009 7.1038 7.1038 7.1038 7.1038 7.1896 7.1896 7.1896 7.1896 8.5131 8.5131 8.5131 8.5131 8.6328 8.6328 8.6328 8.6328 9.1044 9.1044 9.1044 9.1044 9.4155 9.4155 9.4155 9.4155 9.4380 9.4380 9.4380 9.4380 9.5712 9.5712 9.5712 9.5712 10.8316 10.8316 10.8316 10.8316 11.0109 11.0109 11.0109 11.0109 11.1266 11.1266 11.1266 11.1266 11.1924 11.1924 11.1924 11.1924 11.3162 11.3162 11.3162 11.3162 k = 0.2933 0.5081 0.7276 ( 15262 PWs) bands (ev): -0.8506 -0.8506 -0.8506 -0.8506 0.1270 0.1270 0.1270 0.1270 0.1937 0.1937 0.1937 0.1937 0.5466 0.5466 0.5466 0.5466 4.8447 4.8447 4.8447 4.8447 5.1161 5.1161 5.1161 5.1161 5.8839 5.8839 5.8839 5.8839 6.2559 6.2559 6.2559 6.2559 6.4104 6.4104 6.4104 6.4104 6.9206 6.9206 6.9206 6.9206 7.0078 7.0078 7.0078 7.0078 7.1169 7.1169 7.1169 7.1169 7.2017 7.2017 7.2017 7.2017 8.5029 8.5029 8.5029 8.5029 8.6256 8.6256 8.6256 8.6256 9.1009 9.1009 9.1009 9.1009 9.4091 9.4091 9.4091 9.4091 9.4283 9.4283 9.4283 9.4283 9.6071 9.6071 9.6071 9.6071 10.8243 10.8243 10.8243 10.8243 10.9636 10.9636 10.9636 10.9636 11.1459 11.1459 11.1459 11.1459 11.2121 11.2121 11.2121 11.2121 11.3207 11.3207 11.3207 11.3207 k = 0.2800 0.4850 0.7276 ( 15246 PWs) bands (ev): -0.8559 -0.8559 -0.8559 -0.8559 0.1245 0.1245 0.1245 0.1245 0.2082 0.2082 0.2082 0.2082 0.5440 0.5440 0.5440 0.5440 4.8056 4.8056 4.8056 4.8056 5.1533 5.1533 5.1533 5.1533 5.8604 5.8604 5.8604 5.8604 6.2552 6.2552 6.2552 6.2552 6.4181 6.4181 6.4181 6.4181 6.9111 6.9111 6.9111 6.9111 7.0105 7.0105 7.0105 7.0105 7.1326 7.1326 7.1326 7.1326 7.2189 7.2189 7.2189 7.2189 8.4904 8.4904 8.4904 8.4904 8.6151 8.6151 8.6151 8.6151 9.0950 9.0950 9.0950 9.0950 9.4023 9.4023 9.4023 9.4023 9.4193 9.4193 9.4193 9.4193 9.6498 9.6498 9.6498 9.6498 10.8165 10.8165 10.8165 10.8165 10.9164 10.9164 10.9164 10.9164 11.1649 11.1649 11.1649 11.1649 11.2309 11.2309 11.2309 11.2309 11.3297 11.3297 11.3297 11.3297 k = 0.2667 0.4619 0.7276 ( 15258 PWs) bands (ev): -0.8629 -0.8629 -0.8629 -0.8629 0.1253 0.1253 0.1253 0.1253 0.2230 0.2230 0.2230 0.2230 0.5409 0.5409 0.5409 0.5409 4.7696 4.7696 4.7696 4.7696 5.1826 5.1826 5.1826 5.1826 5.8340 5.8340 5.8340 5.8340 6.2520 6.2520 6.2520 6.2520 6.4346 6.4346 6.4346 6.4346 6.9023 6.9023 6.9023 6.9023 7.0094 7.0094 7.0094 7.0094 7.1505 7.1505 7.1505 7.1505 7.2407 7.2407 7.2407 7.2407 8.4759 8.4759 8.4759 8.4759 8.6018 8.6018 8.6018 8.6018 9.0867 9.0867 9.0867 9.0867 9.3936 9.3936 9.3936 9.3936 9.4131 9.4131 9.4131 9.4131 9.6972 9.6972 9.6972 9.6972 10.8076 10.8076 10.8076 10.8076 10.8727 10.8727 10.8727 10.8727 11.1845 11.1845 11.1845 11.1845 11.2475 11.2475 11.2475 11.2475 11.3427 11.3427 11.3427 11.3427 k = 0.2533 0.4388 0.7276 ( 15260 PWs) bands (ev): -0.8716 -0.8716 -0.8716 -0.8716 0.1293 0.1293 0.1293 0.1293 0.2379 0.2379 0.2379 0.2379 0.5374 0.5374 0.5374 0.5374 4.7364 4.7364 4.7364 4.7364 5.2010 5.2010 5.2010 5.2010 5.8096 5.8096 5.8096 5.8096 6.2444 6.2444 6.2444 6.2444 6.4614 6.4614 6.4614 6.4614 6.8927 6.8927 6.8927 6.8927 7.0053 7.0053 7.0053 7.0053 7.1711 7.1711 7.1711 7.1711 7.2656 7.2656 7.2656 7.2656 8.4591 8.4591 8.4591 8.4591 8.5864 8.5864 8.5864 8.5864 9.0761 9.0761 9.0761 9.0761 9.3838 9.3838 9.3838 9.3838 9.4089 9.4089 9.4089 9.4089 9.7484 9.7484 9.7484 9.7484 10.7913 10.7913 10.7913 10.7913 10.8404 10.8404 10.8404 10.8404 11.2057 11.2057 11.2057 11.2057 11.2604 11.2604 11.2604 11.2604 11.3589 11.3589 11.3589 11.3589 k = 0.2400 0.4157 0.7276 ( 15268 PWs) bands (ev): -0.8817 -0.8817 -0.8817 -0.8817 0.1364 0.1364 0.1364 0.1364 0.2528 0.2528 0.2528 0.2528 0.5334 0.5334 0.5334 0.5334 4.7063 4.7063 4.7063 4.7063 5.2057 5.2057 5.2057 5.2057 5.7923 5.7923 5.7923 5.7923 6.2322 6.2322 6.2322 6.2322 6.4974 6.4974 6.4974 6.4974 6.8812 6.8812 6.8812 6.8812 6.9993 6.9993 6.9993 6.9993 7.1947 7.1947 7.1947 7.1947 7.2926 7.2926 7.2926 7.2926 8.4396 8.4396 8.4396 8.4396 8.5697 8.5697 8.5697 8.5697 9.0637 9.0637 9.0637 9.0637 9.3742 9.3742 9.3742 9.3742 9.4050 9.4050 9.4050 9.4050 9.8021 9.8021 9.8021 9.8021 10.7609 10.7609 10.7609 10.7609 10.8276 10.8276 10.8276 10.8276 11.2293 11.2293 11.2293 11.2293 11.2688 11.2688 11.2688 11.2688 11.3774 11.3774 11.3774 11.3774 k = 0.2267 0.3926 0.7276 ( 15272 PWs) bands (ev): -0.8930 -0.8930 -0.8930 -0.8930 0.1464 0.1464 0.1464 0.1464 0.2678 0.2678 0.2678 0.2678 0.5291 0.5291 0.5291 0.5291 4.6791 4.6791 4.6791 4.6791 5.1949 5.1949 5.1949 5.1949 5.7856 5.7856 5.7856 5.7856 6.2163 6.2163 6.2163 6.2163 6.5404 6.5404 6.5404 6.5404 6.8669 6.8669 6.8669 6.8669 6.9924 6.9924 6.9924 6.9924 7.2219 7.2219 7.2219 7.2219 7.3206 7.3206 7.3206 7.3206 8.4170 8.4170 8.4170 8.4170 8.5525 8.5525 8.5525 8.5525 9.0499 9.0499 9.0499 9.0499 9.3655 9.3655 9.3655 9.3655 9.4006 9.4006 9.4006 9.4006 9.8573 9.8573 9.8573 9.8573 10.7261 10.7261 10.7261 10.7261 10.8258 10.8258 10.8258 10.8258 11.2540 11.2540 11.2540 11.2540 11.2735 11.2735 11.2735 11.2735 11.3974 11.3974 11.3974 11.3974 k = 0.2133 0.3695 0.7276 ( 15264 PWs) bands (ev): -0.9055 -0.9055 -0.9055 -0.9055 0.1591 0.1591 0.1591 0.1591 0.2825 0.2825 0.2825 0.2825 0.5245 0.5245 0.5245 0.5245 4.6549 4.6549 4.6549 4.6549 5.1690 5.1690 5.1690 5.1690 5.7907 5.7907 5.7907 5.7907 6.1978 6.1978 6.1978 6.1978 6.5881 6.5881 6.5881 6.5881 6.8497 6.8497 6.8497 6.8497 6.9850 6.9850 6.9850 6.9850 7.2526 7.2526 7.2526 7.2526 7.3494 7.3494 7.3494 7.3494 8.3907 8.3907 8.3907 8.3907 8.5356 8.5356 8.5356 8.5356 9.0351 9.0351 9.0351 9.0351 9.3578 9.3578 9.3578 9.3578 9.3954 9.3954 9.3954 9.3954 9.9124 9.9124 9.9124 9.9124 10.6942 10.6942 10.6942 10.6942 10.8286 10.8286 10.8286 10.8286 11.2679 11.2679 11.2679 11.2679 11.2860 11.2860 11.2860 11.2860 11.4188 11.4188 11.4188 11.4188 k = 0.2000 0.3464 0.7276 ( 15256 PWs) bands (ev): -0.9187 -0.9187 -0.9187 -0.9187 0.1740 0.1740 0.1740 0.1740 0.2970 0.2970 0.2970 0.2970 0.5197 0.5197 0.5197 0.5197 4.6336 4.6336 4.6336 4.6336 5.1307 5.1307 5.1307 5.1307 5.8064 5.8064 5.8064 5.8064 6.1776 6.1776 6.1776 6.1776 6.6379 6.6379 6.6379 6.6379 6.8303 6.8303 6.8303 6.8303 6.9770 6.9770 6.9770 6.9770 7.2867 7.2867 7.2867 7.2867 7.3788 7.3788 7.3788 7.3788 8.3609 8.3609 8.3609 8.3609 8.5194 8.5194 8.5194 8.5194 9.0195 9.0195 9.0195 9.0195 9.3513 9.3513 9.3513 9.3513 9.3894 9.3894 9.3894 9.3894 9.9656 9.9656 9.9656 9.9656 10.6684 10.6684 10.6684 10.6684 10.8344 10.8344 10.8344 10.8344 11.2670 11.2670 11.2670 11.2670 11.3085 11.3085 11.3085 11.3085 11.4423 11.4423 11.4425 11.4427 k = 0.1867 0.3233 0.7276 ( 15244 PWs) bands (ev): -0.9325 -0.9325 -0.9325 -0.9325 0.1909 0.1909 0.1909 0.1909 0.3112 0.3112 0.3112 0.3112 0.5148 0.5148 0.5148 0.5148 4.6150 4.6150 4.6150 4.6150 5.0833 5.0833 5.0833 5.0833 5.8302 5.8302 5.8302 5.8302 6.1565 6.1565 6.1565 6.1565 6.6870 6.6870 6.6870 6.6870 6.8107 6.8107 6.8107 6.8107 6.9684 6.9684 6.9684 6.9684 7.3233 7.3233 7.3233 7.3233 7.4093 7.4093 7.4093 7.4093 8.3276 8.3276 8.3276 8.3276 8.5042 8.5042 8.5042 8.5042 9.0033 9.0033 9.0033 9.0033 9.3458 9.3458 9.3458 9.3458 9.3831 9.3831 9.3831 9.3831 10.0147 10.0147 10.0147 10.0147 10.6511 10.6511 10.6511 10.6511 10.8424 10.8424 10.8424 10.8424 11.2640 11.2640 11.2640 11.2640 11.3257 11.3257 11.3257 11.3257 11.4704 11.4704 11.4704 11.4704 k = 0.1733 0.3002 0.7276 ( 15244 PWs) bands (ev): -0.9465 -0.9465 -0.9465 -0.9465 0.2093 0.2093 0.2093 0.2093 0.3248 0.3248 0.3248 0.3248 0.5097 0.5097 0.5097 0.5097 4.5992 4.5992 4.5992 4.5992 5.0304 5.0304 5.0304 5.0304 5.8591 5.8591 5.8591 5.8591 6.1355 6.1355 6.1355 6.1355 6.7270 6.7270 6.7270 6.7270 6.7982 6.7982 6.7982 6.7982 6.9588 6.9588 6.9588 6.9588 7.3609 7.3609 7.3609 7.3609 7.4420 7.4420 7.4420 7.4420 8.2916 8.2916 8.2916 8.2916 8.4902 8.4902 8.4902 8.4902 8.9865 8.9865 8.9865 8.9865 9.3413 9.3413 9.3413 9.3413 9.3767 9.3767 9.3767 9.3767 10.0568 10.0568 10.0568 10.0568 10.6445 10.6445 10.6445 10.6445 10.8522 10.8522 10.8522 10.8522 11.2614 11.2614 11.2614 11.2614 11.3339 11.3339 11.3339 11.3339 11.5039 11.5039 11.5040 11.5040 k = 0.1600 0.2771 0.7276 ( 15258 PWs) bands (ev): -0.9606 -0.9606 -0.9606 -0.9606 0.2288 0.2288 0.2288 0.2288 0.3379 0.3379 0.3379 0.3379 0.5047 0.5047 0.5047 0.5047 4.5860 4.5860 4.5860 4.5860 4.9747 4.9747 4.9747 4.9747 5.8904 5.8904 5.8904 5.8904 6.1161 6.1161 6.1161 6.1161 6.7346 6.7346 6.7346 6.7346 6.8151 6.8151 6.8151 6.8151 6.9491 6.9491 6.9491 6.9491 7.3968 7.3968 7.3968 7.3968 7.4787 7.4787 7.4787 7.4787 8.2537 8.2537 8.2537 8.2537 8.4772 8.4772 8.4772 8.4772 8.9688 8.9688 8.9688 8.9688 9.3377 9.3377 9.3377 9.3377 9.3706 9.3706 9.3706 9.3706 10.0898 10.0898 10.0898 10.0898 10.6502 10.6502 10.6502 10.6502 10.8634 10.8634 10.8634 10.8634 11.2602 11.2602 11.2602 11.2602 11.3329 11.3329 11.3329 11.3329 11.5408 11.5408 11.5408 11.5408 k = 0.1467 0.2540 0.7276 ( 15246 PWs) bands (ev): -0.9744 -0.9744 -0.9744 -0.9744 0.2491 0.2491 0.2491 0.2491 0.3503 0.3503 0.3503 0.3503 0.4995 0.4995 0.4995 0.4995 4.5751 4.5751 4.5751 4.5751 4.9184 4.9184 4.9184 4.9184 5.9205 5.9205 5.9205 5.9205 6.1007 6.1007 6.1007 6.1007 6.7178 6.7178 6.7178 6.7178 6.8499 6.8499 6.8499 6.8499 6.9424 6.9424 6.9424 6.9424 7.4289 7.4289 7.4289 7.4289 7.5203 7.5203 7.5203 7.5203 8.2154 8.2154 8.2154 8.2154 8.4654 8.4654 8.4654 8.4654 8.9502 8.9502 8.9502 8.9502 9.3348 9.3348 9.3348 9.3348 9.3651 9.3651 9.3651 9.3651 10.1122 10.1122 10.1122 10.1122 10.6685 10.6685 10.6685 10.6685 10.8759 10.8759 10.8759 10.8759 11.2613 11.2613 11.2613 11.2613 11.3245 11.3245 11.3245 11.3245 11.5776 11.5776 11.5776 11.5776 k = 0.1333 0.2309 0.7276 ( 15256 PWs) bands (ev): -0.9877 -0.9877 -0.9877 -0.9877 0.2697 0.2697 0.2697 0.2697 0.3619 0.3619 0.3619 0.3619 0.4944 0.4944 0.4944 0.4944 4.5664 4.5664 4.5664 4.5664 4.8632 4.8632 4.8632 4.8632 5.9440 5.9440 5.9440 5.9440 6.0939 6.0939 6.0939 6.0939 6.6962 6.6962 6.6962 6.6962 6.8710 6.8710 6.8710 6.8710 6.9508 6.9508 6.9508 6.9508 7.4564 7.4564 7.4564 7.4564 7.5653 7.5653 7.5653 7.5653 8.1783 8.1783 8.1783 8.1783 8.4547 8.4547 8.4547 8.4547 8.9304 8.9304 8.9304 8.9304 9.3324 9.3324 9.3324 9.3324 9.3606 9.3606 9.3606 9.3606 10.1244 10.1244 10.1244 10.1244 10.6979 10.6979 10.6979 10.6979 10.8891 10.8891 10.8891 10.8891 11.2648 11.2648 11.2648 11.2648 11.3108 11.3108 11.3108 11.3108 11.6132 11.6132 11.6132 11.6132 k = 0.1200 0.2078 0.7276 ( 15268 PWs) bands (ev): -1.0003 -1.0003 -1.0003 -1.0003 0.2903 0.2903 0.2903 0.2903 0.3728 0.3728 0.3728 0.3728 0.4893 0.4893 0.4893 0.4893 4.5596 4.5596 4.5596 4.5596 4.8103 4.8103 4.8103 4.8103 5.9546 5.9546 5.9546 5.9546 6.1019 6.1019 6.1019 6.1019 6.6745 6.6745 6.6745 6.6745 6.8662 6.8662 6.8662 6.8662 6.9824 6.9824 6.9824 6.9824 7.4799 7.4799 7.4799 7.4799 7.6102 7.6102 7.6102 7.6102 8.1449 8.1449 8.1449 8.1449 8.4455 8.4455 8.4455 8.4455 8.9092 8.9092 8.9092 8.9092 9.3304 9.3304 9.3304 9.3304 9.3570 9.3570 9.3570 9.3570 10.1284 10.1284 10.1284 10.1284 10.7348 10.7348 10.7348 10.7348 10.9029 10.9029 10.9029 10.9029 11.2664 11.2664 11.2664 11.2664 11.2983 11.2983 11.2983 11.2983 11.6475 11.6475 11.6475 11.6476 k = 0.1067 0.1848 0.7276 ( 15256 PWs) bands (ev): -1.0121 -1.0121 -1.0121 -1.0121 0.3104 0.3104 0.3104 0.3104 0.3826 0.3826 0.3826 0.3826 0.4841 0.4841 0.4841 0.4841 4.5544 4.5544 4.5544 4.5544 4.7608 4.7608 4.7608 4.7608 5.9513 5.9513 5.9513 5.9513 6.1254 6.1254 6.1254 6.1254 6.6541 6.6541 6.6541 6.6541 6.8482 6.8482 6.8482 6.8482 7.0235 7.0235 7.0235 7.0235 7.5002 7.5002 7.5002 7.5002 7.6499 7.6499 7.6499 7.6499 8.1185 8.1185 8.1185 8.1185 8.4379 8.4379 8.4379 8.4379 8.8863 8.8863 8.8863 8.8863 9.3288 9.3288 9.3288 9.3288 9.3544 9.3544 9.3544 9.3544 10.1266 10.1266 10.1266 10.1266 10.7751 10.7751 10.7751 10.7751 10.9170 10.9170 10.9170 10.9170 11.2514 11.2514 11.2514 11.2514 11.3039 11.3039 11.3039 11.3039 11.6773 11.6774 11.6774 11.6775 k = 0.0933 0.1617 0.7276 ( 15248 PWs) bands (ev): -1.0229 -1.0229 -1.0229 -1.0229 0.3299 0.3299 0.3299 0.3299 0.3915 0.3915 0.3915 0.3915 0.4789 0.4789 0.4789 0.4789 4.5505 4.5505 4.5505 4.5505 4.7157 4.7157 4.7157 4.7157 5.9397 5.9397 5.9397 5.9397 6.1583 6.1583 6.1583 6.1583 6.6358 6.6358 6.6358 6.6358 6.8247 6.8247 6.8247 6.8247 7.0666 7.0666 7.0666 7.0666 7.5177 7.5177 7.5177 7.5177 7.6790 7.6790 7.6790 7.6790 8.1033 8.1033 8.1033 8.1033 8.4324 8.4324 8.4324 8.4324 8.8617 8.8617 8.8617 8.8617 9.3276 9.3276 9.3276 9.3276 9.3528 9.3528 9.3528 9.3528 10.1213 10.1213 10.1213 10.1213 10.8144 10.8144 10.8144 10.8144 10.9313 10.9313 10.9313 10.9313 11.2248 11.2248 11.2248 11.2248 11.3252 11.3252 11.3252 11.3252 11.6831 11.6831 11.6832 11.6832 k = 0.0800 0.1386 0.7276 ( 15262 PWs) bands (ev): -1.0325 -1.0325 -1.0325 -1.0325 0.3483 0.3483 0.3483 0.3483 0.3994 0.3994 0.3994 0.3994 0.4736 0.4736 0.4736 0.4736 4.5474 4.5474 4.5474 4.5474 4.6757 4.6757 4.6757 4.6757 5.9251 5.9251 5.9251 5.9251 6.1953 6.1953 6.1953 6.1953 6.6202 6.6202 6.6202 6.6202 6.7978 6.7978 6.7978 6.7978 7.1094 7.1094 7.1094 7.1094 7.5325 7.5325 7.5325 7.5325 7.6929 7.6929 7.6929 7.6929 8.1023 8.1023 8.1023 8.1023 8.4296 8.4296 8.4296 8.4296 8.8352 8.8352 8.8352 8.8352 9.3266 9.3266 9.3266 9.3266 9.3520 9.3520 9.3520 9.3520 10.1142 10.1142 10.1142 10.1142 10.8491 10.8491 10.8491 10.8491 10.9457 10.9457 10.9457 10.9457 11.1945 11.1945 11.1945 11.1945 11.3566 11.3566 11.3566 11.3566 11.6784 11.6784 11.6784 11.6784 k = 0.0667 0.1155 0.7276 ( 15274 PWs) bands (ev): -1.0408 -1.0408 -1.0408 -1.0408 0.3654 0.3654 0.3654 0.3654 0.4061 0.4061 0.4061 0.4061 0.4682 0.4682 0.4682 0.4682 4.5446 4.5446 4.5446 4.5446 4.6417 4.6417 4.6417 4.6417 5.9102 5.9102 5.9102 5.9102 6.2332 6.2332 6.2332 6.2332 6.6079 6.6079 6.6079 6.6079 6.7686 6.7686 6.7686 6.7686 7.1510 7.1510 7.1510 7.1510 7.5445 7.5445 7.5445 7.5445 7.6911 7.6911 7.6911 7.6911 8.1147 8.1147 8.1147 8.1147 8.4303 8.4303 8.4303 8.4303 8.8072 8.8072 8.8072 8.8072 9.3260 9.3260 9.3260 9.3260 9.3516 9.3516 9.3516 9.3516 10.1066 10.1066 10.1066 10.1066 10.8771 10.8771 10.8771 10.8771 10.9600 10.9600 10.9600 10.9600 11.1638 11.1638 11.1638 11.1638 11.3971 11.3971 11.3971 11.3971 11.6769 11.6769 11.6769 11.6769 k = 0.0533 0.0924 0.7276 ( 15286 PWs) bands (ev): -1.0477 -1.0477 -1.0477 -1.0477 0.3811 0.3811 0.3811 0.3811 0.4117 0.4117 0.4117 0.4117 0.4625 0.4625 0.4625 0.4625 4.5415 4.5415 4.5415 4.5415 4.6146 4.6146 4.6146 4.6146 5.8966 5.8966 5.8966 5.8966 6.2695 6.2695 6.2695 6.2695 6.5996 6.5996 6.5996 6.5996 6.7381 6.7381 6.7381 6.7381 7.1904 7.1904 7.1904 7.1904 7.5535 7.5535 7.5535 7.5535 7.6775 7.6775 7.6775 7.6775 8.1356 8.1356 8.1356 8.1356 8.4351 8.4351 8.4351 8.4351 8.7781 8.7781 8.7781 8.7781 9.3256 9.3256 9.3256 9.3256 9.3517 9.3517 9.3517 9.3517 10.0995 10.0995 10.0995 10.0995 10.8980 10.8980 10.8980 10.8980 10.9736 10.9736 10.9736 10.9736 11.1347 11.1347 11.1347 11.1347 11.4458 11.4458 11.4458 11.4458 11.6799 11.6799 11.6799 11.6799 k = 0.0400 0.0693 0.7276 ( 15302 PWs) bands (ev): -1.0532 -1.0532 -1.0532 -1.0532 0.3951 0.3951 0.3951 0.3951 0.4161 0.4161 0.4161 0.4161 0.4565 0.4565 0.4565 0.4565 4.5373 4.5373 4.5373 4.5373 4.5951 4.5951 4.5951 4.5951 5.8853 5.8853 5.8853 5.8853 6.3021 6.3021 6.3021 6.3021 6.5960 6.5960 6.5960 6.5960 6.7073 6.7073 6.7073 6.7073 7.2263 7.2263 7.2263 7.2263 7.5589 7.5589 7.5589 7.5589 7.6587 7.6587 7.6587 7.6587 8.1581 8.1581 8.1581 8.1581 8.4441 8.4441 8.4441 8.4441 8.7495 8.7495 8.7495 8.7495 9.3254 9.3254 9.3254 9.3254 9.3519 9.3519 9.3519 9.3519 10.0935 10.0935 10.0935 10.0935 10.9128 10.9128 10.9128 10.9128 10.9854 10.9854 10.9854 10.9854 11.1092 11.1092 11.1092 11.1092 11.5009 11.5009 11.5009 11.5009 11.6863 11.6863 11.6863 11.6863 k = 0.0267 0.0462 0.7276 ( 15290 PWs) bands (ev): -1.0571 -1.0571 -1.0571 -1.0571 0.4072 0.4072 0.4072 0.4072 0.4193 0.4193 0.4193 0.4193 0.4502 0.4502 0.4502 0.4502 4.5324 4.5324 4.5324 4.5324 4.5831 4.5831 4.5831 4.5831 5.8768 5.8768 5.8768 5.8768 6.3284 6.3284 6.3284 6.3284 6.5982 6.5982 6.5982 6.5982 6.6775 6.6775 6.6775 6.6775 7.2563 7.2563 7.2563 7.2563 7.5601 7.5601 7.5601 7.5601 7.6411 7.6411 7.6411 7.6411 8.1770 8.1770 8.1770 8.1770 8.4560 8.4560 8.4560 8.4560 8.7236 8.7236 8.7236 8.7236 9.3253 9.3253 9.3253 9.3253 9.3521 9.3521 9.3521 9.3521 10.0889 10.0889 10.0889 10.0889 10.9228 10.9228 10.9228 10.9228 10.9947 10.9947 10.9947 10.9947 11.0888 11.0888 11.0888 11.0888 11.5605 11.5605 11.5605 11.5605 11.6939 11.6939 11.6939 11.6939 k = 0.0133 0.0231 0.7276 ( 15296 PWs) bands (ev): -1.0595 -1.0595 -1.0595 -1.0595 0.4168 0.4168 0.4168 0.4168 0.4214 0.4214 0.4214 0.4214 0.4441 0.4441 0.4441 0.4441 4.5282 4.5282 4.5282 4.5282 4.5772 4.5772 4.5772 4.5772 5.8715 5.8715 5.8715 5.8715 6.3458 6.3458 6.3458 6.3458 6.6066 6.6066 6.6066 6.6066 6.6509 6.6509 6.6509 6.6509 7.2769 7.2769 7.2769 7.2769 7.5581 7.5581 7.5581 7.5581 7.6298 7.6298 7.6298 7.6298 8.1891 8.1891 8.1891 8.1891 8.4669 8.4669 8.4669 8.4669 8.7045 8.7045 8.7045 8.7045 9.3253 9.3253 9.3253 9.3253 9.3523 9.3523 9.3523 9.3523 10.0860 10.0860 10.0860 10.0860 10.9286 10.9286 10.9286 10.9286 11.0009 11.0009 11.0009 11.0009 11.0754 11.0754 11.0754 11.0754 11.6215 11.6215 11.6215 11.6215 11.7001 11.7001 11.7001 11.7001 k = 0.0000 0.0000 0.7276 ( 15290 PWs) bands (ev): -1.0603 -1.0603 -1.0603 -1.0603 0.4205 0.4205 0.4205 0.4205 0.4228 0.4228 0.4228 0.4228 0.4408 0.4408 0.4408 0.4408 4.5265 4.5265 4.5265 4.5265 4.5754 4.5754 4.5754 4.5754 5.8698 5.8698 5.8698 5.8698 6.3519 6.3519 6.3519 6.3519 6.6159 6.6159 6.6159 6.6159 6.6353 6.6353 6.6353 6.6353 7.2845 7.2845 7.2845 7.2845 7.5566 7.5566 7.5566 7.5566 7.6261 7.6261 7.6261 7.6261 8.1932 8.1932 8.1932 8.1932 8.4715 8.4715 8.4715 8.4715 8.6973 8.6973 8.6973 8.6973 9.3253 9.3253 9.3253 9.3253 9.3524 9.3524 9.3524 9.3524 10.0851 10.0851 10.0851 10.0851 10.9305 10.9305 10.9305 10.9305 11.0031 11.0031 11.0031 11.0031 11.0706 11.0706 11.0706 11.0706 11.6665 11.6665 11.6665 11.6665 11.7053 11.7053 11.7055 11.7057 k = 0.5000 0.2887 0.7276 ( 15220 PWs) bands (ev): -0.8715 -0.8715 -0.8715 -0.8715 0.0655 0.0655 0.0655 0.0655 0.3419 0.3419 0.3419 0.3419 0.5007 0.5007 0.5007 0.5007 4.5886 4.5886 4.5886 4.5886 5.6481 5.6481 5.6481 5.6481 5.8026 5.8026 5.8026 5.8026 5.9317 5.9317 5.9317 5.9317 6.3157 6.3157 6.3157 6.3157 6.9105 6.9105 6.9105 6.9105 6.9863 6.9863 6.9863 6.9863 7.0916 7.0916 7.0916 7.0916 7.7216 7.7216 7.7216 7.7216 8.0745 8.0745 8.0745 8.0745 8.6795 8.6795 8.6795 8.6795 9.1489 9.1489 9.1489 9.1489 9.2928 9.2928 9.2928 9.2928 9.6464 9.6464 9.6464 9.6464 9.7460 9.7460 9.7460 9.7460 10.5831 10.5831 10.5831 10.5831 10.7924 10.7924 10.7924 10.7924 11.0054 11.0054 11.0054 11.0054 11.1763 11.1763 11.1763 11.1763 11.5395 11.5395 11.5395 11.5395 k = 0.5000 0.2887 0.7006 ( 15230 PWs) bands (ev): -0.9439 -0.9439 -0.7972 -0.7972 0.0128 0.0128 0.1186 0.1186 0.3321 0.3321 0.3384 0.3384 0.4990 0.4990 0.5154 0.5154 4.5594 4.5594 4.6200 4.6200 5.6051 5.6051 5.6907 5.6907 5.7632 5.7632 5.8427 5.8427 5.8975 5.8975 5.9675 5.9675 6.2889 6.2889 6.3441 6.3441 6.8860 6.8860 6.9149 6.9149 6.9402 6.9402 7.0205 7.0205 7.0552 7.0552 7.1565 7.1565 7.6919 7.6919 7.7359 7.7359 8.0531 8.0531 8.1098 8.1098 8.6719 8.6719 8.6795 8.6795 9.0655 9.0655 9.2310 9.2310 9.2885 9.2885 9.3004 9.3004 9.5991 9.5991 9.6825 9.6825 9.7292 9.7292 9.7823 9.7823 10.5120 10.5120 10.6461 10.6461 10.7174 10.7174 10.8713 10.8713 10.9642 10.9642 11.0379 11.0379 11.1112 11.1112 11.2377 11.2377 11.4817 11.4817 11.6004 11.6004 k = 0.5000 0.2887 0.6737 ( 15216 PWs) bands (ev): -1.0140 -1.0140 -0.7210 -0.7210 -0.0393 -0.0393 0.1719 0.1719 0.3134 0.3134 0.3221 0.3221 0.5097 0.5097 0.5389 0.5389 4.5330 4.5330 4.6533 4.6533 5.5625 5.5625 5.7165 5.7165 5.7403 5.7403 5.8643 5.8643 5.8843 5.8843 6.0034 6.0034 6.2647 6.2647 6.3733 6.3733 6.8053 6.8053 6.9146 6.9146 6.9344 6.9344 7.0324 7.0324 7.0453 7.0453 7.2319 7.2319 7.6524 7.6524 7.7304 7.7304 8.0497 8.0497 8.1533 8.1533 8.6565 8.6565 8.6726 8.6726 8.9855 8.9855 9.2726 9.2726 9.3090 9.3090 9.3197 9.3197 9.5650 9.5650 9.6630 9.6630 9.7719 9.7719 9.8228 9.8228 10.4409 10.4409 10.6167 10.6167 10.7312 10.7312 10.8962 10.8962 10.9667 10.9667 11.0330 11.0330 11.0722 11.0722 11.2933 11.2933 11.4287 11.4287 11.6622 11.6622 k = 0.5000 0.2887 0.6467 ( 15222 PWs) bands (ev): -1.0820 -1.0820 -0.6431 -0.6431 -0.0905 -0.0905 0.2253 0.2253 0.2900 0.2900 0.2976 0.2976 0.5283 0.5283 0.5668 0.5668 4.5099 4.5099 4.6877 4.6877 5.5211 5.5211 5.6819 5.6819 5.7768 5.7768 5.8367 5.8367 5.9225 5.9225 6.0366 6.0366 6.2442 6.2442 6.4022 6.4022 6.7072 6.7072 6.9148 6.9148 6.9426 6.9426 7.0235 7.0235 7.0590 7.0590 7.3047 7.3047 7.6073 7.6073 7.7063 7.7063 8.0623 8.0623 8.2001 8.2001 8.6334 8.6334 8.6599 8.6599 8.9106 8.9106 9.2693 9.2693 9.3214 9.3214 9.3659 9.3659 9.5673 9.5673 9.6321 9.6321 9.8267 9.8267 9.8668 9.8668 10.3715 10.3715 10.5396 10.5396 10.7708 10.7708 10.8643 10.8643 10.9489 10.9489 11.0545 11.0545 11.0803 11.0803 11.3419 11.3419 11.3843 11.3843 11.7132 11.7132 k = 0.5000 0.2887 0.6198 ( 15260 PWs) bands (ev): -1.1475 -1.1475 -0.5638 -0.5638 -0.1409 -0.1409 0.2644 0.2644 0.2688 0.2688 0.2787 0.2787 0.5508 0.5508 0.5970 0.5970 4.4903 4.4903 4.7228 4.7228 5.4814 5.4814 5.6440 5.6440 5.8091 5.8091 5.8182 5.8182 5.9584 5.9584 6.0622 6.0622 6.2297 6.2297 6.4279 6.4279 6.6129 6.6129 6.9162 6.9162 6.9546 6.9546 7.0153 7.0153 7.0744 7.0744 7.3705 7.3705 7.5593 7.5593 7.6692 7.6692 8.0846 8.0846 8.2460 8.2460 8.6030 8.6030 8.6424 8.6424 8.8413 8.8413 9.2623 9.2623 9.3344 9.3344 9.3725 9.3725 9.6009 9.6009 9.6233 9.6233 9.8796 9.8796 9.9138 9.9138 10.3057 10.3057 10.4625 10.4625 10.7394 10.7394 10.8634 10.8634 10.9037 10.9037 11.0842 11.0842 11.1195 11.1195 11.3501 11.3501 11.3901 11.3901 11.7333 11.7339 k = 0.5000 0.2887 0.5928 ( 15258 PWs) bands (ev): -1.2107 -1.2107 -0.4834 -0.4834 -0.1901 -0.1901 0.2374 0.2374 0.2390 0.2390 0.3314 0.3314 0.5749 0.5749 0.6280 0.6280 4.4746 4.4746 4.7580 4.7580 5.4439 5.4439 5.6064 5.6064 5.7910 5.7910 5.8515 5.8515 5.9881 5.9881 6.0707 6.0707 6.2249 6.2249 6.4392 6.4392 6.5460 6.5460 6.9187 6.9187 6.9694 6.9694 7.0086 7.0086 7.0909 7.0909 7.4278 7.4278 7.5101 7.5101 7.6249 7.6249 8.1109 8.1109 8.2871 8.2871 8.5664 8.5664 8.6212 8.6212 8.7780 8.7780 9.2533 9.2533 9.3473 9.3473 9.3614 9.3614 9.5727 9.5727 9.7071 9.7071 9.9281 9.9281 9.9617 9.9617 10.2465 10.2465 10.3880 10.3880 10.6764 10.6764 10.7883 10.7883 10.9540 10.9540 11.0833 11.0833 11.1545 11.1545 11.3577 11.3577 11.4273 11.4273 11.6885 11.6886 k = 0.5000 0.2887 0.5659 ( 15256 PWs) bands (ev): -1.2714 -1.2714 -0.4024 -0.4024 -0.2381 -0.2381 0.2064 0.2064 0.2125 0.2125 0.3837 0.3837 0.5995 0.5995 0.6594 0.6594 4.4632 4.4632 4.7926 4.7926 5.4090 5.4090 5.5694 5.5694 5.7744 5.7744 5.8826 5.8826 6.0017 6.0017 6.0548 6.0548 6.2337 6.2337 6.4208 6.4208 6.5374 6.5374 6.9218 6.9218 6.9859 6.9859 7.0032 7.0032 7.1094 7.1094 7.4583 7.4583 7.4769 7.4769 7.5782 7.5782 8.1372 8.1372 8.3195 8.3195 8.5252 8.5252 8.5973 8.5973 8.7209 8.7209 9.2429 9.2429 9.3524 9.3524 9.3588 9.3588 9.5475 9.5475 9.7971 9.7971 9.9695 9.9695 10.0057 10.0057 10.2004 10.2004 10.3172 10.3172 10.6108 10.6108 10.7082 10.7082 11.0069 11.0069 11.0809 11.0809 11.1468 11.1468 11.4111 11.4111 11.4599 11.4599 11.6535 11.6535 k = 0.5000 0.2887 0.5390 ( 15258 PWs) bands (ev): -1.3295 -1.3295 -0.3218 -0.3218 -0.2847 -0.2847 0.1749 0.1749 0.1879 0.1879 0.4351 0.4351 0.6238 0.6238 0.6907 0.6907 4.4561 4.4561 4.8262 4.8262 5.3770 5.3770 5.5331 5.5331 5.7605 5.7605 5.9019 5.9019 5.9661 5.9661 6.0488 6.0488 6.2548 6.2548 6.4078 6.4078 6.5606 6.5606 6.9254 6.9254 6.9970 6.9970 7.0051 7.0051 7.1305 7.1305 7.4104 7.4104 7.4981 7.4981 7.5458 7.5458 8.1612 8.1612 8.3392 8.3392 8.4821 8.4821 8.5714 8.5714 8.6701 8.6701 9.2316 9.2316 9.3551 9.3551 9.3642 9.3642 9.5279 9.5279 9.8781 9.8781 9.9929 9.9929 10.0453 10.0453 10.1796 10.1796 10.2515 10.2515 10.5523 10.5523 10.6304 10.6304 11.0490 11.0490 11.0812 11.0812 11.1200 11.1200 11.4873 11.4873 11.4889 11.4889 11.6224 11.6224 k = 0.5000 0.2887 0.5120 ( 15260 PWs) bands (ev): -1.3851 -1.3851 -0.3298 -0.3298 -0.2427 -0.2427 0.1436 0.1436 0.1661 0.1661 0.4856 0.4856 0.6476 0.6476 0.7219 0.7219 4.4536 4.4536 4.8581 4.8581 5.3480 5.3480 5.4978 5.4978 5.7441 5.7441 5.8523 5.8523 5.9514 5.9514 6.0567 6.0567 6.2844 6.2844 6.4156 6.4156 6.5920 6.5920 6.9292 6.9292 6.9937 6.9937 7.0217 7.0217 7.1543 7.1543 7.3626 7.3626 7.4636 7.4636 7.5620 7.5620 8.1814 8.1814 8.3408 8.3408 8.4427 8.4427 8.5444 8.5444 8.6253 8.6253 9.2193 9.2193 9.3612 9.3612 9.3713 9.3713 9.5160 9.5160 9.9202 9.9202 10.0055 10.0055 10.0840 10.0840 10.1790 10.1790 10.2007 10.2007 10.5104 10.5104 10.5604 10.5604 11.0661 11.0661 11.0729 11.0729 11.1127 11.1127 11.5093 11.5093 11.5751 11.5751 11.5979 11.5979 k = 0.5000 0.2887 0.4851 ( 15258 PWs) bands (ev): -1.4380 -1.4380 -0.3732 -0.3732 -0.1680 -0.1680 0.1129 0.1129 0.1496 0.1496 0.5348 0.5348 0.6705 0.6705 0.7530 0.7530 4.4557 4.4557 4.8880 4.8880 5.3223 5.3223 5.4635 5.4635 5.6917 5.6917 5.7860 5.7860 5.9679 5.9679 6.0661 6.0661 6.3190 6.3190 6.4350 6.4350 6.6266 6.6266 6.9334 6.9334 6.9906 6.9906 7.0374 7.0374 7.1797 7.1797 7.3171 7.3171 7.4184 7.4184 7.5831 7.5831 8.1966 8.1966 8.3182 8.3182 8.4154 8.4154 8.5172 8.5172 8.5863 8.5863 9.2058 9.2058 9.3485 9.3485 9.4013 9.4013 9.5116 9.5116 9.8990 9.8990 10.0347 10.0347 10.1076 10.1076 10.1425 10.1425 10.2120 10.2120 10.4775 10.4775 10.5276 10.5276 11.0370 11.0370 11.0757 11.0757 11.1300 11.1300 11.5257 11.5257 11.5833 11.5833 11.6641 11.6641 k = 0.5000 0.2887 0.4581 ( 15258 PWs) bands (ev): -1.4882 -1.4882 -0.4149 -0.4149 -0.1034 -0.1034 0.0830 0.0830 0.1438 0.1438 0.5825 0.5825 0.6924 0.6924 0.7841 0.7841 4.4624 4.4624 4.9154 4.9154 5.2996 5.2996 5.4303 5.4303 5.5799 5.5799 5.7697 5.7697 5.9841 5.9841 6.0774 6.0774 6.3548 6.3548 6.4579 6.4579 6.6634 6.6634 6.9382 6.9382 6.9880 6.9880 7.0505 7.0505 7.2015 7.2015 7.2750 7.2750 7.3808 7.3808 7.5965 7.5965 8.2039 8.2039 8.2782 8.2782 8.3992 8.3992 8.4912 8.4912 8.5523 8.5523 9.1908 9.1908 9.3282 9.3282 9.4434 9.4434 9.5111 9.5111 9.8548 9.8548 10.0420 10.0420 10.0796 10.0796 10.1363 10.1363 10.2397 10.2397 10.4386 10.4386 10.5633 10.5633 11.0006 11.0006 11.0854 11.0854 11.1375 11.1375 11.5362 11.5362 11.5808 11.5808 11.7530 11.7531 k = 0.5000 0.2887 0.4312 ( 15258 PWs) bands (ev): -1.5358 -1.5358 -0.4548 -0.4548 -0.0590 -0.0590 0.0541 0.0541 0.1584 0.1584 0.6286 0.6286 0.7131 0.7131 0.8156 0.8156 4.4733 4.4733 4.9401 4.9401 5.2792 5.2792 5.3977 5.3977 5.4536 5.4536 5.7681 5.7681 5.9979 5.9979 6.0920 6.0920 6.3871 6.3871 6.4815 6.4815 6.7013 6.7013 6.9440 6.9440 6.9862 6.9862 7.0604 7.0604 7.2067 7.2067 7.2381 7.2381 7.3648 7.3648 7.6005 7.6005 8.1901 8.1901 8.2452 8.2452 8.3865 8.3865 8.4679 8.4679 8.5225 8.5225 9.1746 9.1746 9.3034 9.3034 9.4935 9.4935 9.5104 9.5104 9.8053 9.8053 10.0156 10.0156 10.0451 10.0451 10.1197 10.1197 10.2760 10.2760 10.4252 10.4252 10.6360 10.6360 10.9649 10.9649 11.0974 11.0974 11.1335 11.1335 11.5404 11.5404 11.5904 11.5904 11.7664 11.7664 k = 0.5000 0.2887 0.4042 ( 15266 PWs) bands (ev): -1.5806 -1.5806 -0.4927 -0.4927 -0.0416 -0.0416 0.0264 0.0264 0.1996 0.1996 0.6727 0.6727 0.7326 0.7326 0.8479 0.8479 4.4879 4.4879 4.9615 4.9615 5.2542 5.2542 5.3252 5.3252 5.3735 5.3735 5.7715 5.7715 6.0093 6.0093 6.1106 6.1106 6.4086 6.4086 6.5078 6.5078 6.7387 6.7387 6.9517 6.9517 6.9851 6.9851 7.0667 7.0667 7.1883 7.1883 7.2055 7.2055 7.3800 7.3800 7.5949 7.5949 8.1442 8.1442 8.2366 8.2366 8.3738 8.3738 8.4494 8.4494 8.4967 8.4967 9.1574 9.1574 9.2763 9.2763 9.5031 9.5031 9.5495 9.5495 9.7548 9.7548 9.9710 9.9710 10.0204 10.0204 10.0804 10.0804 10.3139 10.3139 10.4431 10.4431 10.7267 10.7267 10.9307 10.9307 11.0967 11.0967 11.1356 11.1356 11.5382 11.5382 11.6094 11.6094 11.7454 11.7454 k = 0.5000 0.2887 0.3773 ( 15254 PWs) bands (ev): -1.6226 -1.6226 -0.5285 -0.5285 -0.0437 -0.0437 0.0000 0.0000 0.2589 0.2589 0.7149 0.7149 0.7507 0.7507 0.8817 0.8817 4.5051 4.5051 4.9787 4.9787 5.1708 5.1708 5.2669 5.2669 5.3454 5.3454 5.7784 5.7784 6.0184 6.0184 6.1332 6.1332 6.4128 6.4128 6.5402 6.5402 6.7732 6.7732 6.9626 6.9626 6.9844 6.9844 7.0689 7.0689 7.1612 7.1612 7.1745 7.1745 7.4149 7.4149 7.5804 7.5804 8.0881 8.0881 8.2339 8.2339 8.3599 8.3599 8.4365 8.4365 8.4758 8.4758 9.1395 9.1395 9.2485 9.2485 9.4905 9.4905 9.6007 9.6007 9.7049 9.7049 9.9244 9.9244 10.0077 10.0077 10.0262 10.0262 10.3504 10.3504 10.4826 10.4826 10.8247 10.8247 10.8984 10.8984 11.0733 11.0733 11.1576 11.1576 11.5292 11.5292 11.6345 11.6345 11.7289 11.7289 k = 0.5000 0.2887 0.3503 ( 15278 PWs) bands (ev): -1.6618 -1.6618 -0.5622 -0.5622 -0.0550 -0.0550 -0.0249 -0.0249 0.3251 0.3251 0.7548 0.7548 0.7675 0.7675 0.9178 0.9178 4.5225 4.5225 4.9842 4.9842 5.0594 5.0594 5.2507 5.2507 5.3224 5.3224 5.7886 5.7886 6.0253 6.0253 6.1597 6.1597 6.3994 6.3994 6.5778 6.5778 6.8016 6.8016 6.9774 6.9774 6.9833 6.9833 7.0661 7.0661 7.1333 7.1333 7.1517 7.1517 7.4549 7.4549 7.5609 7.5609 8.0307 8.0307 8.2305 8.2305 8.3446 8.3446 8.4259 8.4259 8.4639 8.4639 9.1213 9.1213 9.2209 9.2209 9.4709 9.4709 9.6329 9.6329 9.6601 9.6601 9.8913 9.8913 9.9657 9.9657 10.0069 10.0069 10.3855 10.3855 10.5337 10.5337 10.8676 10.8676 10.9229 10.9229 11.0441 11.0441 11.1878 11.1878 11.5132 11.5132 11.6626 11.6626 11.7168 11.7168 k = 0.5000 0.2887 0.3234 ( 15266 PWs) bands (ev): -1.6982 -1.6982 -0.5937 -0.5937 -0.0699 -0.0699 -0.0484 -0.0484 0.3911 0.3911 0.7829 0.7829 0.7922 0.7922 0.9571 0.9571 4.5341 4.5341 4.9189 4.9189 5.0239 5.0239 5.2385 5.2385 5.3051 5.3051 5.8023 5.8023 6.0301 6.0301 6.1886 6.1886 6.3719 6.3719 6.6175 6.6175 6.8216 6.8216 6.9790 6.9790 6.9929 6.9929 7.0611 7.0611 7.1128 7.1128 7.1375 7.1375 7.4780 7.4780 7.5541 7.5541 7.9748 7.9748 8.2258 8.2258 8.3288 8.3288 8.4120 8.4120 8.4658 8.4658 9.1029 9.1029 9.1942 9.1942 9.4453 9.4453 9.6032 9.6032 9.6465 9.6465 9.8875 9.8875 9.9055 9.9055 10.0168 10.0168 10.4191 10.4191 10.5910 10.5910 10.8396 10.8396 10.9849 10.9849 11.0469 11.0469 11.2231 11.2231 11.4905 11.4905 11.6916 11.6916 11.7090 11.7090 k = 0.5000 0.2887 0.2964 ( 15272 PWs) bands (ev): -1.7318 -1.7318 -0.6230 -0.6230 -0.0859 -0.0859 -0.0703 -0.0703 0.4533 0.4533 0.7969 0.7969 0.8272 0.8272 1.0006 1.0006 4.5259 4.5259 4.8357 4.8357 5.0297 5.0297 5.2253 5.2253 5.2949 5.2949 5.8199 5.8199 6.0332 6.0332 6.2165 6.2165 6.3359 6.3359 6.6568 6.6568 6.8325 6.8325 6.9674 6.9674 6.9988 6.9988 7.0667 7.0667 7.1044 7.1044 7.1295 7.1295 7.4576 7.4576 7.5849 7.5849 7.9223 7.9223 8.2200 8.2200 8.3136 8.3136 8.3959 8.3959 8.4791 8.4791 9.0846 9.0846 9.1689 9.1689 9.4156 9.4156 9.5580 9.5580 9.6169 9.6169 9.8408 9.8408 9.9206 9.9206 10.0356 10.0356 10.4513 10.4513 10.6511 10.6511 10.8143 10.8143 10.9624 10.9624 11.1315 11.1315 11.2623 11.2623 11.4615 11.4615 11.7055 11.7055 11.7203 11.7203 k = 0.5000 0.2887 0.2695 ( 15278 PWs) bands (ev): -1.7625 -1.7625 -0.6499 -0.6499 -0.1018 -0.1018 -0.0906 -0.0906 0.5094 0.5094 0.8096 0.8096 0.8594 0.8594 1.0488 1.0488 4.4779 4.4779 4.7961 4.7961 5.0367 5.0367 5.2102 5.2102 5.2920 5.2920 5.8414 5.8414 6.0346 6.0346 6.2278 6.2278 6.3086 6.3086 6.6936 6.6936 6.8347 6.8347 6.9489 6.9489 6.9932 6.9932 7.0827 7.0827 7.1099 7.1099 7.1267 7.1267 7.4176 7.4176 7.6285 7.6285 7.8751 7.8751 8.2138 8.2138 8.2998 8.2998 8.3798 8.3798 8.5000 8.5000 9.0667 9.0667 9.1453 9.1453 9.3836 9.3836 9.5141 9.5141 9.5712 9.5712 9.7818 9.7818 9.9643 9.9643 10.0616 10.0616 10.4818 10.4818 10.7097 10.7097 10.7947 10.7947 10.9322 10.9322 11.2213 11.2213 11.3050 11.3050 11.4271 11.4271 11.7063 11.7063 11.7477 11.7477 k = 0.5000 0.2887 0.2425 ( 15286 PWs) bands (ev): -1.7904 -1.7904 -0.6744 -0.6744 -0.1170 -0.1170 -0.1090 -0.1090 0.5579 0.5579 0.8209 0.8209 0.8889 0.8889 1.1019 1.1019 4.3927 4.3927 4.8012 4.8012 5.0424 5.0424 5.1943 5.1943 5.2949 5.2949 5.8670 5.8670 6.0343 6.0343 6.1943 6.1943 6.3197 6.3197 6.7253 6.7253 6.8281 6.8281 6.9317 6.9317 6.9829 6.9829 7.0919 7.0919 7.1214 7.1214 7.1395 7.1395 7.3718 7.3718 7.6684 7.6684 7.8372 7.8372 8.2079 8.2079 8.2878 8.2878 8.3645 8.3645 8.5260 8.5260 9.0494 9.0494 9.1237 9.1237 9.3509 9.3509 9.4726 9.4726 9.5200 9.5200 9.7257 9.7257 10.0096 10.0096 10.0931 10.0931 10.5102 10.5102 10.7435 10.7435 10.8028 10.8028 10.9056 10.9056 11.3048 11.3048 11.3513 11.3513 11.3884 11.3884 11.7110 11.7110 11.7733 11.7733 k = 0.5000 0.2887 0.2156 ( 15296 PWs) bands (ev): -1.8153 -1.8153 -0.6964 -0.6964 -0.1311 -0.1311 -0.1257 -0.1257 0.5987 0.5987 0.8309 0.8309 0.9154 0.9154 1.1589 1.1589 4.2919 4.2919 4.8308 4.8308 5.0465 5.0465 5.1790 5.1790 5.3018 5.3018 5.8966 5.8966 6.0315 6.0315 6.1384 6.1384 6.3484 6.3484 6.7475 6.7475 6.8148 6.8148 6.9220 6.9220 6.9718 6.9718 7.0960 7.0960 7.1254 7.1254 7.1697 7.1697 7.3245 7.3245 7.6916 7.6916 7.8184 7.8184 8.2029 8.2029 8.2779 8.2779 8.3503 8.3503 8.5558 8.5558 9.0327 9.0327 9.1044 9.1044 9.3189 9.3189 9.4339 9.4339 9.4682 9.4682 9.6733 9.6733 10.0509 10.0509 10.1281 10.1281 10.5363 10.5363 10.7344 10.7344 10.8540 10.8540 10.8867 10.8867 11.3447 11.3447 11.3779 11.3779 11.4050 11.4050 11.7193 11.7193 11.7970 11.7970 k = 0.5000 0.2887 0.1886 ( 15312 PWs) bands (ev): -1.8373 -1.8373 -0.7160 -0.7160 -0.1440 -0.1440 -0.1406 -0.1406 0.6319 0.6319 0.8396 0.8396 0.9390 0.9390 1.2183 1.2183 4.1890 4.1890 4.8720 4.8720 5.0492 5.0492 5.1653 5.1653 5.3114 5.3114 5.9298 5.9298 6.0208 6.0208 6.0824 6.0824 6.3781 6.3781 6.7531 6.7531 6.8036 6.8036 6.9186 6.9186 6.9649 6.9649 7.0959 7.0959 7.1308 7.1308 7.2007 7.2007 7.2792 7.2792 7.6867 7.6867 7.8287 7.8287 8.1992 8.1992 8.2701 8.2701 8.3373 8.3373 8.5879 8.5879 9.0170 9.0170 9.0874 9.0874 9.2884 9.2884 9.3982 9.3982 9.4181 9.4181 9.6252 9.6252 10.0862 10.0862 10.1640 10.1640 10.5598 10.5598 10.7183 10.7183 10.8676 10.8676 10.9203 10.9203 11.3011 11.3011 11.4350 11.4350 11.4661 11.4661 11.7308 11.7308 11.8186 11.8187 k = 0.5000 0.2887 0.1617 ( 15304 PWs) bands (ev): -1.8565 -1.8565 -0.7330 -0.7330 -0.1553 -0.1553 -0.1535 -0.1535 0.6583 0.6583 0.8471 0.8471 0.9595 0.9595 1.2780 1.2780 4.0906 4.0906 4.9186 4.9186 5.0510 5.0510 5.1539 5.1539 5.3226 5.3226 5.9661 5.9661 5.9809 5.9809 6.0526 6.0526 6.4028 6.4028 6.7421 6.7421 6.7994 6.7994 6.9142 6.9142 6.9688 6.9688 7.0906 7.0906 7.1360 7.1360 7.2293 7.2293 7.2403 7.2403 7.6647 7.6647 7.8558 7.8558 8.1973 8.1973 8.2646 8.2646 8.3253 8.3253 8.6213 8.6213 9.0024 9.0024 9.0730 9.0730 9.2603 9.2603 9.3632 9.3632 9.3737 9.3737 9.5821 9.5821 10.1151 10.1151 10.1988 10.1988 10.5804 10.5804 10.7029 10.7029 10.8618 10.8618 10.9798 10.9798 11.2566 11.2566 11.4864 11.4864 11.5252 11.5252 11.7450 11.7450 11.8384 11.8384 k = 0.5000 0.2887 0.1347 ( 15302 PWs) bands (ev): -1.8727 -1.8727 -0.7475 -0.7475 -0.1651 -0.1651 -0.1644 -0.1644 0.6790 0.6790 0.8533 0.8533 0.9770 0.9770 1.3352 1.3352 4.0006 4.0006 4.9662 4.9662 5.0523 5.0523 5.1461 5.1461 5.3345 5.3345 5.9182 5.9182 6.0050 6.0050 6.0447 6.0447 6.4182 6.4182 6.7290 6.7290 6.7952 6.7952 6.9070 6.9070 6.9820 6.9820 7.0785 7.0785 7.1371 7.1371 7.2142 7.2142 7.2545 7.2545 7.6392 7.6392 7.8851 7.8851 8.1973 8.1973 8.2611 8.2611 8.3145 8.3145 8.6547 8.6547 8.9893 8.9893 9.0611 9.0611 9.2353 9.2353 9.3221 9.3221 9.3430 9.3430 9.5443 9.5443 10.1371 10.1371 10.2314 10.2314 10.5979 10.5979 10.6891 10.6891 10.8617 10.8617 11.0367 11.0367 11.2135 11.2135 11.5359 11.5359 11.5761 11.5761 11.7611 11.7611 11.8562 11.8562 k = 0.5000 0.2887 0.1078 ( 15296 PWs) bands (ev): -1.8859 -1.8859 -0.7594 -0.7594 -0.1738 -0.1738 -0.1729 -0.1729 0.6947 0.6947 0.8583 0.8583 0.9913 0.9913 1.3873 1.3873 3.9220 3.9220 5.0092 5.0092 5.0543 5.0543 5.1439 5.1439 5.3463 5.3463 5.8530 5.8530 6.0416 6.0416 6.0451 6.0451 6.4209 6.4209 6.7231 6.7231 6.7895 6.7895 6.9000 6.9000 6.9941 6.9941 7.0620 7.0620 7.1329 7.1329 7.2039 7.2039 7.2754 7.2754 7.6154 7.6154 7.9111 7.9111 8.1991 8.1991 8.2592 8.2592 8.3051 8.3051 8.6865 8.6865 8.9778 8.9778 9.0518 9.0518 9.2137 9.2137 9.2824 9.2824 9.3198 9.3198 9.5126 9.5126 10.1524 10.1524 10.2612 10.2612 10.6124 10.6124 10.6776 10.6776 10.8661 10.8661 11.0881 11.0881 11.1738 11.1738 11.5831 11.5831 11.6175 11.6175 11.7784 11.7784 11.8719 11.8719 k = 0.5000 0.2887 0.0808 ( 15312 PWs) bands (ev): -1.8962 -1.8962 -0.7687 -0.7687 -0.1808 -0.1808 -0.1793 -0.1793 0.7062 0.7062 0.8622 0.8622 1.0024 1.0024 1.4315 1.4315 3.8574 3.8574 5.0366 5.0366 5.0614 5.0614 5.1515 5.1515 5.3572 5.3572 5.7918 5.7918 6.0400 6.0400 6.0845 6.0845 6.4109 6.4109 6.7249 6.7249 6.7861 6.7861 6.8947 6.8947 6.9884 6.9884 7.0565 7.0565 7.1265 7.1265 7.2034 7.2034 7.2918 7.2918 7.5952 7.5952 7.9317 7.9317 8.2023 8.2023 8.2580 8.2580 8.2976 8.2976 8.7149 8.7149 8.9684 8.9684 9.0448 9.0448 9.1963 9.1963 9.2480 9.2480 9.3019 9.3019 9.4873 9.4873 10.1619 10.1619 10.2871 10.2871 10.6237 10.6237 10.6684 10.6684 10.8730 10.8730 11.1296 11.1296 11.1415 11.1415 11.6262 11.6262 11.6492 11.6492 11.7960 11.7960 11.8844 11.8844 k = 0.5000 0.2887 0.0539 ( 15298 PWs) bands (ev): -1.9036 -1.9036 -0.7753 -0.7753 -0.1859 -0.1859 -0.1839 -0.1839 0.7141 0.7141 0.8650 0.8650 1.0104 1.0104 1.4654 1.4654 3.8092 3.8092 5.0439 5.0439 5.0724 5.0724 5.1699 5.1699 5.3666 5.3666 5.7398 5.7398 6.0390 6.0390 6.1206 6.1206 6.3927 6.3927 6.7287 6.7287 6.7898 6.7898 6.8912 6.8912 6.9641 6.9641 7.0670 7.0670 7.1194 7.1194 7.2060 7.2060 7.3036 7.3036 7.5799 7.5799 7.9463 7.9463 8.2061 8.2061 8.2568 8.2568 8.2924 8.2924 8.7380 8.7380 8.9615 8.9615 9.0400 9.0400 9.1834 9.1834 9.2209 9.2209 9.2890 9.2890 9.4689 9.4689 10.1672 10.1672 10.3075 10.3075 10.6320 10.6320 10.6617 10.6617 10.8799 10.8799 11.1115 11.1115 11.1664 11.1664 11.6617 11.6617 11.6715 11.6715 11.8130 11.8130 11.8841 11.8843 k = 0.5000 0.2887 0.0269 ( 15282 PWs) bands (ev): -1.9080 -1.9080 -0.7793 -0.7793 -0.1889 -0.1889 -0.1866 -0.1866 0.7186 0.7186 0.8666 0.8666 1.0152 1.0152 1.4866 1.4866 3.7794 3.7794 5.0454 5.0454 5.0777 5.0777 5.1894 5.1894 5.3734 5.3734 5.7035 5.7035 6.0384 6.0384 6.1480 6.1480 6.3747 6.3747 6.7300 6.7300 6.8002 6.8002 6.8892 6.8892 6.9394 6.9394 7.0801 7.0801 7.1119 7.1119 7.2084 7.2084 7.3107 7.3107 7.5703 7.5703 7.9550 7.9550 8.2093 8.2093 8.2554 8.2554 8.2896 8.2896 8.7531 8.7531 8.9573 8.9573 9.0372 9.0372 9.1754 9.1754 9.2034 9.2034 9.2812 9.2812 9.4578 9.4578 10.1697 10.1697 10.3208 10.3208 10.6372 10.6372 10.6574 10.6574 10.8849 10.8849 11.0944 11.0944 11.1877 11.1877 11.6825 11.6825 11.6880 11.6880 11.8292 11.8292 11.8659 11.8659 k = 0.5000 0.2887-0.0000 ( 15278 PWs) bands (ev): -1.9095 -1.9095 -0.7806 -0.7806 -0.1899 -0.1899 -0.1875 -0.1875 0.7201 0.7201 0.8672 0.8672 1.0168 1.0168 1.4939 1.4939 3.7693 3.7693 5.0456 5.0456 5.0790 5.0790 5.1975 5.1975 5.3760 5.3760 5.6902 5.6902 6.0382 6.0382 6.1587 6.1587 6.3668 6.3668 6.7300 6.7300 6.8065 6.8065 6.8885 6.8885 6.9286 6.9286 7.0871 7.0871 7.1072 7.1072 7.2093 7.2093 7.3130 7.3130 7.5670 7.5670 7.9578 7.9578 8.2105 8.2105 8.2547 8.2547 8.2888 8.2888 8.7585 8.7585 8.9559 8.9559 9.0363 9.0363 9.1727 9.1727 9.1973 9.1973 9.2786 9.2786 9.4540 9.4540 10.1704 10.1704 10.3254 10.3254 10.6391 10.6391 10.6559 10.6559 10.8868 10.8868 11.0884 11.0884 11.1950 11.1950 11.6873 11.6873 11.6961 11.6961 11.8409 11.8409 11.8531 11.8532 k = 0.3333 0.5774-0.0000 ( 15312 PWs) bands (ev): -1.8761 -1.8761 -0.6287 -0.6287 -0.6284 -0.6284 0.0004 0.0004 0.8215 0.8215 0.9217 0.9217 0.9239 0.9239 1.4933 1.4933 3.7548 3.7548 4.8864 4.8864 4.9752 4.9752 5.5044 5.5044 5.5059 5.5059 5.7323 5.7323 5.7976 5.7976 6.1907 6.1907 6.4690 6.4690 6.8080 6.8080 6.8662 6.8662 6.9437 6.9437 6.9675 6.9675 7.0384 7.0384 7.0601 7.0601 7.1313 7.1313 7.4526 7.4526 7.7128 7.7128 7.7405 7.7405 7.8661 7.8661 8.3392 8.3392 8.3842 8.3842 8.3884 8.3884 9.0377 9.0377 9.1269 9.1269 9.1620 9.1620 9.1804 9.1804 9.8651 9.8651 9.8882 9.8882 9.9253 9.9253 9.9948 9.9948 10.2949 10.2949 10.3599 10.3599 10.8767 10.8767 11.2408 11.2408 11.3686 11.3686 11.7224 11.7224 11.7379 11.7379 11.7451 11.7451 11.8364 11.8366 k = 0.3333 0.5774 0.0269 ( 15294 PWs) bands (ev): -1.8746 -1.8746 -0.6275 -0.6275 -0.6272 -0.6272 0.0011 0.0011 0.8202 0.8202 0.9206 0.9206 0.9228 0.9228 1.4857 1.4857 3.7654 3.7654 4.8839 4.8839 4.9720 4.9720 5.5048 5.5048 5.5049 5.5049 5.7368 5.7368 5.7996 5.7996 6.1794 6.1794 6.4806 6.4806 6.8054 6.8054 6.8547 6.8547 6.9345 6.9345 6.9782 6.9782 7.0436 7.0436 7.0612 7.0612 7.1398 7.1398 7.4514 7.4514 7.7109 7.7109 7.7410 7.7410 7.8659 7.8659 8.3389 8.3389 8.3830 8.3830 8.3867 8.3867 9.0382 9.0382 9.1294 9.1294 9.1651 9.1651 9.1835 9.1835 9.8623 9.8623 9.8911 9.8911 9.9203 9.9203 9.9996 9.9996 10.2965 10.2965 10.3610 10.3610 10.8754 10.8754 11.2417 11.2417 11.3603 11.3603 11.7264 11.7264 11.7353 11.7353 11.7366 11.7366 11.8379 11.8381 k = 0.3333 0.5774 0.0539 ( 15282 PWs) bands (ev): -1.8702 -1.8702 -0.6237 -0.6237 -0.6234 -0.6234 0.0032 0.0032 0.8163 0.8163 0.9174 0.9174 0.9195 0.9195 1.4634 1.4634 3.7965 3.7965 4.8766 4.8766 4.9627 4.9627 5.5025 5.5025 5.5058 5.5058 5.7498 5.7498 5.8052 5.8052 6.1503 6.1503 6.5108 6.5108 6.7919 6.7919 6.8375 6.8375 6.9109 6.9109 6.9960 6.9960 7.0621 7.0621 7.0627 7.0627 7.1632 7.1632 7.4478 7.4478 7.7056 7.7056 7.7424 7.7424 7.8655 7.8655 8.3378 8.3378 8.3795 8.3795 8.3819 8.3819 9.0397 9.0397 9.1368 9.1368 9.1744 9.1744 9.1927 9.1927 9.8565 9.8565 9.8973 9.8973 9.9084 9.9084 10.0111 10.0111 10.3015 10.3015 10.3644 10.3644 10.8714 10.8714 11.2443 11.2443 11.3381 11.3381 11.7050 11.7050 11.7121 11.7121 11.7594 11.7594 11.8459 11.8474 k = 0.3333 0.5774 0.0808 ( 15282 PWs) bands (ev): -1.8629 -1.8629 -0.6174 -0.6174 -0.6171 -0.6171 0.0066 0.0066 0.8096 0.8096 0.9119 0.9119 0.9141 0.9141 1.4280 1.4280 3.8468 3.8468 4.8649 4.8649 4.9480 4.9480 5.4996 5.4996 5.5077 5.5077 5.7695 5.7695 5.8140 5.8140 6.1115 6.1115 6.5506 6.5506 6.7610 6.7610 6.8323 6.8323 6.8793 6.8793 7.0079 7.0079 7.0629 7.0629 7.0958 7.0958 7.1968 7.1968 7.4420 7.4420 7.6974 7.6974 7.7441 7.7441 7.8647 7.8647 8.3364 8.3364 8.3738 8.3738 8.3742 8.3742 9.0426 9.0426 9.1487 9.1487 9.1895 9.1895 9.2077 9.2077 9.8500 9.8500 9.8938 9.8938 9.9045 9.9045 10.0246 10.0246 10.3102 10.3102 10.3702 10.3702 10.8638 10.8638 11.2482 11.2482 11.3080 11.3080 11.6688 11.6688 11.6740 11.6740 11.7968 11.7968 11.8356 11.8357 k = 0.3333 0.5774 0.1078 ( 15276 PWs) bands (ev): -1.8527 -1.8527 -0.6087 -0.6087 -0.6084 -0.6084 0.0113 0.0113 0.7998 0.7998 0.9043 0.9043 0.9064 0.9064 1.3816 1.3816 3.9145 3.9145 4.8496 4.8496 4.9288 4.9288 5.4973 5.4973 5.5106 5.5106 5.7940 5.7940 5.8251 5.8251 6.0690 6.0690 6.5933 6.5933 6.7218 6.7218 6.8349 6.8349 6.8432 6.8432 7.0147 7.0147 7.0615 7.0615 7.1397 7.1397 7.2375 7.2375 7.4341 7.4341 7.6869 7.6869 7.7456 7.7456 7.8633 7.8633 8.3350 8.3350 8.3641 8.3641 8.3665 8.3665 9.0470 9.0470 9.1647 9.1647 9.2101 9.2101 9.2280 9.2280 9.8435 9.8435 9.8785 9.8785 9.9118 9.9118 10.0381 10.0381 10.3229 10.3229 10.3786 10.3786 10.8513 10.8513 11.2451 11.2451 11.2834 11.2834 11.6232 11.6232 11.6262 11.6262 11.7835 11.7836 11.8400 11.8401 k = 0.3333 0.5774 0.1347 ( 15270 PWs) bands (ev): -1.8395 -1.8395 -0.5974 -0.5974 -0.5972 -0.5972 0.0171 0.0171 0.7862 0.7862 0.8944 0.8944 0.8965 0.8965 1.3271 1.3271 3.9973 3.9973 4.8315 4.8315 4.9062 4.9062 5.4960 5.4960 5.5146 5.5146 5.8216 5.8216 5.8373 5.8373 6.0262 6.0262 6.6316 6.6316 6.6824 6.6824 6.8044 6.8044 6.8416 6.8416 7.0189 7.0189 7.0583 7.0583 7.1900 7.1900 7.2835 7.2835 7.4244 7.4244 7.6748 7.6748 7.7466 7.7466 7.8613 7.8613 8.3338 8.3338 8.3523 8.3523 8.3582 8.3582 9.0531 9.0531 9.1844 9.1844 9.2354 9.2354 9.2529 9.2529 9.8372 9.8372 9.8632 9.8632 9.9195 9.9195 10.0508 10.0508 10.3397 10.3397 10.3896 10.3896 10.8333 10.8333 11.2160 11.2160 11.2865 11.2865 11.5717 11.5717 11.5724 11.5724 11.7228 11.7228 11.8647 11.8651 k = 0.3333 0.5774 0.1617 ( 15270 PWs) bands (ev): -1.8234 -1.8234 -0.5838 -0.5838 -0.5835 -0.5835 0.0241 0.0241 0.7681 0.7681 0.8822 0.8822 0.8843 0.8843 1.2673 1.2673 4.0930 4.0930 4.8114 4.8114 4.8815 4.8815 5.4960 5.4960 5.5195 5.5195 5.8491 5.8491 5.8512 5.8512 5.9857 5.9857 6.6253 6.6253 6.6818 6.6818 6.7640 6.7640 6.8520 6.8520 7.0210 7.0210 7.0532 7.0532 7.2449 7.2449 7.3339 7.3339 7.4133 7.4133 7.6620 7.6620 7.7469 7.7469 7.8583 7.8583 8.3325 8.3325 8.3403 8.3403 8.3494 8.3494 9.0611 9.0611 9.2075 9.2075 9.2649 9.2649 9.2815 9.2815 9.8304 9.8304 9.8482 9.8482 9.9281 9.9281 10.0627 10.0627 10.3607 10.3607 10.4035 10.4035 10.8093 10.8093 11.1765 11.1765 11.3022 11.3022 11.5160 11.5160 11.5178 11.5178 11.6556 11.6556 11.8774 11.8775 k = 0.3333 0.5774 0.1886 ( 15246 PWs) bands (ev): -1.8044 -1.8044 -0.5677 -0.5677 -0.5675 -0.5675 0.0320 0.0320 0.7445 0.7445 0.8678 0.8678 0.8698 0.8698 1.2056 1.2056 4.1996 4.1996 4.7905 4.7905 4.8559 4.8559 5.4969 5.4969 5.5250 5.5250 5.8573 5.8573 5.8818 5.8818 5.9513 5.9513 6.5827 6.5827 6.7097 6.7097 6.7228 6.7228 6.8656 6.8656 7.0211 7.0211 7.0460 7.0460 7.3037 7.3037 7.3878 7.3878 7.4015 7.4015 7.6498 7.6498 7.7461 7.7461 7.8544 7.8544 8.3239 8.3239 8.3363 8.3363 8.3411 8.3411 9.0710 9.0710 9.2333 9.2333 9.2977 9.2977 9.3129 9.3129 9.8225 9.8225 9.8331 9.8331 9.9390 9.9390 10.0749 10.0749 10.3853 10.3853 10.4199 10.4199 10.7798 10.7798 11.1355 11.1355 11.3189 11.3189 11.4596 11.4596 11.4644 11.4644 11.5861 11.5861 11.8892 11.8892 k = 0.3333 0.5774 0.2156 ( 15264 PWs) bands (ev): -1.7826 -1.7826 -0.5493 -0.5493 -0.5490 -0.5490 0.0404 0.0404 0.7141 0.7141 0.8510 0.8510 0.8530 0.8530 1.1448 1.1448 4.3153 4.3153 4.7696 4.7696 4.8304 4.8304 5.4982 5.4982 5.5308 5.5308 5.8546 5.8546 5.9128 5.9128 5.9307 5.9307 6.5378 6.5378 6.6813 6.6813 6.7323 6.7323 6.8807 6.8807 7.0190 7.0190 7.0369 7.0369 7.3654 7.3654 7.3897 7.3897 7.4441 7.4441 7.6400 7.6400 7.7437 7.7437 7.8497 7.8497 8.3116 8.3116 8.3341 8.3341 8.3377 8.3377 9.0828 9.0828 9.2617 9.2617 9.3329 9.3329 9.3460 9.3460 9.8126 9.8126 9.8176 9.8176 9.9533 9.9533 10.0884 10.0884 10.4131 10.4131 10.4388 10.4388 10.7455 10.7455 11.0949 11.0949 11.3238 11.3238 11.4054 11.4054 11.4136 11.4136 11.5256 11.5256 11.8989 11.8990 k = 0.3333 0.5774 0.2425 ( 15261 PWs) bands (ev): -1.7578 -1.7578 -0.5285 -0.5285 -0.5283 -0.5283 0.0492 0.0492 0.6758 0.6758 0.8318 0.8318 0.8338 0.8338 1.0878 1.0878 4.4383 4.4383 4.7497 4.7497 4.8061 4.8061 5.4993 5.4993 5.5362 5.5362 5.8358 5.8358 5.9291 5.9291 5.9439 5.9439 6.4932 6.4932 6.6403 6.6403 6.7480 6.7480 6.8943 6.8943 7.0144 7.0144 7.0257 7.0257 7.3780 7.3780 7.4297 7.4297 7.5006 7.5006 7.6351 7.6351 7.7394 7.7394 7.8453 7.8453 8.3004 8.3004 8.3291 8.3291 8.3405 8.3405 9.0966 9.0966 9.2920 9.2920 9.3692 9.3692 9.3794 9.3794 9.8006 9.8006 9.8013 9.8013 9.9722 9.9722 10.1047 10.1047 10.4434 10.4434 10.4595 10.4595 10.7079 10.7079 11.0557 11.0557 11.2962 11.2962 11.3551 11.3551 11.3630 11.3630 11.4976 11.4976 11.9042 11.9043 k = 0.3333 0.5774 0.2695 ( 15243 PWs) bands (ev): -1.7301 -1.7301 -0.5054 -0.5054 -0.5053 -0.5053 0.0575 0.0575 0.6295 0.6295 0.8103 0.8103 0.8122 0.8122 1.0367 1.0367 4.5671 4.5671 4.7317 4.7317 4.7836 4.7836 5.4994 5.4994 5.5404 5.5404 5.8098 5.8098 5.9382 5.9382 5.9750 5.9750 6.4501 6.4501 6.6005 6.6005 6.7574 6.7574 6.9031 6.9031 7.0074 7.0074 7.0128 7.0128 7.3672 7.3672 7.4933 7.4933 7.5533 7.5533 7.6379 7.6379 7.7334 7.7334 7.8441 7.8441 8.2918 8.2918 8.3270 8.3270 8.3441 8.3441 9.1121 9.1121 9.3239 9.3239 9.4052 9.4052 9.4114 9.4114 9.7843 9.7843 9.7865 9.7865 9.9966 9.9966 10.1249 10.1249 10.4754 10.4754 10.4811 10.4811 10.6689 10.6689 11.0183 11.0183 11.2304 11.2304 11.3100 11.3100 11.3148 11.3148 11.5044 11.5044 11.9028 11.9029 k = 0.3333 0.5774 0.2964 ( 15261 PWs) bands (ev): -1.6996 -1.6996 -0.4801 -0.4801 -0.4800 -0.4800 0.0644 0.0644 0.5762 0.5762 0.7864 0.7864 0.7883 0.7883 0.9922 0.9922 4.6933 4.6933 4.7235 4.7235 4.7637 4.7637 5.4977 5.4977 5.5423 5.5423 5.7837 5.7837 5.9511 5.9511 6.0059 6.0059 6.4095 6.4095 6.5628 6.5628 6.7608 6.7608 6.9053 6.9053 6.9984 6.9984 6.9988 6.9988 7.3561 7.3561 7.5529 7.5529 7.5950 7.5950 7.6498 7.6498 7.7290 7.7290 7.8525 7.8525 8.2868 8.2868 8.3284 8.3284 8.3482 8.3482 9.1295 9.1295 9.3569 9.3569 9.4389 9.4389 9.4401 9.4401 9.7669 9.7669 9.7711 9.7711 10.0271 10.0271 10.1503 10.1503 10.5014 10.5014 10.5086 10.5086 10.6315 10.6315 10.9833 10.9833 11.1418 11.1418 11.2713 11.2713 11.2753 11.2753 11.5224 11.5224 11.8946 11.8947 k = 0.3333 0.5774 0.3234 ( 15264 PWs) bands (ev): -1.6663 -1.6663 -0.4527 -0.4527 -0.4526 -0.4526 0.0684 0.0684 0.5187 0.5187 0.7601 0.7601 0.7620 0.7620 0.9538 0.9538 4.6995 4.6995 4.7470 4.7470 4.8417 4.8417 5.4932 5.4932 5.5412 5.5412 5.7602 5.7602 5.9657 5.9657 6.0367 6.0367 6.3722 6.3722 6.5279 6.5279 6.7570 6.7570 6.9016 6.9016 6.9829 6.9829 6.9896 6.9896 7.3439 7.3439 7.6027 7.6027 7.6167 7.6167 7.6617 7.6617 7.7405 7.7405 7.8787 7.8787 8.2861 8.2861 8.3336 8.3336 8.3524 8.3524 9.1485 9.1485 9.3902 9.3902 9.4632 9.4632 9.4678 9.4678 9.7504 9.7504 9.7557 9.7557 10.0638 10.0638 10.1815 10.1815 10.5131 10.5131 10.5423 10.5423 10.6034 10.6034 10.9513 10.9513 11.0437 11.0437 11.2401 11.2401 11.2440 11.2440 11.5358 11.5358 11.8808 11.8809 k = 0.3333 0.5774 0.3503 ( 15264 PWs) bands (ev): -1.6301 -1.6301 -0.4231 -0.4231 -0.4231 -0.4231 0.0665 0.0665 0.4617 0.4617 0.7316 0.7316 0.7333 0.7333 0.9203 0.9203 4.6902 4.6902 4.7339 4.7339 4.9812 4.9812 5.4851 5.4851 5.5361 5.5361 5.7403 5.7403 5.9813 5.9813 6.0676 6.0676 6.3392 6.3392 6.4965 6.4965 6.7440 6.7440 6.8949 6.8949 6.9665 6.9665 6.9812 6.9812 7.3295 7.3295 7.6152 7.6152 7.6377 7.6377 7.6597 7.6597 7.7845 7.7845 7.9252 7.9252 8.2902 8.2902 8.3429 8.3429 8.3570 8.3570 9.1692 9.1692 9.4234 9.4234 9.4781 9.4781 9.4889 9.4889 9.7368 9.7368 9.7420 9.7420 10.1067 10.1067 10.2190 10.2190 10.5010 10.5010 10.5761 10.5761 10.5998 10.5998 10.9225 10.9225 10.9429 10.9429 11.2172 11.2172 11.2209 11.2209 11.5370 11.5370 11.8625 11.8625 k = 0.3333 0.5774 0.3773 ( 15264 PWs) bands (ev): -1.5911 -1.5911 -0.3916 -0.3916 -0.3915 -0.3915 0.0546 0.0546 0.4110 0.4110 0.7007 0.7007 0.7024 0.7024 0.8904 0.8904 4.6840 4.6840 4.7247 4.7247 5.1218 5.1218 5.4727 5.4727 5.5268 5.5268 5.7247 5.7247 5.9978 5.9978 6.0987 6.0987 6.3109 6.3109 6.4694 6.4694 6.7204 6.7204 6.8889 6.8889 6.9497 6.9497 6.9744 6.9744 7.3130 7.3130 7.5957 7.5957 7.6268 7.6268 7.6853 7.6853 7.8470 7.8470 7.9865 7.9865 8.2993 8.2993 8.3560 8.3560 8.3626 8.3626 9.1914 9.1914 9.4556 9.4556 9.4829 9.4829 9.4988 9.4988 9.7280 9.7280 9.7312 9.7312 10.1548 10.1548 10.2632 10.2632 10.4677 10.4677 10.6097 10.6097 10.6174 10.6174 10.8435 10.8435 10.8986 10.8986 11.2031 11.2031 11.2062 11.2062 11.5238 11.5238 11.8401 11.8401 k = 0.3333 0.5774 0.4042 ( 15264 PWs) bands (ev): -1.5494 -1.5494 -0.3581 -0.3581 -0.3581 -0.3581 0.0279 0.0279 0.3732 0.3732 0.6676 0.6676 0.6693 0.6693 0.8628 0.8628 4.6816 4.6816 4.7197 4.7197 5.2592 5.2592 5.4554 5.4554 5.5154 5.5154 5.7141 5.7141 6.0155 6.0155 6.1300 6.1300 6.2876 6.2876 6.4470 6.4470 6.6869 6.6869 6.8852 6.8852 6.9330 6.9330 6.9695 6.9695 7.2945 7.2945 7.5645 7.5645 7.5981 7.5981 7.7185 7.7185 7.9152 7.9152 8.0556 8.0556 8.3130 8.3130 8.3708 8.3708 8.3731 8.3731 9.2150 9.2150 9.4757 9.4757 9.4876 9.4876 9.4962 9.4962 9.7235 9.7235 9.7248 9.7248 10.2050 10.2050 10.3141 10.3141 10.4260 10.4260 10.6426 10.6426 10.6431 10.6431 10.7533 10.7533 10.8788 10.8788 11.1982 11.1982 11.2001 11.2001 11.4980 11.4980 11.8138 11.8139 k = 0.3333 0.5774 0.4312 ( 15261 PWs) bands (ev): -1.5049 -1.5049 -0.3228 -0.3228 -0.3227 -0.3227 -0.0160 -0.0160 0.3519 0.3519 0.6325 0.6325 0.6341 0.6341 0.8366 0.8366 4.6834 4.6834 4.7191 4.7191 5.3757 5.3757 5.4330 5.4330 5.5172 5.5172 5.7098 5.7098 6.0340 6.0340 6.1615 6.1615 6.2690 6.2690 6.4295 6.4295 6.6464 6.6464 6.8835 6.8835 6.9169 6.9169 6.9672 6.9672 7.2744 7.2744 7.5256 7.5256 7.5638 7.5638 7.7466 7.7466 7.9841 7.9841 8.1282 8.1282 8.3307 8.3307 8.3844 8.3844 8.3938 8.3938 9.2399 9.2399 9.4611 9.4611 9.4826 9.4826 9.5154 9.5154 9.7171 9.7171 9.7248 9.7248 10.2431 10.2431 10.3715 10.3715 10.3884 10.3884 10.6642 10.6642 10.6767 10.6767 10.6861 10.6861 10.8645 10.8645 11.2022 11.2022 11.2024 11.2024 11.4625 11.4625 11.7835 11.7836 k = 0.3333 0.5774 0.4581 ( 15243 PWs) bands (ev): -1.4576 -1.4576 -0.2858 -0.2858 -0.2856 -0.2856 -0.0750 -0.0750 0.3456 0.3456 0.5953 0.5953 0.5968 0.5968 0.8111 0.8111 4.6895 4.6895 4.7229 4.7229 5.4056 5.4056 5.4110 5.4110 5.5864 5.5864 5.7171 5.7171 6.0532 6.0532 6.1930 6.1930 6.2546 6.2546 6.4170 6.4170 6.6026 6.6026 6.8829 6.8829 6.9018 6.9018 6.9678 6.9678 7.2532 7.2532 7.4815 7.4815 7.5258 7.5258 7.7646 7.7646 8.0514 8.0514 8.2012 8.2012 8.3516 8.3516 8.4068 8.4068 8.4181 8.4181 9.2659 9.2659 9.4394 9.4394 9.4614 9.4614 9.5406 9.5406 9.7096 9.7096 9.7246 9.7246 10.2231 10.2231 10.3970 10.3970 10.4348 10.4348 10.6236 10.6236 10.7058 10.7058 10.7110 10.7110 10.8564 10.8564 11.2124 11.2124 11.2145 11.2145 11.4198 11.4198 11.7490 11.7490 k = 0.3333 0.5774 0.4851 ( 15273 PWs) bands (ev): -1.4077 -1.4077 -0.2471 -0.2471 -0.2469 -0.2469 -0.1442 -0.1442 0.3504 0.3504 0.5564 0.5564 0.5578 0.5578 0.7860 0.7860 4.6998 4.6998 4.7312 4.7312 5.3734 5.3734 5.3887 5.3887 5.6663 5.6663 5.7683 5.7683 6.0722 6.0722 6.2243 6.2243 6.2434 6.2434 6.4090 6.4090 6.5593 6.5593 6.8829 6.8829 6.8886 6.8886 6.9715 6.9715 7.2311 7.2311 7.4337 7.4337 7.4855 7.4855 7.7678 7.7678 8.1162 8.1162 8.2720 8.2720 8.3755 8.3755 8.4402 8.4402 8.4460 8.4460 9.2928 9.2928 9.4143 9.4143 9.4365 9.4365 9.5620 9.5620 9.6988 9.6988 9.7206 9.7206 10.1444 10.1444 10.4521 10.4521 10.5035 10.5035 10.5954 10.5954 10.7387 10.7387 10.7469 10.7469 10.8553 10.8553 11.2290 11.2290 11.2339 11.2339 11.3720 11.3720 11.7102 11.7103 k = 0.3333 0.5774 0.5120 ( 15237 PWs) bands (ev): -1.3550 -1.3550 -0.2197 -0.2197 -0.2069 -0.2069 -0.2066 -0.2066 0.3625 0.3625 0.5157 0.5157 0.5171 0.5171 0.7608 0.7608 4.7146 4.7146 4.7439 4.7439 5.3370 5.3370 5.3519 5.3519 5.6933 5.6933 5.8823 5.8823 6.0900 6.0900 6.2345 6.2345 6.2550 6.2550 6.4051 6.4051 6.5213 6.5213 6.8779 6.8779 6.8836 6.8836 6.9779 6.9779 7.2086 7.2086 7.3833 7.3833 7.4436 7.4436 7.7532 7.7532 8.1783 8.1783 8.3383 8.3383 8.4027 8.4027 8.4776 8.4776 8.4848 8.4848 9.3204 9.3204 9.3883 9.3883 9.4108 9.4108 9.5787 9.5787 9.6830 9.6830 9.7108 9.7108 10.0433 10.0433 10.5194 10.5194 10.5765 10.5765 10.5886 10.5886 10.7741 10.7741 10.7852 10.7852 10.8622 10.8622 11.2502 11.2502 11.2585 11.2585 11.3209 11.3209 11.6674 11.6675 k = 0.3333 0.5774 0.5390 ( 15234 PWs) bands (ev): -1.2998 -1.2998 -0.2981 -0.2981 -0.1653 -0.1653 -0.1650 -0.1650 0.3794 0.3794 0.4735 0.4735 0.4749 0.4749 0.7354 0.7354 4.7336 4.7336 4.7610 4.7610 5.2971 5.2971 5.3090 5.3090 5.7100 5.7100 6.0027 6.0027 6.1052 6.1052 6.2276 6.2276 6.2843 6.2843 6.4045 6.4045 6.4955 6.4955 6.8707 6.8707 6.8856 6.8856 6.9863 6.9863 7.1860 7.1860 7.3313 7.3313 7.4013 7.4013 7.7199 7.7199 8.2376 8.2376 8.3979 8.3979 8.4325 8.4325 8.5129 8.5129 8.5393 8.5393 9.3484 9.3484 9.3641 9.3641 9.3871 9.3871 9.5902 9.5902 9.6615 9.6615 9.6943 9.6943 9.9335 9.9335 10.5704 10.5704 10.6184 10.6184 10.6526 10.6526 10.8110 10.8110 10.8265 10.8265 10.8781 10.8781 11.2584 11.2584 11.2830 11.2830 11.2862 11.2862 11.6209 11.6212 k = 0.3333 0.5774 0.5659 ( 15240 PWs) bands (ev): -1.2420 -1.2420 -0.3781 -0.3781 -0.1225 -0.1225 -0.1221 -0.1221 0.3994 0.3994 0.4301 0.4301 0.4314 0.4314 0.7098 0.7098 4.7568 4.7568 4.7823 4.7823 5.2545 5.2545 5.2625 5.2625 5.7284 5.7284 6.0857 6.0857 6.1339 6.1339 6.2244 6.2244 6.3115 6.3115 6.4065 6.4065 6.4934 6.4934 6.8679 6.8679 6.8898 6.8898 6.9957 6.9957 7.1641 7.1641 7.2785 7.2785 7.3593 7.3593 7.6691 7.6691 8.2936 8.2936 8.4493 8.4493 8.4633 8.4633 8.5505 8.5505 8.6018 8.6018 9.3431 9.3431 9.3679 9.3679 9.3772 9.3772 9.5956 9.5956 9.6342 9.6342 9.6709 9.6709 9.8210 9.8210 10.5942 10.5942 10.6895 10.6895 10.7305 10.7305 10.8482 10.8482 10.8712 10.8712 10.9042 10.9042 11.2069 11.2069 11.3033 11.3033 11.3140 11.3140 11.5712 11.5712 k = 0.3333 0.5774 0.5928 ( 15279 PWs) bands (ev): -1.1816 -1.1816 -0.4583 -0.4583 -0.0785 -0.0785 -0.0781 -0.0781 0.3854 0.3854 0.3864 0.3864 0.4221 0.4221 0.6838 0.6838 4.7840 4.7840 4.8077 4.8077 5.2100 5.2100 5.2139 5.2139 5.7504 5.7504 6.0877 6.0877 6.1955 6.1955 6.2294 6.2294 6.3361 6.3361 6.4100 6.4100 6.5306 6.5306 6.8706 6.8706 6.8970 6.8970 7.0044 7.0044 7.1443 7.1443 7.2255 7.2255 7.3184 7.3184 7.6030 7.6030 8.3457 8.3457 8.4926 8.4926 8.4932 8.4932 8.5870 8.5870 8.6714 8.6714 9.3281 9.3281 9.3556 9.3556 9.4054 9.4054 9.5872 9.5872 9.6069 9.6069 9.6411 9.6411 9.7116 9.7116 10.6209 10.6209 10.7674 10.7674 10.8081 10.8081 10.8851 10.8851 10.9190 10.9190 10.9401 10.9401 11.1506 11.1506 11.3243 11.3243 11.3379 11.3379 11.5152 11.5154 k = 0.3333 0.5774 0.6198 ( 15261 PWs) bands (ev): -1.1188 -1.1188 -0.5381 -0.5381 -0.0336 -0.0336 -0.0331 -0.0331 0.3399 0.3399 0.3409 0.3409 0.4459 0.4459 0.6574 0.6574 4.8151 4.8151 4.8368 4.8368 5.1644 5.1644 5.1645 5.1645 5.7761 5.7761 6.0654 6.0654 6.2227 6.2227 6.2468 6.2468 6.3574 6.3574 6.4138 6.4138 6.6107 6.6107 6.8797 6.8797 6.9079 6.9079 7.0097 7.0097 7.1292 7.1292 7.1732 7.1732 7.2793 7.2793 7.5239 7.5239 8.3929 8.3929 8.5172 8.5172 8.5312 8.5312 8.6179 8.6179 8.7473 8.7473 9.3193 9.3193 9.3525 9.3525 9.4330 9.4330 9.5403 9.5403 9.5969 9.5969 9.6059 9.6059 9.6175 9.6175 10.6544 10.6544 10.8447 10.8447 10.8833 10.8833 10.9215 10.9215 10.9694 10.9694 10.9829 10.9829 11.0962 11.0962 11.3368 11.3368 11.3535 11.3535 11.4403 11.4403 k = 0.3333 0.5774 0.6467 ( 15279 PWs) bands (ev): -1.0535 -1.0535 -0.6169 -0.6169 0.0121 0.0121 0.0127 0.0127 0.2936 0.2936 0.2945 0.2945 0.4710 0.4710 0.6308 0.6308 4.8497 4.8497 4.8694 4.8694 5.1149 5.1149 5.1185 5.1185 5.8057 5.8057 6.0324 6.0324 6.2351 6.2351 6.2591 6.2591 6.3753 6.3753 6.4166 6.4166 6.7157 6.7157 6.8960 6.8960 6.9241 6.9241 7.0075 7.0075 7.1222 7.1222 7.1230 7.1230 7.2424 7.2424 7.4344 7.4344 8.4349 8.4349 8.5339 8.5339 8.5648 8.5648 8.6393 8.6393 8.8293 8.8293 9.3121 9.3121 9.3601 9.3601 9.4517 9.4517 9.4727 9.4727 9.5534 9.5534 9.5666 9.5666 9.5878 9.5878 10.6941 10.6941 10.9183 10.9183 10.9503 10.9503 10.9532 10.9532 11.0203 11.0203 11.0254 11.0254 11.0562 11.0562 11.3345 11.3345 11.3572 11.3572 11.3680 11.3680 k = 0.3333 0.5774 0.6737 ( 15288 PWs) bands (ev): -0.9859 -0.9859 -0.6943 -0.6943 0.0585 0.0585 0.0591 0.0591 0.2468 0.2468 0.2477 0.2477 0.4969 0.4969 0.6040 0.6040 4.8877 4.8877 4.9053 4.9053 5.0660 5.0660 5.0729 5.0729 5.8387 5.8387 5.9940 5.9940 6.2452 6.2452 6.2633 6.2633 6.3899 6.3899 6.4173 6.4173 6.8245 6.8245 6.9194 6.9194 6.9496 6.9496 6.9957 6.9957 7.0735 7.0735 7.1279 7.1279 7.2072 7.2072 7.3378 7.3378 8.4710 8.4710 8.5407 8.5407 8.5942 8.5942 8.6495 8.6495 8.9171 8.9171 9.2809 9.2809 9.3787 9.3787 9.4046 9.4046 9.4862 9.4862 9.5092 9.5092 9.5249 9.5249 9.5742 9.5742 10.7391 10.7391 10.9385 10.9385 10.9854 10.9854 11.0148 11.0148 11.0485 11.0485 11.0663 11.0663 11.0776 11.0776 11.2912 11.2912 11.3261 11.3261 11.3507 11.3507 k = 0.3333 0.5774 0.7006 ( 15261 PWs) bands (ev): -0.9161 -0.9161 -0.7701 -0.7701 0.1054 0.1054 0.1060 0.1060 0.1997 0.1997 0.2005 0.2005 0.5233 0.5233 0.5770 0.5770 4.9287 4.9287 4.9440 4.9440 5.0183 5.0183 5.0283 5.0283 5.8749 5.8749 5.9536 5.9536 6.2534 6.2534 6.2629 6.2629 6.4014 6.4014 6.4151 6.4151 6.9083 6.9083 6.9498 6.9498 6.9758 6.9758 7.0034 7.0034 7.0278 7.0278 7.1390 7.1390 7.1726 7.1726 7.2426 7.2426 8.5008 8.5008 8.5369 8.5369 8.6189 8.6189 8.6484 8.6484 9.0098 9.0098 9.2016 9.2016 9.4037 9.4037 9.4069 9.4069 9.4636 9.4636 9.4827 9.4827 9.5151 9.5151 9.5572 9.5572 10.7881 10.7881 10.8923 10.8923 11.0417 11.0417 11.0644 11.0644 11.0798 11.0798 11.0956 11.0956 11.1148 11.1148 11.2256 11.2256 11.3103 11.3104 11.3427 11.3429 k = 0.3333 0.5774 0.7276 ( 15240 PWs) bands (ev): -0.8441 -0.8441 -0.8441 -0.8441 0.1525 0.1525 0.1525 0.1525 0.1532 0.1532 0.1532 0.1532 0.5501 0.5501 0.5501 0.5501 4.9724 4.9724 4.9724 4.9724 4.9852 4.9852 4.9852 4.9852 5.9135 5.9135 5.9135 5.9135 6.2595 6.2595 6.2595 6.2595 6.4098 6.4098 6.4098 6.4098 6.9498 6.9498 6.9498 6.9498 6.9862 6.9862 6.9862 6.9862 7.0909 7.0909 7.0909 7.0909 7.1800 7.1800 7.1800 7.1800 8.5232 8.5232 8.5232 8.5232 8.6376 8.6376 8.6376 8.6376 9.1060 9.1060 9.1060 9.1060 9.4288 9.4288 9.4288 9.4288 9.4425 9.4425 9.4425 9.4425 9.5371 9.5371 9.5371 9.5371 10.8399 10.8399 10.8399 10.8399 11.0788 11.0788 11.0788 11.0788 11.0948 11.0948 11.0948 11.0948 11.1646 11.1646 11.1646 11.1646 11.3160 11.3160 11.3160 11.3160 Writing output data file Zr5Sb4.save init_run : 0.27s CPU 0.44s WALL ( 1 calls) electrons : 1392.54s CPU 1402.77s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 1392.53s CPU 1402.76s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.09s CPU 0.12s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.18s WALL ( 210 calls) cegterg : 1310.51s CPU 1319.41s WALL ( 1015 calls) Called by sum_band: Called by *egterg: h_psi : 723.40s CPU 731.95s WALL ( 19986 calls) s_psi : 68.85s CPU 69.15s WALL ( 19986 calls) g_psi : 1.44s CPU 1.28s WALL ( 18761 calls) cdiaghg : 436.82s CPU 437.85s WALL ( 18971 calls) cegterg:over : 59.66s CPU 59.47s WALL ( 18761 calls) cegterg:upda : 50.24s CPU 50.39s WALL ( 18761 calls) cegterg:last : 23.78s CPU 23.84s WALL ( 2092 calls) cdiaghg:chol : 19.32s CPU 19.51s WALL ( 18971 calls) cdiaghg:inve : 14.30s CPU 14.67s WALL ( 18971 calls) cdiaghg:para : 28.50s CPU 28.55s WALL ( 37942 calls) Called by h_psi: h_psi:vloc : 581.82s CPU 589.75s WALL ( 19986 calls) h_psi:vnl : 139.95s CPU 140.57s WALL ( 19986 calls) add_vuspsi : 72.70s CPU 72.79s WALL ( 19986 calls) General routines calbec : 67.14s CPU 67.71s WALL ( 19986 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 562.11s CPU 569.82s WALL ( 2411872 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.28s CPU 0.43s WALL ( 420 calls) Parallel routines fft_scatter : 306.28s CPU 311.20s WALL ( 2411895 calls) PWSCF : 24m 8.84s CPU 24m39.66s WALL This run was terminated on: 10:11:13 1Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=