Program PWSCF v.5.3.0 (svn rev. 11974) starts on 1Feb2017 at 9:28:55 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: ./Zr5Sb3S.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 58 48 13 2160 1614 235 Max 59 49 14 2165 1637 240 Sum 4243 3481 955 155689 116871 17085 bravais-lattice index = 14 lattice parameter (alat) = 15.9238 a.u. unit-cell volume = 2448.3091 (a.u.)^3 number of atoms/cell = 18 number of atomic types = 3 number of electrons = 82.00 number of Kohn-Sham states= 98 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)= 15.923776 celldm(2)= 1.000000 celldm(3)= 0.700160 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 0.700160 ) 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 1.428245 ) PseudoPot. # 1 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for 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. # 3 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 S 6.00 32.06500 S( 1.00) 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 ) ( -0.3500801 ) 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 ) ( -0.3500801 ) 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 ) ( -0.3500801 ) 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 ) ( -0.3500801 ) 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 ) ( -0.3500801 ) 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 ) ( -0.3500801 ) 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 ) ( -0.3500801 ) 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 ) ( -0.3500801 ) 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 ) ( -0.3500801 ) 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 ) ( -0.3500801 ) 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 ) ( -0.3500801 ) 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 ) ( -0.3500801 ) 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 0.0264490), wk = 0.0047619 k( 66) = ( 0.0000000 0.0000000 0.0528980), wk = 0.0047619 k( 67) = ( 0.0000000 0.0000000 0.0793469), wk = 0.0047619 k( 68) = ( 0.0000000 0.0000000 0.1057959), wk = 0.0047619 k( 69) = ( 0.0000000 0.0000000 0.1322449), wk = 0.0047619 k( 70) = ( 0.0000000 0.0000000 0.1586938), wk = 0.0047619 k( 71) = ( 0.0000000 0.0000000 0.1851428), wk = 0.0047619 k( 72) = ( 0.0000000 0.0000000 0.2115918), wk = 0.0047619 k( 73) = ( 0.0000000 0.0000000 0.2380408), wk = 0.0047619 k( 74) = ( 0.0000000 0.0000000 0.2644897), wk = 0.0047619 k( 75) = ( 0.0000000 0.0000000 0.2909387), wk = 0.0047619 k( 76) = ( 0.0000000 0.0000000 0.3173877), wk = 0.0047619 k( 77) = ( 0.0000000 0.0000000 0.3438366), wk = 0.0047619 k( 78) = ( 0.0000000 0.0000000 0.3702856), wk = 0.0047619 k( 79) = ( 0.0000000 0.0000000 0.3967346), wk = 0.0047619 k( 80) = ( 0.0000000 0.0000000 0.4231836), wk = 0.0047619 k( 81) = ( 0.0000000 0.0000000 0.4496325), wk = 0.0047619 k( 82) = ( 0.0000000 0.0000000 0.4760815), wk = 0.0047619 k( 83) = ( 0.0000000 0.0000000 0.5025305), wk = 0.0047619 k( 84) = ( 0.0000000 0.0000000 0.5289795), wk = 0.0047619 k( 85) = ( 0.0000000 0.0000000 0.5554284), wk = 0.0047619 k( 86) = ( 0.0000000 0.0000000 0.5818774), wk = 0.0047619 k( 87) = ( 0.0000000 0.0000000 0.6083264), wk = 0.0047619 k( 88) = ( 0.0000000 0.0000000 0.6347753), wk = 0.0047619 k( 89) = ( 0.0000000 0.0000000 0.6612243), wk = 0.0047619 k( 90) = ( 0.0000000 0.0000000 0.6876733), wk = 0.0047619 k( 91) = ( 0.0000000 0.0000000 0.7141223), wk = 0.0047619 k( 92) = ( 0.0000000 0.0000000 0.7141223), wk = 0.0047619 k( 93) = ( 0.0227273 0.0131216 0.7141223), wk = 0.0047619 k( 94) = ( 0.0454546 0.0262432 0.7141223), wk = 0.0047619 k( 95) = ( 0.0681818 0.0393648 0.7141223), wk = 0.0047619 k( 96) = ( 0.0909091 0.0524864 0.7141223), wk = 0.0047619 k( 97) = ( 0.1136364 0.0656080 0.7141223), wk = 0.0047619 k( 98) = ( 0.1363636 0.0787296 0.7141223), wk = 0.0047619 k( 99) = ( 0.1590909 0.0918512 0.7141223), wk = 0.0047619 k( 100) = ( 0.1818182 0.1049728 0.7141223), wk = 0.0047619 k( 101) = ( 0.2045454 0.1180944 0.7141223), wk = 0.0047619 k( 102) = ( 0.2272727 0.1312160 0.7141223), wk = 0.0047619 k( 103) = ( 0.2500000 0.1443376 0.7141223), wk = 0.0047619 k( 104) = ( 0.2727273 0.1574592 0.7141223), wk = 0.0047619 k( 105) = ( 0.2954545 0.1705808 0.7141223), wk = 0.0047619 k( 106) = ( 0.3181818 0.1837024 0.7141223), wk = 0.0047619 k( 107) = ( 0.3409091 0.1968240 0.7141223), wk = 0.0047619 k( 108) = ( 0.3636364 0.2099456 0.7141223), wk = 0.0047619 k( 109) = ( 0.3863636 0.2230672 0.7141223), wk = 0.0047619 k( 110) = ( 0.4090909 0.2361887 0.7141223), wk = 0.0047619 k( 111) = ( 0.4318182 0.2493103 0.7141223), wk = 0.0047619 k( 112) = ( 0.4545455 0.2624319 0.7141223), wk = 0.0047619 k( 113) = ( 0.4772727 0.2755535 0.7141223), wk = 0.0047619 k( 114) = ( 0.5000000 0.2886751 0.7141223), wk = 0.0047619 k( 115) = ( 0.5000000 0.2886751 0.7141223), wk = 0.0047619 k( 116) = ( 0.4871795 0.3108809 0.7141223), wk = 0.0047619 k( 117) = ( 0.4743590 0.3330867 0.7141223), wk = 0.0047619 k( 118) = ( 0.4615385 0.3552925 0.7141223), wk = 0.0047619 k( 119) = ( 0.4487179 0.3774983 0.7141223), wk = 0.0047619 k( 120) = ( 0.4358974 0.3997040 0.7141223), wk = 0.0047619 k( 121) = ( 0.4230769 0.4219098 0.7141223), wk = 0.0047619 k( 122) = ( 0.4102564 0.4441156 0.7141223), wk = 0.0047619 k( 123) = ( 0.3974359 0.4663214 0.7141223), wk = 0.0047619 k( 124) = ( 0.3846154 0.4885271 0.7141223), wk = 0.0047619 k( 125) = ( 0.3717949 0.5107329 0.7141223), wk = 0.0047619 k( 126) = ( 0.3589744 0.5329387 0.7141223), wk = 0.0047619 k( 127) = ( 0.3461538 0.5551445 0.7141223), wk = 0.0047619 k( 128) = ( 0.3333333 0.5773503 0.7141223), wk = 0.0047619 k( 129) = ( 0.3333333 0.5773503 0.7141223), wk = 0.0047619 k( 130) = ( 0.3200000 0.5542563 0.7141223), wk = 0.0047619 k( 131) = ( 0.3066667 0.5311623 0.7141223), wk = 0.0047619 k( 132) = ( 0.2933333 0.5080682 0.7141223), wk = 0.0047619 k( 133) = ( 0.2800000 0.4849742 0.7141223), wk = 0.0047619 k( 134) = ( 0.2666667 0.4618802 0.7141223), wk = 0.0047619 k( 135) = ( 0.2533333 0.4387862 0.7141223), wk = 0.0047619 k( 136) = ( 0.2400000 0.4156922 0.7141223), wk = 0.0047619 k( 137) = ( 0.2266667 0.3925982 0.7141223), wk = 0.0047619 k( 138) = ( 0.2133333 0.3695042 0.7141223), wk = 0.0047619 k( 139) = ( 0.2000000 0.3464102 0.7141223), wk = 0.0047619 k( 140) = ( 0.1866667 0.3233162 0.7141223), wk = 0.0047619 k( 141) = ( 0.1733333 0.3002221 0.7141223), wk = 0.0047619 k( 142) = ( 0.1600000 0.2771281 0.7141223), wk = 0.0047619 k( 143) = ( 0.1466667 0.2540341 0.7141223), wk = 0.0047619 k( 144) = ( 0.1333333 0.2309401 0.7141223), wk = 0.0047619 k( 145) = ( 0.1200000 0.2078461 0.7141223), wk = 0.0047619 k( 146) = ( 0.1066667 0.1847521 0.7141223), wk = 0.0047619 k( 147) = ( 0.0933333 0.1616581 0.7141223), wk = 0.0047619 k( 148) = ( 0.0800000 0.1385641 0.7141223), wk = 0.0047619 k( 149) = ( 0.0666667 0.1154701 0.7141223), wk = 0.0047619 k( 150) = ( 0.0533333 0.0923760 0.7141223), wk = 0.0047619 k( 151) = ( 0.0400000 0.0692820 0.7141223), wk = 0.0047619 k( 152) = ( 0.0266667 0.0461880 0.7141223), wk = 0.0047619 k( 153) = ( 0.0133333 0.0230940 0.7141223), wk = 0.0047619 k( 154) = ( 0.0000000 0.0000000 0.7141223), wk = 0.0047619 k( 155) = ( 0.5000000 0.2886751 0.7141223), wk = 0.0047619 k( 156) = ( 0.5000000 0.2886751 0.6876733), wk = 0.0047619 k( 157) = ( 0.5000000 0.2886751 0.6612243), wk = 0.0047619 k( 158) = ( 0.5000000 0.2886751 0.6347753), wk = 0.0047619 k( 159) = ( 0.5000000 0.2886751 0.6083264), wk = 0.0047619 k( 160) = ( 0.5000000 0.2886751 0.5818774), wk = 0.0047619 k( 161) = ( 0.5000000 0.2886751 0.5554284), wk = 0.0047619 k( 162) = ( 0.5000000 0.2886751 0.5289795), wk = 0.0047619 k( 163) = ( 0.5000000 0.2886751 0.5025305), wk = 0.0047619 k( 164) = ( 0.5000000 0.2886751 0.4760815), wk = 0.0047619 k( 165) = ( 0.5000000 0.2886751 0.4496325), wk = 0.0047619 k( 166) = ( 0.5000000 0.2886751 0.4231836), wk = 0.0047619 k( 167) = ( 0.5000000 0.2886751 0.3967346), wk = 0.0047619 k( 168) = ( 0.5000000 0.2886751 0.3702856), wk = 0.0047619 k( 169) = ( 0.5000000 0.2886751 0.3438366), wk = 0.0047619 k( 170) = ( 0.5000000 0.2886751 0.3173877), wk = 0.0047619 k( 171) = ( 0.5000000 0.2886751 0.2909387), wk = 0.0047619 k( 172) = ( 0.5000000 0.2886751 0.2644897), wk = 0.0047619 k( 173) = ( 0.5000000 0.2886751 0.2380408), wk = 0.0047619 k( 174) = ( 0.5000000 0.2886751 0.2115918), wk = 0.0047619 k( 175) = ( 0.5000000 0.2886751 0.1851428), wk = 0.0047619 k( 176) = ( 0.5000000 0.2886751 0.1586938), wk = 0.0047619 k( 177) = ( 0.5000000 0.2886751 0.1322449), wk = 0.0047619 k( 178) = ( 0.5000000 0.2886751 0.1057959), wk = 0.0047619 k( 179) = ( 0.5000000 0.2886751 0.0793469), wk = 0.0047619 k( 180) = ( 0.5000000 0.2886751 0.0528980), wk = 0.0047619 k( 181) = ( 0.5000000 0.2886751 0.0264490), 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 0.0264490), wk = 0.0047619 k( 185) = ( 0.3333333 0.5773503 0.0528980), wk = 0.0047619 k( 186) = ( 0.3333333 0.5773503 0.0793469), wk = 0.0047619 k( 187) = ( 0.3333333 0.5773503 0.1057959), wk = 0.0047619 k( 188) = ( 0.3333333 0.5773503 0.1322449), wk = 0.0047619 k( 189) = ( 0.3333333 0.5773503 0.1586938), wk = 0.0047619 k( 190) = ( 0.3333333 0.5773503 0.1851428), wk = 0.0047619 k( 191) = ( 0.3333333 0.5773503 0.2115918), wk = 0.0047619 k( 192) = ( 0.3333333 0.5773503 0.2380408), wk = 0.0047619 k( 193) = ( 0.3333333 0.5773503 0.2644897), wk = 0.0047619 k( 194) = ( 0.3333333 0.5773503 0.2909387), wk = 0.0047619 k( 195) = ( 0.3333333 0.5773503 0.3173877), wk = 0.0047619 k( 196) = ( 0.3333333 0.5773503 0.3438366), wk = 0.0047619 k( 197) = ( 0.3333333 0.5773503 0.3702856), wk = 0.0047619 k( 198) = ( 0.3333333 0.5773503 0.3967346), wk = 0.0047619 k( 199) = ( 0.3333333 0.5773503 0.4231836), wk = 0.0047619 k( 200) = ( 0.3333333 0.5773503 0.4496325), wk = 0.0047619 k( 201) = ( 0.3333333 0.5773503 0.4760815), wk = 0.0047619 k( 202) = ( 0.3333333 0.5773503 0.5025305), wk = 0.0047619 k( 203) = ( 0.3333333 0.5773503 0.5289795), wk = 0.0047619 k( 204) = ( 0.3333333 0.5773503 0.5554284), wk = 0.0047619 k( 205) = ( 0.3333333 0.5773503 0.5818774), wk = 0.0047619 k( 206) = ( 0.3333333 0.5773503 0.6083264), wk = 0.0047619 k( 207) = ( 0.3333333 0.5773503 0.6347753), wk = 0.0047619 k( 208) = ( 0.3333333 0.5773503 0.6612243), wk = 0.0047619 k( 209) = ( 0.3333333 0.5773503 0.6876733), wk = 0.0047619 k( 210) = ( 0.3333333 0.5773503 0.7141223), 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 0.1538462 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 0.3518519), 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 0.1538462 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: 155689 G-vectors FFT dimensions: ( 80, 80, 60) Smooth grid: 116871 G-vectors FFT dimensions: ( 72, 72, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.63 Mb ( 424, 98) NL pseudopotentials 1.40 Mb ( 212, 432) Each V/rho on FFT grid 0.10 Mb ( 6400) Each G-vector array 0.02 Mb ( 2163) G-vector shells 0.01 Mb ( 1100) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.54 Mb ( 424, 392) Each subspace H/S matrix 0.06 Mb ( 65, 65) Each matrix 1.29 Mb ( 432, 2, 98) The potential is recalculated from file : ./Zr5Sb3S.save/charge-density.dat Starting wfc are 244 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 6.9 secs Computing kpt #: 2 total cpu time spent up to now is 12.2 secs Computing kpt #: 3 total cpu time spent up to now is 17.7 secs Computing kpt #: 4 total cpu time spent up to now is 23.6 secs Computing kpt #: 5 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 30.5 secs Computing kpt #: 6 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 37.5 secs Computing kpt #: 7 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 44.4 secs Computing kpt #: 8 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 51.4 secs Computing kpt #: 9 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 58.4 secs Computing kpt #: 10 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 65.5 secs Computing kpt #: 11 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 72.7 secs Computing kpt #: 12 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 79.8 secs Computing kpt #: 13 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 86.9 secs Computing kpt #: 14 total cpu time spent up to now is 93.0 secs Computing kpt #: 15 total cpu time spent up to now is 97.9 secs Computing kpt #: 16 total cpu time spent up to now is 103.3 secs Computing kpt #: 17 total cpu time spent up to now is 109.3 secs Computing kpt #: 18 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 116.3 secs Computing kpt #: 19 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 123.5 secs Computing kpt #: 20 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 131.1 secs Computing kpt #: 21 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 138.3 secs Computing kpt #: 22 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 145.5 secs Computing kpt #: 23 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 152.6 secs Computing kpt #: 24 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 159.8 secs Computing kpt #: 25 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 166.9 secs Computing kpt #: 26 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 174.0 secs Computing kpt #: 27 total cpu time spent up to now is 180.1 secs Computing kpt #: 28 total cpu time spent up to now is 185.4 secs Computing kpt #: 29 total cpu time spent up to now is 190.6 secs Computing kpt #: 30 total cpu time spent up to now is 196.6 secs Computing kpt #: 31 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 203.8 secs Computing kpt #: 32 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 210.9 secs Computing kpt #: 33 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 218.2 secs Computing kpt #: 34 total cpu time spent up to now is 224.9 secs Computing kpt #: 35 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 232.0 secs Computing kpt #: 36 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 239.1 secs Computing kpt #: 37 total cpu time spent up to now is 245.9 secs Computing kpt #: 38 total cpu time spent up to now is 252.8 secs Computing kpt #: 39 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 260.1 secs Computing kpt #: 40 total cpu time spent up to now is 264.8 secs Computing kpt #: 41 total cpu time spent up to now is 269.6 secs Computing kpt #: 42 total cpu time spent up to now is 274.5 secs Computing kpt #: 43 total cpu time spent up to now is 279.3 secs Computing kpt #: 44 total cpu time spent up to now is 284.0 secs Computing kpt #: 45 total cpu time spent up to now is 288.9 secs Computing kpt #: 46 total cpu time spent up to now is 293.8 secs Computing kpt #: 47 total cpu time spent up to now is 298.7 secs Computing kpt #: 48 total cpu time spent up to now is 304.0 secs Computing kpt #: 49 total cpu time spent up to now is 310.1 secs Computing kpt #: 50 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 317.2 secs Computing kpt #: 51 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 324.4 secs Computing kpt #: 52 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 331.6 secs Computing kpt #: 53 total cpu time spent up to now is 338.3 secs Computing kpt #: 54 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 345.4 secs Computing kpt #: 55 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 352.5 secs Computing kpt #: 56 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 359.5 secs Computing kpt #: 57 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 366.6 secs Computing kpt #: 58 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 373.7 secs Computing kpt #: 59 total cpu time spent up to now is 378.9 secs Computing kpt #: 60 total cpu time spent up to now is 385.6 secs Computing kpt #: 61 total cpu time spent up to now is 391.5 secs Computing kpt #: 62 total cpu time spent up to now is 396.6 secs Computing kpt #: 63 total cpu time spent up to now is 401.7 secs Computing kpt #: 64 total cpu time spent up to now is 406.0 secs Computing kpt #: 65 total cpu time spent up to now is 410.8 secs Computing kpt #: 66 total cpu time spent up to now is 415.7 secs Computing kpt #: 67 total cpu time spent up to now is 420.7 secs Computing kpt #: 68 total cpu time spent up to now is 426.5 secs Computing kpt #: 69 total cpu time spent up to now is 432.8 secs Computing kpt #: 70 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 440.1 secs Computing kpt #: 71 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 447.8 secs Computing kpt #: 72 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 455.4 secs Computing kpt #: 73 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 463.1 secs Computing kpt #: 74 total cpu time spent up to now is 470.0 secs Computing kpt #: 75 total cpu time spent up to now is 477.3 secs Computing kpt #: 76 total cpu time spent up to now is 484.5 secs Computing kpt #: 77 total cpu time spent up to now is 491.8 secs Computing kpt #: 78 total cpu time spent up to now is 499.4 secs Computing kpt #: 79 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 507.4 secs Computing kpt #: 80 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 515.1 secs Computing kpt #: 81 total cpu time spent up to now is 522.7 secs Computing kpt #: 82 total cpu time spent up to now is 530.1 secs Computing kpt #: 83 total cpu time spent up to now is 537.5 secs Computing kpt #: 84 total cpu time spent up to now is 543.7 secs Computing kpt #: 85 total cpu time spent up to now is 549.0 secs Computing kpt #: 86 total cpu time spent up to now is 554.3 secs Computing kpt #: 87 total cpu time spent up to now is 559.6 secs Computing kpt #: 88 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 566.7 secs Computing kpt #: 89 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 573.9 secs Computing kpt #: 90 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 581.1 secs Computing kpt #: 91 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 588.3 secs Computing kpt #: 92 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 595.5 secs Computing kpt #: 93 total cpu time spent up to now is 602.7 secs Computing kpt #: 94 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 610.0 secs Computing kpt #: 95 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 617.4 secs Computing kpt #: 96 total cpu time spent up to now is 624.5 secs Computing kpt #: 97 total cpu time spent up to now is 631.4 secs Computing kpt #: 98 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 638.8 secs Computing kpt #: 99 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 646.2 secs Computing kpt #: 100 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 653.7 secs Computing kpt #: 101 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 661.1 secs Computing kpt #: 102 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 668.5 secs Computing kpt #: 103 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 675.8 secs Computing kpt #: 104 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 683.1 secs Computing kpt #: 105 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 690.3 secs Computing kpt #: 106 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 697.5 secs Computing kpt #: 107 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 704.6 secs Computing kpt #: 108 total cpu time spent up to now is 710.0 secs Computing kpt #: 109 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 717.3 secs Computing kpt #: 110 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 724.8 secs Computing kpt #: 111 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 732.4 secs Computing kpt #: 112 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 739.7 secs Computing kpt #: 113 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 747.2 secs Computing kpt #: 114 total cpu time spent up to now is 753.8 secs Computing kpt #: 115 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 760.9 secs Computing kpt #: 116 total cpu time spent up to now is 767.3 secs Computing kpt #: 117 total cpu time spent up to now is 772.5 secs Computing kpt #: 118 total cpu time spent up to now is 777.8 secs Computing kpt #: 119 total cpu time spent up to now is 783.0 secs Computing kpt #: 120 total cpu time spent up to now is 787.8 secs Computing kpt #: 121 total cpu time spent up to now is 792.6 secs Computing kpt #: 122 total cpu time spent up to now is 797.3 secs Computing kpt #: 123 total cpu time spent up to now is 802.6 secs Computing kpt #: 124 total cpu time spent up to now is 808.1 secs Computing kpt #: 125 total cpu time spent up to now is 815.1 secs Computing kpt #: 126 total cpu time spent up to now is 822.2 secs Computing kpt #: 127 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 829.8 secs Computing kpt #: 128 total cpu time spent up to now is 836.9 secs Computing kpt #: 129 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 844.5 secs Computing kpt #: 130 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 852.2 secs Computing kpt #: 131 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 859.7 secs Computing kpt #: 132 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 867.2 secs Computing kpt #: 133 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 874.6 secs Computing kpt #: 134 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 881.9 secs Computing kpt #: 135 total cpu time spent up to now is 889.1 secs Computing kpt #: 136 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 896.3 secs Computing kpt #: 137 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 903.5 secs Computing kpt #: 138 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 910.7 secs Computing kpt #: 139 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 918.0 secs Computing kpt #: 140 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 925.3 secs Computing kpt #: 141 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 932.7 secs Computing kpt #: 142 total cpu time spent up to now is 939.3 secs Computing kpt #: 143 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 946.9 secs Computing kpt #: 144 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 954.4 secs Computing kpt #: 145 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 962.0 secs Computing kpt #: 146 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 969.4 secs Computing kpt #: 147 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 976.8 secs Computing kpt #: 148 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 984.3 secs Computing kpt #: 149 total cpu time spent up to now is 991.4 secs Computing kpt #: 150 total cpu time spent up to now is 998.3 secs Computing kpt #: 151 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1005.7 secs Computing kpt #: 152 total cpu time spent up to now is 1012.8 secs Computing kpt #: 153 total cpu time spent up to now is 1019.9 secs Computing kpt #: 154 total cpu time spent up to now is 1027.3 secs Computing kpt #: 155 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1035.0 secs Computing kpt #: 156 total cpu time spent up to now is 1039.9 secs Computing kpt #: 157 total cpu time spent up to now is 1044.7 secs Computing kpt #: 158 total cpu time spent up to now is 1049.3 secs Computing kpt #: 159 total cpu time spent up to now is 1053.9 secs Computing kpt #: 160 total cpu time spent up to now is 1058.6 secs Computing kpt #: 161 total cpu time spent up to now is 1063.4 secs Computing kpt #: 162 total cpu time spent up to now is 1068.2 secs Computing kpt #: 163 total cpu time spent up to now is 1073.2 secs Computing kpt #: 164 total cpu time spent up to now is 1079.3 secs Computing kpt #: 165 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1086.5 secs Computing kpt #: 166 total cpu time spent up to now is 1092.7 secs Computing kpt #: 167 total cpu time spent up to now is 1097.9 secs Computing kpt #: 168 total cpu time spent up to now is 1102.5 secs Computing kpt #: 169 total cpu time spent up to now is 1107.1 secs Computing kpt #: 170 total cpu time spent up to now is 1111.5 secs Computing kpt #: 171 total cpu time spent up to now is 1115.9 secs Computing kpt #: 172 total cpu time spent up to now is 1120.6 secs Computing kpt #: 173 total cpu time spent up to now is 1125.3 secs Computing kpt #: 174 total cpu time spent up to now is 1130.4 secs Computing kpt #: 175 total cpu time spent up to now is 1135.6 secs Computing kpt #: 176 total cpu time spent up to now is 1141.7 secs Computing kpt #: 177 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1148.8 secs Computing kpt #: 178 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1156.0 secs Computing kpt #: 179 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1163.2 secs Computing kpt #: 180 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1170.3 secs Computing kpt #: 181 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1177.5 secs Computing kpt #: 182 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1184.6 secs Computing kpt #: 183 total cpu time spent up to now is 1191.4 secs Computing kpt #: 184 total cpu time spent up to now is 1197.8 secs Computing kpt #: 185 total cpu time spent up to now is 1203.1 secs Computing kpt #: 186 total cpu time spent up to now is 1208.0 secs Computing kpt #: 187 total cpu time spent up to now is 1213.3 secs Computing kpt #: 188 total cpu time spent up to now is 1220.0 secs Computing kpt #: 189 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1227.1 secs Computing kpt #: 190 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1234.1 secs Computing kpt #: 191 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1241.1 secs Computing kpt #: 192 total cpu time spent up to now is 1248.0 secs Computing kpt #: 193 total cpu time spent up to now is 1254.1 secs Computing kpt #: 194 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1261.2 secs Computing kpt #: 195 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1268.2 secs Computing kpt #: 196 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1275.2 secs Computing kpt #: 197 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1282.2 secs Computing kpt #: 198 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1289.3 secs Computing kpt #: 199 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1296.8 secs Computing kpt #: 200 total cpu time spent up to now is 1304.0 secs Computing kpt #: 201 total cpu time spent up to now is 1309.2 secs Computing kpt #: 202 total cpu time spent up to now is 1315.6 secs Computing kpt #: 203 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1322.9 secs Computing kpt #: 204 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1330.7 secs Computing kpt #: 205 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1338.1 secs Computing kpt #: 206 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1345.5 secs Computing kpt #: 207 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1352.9 secs Computing kpt #: 208 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1360.6 secs Computing kpt #: 209 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1368.1 secs Computing kpt #: 210 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1375.7 secs ethr = 1.22E-08, avg # of iterations = 98.6 total cpu time spent up to now is 1375.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 14515 PWs) bands (ev): -3.7660 -3.7660 -2.1590 -2.1590 -0.8857 -0.8857 -0.0540 -0.0540 -0.0532 -0.0532 0.5351 0.5351 0.5485 0.5485 0.8287 0.8287 4.5321 4.5321 4.6786 4.6786 4.7203 4.7203 4.7889 4.7889 5.1161 5.1161 5.9391 5.9391 6.0168 6.0168 6.0402 6.0402 6.1230 6.1230 6.1385 6.1385 6.2867 6.2867 6.3582 6.3582 6.4890 6.4890 6.6578 6.6578 6.6696 6.6696 6.6755 6.6755 8.2075 8.2075 8.2268 8.2268 8.3056 8.3056 8.3973 8.3973 8.4496 8.4496 8.4863 8.4863 8.6396 8.6396 8.6674 8.6674 8.9119 8.9119 8.9208 8.9208 8.9485 8.9485 8.9670 8.9670 9.4052 9.4052 9.5313 9.5313 10.8733 10.8733 11.0919 11.0919 11.1424 11.1424 11.2607 11.2607 11.3467 11.3467 11.3490 11.3490 11.3723 11.3723 11.4046 11.4046 11.6368 11.6368 11.6577 11.6577 11.6620 11.6620 k = 0.0227 0.0131-0.0000 ( 14537 PWs) bands (ev): -3.7658 -3.7658 -2.1590 -2.1590 -0.8855 -0.8855 -0.0555 -0.0555 -0.0543 -0.0543 0.5358 0.5358 0.5492 0.5492 0.8290 0.8290 4.5293 4.5293 4.6798 4.6798 4.7214 4.7214 4.7892 4.7892 5.1166 5.1166 5.9407 5.9407 6.0176 6.0176 6.0401 6.0401 6.1224 6.1224 6.1406 6.1406 6.2869 6.2869 6.3616 6.3616 6.4907 6.4907 6.6189 6.6189 6.6685 6.6685 6.7146 6.7146 8.2060 8.2060 8.2305 8.2305 8.3017 8.3017 8.3961 8.3961 8.4408 8.4408 8.4847 8.4847 8.6141 8.6141 8.6959 8.6959 8.9094 8.9094 8.9201 8.9201 8.9497 8.9497 8.9676 8.9676 9.4116 9.4116 9.5309 9.5309 10.8707 10.8707 11.0886 11.0886 11.1407 11.1407 11.2605 11.2605 11.3307 11.3307 11.3464 11.3464 11.3694 11.3694 11.3962 11.3962 11.6330 11.6330 11.6552 11.6552 11.6842 11.6842 k = 0.0455 0.0262-0.0000 ( 14555 PWs) bands (ev): -3.7652 -3.7652 -2.1590 -2.1590 -0.8850 -0.8850 -0.0604 -0.0604 -0.0568 -0.0568 0.5380 0.5380 0.5512 0.5512 0.8299 0.8299 4.5207 4.5207 4.6832 4.6832 4.7247 4.7247 4.7905 4.7905 5.1179 5.1179 5.9450 5.9450 6.0200 6.0200 6.0398 6.0398 6.1204 6.1204 6.1467 6.1467 6.2876 6.2876 6.3717 6.3717 6.4950 6.4950 6.5705 6.5705 6.6728 6.6728 6.7568 6.7568 8.2013 8.2013 8.2415 8.2415 8.2902 8.2902 8.3923 8.3923 8.4161 8.4161 8.4800 8.4800 8.5829 8.5829 8.7346 8.7346 8.8976 8.8976 8.9230 8.9230 8.9536 8.9536 8.9697 8.9697 9.4299 9.4299 9.5296 9.5296 10.8626 10.8626 11.0789 11.0789 11.1347 11.1347 11.2599 11.2599 11.2831 11.2831 11.3387 11.3387 11.3571 11.3571 11.3918 11.3918 11.6243 11.6243 11.6486 11.6486 11.7252 11.7252 k = 0.0682 0.0394-0.0000 ( 14571 PWs) bands (ev): -3.7642 -3.7642 -2.1590 -2.1590 -0.8841 -0.8841 -0.0687 -0.0687 -0.0608 -0.0608 0.5415 0.5415 0.5545 0.5545 0.8314 0.8314 4.5064 4.5064 4.6888 4.6888 4.7298 4.7298 4.7939 4.7939 5.1202 5.1202 5.9508 5.9508 6.0239 6.0239 6.0395 6.0395 6.1177 6.1177 6.1568 6.1568 6.2892 6.2892 6.3872 6.3872 6.4941 6.4941 6.5307 6.5307 6.6799 6.6799 6.7956 6.7956 8.1933 8.1933 8.2583 8.2583 8.2724 8.2724 8.3739 8.3739 8.3911 8.3911 8.4721 8.4721 8.5548 8.5548 8.7707 8.7707 8.8785 8.8785 8.9296 8.9296 8.9599 8.9599 8.9744 8.9744 9.4580 9.4580 9.5275 9.5275 10.8487 10.8487 11.0628 11.0628 11.1198 11.1198 11.2233 11.2233 11.2590 11.2590 11.3265 11.3265 11.3385 11.3385 11.3961 11.3961 11.6092 11.6092 11.6398 11.6398 11.7542 11.7543 k = 0.0909 0.0525-0.0000 ( 14587 PWs) bands (ev): -3.7629 -3.7629 -2.1591 -2.1591 -0.8827 -0.8827 -0.0800 -0.0800 -0.0661 -0.0661 0.5461 0.5461 0.5589 0.5589 0.8336 0.8336 4.4864 4.4864 4.6964 4.6964 4.7357 4.7357 4.8011 4.8011 5.1234 5.1234 5.9563 5.9563 6.0271 6.0271 6.0416 6.0416 6.1149 6.1149 6.1706 6.1706 6.2922 6.2922 6.4023 6.4023 6.4633 6.4633 6.5301 6.5301 6.6899 6.6899 6.8303 6.8303 8.1819 8.1819 8.2435 8.2435 8.2853 8.2853 8.3289 8.3289 8.3827 8.3827 8.4607 8.4607 8.5290 8.5290 8.7993 8.7993 8.8566 8.8566 8.9387 8.9387 8.9669 8.9669 8.9849 8.9849 9.4936 9.4936 9.5245 9.5245 10.8282 10.8282 11.0408 11.0408 11.0828 11.0828 11.1771 11.1771 11.2572 11.2572 11.3107 11.3107 11.3170 11.3170 11.4049 11.4049 11.5872 11.5872 11.6305 11.6305 11.7681 11.7682 k = 0.1136 0.0656-0.0000 ( 14597 PWs) bands (ev): -3.7612 -3.7612 -2.1591 -2.1591 -0.8810 -0.8810 -0.0940 -0.0940 -0.0726 -0.0726 0.5517 0.5517 0.5642 0.5642 0.8365 0.8365 4.4615 4.4615 4.7051 4.7051 4.7418 4.7418 4.8137 4.8137 5.1275 5.1275 5.9590 5.9590 6.0253 6.0253 6.0503 6.0503 6.1131 6.1131 6.1875 6.1875 6.2969 6.2969 6.3866 6.3866 6.4556 6.4556 6.5467 6.5467 6.7027 6.7027 6.8606 6.8606 8.1665 8.1665 8.2108 8.2108 8.2773 8.2773 8.3143 8.3143 8.3751 8.3751 8.4456 8.4456 8.5048 8.5048 8.8088 8.8088 8.8440 8.8440 8.9496 8.9496 8.9729 8.9729 9.0040 9.0040 9.5202 9.5202 9.5350 9.5350 10.8003 10.8003 11.0108 11.0108 11.0235 11.0235 11.1526 11.1526 11.2543 11.2543 11.2908 11.2908 11.2959 11.2959 11.4175 11.4175 11.5593 11.5593 11.6214 11.6214 11.7754 11.7755 k = 0.1364 0.0787-0.0000 ( 14603 PWs) bands (ev): -3.7593 -3.7593 -2.1592 -2.1592 -0.8789 -0.8789 -0.1103 -0.1103 -0.0800 -0.0800 0.5578 0.5578 0.5702 0.5702 0.8401 0.8401 4.4322 4.4322 4.7137 4.7137 4.7492 4.7492 4.8322 4.8322 5.1325 5.1325 5.9570 5.9570 6.0198 6.0198 6.0640 6.0640 6.1133 6.1133 6.2065 6.2065 6.3017 6.3017 6.3448 6.3448 6.4800 6.4800 6.5693 6.5693 6.7185 6.7185 6.8865 6.8865 8.1464 8.1464 8.1721 8.1721 8.2236 8.2236 8.3384 8.3384 8.3749 8.3749 8.4273 8.4273 8.4824 8.4824 8.7903 8.7903 8.8508 8.8508 8.9620 8.9620 8.9790 8.9790 9.0303 9.0303 9.5154 9.5154 9.5795 9.5795 10.7646 10.7646 10.9447 10.9447 10.9874 10.9874 11.1360 11.1360 11.2495 11.2495 11.2663 11.2663 11.2779 11.2779 11.4337 11.4337 11.5273 11.5273 11.6132 11.6132 11.7802 11.7803 k = 0.1591 0.0919-0.0000 ( 14611 PWs) bands (ev): -3.7571 -3.7571 -2.1592 -2.1592 -0.8764 -0.8764 -0.1287 -0.1287 -0.0882 -0.0882 0.5644 0.5644 0.5766 0.5766 0.8445 0.8445 4.3997 4.3997 4.7203 4.7203 4.7601 4.7601 4.8557 4.8557 5.1383 5.1383 5.9486 5.9486 6.0134 6.0134 6.0803 6.0803 6.1147 6.1147 6.2239 6.2239 6.2875 6.2875 6.3270 6.3270 6.5107 6.5107 6.5963 6.5963 6.7371 6.7371 6.9082 6.9082 8.1173 8.1173 8.1317 8.1317 8.1695 8.1695 8.3355 8.3355 8.3964 8.3964 8.4140 8.4140 8.4616 8.4616 8.7654 8.7654 8.8587 8.8587 8.9751 8.9751 8.9860 8.9860 9.0614 9.0614 9.5094 9.5094 9.6267 9.6267 10.7214 10.7214 10.8698 10.8698 10.9570 10.9570 11.1199 11.1199 11.2380 11.2380 11.2435 11.2435 11.2615 11.2615 11.4533 11.4533 11.4935 11.4935 11.6066 11.6066 11.7839 11.7840 k = 0.1818 0.1050-0.0000 ( 14619 PWs) bands (ev): -3.7546 -3.7546 -2.1593 -2.1593 -0.8734 -0.8734 -0.1486 -0.1486 -0.0969 -0.0969 0.5711 0.5711 0.5833 0.5833 0.8496 0.8496 4.3648 4.3648 4.7250 4.7250 4.7752 4.7752 4.8831 4.8831 5.1451 5.1451 5.9334 5.9334 6.0080 6.0080 6.0965 6.0965 6.1152 6.1152 6.2206 6.2206 6.2755 6.2755 6.3386 6.3386 6.5424 6.5424 6.6271 6.6271 6.7587 6.7587 6.9262 6.9262 8.0706 8.0706 8.0961 8.0961 8.1188 8.1188 8.3192 8.3192 8.3827 8.3827 8.4368 8.4368 8.4543 8.4543 8.7409 8.7409 8.8639 8.8639 8.9880 8.9880 8.9950 8.9950 9.0946 9.0946 9.5022 9.5022 9.6752 9.6752 10.6720 10.6720 10.7952 10.7952 10.9269 10.9269 11.1022 11.1022 11.2118 11.2118 11.2299 11.2299 11.2465 11.2465 11.4570 11.4570 11.4799 11.4799 11.6025 11.6025 11.7862 11.7865 k = 0.2045 0.1181-0.0000 ( 14621 PWs) bands (ev): -3.7520 -3.7520 -2.1594 -2.1594 -0.8700 -0.8700 -0.1698 -0.1698 -0.1060 -0.1060 0.5778 0.5778 0.5900 0.5900 0.8554 0.8554 4.3285 4.3285 4.7292 4.7292 4.7936 4.7936 4.9131 4.9131 5.1528 5.1528 5.9124 5.9124 6.0041 6.0041 6.0981 6.0981 6.1201 6.1201 6.1994 6.1994 6.2941 6.2941 6.3569 6.3569 6.5732 6.5732 6.6602 6.6602 6.7835 6.7835 6.9413 6.9413 8.0148 8.0148 8.0519 8.0519 8.0781 8.0781 8.2982 8.2982 8.3635 8.3635 8.4186 8.4186 8.4996 8.4996 8.7183 8.7183 8.8671 8.8671 8.9994 8.9994 9.0072 9.0072 9.1283 9.1283 9.4937 9.4937 9.7244 9.7244 10.6183 10.6183 10.7222 10.7222 10.8970 10.8970 11.0824 11.0824 11.1846 11.1846 11.2113 11.2113 11.2317 11.2317 11.4274 11.4274 11.5064 11.5064 11.6016 11.6016 11.7866 11.7866 k = 0.2273 0.1312-0.0000 ( 14615 PWs) bands (ev): -3.7493 -3.7493 -2.1595 -2.1595 -0.8662 -0.8662 -0.1918 -0.1918 -0.1151 -0.1151 0.5844 0.5844 0.5964 0.5964 0.8619 0.8619 4.2916 4.2916 4.7341 4.7341 4.8143 4.8143 4.9443 4.9443 5.1614 5.1614 5.8874 5.8874 6.0011 6.0011 6.0719 6.0719 6.1356 6.1356 6.1917 6.1917 6.3206 6.3206 6.3789 6.3789 6.6017 6.6017 6.6938 6.6938 6.8114 6.8114 6.9549 6.9549 7.9539 7.9539 8.0021 8.0021 8.0419 8.0419 8.2748 8.2748 8.3455 8.3455 8.3976 8.3976 8.5502 8.5502 8.6981 8.6981 8.8694 8.8694 9.0103 9.0103 9.0214 9.0214 9.1611 9.1611 9.4839 9.4839 9.7736 9.7736 10.5625 10.5625 10.6516 10.6516 10.8674 10.8674 11.0603 11.0603 11.1580 11.1580 11.1858 11.1858 11.2163 11.2163 11.4027 11.4027 11.5370 11.5370 11.6047 11.6047 11.7839 11.7839 k = 0.2500 0.1443-0.0000 ( 14623 PWs) bands (ev): -3.7465 -3.7465 -2.1595 -2.1595 -0.8620 -0.8620 -0.2142 -0.2142 -0.1242 -0.1242 0.5907 0.5907 0.6025 0.6025 0.8690 0.8690 4.2550 4.2550 4.7408 4.7408 4.8365 4.8365 4.9754 4.9754 5.1709 5.1709 5.8601 5.8601 5.9986 5.9986 6.0354 6.0354 6.1517 6.1517 6.1958 6.1958 6.3501 6.3501 6.4029 6.4029 6.6268 6.6268 6.7261 6.7261 6.8423 6.8423 6.9683 6.9683 7.8896 7.8896 7.9528 7.9528 8.0046 8.0046 8.2508 8.2508 8.3284 8.3284 8.3762 8.3762 8.6025 8.6025 8.6808 8.6808 8.8713 8.8713 9.0220 9.0220 9.0363 9.0363 9.1922 9.1922 9.4726 9.4726 9.8222 9.8222 10.5064 10.5064 10.5839 10.5839 10.8380 10.8380 11.0362 11.0362 11.1326 11.1326 11.1527 11.1527 11.2007 11.2007 11.3849 11.3849 11.5694 11.5694 11.6129 11.6129 11.7772 11.7772 k = 0.2727 0.1575-0.0000 ( 14619 PWs) bands (ev): -3.7437 -3.7437 -2.1596 -2.1596 -0.8574 -0.8574 -0.2366 -0.2366 -0.1330 -0.1330 0.5967 0.5967 0.6079 0.6079 0.8765 0.8765 4.2193 4.2193 4.7495 4.7495 4.8595 4.8595 5.0047 5.0047 5.1812 5.1812 5.8317 5.8317 5.9932 5.9932 6.0012 6.0012 6.1675 6.1675 6.2044 6.2044 6.3821 6.3821 6.4271 6.4271 6.6480 6.6480 6.7558 6.7558 6.8758 6.8758 6.9830 6.9830 7.8228 7.8228 7.9058 7.9058 7.9657 7.9657 8.2274 8.2274 8.3119 8.3119 8.3548 8.3548 8.6538 8.6538 8.6677 8.6677 8.8734 8.8734 9.0346 9.0346 9.0516 9.0516 9.2208 9.2208 9.4600 9.4600 9.8697 9.8697 10.4516 10.4516 10.5196 10.5196 10.8087 10.8087 11.0104 11.0104 11.1068 11.1068 11.1149 11.1149 11.1853 11.1853 11.3735 11.3735 11.5992 11.5992 11.6302 11.6302 11.7662 11.7662 k = 0.2955 0.1706-0.0000 ( 14649 PWs) bands (ev): -3.7410 -3.7410 -2.1597 -2.1597 -0.8526 -0.8526 -0.2587 -0.2587 -0.1414 -0.1414 0.6022 0.6022 0.6128 0.6128 0.8843 0.8843 4.1851 4.1851 4.7608 4.7608 4.8827 4.8827 5.0305 5.0305 5.1921 5.1921 5.8033 5.8033 5.9627 5.9627 5.9959 5.9959 6.1827 6.1827 6.2142 6.2142 6.4162 6.4162 6.4491 6.4491 6.6656 6.6656 6.7826 6.7826 6.9109 6.9109 6.9994 6.9994 7.7543 7.7543 7.8621 7.8621 7.9257 7.9257 8.2053 8.2053 8.2960 8.2960 8.3339 8.3339 8.6532 8.6532 8.7081 8.7081 8.8760 8.8760 9.0481 9.0481 9.0672 9.0672 9.2462 9.2462 9.4467 9.4467 9.9155 9.9155 10.3993 10.3993 10.4593 10.4593 10.7798 10.7798 10.9834 10.9834 11.0665 11.0665 11.0897 11.0897 11.1703 11.1703 11.3668 11.3668 11.6205 11.6205 11.6612 11.6612 11.7519 11.7519 k = 0.3182 0.1837-0.0000 ( 14639 PWs) bands (ev): -3.7383 -3.7383 -2.1598 -2.1598 -0.8475 -0.8475 -0.2800 -0.2800 -0.1492 -0.1492 0.6073 0.6073 0.6170 0.6170 0.8921 0.8921 4.1531 4.1531 4.7748 4.7748 4.9056 4.9056 5.0513 5.0513 5.2035 5.2035 5.7755 5.7755 5.9353 5.9353 5.9942 5.9942 6.1971 6.1971 6.2240 6.2240 6.4516 6.4516 6.4662 6.4662 6.6815 6.6815 6.8069 6.8069 6.9459 6.9459 7.0170 7.0170 7.6850 7.6850 7.8229 7.8229 7.8853 7.8853 8.1851 8.1851 8.2808 8.2808 8.3139 8.3139 8.6435 8.6435 8.7578 8.7578 8.8792 8.8792 9.0620 9.0620 9.0831 9.0831 9.2669 9.2669 9.4336 9.4336 9.9592 9.9592 10.3507 10.3507 10.4036 10.4036 10.7515 10.7515 10.9558 10.9558 11.0204 11.0204 11.0708 11.0708 11.1561 11.1561 11.3632 11.3632 11.6383 11.6383 11.6998 11.6998 11.7354 11.7354 k = 0.3409 0.1968-0.0000 ( 14641 PWs) bands (ev): -3.7358 -3.7358 -2.1598 -2.1598 -0.8424 -0.8424 -0.3002 -0.3002 -0.1564 -0.1564 0.6118 0.6118 0.6206 0.6206 0.8997 0.8997 4.1237 4.1237 4.7914 4.7914 4.9276 4.9276 5.0654 5.0654 5.2150 5.2150 5.7488 5.7488 5.9160 5.9160 5.9929 5.9929 6.2104 6.2104 6.2332 6.2332 6.4728 6.4728 6.4904 6.4904 6.6988 6.6988 6.8294 6.8294 6.9789 6.9789 7.0348 7.0348 7.6155 7.6155 7.7893 7.7893 7.8453 7.8453 8.1668 8.1668 8.2667 8.2667 8.2953 8.2953 8.6358 8.6358 8.8044 8.8044 8.8831 8.8831 9.0762 9.0762 9.0995 9.0995 9.2814 9.2814 9.4226 9.4226 10.0001 10.0001 10.3065 10.3065 10.3530 10.3530 10.7242 10.7242 10.9283 10.9283 10.9743 10.9743 11.0547 11.0547 11.1427 11.1427 11.3617 11.3617 11.6563 11.6563 11.7184 11.7184 11.7405 11.7405 k = 0.3636 0.2099-0.0000 ( 14633 PWs) bands (ev): -3.7336 -3.7336 -2.1599 -2.1599 -0.8373 -0.8373 -0.3189 -0.3189 -0.1629 -0.1629 0.6159 0.6159 0.6235 0.6235 0.9069 0.9069 4.0973 4.0973 4.8108 4.8108 4.9482 4.9482 5.0717 5.0717 5.2264 5.2264 5.7234 5.7234 5.9059 5.9059 5.9918 5.9918 6.2223 6.2223 6.2418 6.2418 6.4715 6.4715 6.5275 6.5275 6.7199 6.7199 6.8510 6.8510 7.0062 7.0062 7.0532 7.0532 7.5469 7.5469 7.7621 7.7621 7.8067 7.8067 8.1508 8.1508 8.2541 8.2541 8.2783 8.2783 8.6297 8.6297 8.8464 8.8464 8.8878 8.8878 9.0902 9.0902 9.1160 9.1160 9.2873 9.2873 9.4163 9.4163 10.0374 10.0374 10.2675 10.2675 10.3081 10.3081 10.6986 10.6986 10.9016 10.9016 10.9301 10.9301 11.0412 11.0412 11.1305 11.1305 11.3615 11.3615 11.6749 11.6749 11.7018 11.7018 11.7808 11.7808 k = 0.3864 0.2231-0.0000 ( 14635 PWs) bands (ev): -3.7315 -3.7315 -2.1599 -2.1599 -0.8324 -0.8324 -0.3356 -0.3356 -0.1684 -0.1684 0.6193 0.6193 0.6259 0.6259 0.9134 0.9134 4.0743 4.0743 4.8327 4.8327 4.9667 4.9667 5.0698 5.0698 5.2374 5.2374 5.6998 5.6998 5.9048 5.9048 5.9910 5.9910 6.2325 6.2325 6.2498 6.2498 6.4606 6.4606 6.5642 6.5642 6.7451 6.7451 6.8722 6.8722 7.0223 7.0223 7.0749 7.0749 7.4801 7.4801 7.7411 7.7411 7.7711 7.7711 8.1371 8.1371 8.2433 8.2433 8.2634 8.2634 8.6251 8.6251 8.8820 8.8820 8.8936 8.8936 9.1039 9.1039 9.1323 9.1323 9.2842 9.2842 9.4160 9.4160 10.0702 10.0702 10.2342 10.2342 10.2698 10.2698 10.6752 10.6752 10.8764 10.8764 10.8895 10.8895 11.0304 11.0304 11.1197 11.1197 11.3619 11.3619 11.6865 11.6865 11.6936 11.6936 11.8189 11.8189 k = 0.4091 0.2362-0.0000 ( 14641 PWs) bands (ev): -3.7298 -3.7298 -2.1600 -2.1600 -0.8280 -0.8280 -0.3499 -0.3499 -0.1731 -0.1731 0.6222 0.6222 0.6277 0.6277 0.9191 0.9191 4.0551 4.0551 4.8568 4.8568 4.9827 4.9827 5.0601 5.0601 5.2476 5.2476 5.6786 5.6786 5.9112 5.9112 5.9905 5.9905 6.2406 6.2406 6.2572 6.2572 6.4433 6.4433 6.5988 6.5988 6.7725 6.7725 6.8941 6.8941 7.0260 7.0260 7.0994 7.0994 7.4167 7.4167 7.7229 7.7229 7.7429 7.7429 8.1258 8.1258 8.2347 8.2347 8.2506 8.2506 8.6216 8.6216 8.8974 8.8974 8.9132 8.9132 9.1167 9.1167 9.1477 9.1477 9.2743 9.2743 9.4203 9.4203 10.0968 10.0968 10.2071 10.2071 10.2390 10.2390 10.6548 10.6548 10.8518 10.8518 10.8558 10.8558 11.0219 11.0219 11.1104 11.1104 11.3627 11.3627 11.6734 11.6734 11.7111 11.7111 11.8530 11.8530 k = 0.4318 0.2493-0.0000 ( 14633 PWs) bands (ev): -3.7285 -3.7285 -2.1600 -2.1600 -0.8243 -0.8243 -0.3616 -0.3616 -0.1768 -0.1768 0.6245 0.6245 0.6290 0.6290 0.9237 0.9237 4.0399 4.0399 4.8828 4.8828 4.9957 4.9957 5.0437 5.0437 5.2566 5.2566 5.6607 5.6607 5.9220 5.9220 5.9904 5.9904 6.2468 6.2468 6.2636 6.2636 6.4234 6.4234 6.6294 6.6294 6.7991 6.7991 6.9167 6.9167 7.0216 7.0216 7.1222 7.1222 7.3588 7.3588 7.7002 7.7002 7.7293 7.7293 8.1170 8.1170 8.2283 8.2283 8.2402 8.2402 8.6192 8.6192 8.9030 8.9030 8.9355 8.9355 9.1280 9.1280 9.1613 9.1613 9.2617 9.2617 9.4263 9.4263 10.1152 10.1152 10.1866 10.1866 10.2175 10.2175 10.6381 10.6381 10.8235 10.8235 10.8356 10.8356 11.0157 11.0157 11.1029 11.1029 11.3636 11.3636 11.6628 11.6628 11.7266 11.7266 11.8809 11.8810 k = 0.4545 0.2624-0.0000 ( 14633 PWs) bands (ev): -3.7275 -3.7275 -2.1600 -2.1600 -0.8215 -0.8215 -0.3701 -0.3701 -0.1794 -0.1794 0.6261 0.6261 0.6299 0.6299 0.9271 0.9271 4.0288 4.0288 4.9102 4.9102 5.0052 5.0052 5.0222 5.0222 5.2638 5.2638 5.6470 5.6470 5.9336 5.9336 5.9906 5.9906 6.2511 6.2511 6.2686 6.2686 6.4048 6.4048 6.6537 6.6537 6.8220 6.8220 6.9379 6.9379 7.0147 7.0147 7.1395 7.1395 7.3102 7.3102 7.6789 7.6789 7.7246 7.7246 8.1106 8.1106 8.2242 8.2242 8.2321 8.2321 8.6176 8.6176 8.9075 8.9075 8.9512 8.9512 9.1369 9.1369 9.1722 9.1722 9.2501 9.2501 9.4319 9.4319 10.1239 10.1239 10.1724 10.1724 10.2066 10.2066 10.6255 10.6255 10.8015 10.8015 10.8210 10.8210 11.0114 11.0114 11.0975 11.0975 11.3643 11.3643 11.6549 11.6549 11.7388 11.7388 11.9015 11.9017 k = 0.4773 0.2756-0.0000 ( 14637 PWs) bands (ev): -3.7269 -3.7269 -2.1601 -2.1601 -0.8197 -0.8197 -0.3754 -0.3754 -0.1811 -0.1811 0.6272 0.6272 0.6303 0.6303 0.9292 0.9292 4.0222 4.0222 4.9379 4.9379 4.9974 4.9974 5.0113 5.0113 5.2684 5.2684 5.6384 5.6384 5.9424 5.9424 5.9911 5.9911 6.2537 6.2537 6.2718 6.2718 6.3915 6.3915 6.6695 6.6695 6.8383 6.8383 6.9516 6.9516 7.0117 7.0117 7.1490 7.1490 7.2769 7.2769 7.6647 7.6647 7.7230 7.7230 8.1068 8.1068 8.2226 8.2226 8.2266 8.2266 8.6167 8.6167 8.9105 8.9105 8.9604 8.9604 9.1425 9.1425 9.1792 9.1792 9.2420 9.2420 9.4357 9.4357 10.1255 10.1255 10.1637 10.1637 10.2040 10.2040 10.6178 10.6178 10.7879 10.7879 10.8119 10.8119 11.0089 11.0089 11.0941 11.0941 11.3648 11.3648 11.6501 11.6501 11.7466 11.7466 11.9153 11.9286 k = 0.5000 0.2887-0.0000 ( 14634 PWs) bands (ev): -3.7267 -3.7267 -2.1601 -2.1601 -0.8191 -0.8191 -0.3772 -0.3772 -0.1816 -0.1816 0.6275 0.6275 0.6305 0.6305 0.9299 0.9299 4.0199 4.0199 4.9584 4.9584 4.9779 4.9779 5.0132 5.0132 5.2700 5.2700 5.6355 5.6355 5.9456 5.9456 5.9914 5.9914 6.2546 6.2546 6.2729 6.2729 6.3866 6.3866 6.6749 6.6749 6.8444 6.8444 6.9552 6.9552 7.0124 7.0124 7.1514 7.1514 7.2651 7.2651 7.6597 7.6597 7.7227 7.7227 8.1055 8.1055 8.2229 8.2229 8.2238 8.2238 8.6164 8.6164 8.9116 8.9116 8.9634 8.9634 9.1445 9.1445 9.1816 9.1816 9.2392 9.2392 9.4371 9.4371 10.1253 10.1253 10.1607 10.1607 10.2040 10.2040 10.6152 10.6152 10.7833 10.7833 10.8088 10.8088 11.0081 11.0081 11.0930 11.0930 11.3649 11.3649 11.6485 11.6485 11.7493 11.7493 11.9228 11.9350 k = 0.5000 0.2887-0.0000 ( 14634 PWs) bands (ev): -3.7267 -3.7267 -2.1601 -2.1601 -0.8191 -0.8191 -0.3772 -0.3772 -0.1816 -0.1816 0.6275 0.6275 0.6305 0.6305 0.9299 0.9299 4.0199 4.0199 4.9584 4.9584 4.9779 4.9779 5.0132 5.0132 5.2700 5.2700 5.6355 5.6355 5.9456 5.9456 5.9914 5.9914 6.2546 6.2546 6.2729 6.2729 6.3866 6.3866 6.6749 6.6749 6.8444 6.8444 6.9552 6.9552 7.0124 7.0124 7.1514 7.1514 7.2651 7.2651 7.6597 7.6597 7.7227 7.7227 8.1055 8.1055 8.2229 8.2229 8.2238 8.2238 8.6164 8.6164 8.9116 8.9116 8.9634 8.9634 9.1445 9.1445 9.1816 9.1816 9.2392 9.2392 9.4371 9.4371 10.1253 10.1253 10.1607 10.1607 10.2040 10.2040 10.6152 10.6152 10.7833 10.7833 10.8088 10.8088 11.0081 11.0081 11.0930 11.0930 11.3649 11.3649 11.6485 11.6485 11.7493 11.7493 11.9185 11.9329 k = 0.4872 0.3109-0.0000 ( 14636 PWs) bands (ev): -3.7266 -3.7266 -2.1601 -2.1601 -0.8181 -0.8181 -0.3808 -0.3808 -0.1796 -0.1796 0.6172 0.6172 0.6419 0.6419 0.9292 0.9292 4.0200 4.0200 4.9508 4.9508 4.9573 4.9573 5.0434 5.0434 5.2709 5.2709 5.6332 5.6332 5.9450 5.9450 5.9935 5.9935 6.2539 6.2539 6.2725 6.2725 6.3868 6.3868 6.6736 6.6736 6.8445 6.8445 6.9530 6.9530 7.0137 7.0137 7.1536 7.1536 7.2679 7.2679 7.6508 7.6508 7.7311 7.7311 8.1063 8.1063 8.2172 8.2172 8.2248 8.2248 8.6116 8.6116 8.9123 8.9123 8.9633 8.9633 9.1458 9.1458 9.1857 9.1857 9.2410 9.2410 9.4396 9.4396 10.1211 10.1211 10.1640 10.1640 10.2035 10.2035 10.6131 10.6131 10.7212 10.7212 10.8712 10.8712 11.0078 11.0078 11.0960 11.0960 11.3658 11.3658 11.6430 11.6430 11.7493 11.7493 11.9057 11.9059 k = 0.4744 0.3331-0.0000 ( 14632 PWs) bands (ev): -3.7264 -3.7264 -2.1601 -2.1601 -0.8150 -0.8150 -0.3912 -0.3912 -0.1741 -0.1741 0.6068 0.6068 0.6557 0.6557 0.9273 0.9273 4.0202 4.0202 4.9147 4.9147 4.9540 4.9540 5.0888 5.0888 5.2736 5.2736 5.6264 5.6264 5.9431 5.9431 5.9996 5.9996 6.2517 6.2517 6.2710 6.2710 6.3874 6.3874 6.6700 6.6700 6.8447 6.8447 6.9466 6.9466 7.0178 7.0178 7.1601 7.1601 7.2759 7.2759 7.6324 7.6324 7.7480 7.7480 8.1086 8.1086 8.2013 8.2013 8.2268 8.2268 8.5978 8.5978 8.9147 8.9147 8.9632 8.9632 9.1470 9.1470 9.2002 9.2002 9.2461 9.2461 9.4469 9.4469 10.1097 10.1097 10.1706 10.1706 10.2043 10.2043 10.6039 10.6039 10.6523 10.6523 10.9426 10.9426 11.0083 11.0083 11.1052 11.1052 11.3682 11.3682 11.6247 11.6247 11.7495 11.7495 11.8795 11.8796 k = 0.4615 0.3553-0.0000 ( 14640 PWs) bands (ev): -3.7261 -3.7261 -2.1601 -2.1601 -0.8099 -0.8099 -0.4070 -0.4070 -0.1663 -0.1663 0.5975 0.5975 0.6705 0.6705 0.9240 0.9240 4.0204 4.0204 4.8812 4.8812 4.9485 4.9485 5.1377 5.1377 5.2781 5.2781 5.6158 5.6158 5.9393 5.9393 6.0095 6.0095 6.2482 6.2482 6.2687 6.2687 6.3882 6.3882 6.6650 6.6650 6.8449 6.8449 6.9369 6.9369 7.0243 7.0243 7.1699 7.1699 7.2881 7.2881 7.6129 7.6129 7.7653 7.7653 8.1125 8.1125 8.1762 8.1762 8.2300 8.2300 8.5767 8.5767 8.9192 8.9192 8.9631 8.9631 9.1456 9.1456 9.2255 9.2255 9.2543 9.2543 9.4586 9.4586 10.0920 10.0920 10.1736 10.1736 10.2130 10.2130 10.5610 10.5610 10.6147 10.6147 10.9882 10.9882 11.0333 11.0333 11.1201 11.1201 11.3722 11.3722 11.5907 11.5907 11.7495 11.7495 11.8535 11.8535 k = 0.4487 0.3775-0.0000 ( 14634 PWs) bands (ev): -3.7257 -3.7257 -2.1601 -2.1601 -0.8027 -0.8027 -0.4268 -0.4268 -0.1574 -0.1574 0.5893 0.5893 0.6861 0.6861 0.9195 0.9195 4.0206 4.0206 4.8517 4.8517 4.9410 4.9410 5.1888 5.1888 5.2847 5.2847 5.6019 5.6019 5.9330 5.9330 6.0226 6.0226 6.2435 6.2435 6.2654 6.2654 6.3887 6.3887 6.6600 6.6600 6.8447 6.8447 6.9257 6.9257 7.0323 7.0323 7.1821 7.1821 7.3033 7.3033 7.5960 7.5960 7.7798 7.7798 8.1174 8.1174 8.1437 8.1437 8.2343 8.2343 8.5501 8.5501 8.9263 8.9263 8.9629 8.9629 9.1419 9.1419 9.2517 9.2517 9.2722 9.2722 9.4741 9.4741 10.0677 10.0677 10.1716 10.1716 10.2317 10.2317 10.4912 10.4912 10.6027 10.6027 10.9895 10.9895 11.0995 11.0995 11.1414 11.1414 11.3775 11.3775 11.5401 11.5401 11.7493 11.7493 11.8350 11.8350 k = 0.4359 0.3997-0.0000 ( 14636 PWs) bands (ev): -3.7252 -3.7252 -2.1601 -2.1601 -0.7936 -0.7936 -0.4495 -0.4495 -0.1484 -0.1484 0.5822 0.5822 0.7025 0.7025 0.9138 0.9138 4.0206 4.0206 4.8265 4.8265 4.9315 4.9315 5.2408 5.2408 5.2941 5.2941 5.5853 5.5853 5.9237 5.9237 6.0381 6.0381 6.2377 6.2377 6.2613 6.2613 6.3887 6.3887 6.6563 6.6563 6.8435 6.8435 6.9146 6.9146 7.0405 7.0405 7.1956 7.1956 7.3202 7.3202 7.5843 7.5843 7.7896 7.7896 8.1030 8.1030 8.1261 8.1261 8.2393 8.2393 8.5198 8.5198 8.9366 8.9366 8.9628 8.9628 9.1371 9.1371 9.2623 9.2623 9.3126 9.3126 9.4927 9.4927 10.0374 10.0374 10.1679 10.1679 10.2563 10.2563 10.4200 10.4200 10.5928 10.5928 10.9842 10.9842 11.1535 11.1535 11.1838 11.1838 11.3840 11.3840 11.4768 11.4768 11.7487 11.7487 11.8241 11.8241 k = 0.4231 0.4219-0.0000 ( 14640 PWs) bands (ev): -3.7247 -3.7247 -2.1601 -2.1601 -0.7825 -0.7825 -0.4741 -0.4741 -0.1400 -0.1400 0.5762 0.5762 0.7193 0.7193 0.9069 0.9069 4.0204 4.0204 4.8062 4.8062 4.9203 4.9203 5.2865 5.2865 5.3130 5.3130 5.5668 5.5668 5.9108 5.9108 6.0555 6.0555 6.2312 6.2312 6.2565 6.2565 6.3878 6.3878 6.6554 6.6554 6.8407 6.8407 6.9049 6.9049 7.0480 7.0480 7.2085 7.2085 7.3381 7.3381 7.5799 7.5799 7.7934 7.7934 8.0608 8.0608 8.1338 8.1338 8.2450 8.2450 8.4873 8.4873 8.9506 8.9506 8.9629 8.9629 9.1318 9.1318 9.2667 9.2667 9.3627 9.3627 9.5140 9.5140 10.0023 10.0023 10.1643 10.1643 10.2779 10.2779 10.3565 10.3565 10.5829 10.5829 10.9772 10.9772 11.1833 11.1833 11.2534 11.2534 11.3909 11.3909 11.4072 11.4072 11.7474 11.7474 11.8180 11.8180 k = 0.4103 0.4441-0.0000 ( 14646 PWs) bands (ev): -3.7241 -3.7241 -2.1601 -2.1601 -0.7695 -0.7695 -0.4999 -0.4999 -0.1326 -0.1326 0.5712 0.5712 0.7364 0.7364 0.8989 0.8989 4.0198 4.0198 4.7910 4.7910 4.9074 4.9074 5.3076 5.3076 5.3594 5.3594 5.5467 5.5467 5.8936 5.8936 6.0740 6.0740 6.2242 6.2242 6.2510 6.2510 6.3859 6.3859 6.6581 6.6581 6.8360 6.8360 6.8968 6.8968 7.0546 7.0546 7.2187 7.2187 7.3573 7.3573 7.5844 7.5844 7.7904 7.7904 8.0159 8.0159 8.1435 8.1435 8.2510 8.2510 8.4539 8.4539 8.9628 8.9628 8.9687 8.9687 9.1265 9.1265 9.2670 9.2670 9.4184 9.4184 9.5374 9.5374 9.9638 9.9638 10.1611 10.1611 10.2510 10.2510 10.3452 10.3452 10.5735 10.5735 10.9692 10.9692 11.2102 11.2102 11.3250 11.3250 11.3352 11.3352 11.4005 11.4005 11.7452 11.7452 11.8135 11.8135 k = 0.3974 0.4663-0.0000 ( 14638 PWs) bands (ev): -3.7236 -3.7236 -2.1601 -2.1601 -0.7547 -0.7547 -0.5263 -0.5263 -0.1263 -0.1263 0.5671 0.5671 0.7536 0.7536 0.8899 0.8899 4.0187 4.0187 4.7812 4.7812 4.8932 4.8932 5.3222 5.3222 5.4145 5.4145 5.5257 5.5257 5.8717 5.8717 6.0930 6.0930 6.2167 6.2167 6.2450 6.2450 6.3830 6.3830 6.6653 6.6653 6.8292 6.8292 6.8903 6.8903 7.0602 7.0602 7.2241 7.2241 7.3789 7.3789 7.5980 7.5980 7.7799 7.7799 7.9707 7.9707 8.1547 8.1547 8.2572 8.2572 8.4205 8.4205 8.9632 8.9632 8.9903 8.9903 9.1214 9.1214 9.2626 9.2626 9.4784 9.4784 9.5627 9.5627 9.9235 9.9235 10.1579 10.1579 10.1847 10.1847 10.3758 10.3758 10.5652 10.5652 10.9605 10.9605 11.2265 11.2265 11.2761 11.2761 11.3891 11.3891 11.4165 11.4165 11.7422 11.7422 11.8101 11.8182 k = 0.3846 0.4885-0.0000 ( 14638 PWs) bands (ev): -3.7230 -3.7230 -2.1602 -2.1602 -0.7380 -0.7380 -0.5529 -0.5529 -0.1214 -0.1214 0.5639 0.5639 0.7706 0.7706 0.8799 0.8799 4.0174 4.0174 4.7769 4.7769 4.8779 4.8779 5.3375 5.3375 5.4700 5.4700 5.5043 5.5043 5.8452 5.8452 6.1122 6.1122 6.2091 6.2091 6.2386 6.2386 6.3793 6.3793 6.6771 6.6771 6.8205 6.8205 6.8845 6.8845 7.0652 7.0652 7.2240 7.2240 7.4035 7.4035 7.6196 7.6196 7.7624 7.7624 7.9263 7.9263 8.1670 8.1670 8.2633 8.2633 8.3881 8.3881 8.9637 8.9637 9.0151 9.0151 9.1171 9.1171 9.2531 9.2531 9.5417 9.5417 9.5897 9.5897 9.8828 9.8828 10.1118 10.1118 10.1566 10.1566 10.4112 10.4112 10.5590 10.5590 10.9514 10.9514 11.1861 11.1861 11.2778 11.2778 11.4100 11.4100 11.4732 11.4732 11.7388 11.7388 11.8027 11.8042 k = 0.3718 0.5107-0.0000 ( 14636 PWs) bands (ev): -3.7225 -3.7225 -2.1602 -2.1602 -0.7196 -0.7196 -0.5794 -0.5794 -0.1177 -0.1177 0.5615 0.5615 0.7871 0.7871 0.8690 0.8690 4.0158 4.0158 4.7780 4.7780 4.8616 4.8616 5.3542 5.3542 5.4809 5.4809 5.5261 5.5261 5.8145 5.8145 6.1308 6.1308 6.2013 6.2013 6.2320 6.2320 6.3753 6.3753 6.6933 6.6933 6.8097 6.8097 6.8789 6.8789 7.0699 7.0699 7.2199 7.2199 7.4301 7.4301 7.6478 7.6478 7.7396 7.7396 7.8835 7.8835 8.1803 8.1803 8.2691 8.2691 8.3576 8.3576 8.9643 8.9643 9.0417 9.0417 9.1144 9.1144 9.2386 9.2386 9.6068 9.6068 9.6190 9.6190 9.8429 9.8429 10.0394 10.0394 10.1544 10.1544 10.4433 10.4433 10.5564 10.5564 10.9416 10.9416 11.1323 11.1323 11.2990 11.2990 11.4181 11.4181 11.5379 11.5379 11.7365 11.7365 11.7901 11.7901 k = 0.3590 0.5329-0.0000 ( 14646 PWs) bands (ev): -3.7222 -3.7222 -2.1602 -2.1602 -0.6996 -0.6996 -0.6053 -0.6053 -0.1152 -0.1152 0.5599 0.5599 0.8030 0.8030 0.8573 0.8573 4.0142 4.0142 4.7842 4.7842 4.8448 4.8448 5.3724 5.3724 5.4588 5.4588 5.5778 5.5778 5.7806 5.7806 6.1482 6.1482 6.1935 6.1935 6.2256 6.2256 6.3714 6.3714 6.7130 6.7130 6.7970 6.7970 6.8733 6.8733 7.0741 7.0741 7.2138 7.2138 7.4561 7.4561 7.6797 7.6797 7.7161 7.7161 7.8420 7.8420 8.1937 8.1937 8.2739 8.2739 8.3310 8.3310 8.9649 8.9649 9.0663 9.0663 9.1160 9.1160 9.2196 9.2196 9.6458 9.6458 9.6772 9.6772 9.8052 9.8052 9.9670 9.9670 10.1528 10.1528 10.4668 10.4668 10.5587 10.5587 10.9316 10.9316 11.0898 11.0898 11.3170 11.3170 11.4240 11.4240 11.5942 11.5942 11.7395 11.7395 11.7792 11.7794 k = 0.3462 0.5551-0.0000 ( 14662 PWs) bands (ev): -3.7219 -3.7219 -2.1602 -2.1602 -0.6781 -0.6781 -0.6305 -0.6305 -0.1138 -0.1138 0.5590 0.5590 0.8179 0.8179 0.8450 0.8450 4.0130 4.0130 4.7952 4.7952 4.8277 4.8277 5.3922 5.3922 5.4364 5.4364 5.6228 5.6228 5.7472 5.7472 6.1629 6.1629 6.1862 6.1862 6.2202 6.2202 6.3684 6.3684 6.7338 6.7338 6.7828 6.7828 6.8682 6.8682 7.0775 7.0775 7.2084 7.2084 7.4767 7.4767 7.6894 7.6894 7.7224 7.7224 7.8012 7.8012 8.2053 8.2053 8.2758 8.2758 8.3123 8.3123 8.9655 8.9655 9.0807 9.0807 9.1278 9.1278 9.1978 9.1978 9.6737 9.6737 9.7444 9.7444 9.7741 9.7741 9.8956 9.8956 10.1516 10.1516 10.4790 10.4790 10.5645 10.5645 10.9231 10.9231 11.0635 11.0635 11.3284 11.3284 11.4279 11.4279 11.6303 11.6303 11.7550 11.7550 11.7752 11.7753 k = 0.3333 0.5774-0.0000 ( 14676 PWs) bands (ev): -3.7218 -3.7218 -2.1602 -2.1602 -0.6569 -0.6569 -0.6529 -0.6529 -0.1134 -0.1134 0.5587 0.5587 0.8305 0.8305 0.8334 0.8334 4.0125 4.0125 4.8097 4.8097 4.8112 4.8112 5.4106 5.4106 5.4171 5.4171 5.6450 5.6450 5.7289 5.7289 6.1700 6.1700 6.1824 6.1824 6.2177 6.2177 6.3671 6.3671 6.7464 6.7464 6.7735 6.7735 6.8657 6.8657 7.0790 7.0790 7.2061 7.2061 7.4851 7.4851 7.6820 7.6820 7.7593 7.7593 7.7621 7.7621 8.2106 8.2106 8.2746 8.2746 8.3065 8.3065 8.9657 8.9657 9.0838 9.0838 9.1407 9.1407 9.1833 9.1833 9.6890 9.6890 9.7525 9.7525 9.8047 9.8047 9.8393 9.8393 10.1511 10.1511 10.4823 10.4823 10.5676 10.5676 10.9195 10.9195 11.0549 11.0549 11.3322 11.3322 11.4293 11.4293 11.6403 11.6403 11.7673 11.7673 11.7727 11.7727 k = 0.3333 0.5774-0.0000 ( 14676 PWs) bands (ev): -3.7218 -3.7218 -2.1602 -2.1602 -0.6569 -0.6569 -0.6529 -0.6529 -0.1134 -0.1134 0.5587 0.5587 0.8305 0.8305 0.8334 0.8334 4.0125 4.0125 4.8097 4.8097 4.8112 4.8112 5.4106 5.4106 5.4171 5.4171 5.6450 5.6450 5.7289 5.7289 6.1700 6.1700 6.1824 6.1824 6.2177 6.2177 6.3671 6.3671 6.7464 6.7464 6.7735 6.7735 6.8657 6.8657 7.0790 7.0790 7.2061 7.2061 7.4851 7.4851 7.6820 7.6820 7.7593 7.7593 7.7621 7.7621 8.2106 8.2106 8.2746 8.2746 8.3065 8.3065 8.9657 8.9657 9.0838 9.0838 9.1407 9.1407 9.1833 9.1833 9.6890 9.6890 9.7525 9.7525 9.8047 9.8047 9.8393 9.8393 10.1511 10.1511 10.4823 10.4823 10.5676 10.5676 10.9195 10.9195 11.0549 11.0549 11.3322 11.3322 11.4293 11.4293 11.6403 11.6403 11.7673 11.7673 11.7727 11.7727 k = 0.3200 0.5543-0.0000 ( 14672 PWs) bands (ev): -3.7219 -3.7219 -2.1602 -2.1602 -0.6791 -0.6791 -0.6294 -0.6294 -0.1138 -0.1138 0.5590 0.5590 0.8178 0.8178 0.8451 0.8451 4.0132 4.0132 4.7929 4.7929 4.8300 4.8300 5.3907 5.3907 5.4380 5.4380 5.6223 5.6223 5.7470 5.7470 6.1651 6.1651 6.1829 6.1829 6.2212 6.2212 6.3689 6.3689 6.7333 6.7333 6.7807 6.7807 6.8703 6.8703 7.0771 7.0771 7.2091 7.2091 7.4759 7.4759 7.6912 7.6912 7.7193 7.7193 7.8037 7.8037 8.2044 8.2044 8.2791 8.2791 8.3102 8.3102 8.9654 8.9654 9.0823 9.0823 9.1228 9.1228 9.2011 9.2011 9.6724 9.6724 9.7419 9.7419 9.7756 9.7756 9.8975 9.8975 10.1521 10.1521 10.4795 10.4795 10.5641 10.5641 10.9233 10.9233 11.0639 11.0639 11.3286 11.3286 11.4275 11.4275 11.6341 11.6341 11.7490 11.7490 11.7707 11.7708 k = 0.3067 0.5312-0.0000 ( 14656 PWs) bands (ev): -3.7223 -3.7223 -2.1602 -2.1602 -0.7018 -0.7018 -0.6026 -0.6026 -0.1148 -0.1148 0.5598 0.5598 0.8032 0.8032 0.8566 0.8566 4.0156 4.0156 4.7758 4.7758 4.8523 4.8523 5.3683 5.3683 5.4633 5.4633 5.5787 5.5787 5.7759 5.7759 6.1571 6.1571 6.1796 6.1796 6.2301 6.2301 6.3753 6.3753 6.7101 6.7101 6.7839 6.7839 6.8853 6.8853 7.0717 7.0717 7.2181 7.2181 7.4529 7.4529 7.6764 7.6764 7.7189 7.7189 7.8479 7.8479 8.1907 8.1907 8.2902 8.2902 8.3191 8.3191 8.9639 8.9639 9.0784 9.0784 9.0917 9.0917 9.2314 9.2314 9.6418 9.6418 9.6719 9.6719 9.8104 9.8104 9.9666 9.9666 10.1572 10.1572 10.4713 10.4713 10.5572 10.5572 10.9325 10.9325 11.0900 11.0900 11.3191 11.3191 11.4218 11.4218 11.6204 11.6204 11.7058 11.7058 11.7637 11.7637 k = 0.2933 0.5081-0.0000 ( 14644 PWs) bands (ev): -3.7229 -3.7229 -2.1602 -2.1602 -0.7230 -0.7230 -0.5746 -0.5746 -0.1164 -0.1164 0.5611 0.5611 0.7883 0.7883 0.8664 0.8664 4.0200 4.0200 4.7596 4.7596 4.8763 4.8763 5.3464 5.3464 5.4899 5.4899 5.5298 5.5298 5.8002 5.8002 6.1486 6.1486 6.1738 6.1738 6.2401 6.2401 6.3870 6.3870 6.6837 6.6837 6.7786 6.7786 6.9056 6.9056 7.0642 7.0642 7.2314 7.2314 7.4252 7.4252 7.6380 7.6380 7.7538 7.7538 7.8922 7.8922 8.1759 8.1759 8.3016 8.3016 8.3334 8.3334 8.9608 8.9608 9.0534 9.0534 9.0784 9.0784 9.2625 9.2625 9.5993 9.5993 9.6105 9.6105 9.8530 9.8530 10.0244 10.0244 10.1736 10.1736 10.4578 10.4578 10.5530 10.5530 10.9440 10.9440 11.1305 11.1305 11.3063 11.3063 11.4114 11.4114 11.6035 11.6035 11.6635 11.6635 11.7593 11.7593 k = 0.2800 0.4850-0.0000 ( 14644 PWs) bands (ev): -3.7237 -3.7237 -2.1601 -2.1601 -0.7428 -0.7428 -0.5456 -0.5456 -0.1181 -0.1181 0.5627 0.5627 0.7731 0.7731 0.8744 0.8744 4.0270 4.0270 4.7444 4.7444 4.9006 4.9006 5.3251 5.3251 5.4771 5.4771 5.5197 5.5197 5.8170 5.8170 6.1400 6.1400 6.1670 6.1670 6.2490 6.2490 6.4041 6.4041 6.6556 6.6556 6.7690 6.7690 6.9220 6.9220 7.0568 7.0568 7.2452 7.2452 7.4009 7.4009 7.6038 7.6038 7.7937 7.7937 7.9357 7.9357 8.1634 8.1634 8.3106 8.3106 8.3530 8.3530 8.9554 8.9554 9.0180 9.0180 9.0750 9.0750 9.2919 9.2919 9.5305 9.5305 9.5765 9.5765 9.8998 9.8998 10.0575 10.0575 10.2133 10.2133 10.4416 10.4416 10.5548 10.5548 10.9564 10.9564 11.1811 11.1811 11.2928 11.2928 11.3961 11.3961 11.5850 11.5850 11.6270 11.6270 11.7562 11.7562 k = 0.2667 0.4619-0.0000 ( 14640 PWs) bands (ev): -3.7249 -3.7249 -2.1601 -2.1601 -0.7609 -0.7609 -0.5156 -0.5156 -0.1199 -0.1199 0.5646 0.5646 0.7577 0.7577 0.8805 0.8805 4.0366 4.0366 4.7306 4.7306 4.9237 4.9237 5.3043 5.3043 5.4254 5.4254 5.5490 5.5490 5.8272 5.8272 6.1314 6.1314 6.1598 6.1598 6.2559 6.2559 6.4249 6.4249 6.6266 6.6266 6.7584 6.7584 6.9275 6.9275 7.0499 7.0499 7.2530 7.2530 7.3891 7.3891 7.5779 7.5779 7.8360 7.8360 7.9775 7.9775 8.1544 8.1544 8.3180 8.3180 8.3759 8.3759 8.9469 8.9469 8.9832 8.9832 9.0718 9.0718 9.3187 9.3187 9.4637 9.4637 9.5431 9.5431 9.9499 9.9499 10.0662 10.0662 10.2740 10.2740 10.4278 10.4278 10.5624 10.5624 10.9698 10.9698 11.2331 11.2331 11.2850 11.2850 11.3764 11.3764 11.5660 11.5660 11.5972 11.5972 11.7538 11.7538 k = 0.2533 0.4388-0.0000 ( 14642 PWs) bands (ev): -3.7264 -3.7264 -2.1601 -2.1601 -0.7774 -0.7774 -0.4849 -0.4849 -0.1216 -0.1216 0.5667 0.5667 0.7422 0.7422 0.8848 0.8848 4.0493 4.0493 4.7182 4.7182 4.9442 4.9442 5.2838 5.2838 5.3736 5.3736 5.5797 5.5797 5.8333 5.8333 6.1228 6.1228 6.1525 6.1525 6.2603 6.2603 6.4458 6.4458 6.5976 6.5976 6.7494 6.7494 6.9203 6.9203 7.0401 7.0401 7.2475 7.2475 7.3974 7.3974 7.5648 7.5648 7.8792 7.8792 8.0167 8.0167 8.1500 8.1500 8.3248 8.3248 8.4009 8.4009 8.9341 8.9341 8.9505 8.9505 9.0687 9.0687 9.3406 9.3406 9.4025 9.4025 9.5094 9.5094 10.0017 10.0017 10.0627 10.0627 10.3388 10.3388 10.4246 10.4246 10.5750 10.5750 10.9844 10.9844 11.2504 11.2504 11.3172 11.3172 11.3537 11.3537 11.5474 11.5474 11.5740 11.5740 11.7516 11.7516 k = 0.2400 0.4157-0.0000 ( 14636 PWs) bands (ev): -3.7281 -3.7281 -2.1600 -2.1600 -0.7924 -0.7924 -0.4536 -0.4536 -0.1229 -0.1229 0.5688 0.5688 0.7267 0.7267 0.8873 0.8873 4.0651 4.0651 4.7075 4.7075 4.9603 4.9603 5.2628 5.2628 5.3237 5.3237 5.6112 5.6112 5.8386 5.8386 6.1142 6.1142 6.1454 6.1454 6.2620 6.2620 6.4621 6.4621 6.5699 6.5699 6.7443 6.7443 6.9027 6.9027 7.0229 7.0229 7.2280 7.2280 7.4252 7.4252 7.5681 7.5681 7.9222 7.9222 8.0525 8.0525 8.1508 8.1508 8.3315 8.3315 8.4272 8.4272 8.9152 8.9152 8.9217 8.9217 9.0655 9.0655 9.3290 9.3290 9.3764 9.3764 9.4754 9.4754 10.0364 10.0364 10.0715 10.0715 10.3783 10.3783 10.4568 10.4568 10.5922 10.5922 11.0005 11.0005 11.2421 11.2421 11.3292 11.3292 11.3790 11.3790 11.5302 11.5302 11.5560 11.5560 11.7490 11.7490 k = 0.2267 0.3926-0.0000 ( 14650 PWs) bands (ev): -3.7301 -3.7301 -2.1600 -2.1600 -0.8058 -0.8058 -0.4219 -0.4219 -0.1237 -0.1237 0.5709 0.5709 0.7113 0.7113 0.8881 0.8881 4.0840 4.0840 4.6986 4.6986 4.9706 4.9706 5.2378 5.2378 5.2794 5.2794 5.6434 5.6434 5.8462 5.8462 6.1057 6.1057 6.1383 6.1383 6.2611 6.2611 6.4679 6.4679 6.5454 6.5454 6.7450 6.7450 6.8778 6.8778 6.9980 6.9980 7.1976 7.1976 7.4669 7.4669 7.5882 7.5882 7.9641 7.9641 8.0839 8.0839 8.1577 8.1577 8.3385 8.3385 8.4545 8.4545 8.8895 8.8895 8.8972 8.8972 9.0621 9.0621 9.2788 9.2788 9.3917 9.3917 9.4411 9.4411 10.0239 10.0239 10.1243 10.1243 10.3907 10.3907 10.5240 10.5240 10.6137 10.6137 11.0182 11.0182 11.2325 11.2325 11.3058 11.3058 11.4432 11.4432 11.5152 11.5152 11.5422 11.5422 11.7452 11.7452 k = 0.2133 0.3695-0.0000 ( 14660 PWs) bands (ev): -3.7323 -3.7323 -2.1599 -2.1599 -0.8178 -0.8178 -0.3901 -0.3901 -0.1238 -0.1238 0.5728 0.5728 0.6961 0.6961 0.8873 0.8873 4.1061 4.1061 4.6915 4.6915 4.9740 4.9740 5.2016 5.2016 5.2483 5.2483 5.6759 5.6759 5.8587 5.8587 6.0972 6.0972 6.1317 6.1317 6.2576 6.2576 6.4596 6.4596 6.5254 6.5254 6.7512 6.7512 6.8475 6.8475 6.9684 6.9684 7.1594 7.1594 7.5178 7.5178 7.6224 7.6224 8.0038 8.0038 8.1109 8.1109 8.1712 8.1712 8.3458 8.3458 8.4825 8.4825 8.8595 8.8595 8.8745 8.8745 9.0584 9.0584 9.2306 9.2306 9.4019 9.4019 9.4130 9.4130 10.0010 10.0010 10.1850 10.1850 10.4030 10.4030 10.5963 10.5963 10.6416 10.6416 11.0372 11.0372 11.2242 11.2242 11.2848 11.2848 11.4943 11.4943 11.5128 11.5128 11.5324 11.5324 11.7398 11.7398 k = 0.2000 0.3464-0.0000 ( 14662 PWs) bands (ev): -3.7348 -3.7348 -2.1598 -2.1598 -0.8284 -0.8284 -0.3584 -0.3584 -0.1231 -0.1231 0.5744 0.5744 0.6811 0.6811 0.8850 0.8850 4.1312 4.1312 4.6863 4.6863 4.9701 4.9701 5.1572 5.1572 5.2280 5.2280 5.7085 5.7085 5.8778 5.8778 6.0890 6.0890 6.1254 6.1254 6.2515 6.2515 6.4399 6.4399 6.5078 6.5078 6.7590 6.7590 6.8146 6.8146 6.9381 6.9381 7.1162 7.1162 7.5750 7.5750 7.6669 7.6669 8.0398 8.0398 8.1353 8.1353 8.1902 8.1902 8.3535 8.3535 8.5111 8.5111 8.8222 8.8222 8.8566 8.8566 9.0543 9.0543 9.1882 9.1882 9.3690 9.3690 9.4260 9.4260 9.9728 9.9728 10.2481 10.2481 10.4220 10.4220 10.6521 10.6521 10.6896 10.6896 11.0576 11.0576 11.2176 11.2176 11.2673 11.2673 11.4863 11.4863 11.5267 11.5267 11.5640 11.5640 11.7342 11.7342 k = 0.1867 0.3233-0.0000 ( 14632 PWs) bands (ev): -3.7374 -3.7374 -2.1598 -2.1598 -0.8377 -0.8377 -0.3269 -0.3269 -0.1215 -0.1215 0.5756 0.5756 0.6664 0.6664 0.8815 0.8815 4.1591 4.1591 4.6830 4.6830 4.9591 4.9591 5.1115 5.1115 5.2118 5.2118 5.7412 5.7412 5.9036 5.9036 6.0809 6.0809 6.1199 6.1199 6.2432 6.2432 6.4146 6.4146 6.4887 6.4887 6.7530 6.7530 6.7903 6.7903 6.9104 6.9104 7.0711 7.0711 7.6364 7.6364 7.7188 7.7188 8.0707 8.0707 8.1606 8.1606 8.2126 8.2126 8.3616 8.3616 8.5402 8.5402 8.7781 8.7781 8.8441 8.8441 9.0497 9.0497 9.1515 9.1515 9.3326 9.3326 9.4404 9.4404 9.9401 9.9401 10.3130 10.3130 10.4489 10.4489 10.6877 10.6877 10.7587 10.7587 11.0791 11.0791 11.2129 11.2129 11.2542 11.2542 11.4752 11.4752 11.5250 11.5250 11.6022 11.6022 11.7368 11.7368 k = 0.1733 0.3002-0.0000 ( 14628 PWs) bands (ev): -3.7402 -3.7402 -2.1597 -2.1597 -0.8458 -0.8458 -0.2959 -0.2959 -0.1189 -0.1189 0.5762 0.5762 0.6521 0.6521 0.8771 0.8771 4.1896 4.1896 4.6815 4.6815 4.9419 4.9419 5.0668 5.0668 5.1976 5.1976 5.7740 5.7740 5.9355 5.9355 6.0730 6.0730 6.1154 6.1154 6.2328 6.2328 6.3874 6.3874 6.4670 6.4670 6.7202 6.7202 6.7835 6.7835 6.8875 6.8875 7.0272 7.0272 7.7005 7.7005 7.7755 7.7755 8.0959 8.0959 8.1884 8.1884 8.2370 8.2370 8.3699 8.3699 8.5697 8.5697 8.7289 8.7289 8.8363 8.8363 9.0445 9.0445 9.1198 9.1198 9.2954 9.2954 9.4535 9.4535 9.9034 9.9034 10.3785 10.3785 10.4840 10.4840 10.7217 10.7217 10.8288 10.8288 11.1014 11.1014 11.2100 11.2100 11.2457 11.2457 11.4658 11.4658 11.5270 11.5270 11.6098 11.6098 11.7610 11.7610 k = 0.1600 0.2771-0.0000 ( 14624 PWs) bands (ev): -3.7430 -3.7430 -2.1596 -2.1596 -0.8529 -0.8529 -0.2656 -0.2656 -0.1154 -0.1154 0.5761 0.5761 0.6383 0.6383 0.8719 0.8719 4.2221 4.2221 4.6817 4.6817 4.9197 4.9197 5.0241 5.0241 5.1850 5.1850 5.8065 5.8065 5.9715 5.9715 6.0654 6.0654 6.1128 6.1128 6.2207 6.2207 6.3600 6.3600 6.4431 6.4431 6.6798 6.6798 6.7720 6.7720 6.8685 6.8685 6.9890 6.9890 7.7664 7.7664 7.8349 7.8349 8.1165 8.1165 8.2176 8.2176 8.2634 8.2634 8.3784 8.3784 8.5996 8.5996 8.6766 8.6766 8.8328 8.8328 9.0387 9.0387 9.0918 9.0918 9.2573 9.2573 9.4654 9.4654 9.8631 9.8631 10.4435 10.4435 10.5279 10.5279 10.7569 10.7569 10.8950 10.8950 11.1242 11.1242 11.2096 11.2096 11.2416 11.2416 11.4589 11.4589 11.5323 11.5323 11.5933 11.5933 11.8010 11.8011 k = 0.1467 0.2540-0.0000 ( 14616 PWs) bands (ev): -3.7459 -3.7459 -2.1595 -2.1595 -0.8590 -0.8590 -0.2364 -0.2364 -0.1109 -0.1109 0.5752 0.5752 0.6251 0.6251 0.8664 0.8664 4.2564 4.2564 4.6835 4.6835 4.8943 4.8943 4.9838 4.9838 5.1736 5.1736 5.8384 5.8384 6.0080 6.0080 6.0582 6.0582 6.1137 6.1137 6.2081 6.2081 6.3331 6.3331 6.4182 6.4182 6.6391 6.6391 6.7506 6.7506 6.8473 6.8473 6.9614 6.9614 7.8331 7.8331 7.8954 7.8954 8.1342 8.1342 8.2461 8.2461 8.2923 8.2923 8.3870 8.3870 8.6211 8.6211 8.6315 8.6315 8.8328 8.8328 9.0322 9.0322 9.0666 9.0666 9.2185 9.2185 9.4762 9.4762 9.8199 9.8199 10.5062 10.5062 10.5808 10.5808 10.7935 10.7935 10.9552 10.9552 11.1470 11.1470 11.2121 11.2121 11.2413 11.2413 11.4558 11.4558 11.5402 11.5402 11.5676 11.5676 11.8087 11.8087 k = 0.1333 0.2309-0.0000 ( 14620 PWs) bands (ev): -3.7488 -3.7488 -2.1595 -2.1595 -0.8643 -0.8643 -0.2084 -0.2084 -0.1056 -0.1056 0.5734 0.5734 0.6126 0.6126 0.8606 0.8606 4.2918 4.2918 4.6864 4.6864 4.8670 4.8670 4.9462 4.9462 5.1633 5.1633 5.8689 5.8689 6.0379 6.0379 6.0516 6.0516 6.1215 6.1215 6.1976 6.1976 6.3071 6.3071 6.3935 6.3935 6.6000 6.6000 6.7219 6.7219 6.8204 6.8204 6.9449 6.9449 7.8999 7.8999 7.9555 7.9555 8.1506 8.1506 8.2725 8.2725 8.3232 8.3232 8.3959 8.3959 8.5689 8.5689 8.6608 8.6608 8.8352 8.8352 9.0251 9.0251 9.0436 9.0436 9.1791 9.1791 9.4859 9.4859 9.7743 9.7743 10.5654 10.5654 10.6426 10.6426 10.8311 10.8311 11.0077 11.0077 11.1695 11.1695 11.2181 11.2181 11.2441 11.2441 11.4573 11.4573 11.5378 11.5378 11.5522 11.5522 11.8042 11.8043 k = 0.1200 0.2078-0.0000 ( 14598 PWs) bands (ev): -3.7516 -3.7516 -2.1594 -2.1594 -0.8688 -0.8688 -0.1818 -0.1818 -0.0995 -0.0995 0.5706 0.5706 0.6009 0.6009 0.8549 0.8549 4.3277 4.3277 4.6902 4.6902 4.8394 4.8394 4.9116 4.9116 5.1542 5.1542 5.8970 5.8970 6.0449 6.0449 6.0544 6.0544 6.1331 6.1331 6.1993 6.1993 6.2820 6.2820 6.3706 6.3706 6.5634 6.5634 6.6881 6.6881 6.7913 6.7913 6.9335 6.9335 7.9654 7.9654 8.0139 8.0139 8.1669 8.1669 8.2963 8.2963 8.3545 8.3545 8.4051 8.4051 8.5181 8.5181 8.6916 8.6916 8.8389 8.8389 9.0173 9.0173 9.0223 9.0223 9.1394 9.1394 9.4947 9.4947 9.7271 9.7271 10.6210 10.6210 10.7113 10.7113 10.8691 10.8691 11.0510 11.0510 11.1915 11.1915 11.2272 11.2272 11.2497 11.2497 11.4635 11.4635 11.5126 11.5126 11.5635 11.5635 11.8010 11.8010 k = 0.1067 0.1848-0.0000 ( 14592 PWs) bands (ev): -3.7543 -3.7543 -2.1593 -2.1593 -0.8726 -0.8726 -0.1571 -0.1571 -0.0928 -0.0928 0.5670 0.5670 0.5901 0.5901 0.8496 0.8496 4.3633 4.3633 4.6943 4.6943 4.8128 4.8128 4.8806 4.8806 5.1461 5.1461 5.9214 5.9214 6.0399 6.0399 6.0584 6.0584 6.1325 6.1325 6.2252 6.2252 6.2587 6.2587 6.3515 6.3515 6.5293 6.5293 6.6518 6.6518 6.7642 6.7642 6.9217 6.9217 8.0280 8.0280 8.0694 8.0694 8.1848 8.1848 8.3175 8.3175 8.3822 8.3822 8.4144 8.4144 8.4744 8.4744 8.7226 8.7226 8.8425 8.8425 9.0024 9.0024 9.0092 9.0092 9.1001 9.1001 9.5024 9.5024 9.6789 9.6789 10.6730 10.6730 10.7845 10.7845 10.9070 10.9070 11.0850 11.0850 11.2134 11.2134 11.2377 11.2377 11.2580 11.2580 11.4668 11.4668 11.4986 11.4986 11.5766 11.5766 11.7988 11.7989 k = 0.0933 0.1617-0.0000 ( 14594 PWs) bands (ev): -3.7568 -3.7568 -2.1592 -2.1592 -0.8759 -0.8759 -0.1344 -0.1344 -0.0859 -0.0859 0.5625 0.5625 0.5805 0.5805 0.8447 0.8447 4.3978 4.3978 4.6978 4.6978 4.7883 4.7883 4.8535 4.8535 5.1391 5.1391 5.9405 5.9405 6.0362 6.0362 6.0563 6.0563 6.1242 6.1242 6.2307 6.2307 6.2694 6.2694 6.3401 6.3401 6.4976 6.4976 6.6157 6.6157 6.7407 6.7407 6.9066 6.9066 8.0844 8.0844 8.1211 8.1211 8.2069 8.2069 8.3352 8.3352 8.3876 8.3876 8.4258 8.4258 8.4554 8.4554 8.7535 8.7535 8.8443 8.8443 8.9841 8.9841 9.0007 9.0007 9.0622 9.0622 9.5093 9.5093 9.6307 9.6307 10.7209 10.7209 10.8603 10.8603 10.9442 10.9442 11.1108 11.1108 11.2347 11.2347 11.2483 11.2483 11.2692 11.2692 11.4524 11.4524 11.5115 11.5115 11.5901 11.5901 11.7966 11.7991 k = 0.0800 0.1386-0.0000 ( 14586 PWs) bands (ev): -3.7591 -3.7591 -2.1592 -2.1592 -0.8786 -0.8786 -0.1140 -0.1140 -0.0789 -0.0789 0.5573 0.5573 0.5721 0.5721 0.8404 0.8404 4.4303 4.4303 4.6996 4.6996 4.7673 4.7673 4.8309 4.8309 5.1330 5.1330 5.9528 5.9528 6.0342 6.0342 6.0505 6.0505 6.1171 6.1171 6.2093 6.2093 6.2947 6.2947 6.3522 6.3522 6.4682 6.4682 6.5827 6.5827 6.7207 6.7207 6.8868 6.8868 8.1295 8.1295 8.1677 8.1677 8.2378 8.2378 8.3420 8.3420 8.3678 8.3678 8.4392 8.4392 8.4713 8.4713 8.7830 8.7830 8.8427 8.8427 8.9675 8.9675 8.9921 8.9921 9.0275 9.0275 9.5151 9.5151 9.5833 9.5833 10.7631 10.7631 10.9366 10.9366 10.9801 10.9801 11.1309 11.1309 11.2483 11.2483 11.2654 11.2654 11.2829 11.2829 11.4342 11.4342 11.5356 11.5356 11.6035 11.6035 11.7895 11.7900 k = 0.0667 0.1155-0.0000 ( 14588 PWs) bands (ev): -3.7611 -3.7611 -2.1591 -2.1591 -0.8809 -0.8809 -0.0962 -0.0962 -0.0722 -0.0722 0.5517 0.5517 0.5651 0.5651 0.8367 0.8367 4.4598 4.4598 4.6987 4.6987 4.7507 4.7507 4.8133 4.8133 5.1279 5.1279 5.9577 5.9577 6.0331 6.0331 6.0433 6.0433 6.1142 6.1142 6.1891 6.1891 6.2958 6.2958 6.3929 6.3929 6.4429 6.4429 6.5551 6.5551 6.7041 6.7041 6.8619 6.8619 8.1603 8.1603 8.2080 8.2080 8.2796 8.2796 8.3171 8.3171 8.3715 8.3715 8.4514 8.4514 8.4978 8.4978 8.8055 8.8055 8.8400 8.8400 8.9528 8.9528 8.9835 8.9835 8.9990 8.9990 9.5200 9.5200 9.5381 9.5381 10.7987 10.7987 11.0047 11.0047 11.0197 11.0197 11.1492 11.1492 11.2539 11.2539 11.2887 11.2887 11.2981 11.2981 11.4183 11.4183 11.5622 11.5622 11.6163 11.6163 11.7805 11.7806 k = 0.0533 0.0924-0.0000 ( 14586 PWs) bands (ev): -3.7628 -3.7628 -2.1591 -2.1591 -0.8826 -0.8826 -0.0812 -0.0812 -0.0660 -0.0660 0.5464 0.5464 0.5593 0.5593 0.8338 0.8338 4.4852 4.4852 4.6945 4.6945 4.7388 4.7388 4.8012 4.8012 5.1237 5.1237 5.9562 5.9562 6.0298 6.0298 6.0394 6.0394 6.1150 6.1150 6.1715 6.1715 6.2921 6.2921 6.4073 6.4073 6.4536 6.4536 6.5347 6.5347 6.6907 6.6907 6.8320 6.8320 8.1799 8.1799 8.2417 8.2417 8.2869 8.2869 8.3277 8.3277 8.3809 8.3809 8.4626 8.4626 8.5254 8.5254 8.7997 8.7997 8.8540 8.8540 8.9403 8.9403 8.9731 8.9731 8.9812 8.9812 9.4960 9.4960 9.5243 9.5243 10.8269 10.8269 11.0383 11.0383 11.0799 11.0799 11.1739 11.1739 11.2570 11.2570 11.3108 11.3108 11.3156 11.3156 11.4056 11.4056 11.5876 11.5876 11.6282 11.6282 11.7707 11.7707 k = 0.0400 0.0693-0.0000 ( 14580 PWs) bands (ev): -3.7642 -3.7642 -2.1590 -2.1590 -0.8840 -0.8840 -0.0693 -0.0693 -0.0609 -0.0609 0.5417 0.5417 0.5547 0.5547 0.8315 0.8315 4.5056 4.5056 4.6887 4.6887 4.7306 4.7306 4.7940 4.7940 5.1204 5.1204 5.9511 5.9511 6.0244 6.0244 6.0393 6.0393 6.1176 6.1176 6.1574 6.1574 6.2892 6.2892 6.3884 6.3884 6.4914 6.4914 6.5312 6.5312 6.6803 6.6803 6.7973 6.7973 8.1927 8.1927 8.2590 8.2590 8.2716 8.2716 8.3727 8.3727 8.3899 8.3899 8.4724 8.4724 8.5530 8.5530 8.7721 8.7721 8.8771 8.8771 8.9303 8.9303 8.9614 8.9614 8.9737 8.9737 9.4596 9.4596 9.5274 9.5274 10.8480 10.8480 11.0618 11.0618 11.1188 11.1188 11.2201 11.2201 11.2589 11.2589 11.3266 11.3266 11.3371 11.3371 11.3965 11.3965 11.6088 11.6088 11.6389 11.6389 11.7557 11.7557 k = 0.0267 0.0462-0.0000 ( 14559 PWs) bands (ev): -3.7652 -3.7652 -2.1590 -2.1590 -0.8850 -0.8850 -0.0607 -0.0607 -0.0569 -0.0569 0.5381 0.5381 0.5513 0.5513 0.8299 0.8299 4.5203 4.5203 4.6833 4.6833 4.7249 4.7249 4.7906 4.7906 5.1180 5.1180 5.9452 5.9452 6.0201 6.0201 6.0397 6.0397 6.1204 6.1204 6.1470 6.1470 6.2876 6.2876 6.3722 6.3722 6.4951 6.4951 6.5690 6.5690 6.6730 6.6730 6.7581 6.7581 8.2011 8.2011 8.2420 8.2420 8.2897 8.2897 8.3921 8.3921 8.4150 8.4150 8.4799 8.4799 8.5819 8.5819 8.7358 8.7358 8.8970 8.8970 8.9232 8.9232 8.9539 8.9539 8.9697 8.9697 9.4306 9.4306 9.5296 9.5296 10.8623 10.8623 11.0785 11.0785 11.1344 11.1344 11.2599 11.2599 11.2811 11.2811 11.3385 11.3385 11.3565 11.3565 11.3918 11.3918 11.6240 11.6240 11.6482 11.6482 11.7265 11.7265 k = 0.0133 0.0231-0.0000 ( 14539 PWs) bands (ev): -3.7658 -3.7658 -2.1590 -2.1590 -0.8855 -0.8855 -0.0555 -0.0555 -0.0543 -0.0543 0.5358 0.5358 0.5492 0.5492 0.8290 0.8290 4.5292 4.5292 4.6798 4.6798 4.7214 4.7214 4.7892 4.7892 5.1166 5.1166 5.9407 5.9407 6.0176 6.0176 6.0401 6.0401 6.1223 6.1223 6.1407 6.1407 6.2869 6.2869 6.3617 6.3617 6.4907 6.4907 6.6181 6.6181 6.6686 6.6686 6.7153 6.7153 8.2059 8.2059 8.2307 8.2307 8.3016 8.3016 8.3961 8.3961 8.4405 8.4405 8.4847 8.4847 8.6136 8.6136 8.6965 8.6965 8.9092 8.9092 8.9202 8.9202 8.9498 8.9498 8.9676 8.9676 9.4118 9.4118 9.5309 9.5309 10.8706 10.8706 11.0885 11.0885 11.1407 11.1407 11.2605 11.2605 11.3301 11.3301 11.3463 11.3463 11.3693 11.3693 11.3960 11.3960 11.6329 11.6329 11.6551 11.6551 11.6848 11.6848 k = 0.0000 0.0000 0.0000 ( 14515 PWs) bands (ev): -3.7660 -3.7660 -2.1590 -2.1590 -0.8857 -0.8857 -0.0540 -0.0540 -0.0532 -0.0532 0.5351 0.5351 0.5485 0.5485 0.8287 0.8287 4.5321 4.5321 4.6786 4.6786 4.7203 4.7203 4.7889 4.7889 5.1161 5.1161 5.9391 5.9391 6.0168 6.0168 6.0402 6.0402 6.1230 6.1230 6.1385 6.1385 6.2867 6.2867 6.3582 6.3582 6.4890 6.4890 6.6578 6.6578 6.6696 6.6696 6.6755 6.6755 8.2075 8.2075 8.2268 8.2268 8.3056 8.3056 8.3973 8.3973 8.4496 8.4496 8.4863 8.4863 8.6396 8.6396 8.6674 8.6674 8.9119 8.9119 8.9208 8.9208 8.9485 8.9485 8.9670 8.9670 9.4052 9.4052 9.5313 9.5313 10.8733 10.8733 11.0919 11.0919 11.1424 11.1424 11.2607 11.2607 11.3467 11.3467 11.3490 11.3490 11.3723 11.3723 11.4046 11.4046 11.6368 11.6368 11.6577 11.6577 11.6620 11.6620 k = 0.0000 0.0000 0.0000 ( 14515 PWs) bands (ev): -3.7660 -3.7660 -2.1590 -2.1590 -0.8857 -0.8857 -0.0540 -0.0540 -0.0532 -0.0532 0.5351 0.5351 0.5485 0.5485 0.8287 0.8287 4.5321 4.5321 4.6786 4.6786 4.7203 4.7203 4.7889 4.7889 5.1161 5.1161 5.9391 5.9391 6.0168 6.0168 6.0402 6.0402 6.1230 6.1230 6.1385 6.1385 6.2867 6.2867 6.3582 6.3582 6.4890 6.4890 6.6578 6.6578 6.6696 6.6696 6.6755 6.6755 8.2075 8.2075 8.2268 8.2268 8.3056 8.3056 8.3973 8.3973 8.4496 8.4496 8.4863 8.4863 8.6396 8.6396 8.6674 8.6674 8.9119 8.9119 8.9208 8.9208 8.9485 8.9485 8.9670 8.9670 9.4052 9.4052 9.5313 9.5313 10.8733 10.8733 11.0919 11.0919 11.1424 11.1424 11.2607 11.2607 11.3467 11.3467 11.3490 11.3490 11.3723 11.3723 11.4046 11.4046 11.6368 11.6368 11.6577 11.6577 11.6620 11.6620 k = 0.0000 0.0000 0.0264 ( 14539 PWs) bands (ev): -3.7649 -3.7649 -2.1610 -2.1610 -0.8845 -0.8845 -0.0531 -0.0531 -0.0523 -0.0523 0.5353 0.5353 0.5487 0.5487 0.8272 0.8272 4.5346 4.5346 4.6753 4.6753 4.7167 4.7167 4.7906 4.7906 5.1188 5.1188 5.9257 5.9257 6.0041 6.0041 6.0483 6.0483 6.1274 6.1274 6.1390 6.1390 6.2900 6.2900 6.3701 6.3701 6.4948 6.4948 6.6575 6.6575 6.6693 6.6693 6.6770 6.6770 8.1641 8.1641 8.2070 8.2070 8.3680 8.3680 8.3946 8.3946 8.4476 8.4476 8.4850 8.4850 8.6370 8.6370 8.6688 8.6688 8.9144 8.9144 8.9239 8.9239 8.9492 8.9492 8.9677 8.9677 9.3954 9.3954 9.5331 9.5331 10.8674 10.8674 11.0901 11.0901 11.1224 11.1224 11.2536 11.2536 11.3473 11.3473 11.3488 11.3488 11.3770 11.3770 11.4235 11.4235 11.6362 11.6362 11.6573 11.6573 11.6616 11.6616 k = 0.0000 0.0000 0.0529 ( 14539 PWs) bands (ev): -3.7619 -3.7619 -2.1669 -2.1669 -0.8807 -0.8807 -0.0505 -0.0505 -0.0496 -0.0496 0.5359 0.5359 0.5493 0.5493 0.8228 0.8228 4.5422 4.5422 4.6655 4.6655 4.7062 4.7062 4.7957 4.7957 5.1269 5.1269 5.8926 5.8926 5.9701 5.9701 6.0663 6.0663 6.1401 6.1401 6.1402 6.1402 6.2993 6.2993 6.4017 6.4017 6.5119 6.5119 6.6565 6.6565 6.6680 6.6680 6.6815 6.6815 8.0736 8.0736 8.2055 8.2055 8.3868 8.3868 8.4406 8.4406 8.4583 8.4583 8.4811 8.4811 8.6295 8.6295 8.6729 8.6729 8.9216 8.9216 8.9328 8.9328 8.9515 8.9515 8.9699 8.9699 9.3666 9.3666 9.5384 9.5384 10.8483 10.8483 11.0786 11.0786 11.0851 11.0851 11.2330 11.2330 11.3480 11.3480 11.3489 11.3489 11.3820 11.3820 11.4742 11.4742 11.6345 11.6345 11.6560 11.6560 11.6605 11.6605 k = 0.0000 0.0000 0.0793 ( 14569 PWs) bands (ev): -3.7568 -3.7568 -2.1766 -2.1766 -0.8744 -0.8744 -0.0461 -0.0461 -0.0452 -0.0452 0.5369 0.5369 0.5503 0.5503 0.8154 0.8154 4.5548 4.5548 4.6496 4.6496 4.6894 4.6894 4.8043 4.8043 5.1404 5.1404 5.8486 5.8486 5.9226 5.9226 6.0879 6.0879 6.1421 6.1421 6.1606 6.1606 6.3132 6.3132 6.4457 6.4457 6.5387 6.5387 6.6551 6.6551 6.6657 6.6657 6.6893 6.6893 7.9807 7.9807 8.2025 8.2025 8.3740 8.3740 8.4315 8.4315 8.4751 8.4751 8.5482 8.5482 8.6179 8.6179 8.6796 8.6796 8.9330 8.9330 8.9465 8.9465 8.9552 8.9552 8.9736 8.9736 9.3206 9.3206 9.5473 9.5473 10.8126 10.8126 11.0322 11.0322 11.0767 11.0767 11.2013 11.2013 11.3466 11.3466 11.3517 11.3517 11.3868 11.3868 11.5379 11.5379 11.6316 11.6316 11.6538 11.6538 11.6587 11.6587 k = 0.0000 0.0000 0.1058 ( 14569 PWs) bands (ev): -3.7496 -3.7496 -2.1901 -2.1901 -0.8657 -0.8657 -0.0400 -0.0400 -0.0390 -0.0390 0.5383 0.5383 0.5516 0.5516 0.8051 0.8051 4.5724 4.5724 4.6286 4.6286 4.6670 4.6670 4.8162 4.8162 5.1593 5.1593 5.7974 5.7974 5.8670 5.8670 6.1107 6.1107 6.1446 6.1446 6.1880 6.1880 6.3309 6.3309 6.4963 6.4963 6.5731 6.5731 6.6540 6.6540 6.6625 6.6625 6.7003 6.7003 7.8875 7.8875 8.1976 8.1976 8.3566 8.3566 8.4188 8.4188 8.4675 8.4675 8.6033 8.6033 8.6340 8.6340 8.6912 8.6912 8.9481 8.9481 8.9604 8.9604 8.9638 8.9638 8.9788 8.9788 9.2604 9.2604 9.5595 9.5595 10.7582 10.7582 10.9934 10.9934 11.0653 11.0653 11.1610 11.1610 11.3448 11.3448 11.3557 11.3557 11.3926 11.3926 11.6025 11.6025 11.6275 11.6275 11.6508 11.6508 11.6564 11.6564 k = 0.0000 0.0000 0.1322 ( 14569 PWs) bands (ev): -3.7404 -3.7404 -2.2073 -2.2073 -0.8545 -0.8545 -0.0321 -0.0321 -0.0311 -0.0311 0.5399 0.5399 0.5531 0.5531 0.7919 0.7919 4.5949 4.5949 4.6032 4.6032 4.6402 4.6402 4.8315 4.8315 5.1837 5.1837 5.7413 5.7413 5.8065 5.8065 6.1336 6.1336 6.1478 6.1478 6.2211 6.2211 6.3526 6.3526 6.5507 6.5507 6.6099 6.6099 6.6562 6.6562 6.6586 6.6586 6.7144 6.7144 7.7943 7.7943 8.1899 8.1899 8.3348 8.3348 8.4035 8.4035 8.4590 8.4590 8.5866 8.5866 8.6767 8.6767 8.7431 8.7431 8.9660 8.9660 8.9670 8.9670 8.9825 8.9825 8.9865 8.9865 9.1903 9.1903 9.5750 9.5750 10.6875 10.6875 10.9633 10.9633 11.0511 11.0511 11.1151 11.1151 11.3427 11.3427 11.3608 11.3608 11.3998 11.3998 11.6220 11.6220 11.6470 11.6470 11.6492 11.6492 11.6588 11.6588 k = 0.0000 0.0000 0.1587 ( 14581 PWs) bands (ev): -3.7292 -3.7292 -2.2280 -2.2280 -0.8408 -0.8408 -0.0226 -0.0226 -0.0216 -0.0216 0.5418 0.5418 0.5549 0.5549 0.7756 0.7756 4.5745 4.5745 4.6099 4.6099 4.6224 4.6224 4.8501 4.8501 5.2135 5.2135 5.6816 5.6816 5.7429 5.7429 6.1517 6.1517 6.1555 6.1555 6.2586 6.2586 6.3788 6.3788 6.6071 6.6071 6.6316 6.6316 6.6544 6.6544 6.6779 6.6779 6.7316 6.7316 7.7016 7.7016 8.1788 8.1788 8.3094 8.3094 8.3859 8.3859 8.4503 8.4503 8.5686 8.5686 8.6785 8.6785 8.8286 8.8286 8.9750 8.9750 8.9857 8.9857 8.9925 8.9925 9.0059 9.0059 9.1169 9.1169 9.5936 9.5936 10.6056 10.6056 10.9389 10.9389 11.0346 11.0346 11.0661 11.0661 11.3405 11.3405 11.3670 11.3670 11.4082 11.4082 11.6150 11.6150 11.6423 11.6423 11.6474 11.6474 11.6724 11.6724 k = 0.0000 0.0000 0.1851 ( 14569 PWs) bands (ev): -3.7161 -3.7161 -2.2519 -2.2519 -0.8247 -0.8247 -0.0115 -0.0115 -0.0103 -0.0103 0.5437 0.5437 0.5567 0.5567 0.7564 0.7564 4.5434 4.5434 4.5772 4.5772 4.6548 4.6548 4.8720 4.8720 5.2488 5.2488 5.6192 5.6192 5.6771 5.6771 6.1562 6.1562 6.1754 6.1754 6.2989 6.2989 6.4095 6.4095 6.6340 6.6340 6.6501 6.6501 6.6647 6.6647 6.7222 6.7222 6.7518 6.7518 7.6096 7.6096 8.1637 8.1637 8.2807 8.2807 8.3662 8.3662 8.4418 8.4418 8.5495 8.5495 8.6631 8.6631 8.9162 8.9162 8.9843 8.9843 9.0017 9.0017 9.0042 9.0042 9.0283 9.0283 9.0513 9.0513 9.6151 9.6151 10.5170 10.5170 10.9176 10.9176 11.0161 11.0161 11.0163 11.0163 11.3387 11.3387 11.3742 11.3742 11.4177 11.4177 11.6060 11.6060 11.6367 11.6367 11.6386 11.6386 11.6619 11.6620 k = 0.0000 0.0000 0.2116 ( 14575 PWs) bands (ev): -3.7009 -3.7009 -2.2790 -2.2790 -0.8062 -0.8062 0.0012 0.0012 0.0025 0.0025 0.5456 0.5456 0.5584 0.5584 0.7343 0.7343 4.5110 4.5110 4.5432 4.5432 4.6919 4.6919 4.8971 4.8971 5.2895 5.2895 5.5546 5.5546 5.6097 5.6097 6.1614 6.1614 6.1930 6.1930 6.3404 6.3404 6.4440 6.4440 6.6331 6.6331 6.6465 6.6465 6.7230 6.7230 6.7730 6.7730 6.7749 6.7749 7.5185 7.5185 8.1445 8.1445 8.2493 8.2493 8.3439 8.3439 8.4337 8.4337 8.5299 8.5299 8.6247 8.6247 8.9873 8.9873 8.9947 8.9947 9.0033 9.0033 9.0120 9.0120 9.0371 9.0371 9.0512 9.0512 9.6393 9.6393 10.4253 10.4253 10.8978 10.8978 10.9675 10.9675 10.9962 10.9962 11.3374 11.3374 11.3820 11.3820 11.4277 11.4277 11.5944 11.5944 11.6199 11.6199 11.6301 11.6301 11.6527 11.6528 k = 0.0000 0.0000 0.2380 ( 14569 PWs) bands (ev): -3.6838 -3.6838 -2.3090 -2.3090 -0.7853 -0.7853 0.0155 0.0155 0.0168 0.0168 0.5473 0.5473 0.5600 0.5600 0.7092 0.7092 4.4781 4.4781 4.5088 4.5088 4.7338 4.7338 4.9254 4.9254 5.3354 5.3354 5.4884 5.4884 5.5414 5.5414 6.1674 6.1674 6.2083 6.2083 6.3809 6.3809 6.4799 6.4799 6.6338 6.6338 6.6447 6.6447 6.7816 6.7816 6.8008 6.8008 6.8262 6.8262 7.4286 7.4286 8.1213 8.1213 8.2158 8.2158 8.3174 8.3174 8.4256 8.4256 8.5097 8.5097 8.5604 8.5604 8.9569 8.9569 9.0063 9.0063 9.0235 9.0235 9.0575 9.0575 9.0739 9.0739 9.0883 9.0883 9.6658 9.6658 10.3340 10.3340 10.8790 10.8790 10.9212 10.9212 10.9753 10.9753 11.3370 11.3370 11.3899 11.3899 11.4373 11.4373 11.5798 11.5798 11.5967 11.5967 11.6223 11.6223 11.6375 11.6383 k = 0.0000 0.0000 0.2645 ( 14605 PWs) bands (ev): -3.6647 -3.6647 -2.3417 -2.3417 -0.7621 -0.7621 0.0311 0.0311 0.0325 0.0325 0.5488 0.5488 0.5613 0.5613 0.6813 0.6813 4.4455 4.4455 4.4749 4.4749 4.7804 4.7804 4.9568 4.9568 5.3854 5.3854 5.4210 5.4210 5.4740 5.4740 6.1741 6.1741 6.2218 6.2218 6.4178 6.4178 6.5127 6.5127 6.6406 6.6406 6.6461 6.6461 6.8294 6.8294 6.8404 6.8404 6.8808 6.8808 7.3404 7.3404 8.0945 8.0945 8.1808 8.1808 8.2825 8.2825 8.4168 8.4168 8.4792 8.4792 8.4890 8.4890 8.9392 8.9392 9.0189 9.0189 9.0359 9.0359 9.0802 9.0802 9.0960 9.0960 9.1713 9.1713 9.6943 9.6943 10.2466 10.2466 10.8609 10.8609 10.8788 10.8788 10.9540 10.9540 11.3378 11.3378 11.3971 11.3971 11.4445 11.4445 11.5633 11.5633 11.5765 11.5765 11.6126 11.6126 11.6224 11.6224 k = 0.0000 0.0000 0.2909 ( 14587 PWs) bands (ev): -3.6438 -3.6438 -2.3768 -2.3768 -0.7367 -0.7367 0.0481 0.0481 0.0497 0.0497 0.5498 0.5498 0.5621 0.5621 0.6506 0.6506 4.4140 4.4140 4.4421 4.4421 4.8314 4.8314 4.9911 4.9911 5.3528 5.3528 5.3944 5.3944 5.4524 5.4524 6.1816 6.1816 6.2338 6.2338 6.4479 6.4479 6.5354 6.5354 6.6530 6.6530 6.6598 6.6598 6.8604 6.8604 6.8993 6.8993 6.9361 6.9361 7.2546 7.2546 8.0648 8.0648 8.1448 8.1448 8.2288 8.2288 8.4000 8.4000 8.4067 8.4067 8.4678 8.4678 8.9258 8.9258 9.0325 9.0325 9.0493 9.0493 9.1026 9.1026 9.1173 9.1173 9.2519 9.2519 9.7244 9.7244 10.1672 10.1672 10.8412 10.8412 10.8436 10.8436 10.9327 10.9327 11.3403 11.3403 11.4023 11.4023 11.4463 11.4463 11.5463 11.5463 11.5643 11.5643 11.5999 11.5999 11.6106 11.6106 k = 0.0000 0.0000 0.3174 ( 14611 PWs) bands (ev): -3.6210 -3.6210 -2.4142 -2.4142 -0.7090 -0.7090 0.0664 0.0664 0.0681 0.0681 0.5502 0.5502 0.5622 0.5622 0.6173 0.6173 4.3843 4.3843 4.4113 4.4113 4.8868 4.8868 5.0281 5.0281 5.2840 5.2840 5.3285 5.3285 5.5110 5.5110 6.1899 6.1899 6.2447 6.2447 6.4681 6.4681 6.5447 6.5447 6.6666 6.6666 6.6937 6.6937 6.8934 6.8934 6.9581 6.9581 6.9916 6.9916 7.1723 7.1723 8.0328 8.0328 8.1082 8.1082 8.1447 8.1447 8.3409 8.3409 8.3944 8.3944 8.4460 8.4460 8.9082 8.9082 9.0467 9.0467 9.0634 9.0634 9.1241 9.1241 9.1375 9.1375 9.3297 9.3297 9.7555 9.7555 10.1004 10.1004 10.8092 10.8092 10.8272 10.8272 10.9118 10.9118 11.3447 11.3447 11.4045 11.4045 11.4406 11.4406 11.5294 11.5294 11.5636 11.5636 11.5824 11.5824 11.6023 11.6023 k = 0.0000 0.0000 0.3438 ( 14587 PWs) bands (ev): -3.5963 -3.5963 -2.4534 -2.4534 -0.6791 -0.6791 0.0859 0.0859 0.0877 0.0877 0.5499 0.5499 0.5616 0.5616 0.5814 0.5814 4.3569 4.3569 4.3829 4.3829 4.9465 4.9465 5.0674 5.0674 5.2151 5.2151 5.2598 5.2598 5.5784 5.5784 6.1991 6.1991 6.2550 6.2550 6.4778 6.4778 6.5446 6.5446 6.6850 6.6850 6.7379 6.7379 6.9275 6.9275 7.0167 7.0167 7.0470 7.0470 7.0965 7.0965 7.9991 7.9991 8.0356 8.0356 8.0715 8.0715 8.3004 8.3004 8.3793 8.3793 8.4234 8.4234 8.8796 8.8796 9.0616 9.0616 9.0783 9.0783 9.1443 9.1443 9.1564 9.1564 9.4045 9.4045 9.7873 9.7873 10.0507 10.0507 10.7833 10.7833 10.8121 10.8121 10.8920 10.8920 11.3515 11.3515 11.4031 11.4031 11.4289 11.4289 11.5103 11.5103 11.5567 11.5567 11.5731 11.5731 11.5993 11.5993 k = 0.0000 0.0000 0.3703 ( 14593 PWs) bands (ev): -3.5699 -3.5699 -2.4944 -2.4944 -0.6472 -0.6472 0.1064 0.1064 0.1084 0.1084 0.5431 0.5431 0.5487 0.5487 0.5601 0.5601 4.3323 4.3323 4.3575 4.3575 5.0103 5.0103 5.1059 5.1059 5.1462 5.1462 5.1947 5.1947 5.6512 5.6512 6.2094 6.2094 6.2649 6.2649 6.4787 6.4787 6.5395 6.5395 6.7014 6.7014 6.7872 6.7872 6.9586 6.9586 7.0355 7.0355 7.0750 7.0750 7.1020 7.1020 7.9140 7.9140 7.9642 7.9642 8.0353 8.0353 8.2683 8.2683 8.3607 8.3607 8.3999 8.3999 8.8359 8.8359 9.0770 9.0770 9.0936 9.0936 9.1628 9.1628 9.1738 9.1738 9.4759 9.4759 9.8192 9.8192 10.0216 10.0216 10.7638 10.7638 10.7984 10.7984 10.8734 10.8734 11.3609 11.3609 11.3983 11.3983 11.4150 11.4150 11.4853 11.4853 11.5197 11.5197 11.5893 11.5893 11.6035 11.6035 k = 0.0000 0.0000 0.3967 ( 14605 PWs) bands (ev): -3.5417 -3.5417 -2.5369 -2.5369 -0.6132 -0.6132 0.1279 0.1279 0.1301 0.1301 0.5026 0.5026 0.5464 0.5464 0.5575 0.5575 4.3111 4.3111 4.3356 4.3356 5.0775 5.0775 5.0778 5.0778 5.1040 5.1040 5.1736 5.1736 5.7288 5.7288 6.2209 6.2209 6.2745 6.2745 6.4736 6.4736 6.5317 6.5317 6.7035 6.7035 6.8389 6.8389 6.9620 6.9620 7.0227 7.0227 7.1328 7.1328 7.1562 7.1562 7.7874 7.7874 7.9287 7.9287 7.9999 7.9999 8.2390 8.2390 8.3384 8.3384 8.3753 8.3753 8.7755 8.7755 9.0927 9.0927 9.1093 9.1093 9.1795 9.1795 9.1897 9.1897 9.5437 9.5437 9.8505 9.8505 10.0144 10.0144 10.7505 10.7505 10.7865 10.7865 10.8566 10.8566 11.3728 11.3728 11.3913 11.3913 11.4016 11.4016 11.4523 11.4523 11.4723 11.4723 11.6089 11.6090 11.6148 11.6149 k = 0.0000 0.0000 0.4232 ( 14605 PWs) bands (ev): -3.5118 -3.5118 -2.5807 -2.5807 -0.5772 -0.5772 0.1501 0.1501 0.1526 0.1526 0.4601 0.4601 0.5429 0.5429 0.5537 0.5537 4.2936 4.2936 4.3175 4.3175 5.0101 5.0101 5.0425 5.0425 5.1491 5.1491 5.2152 5.2152 5.8107 5.8107 6.2339 6.2339 6.2840 6.2840 6.4642 6.4642 6.5225 6.5225 6.6787 6.6787 6.8915 6.8915 6.9519 6.9519 7.0531 7.0531 7.1901 7.1901 7.2090 7.2090 7.6596 7.6596 7.8929 7.8929 7.9658 7.9658 8.2099 8.2099 8.3123 8.3123 8.3494 8.3494 8.6993 8.6993 9.1085 9.1085 9.1251 9.1251 9.1942 9.1942 9.2040 9.2040 9.6075 9.6075 9.8807 9.8807 10.0283 10.0283 10.7433 10.7433 10.7765 10.7765 10.8419 10.8419 11.3810 11.3810 11.3855 11.3855 11.3904 11.3904 11.4146 11.4146 11.4207 11.4207 11.6222 11.6222 11.6280 11.6281 k = 0.0000 0.0000 0.4496 ( 14611 PWs) bands (ev): -3.4803 -3.4803 -2.6254 -2.6254 -0.5394 -0.5394 0.1731 0.1731 0.1758 0.1758 0.4157 0.4157 0.5381 0.5381 0.5485 0.5485 4.2802 4.2802 4.3036 4.3036 4.9434 4.9434 4.9763 4.9763 5.2222 5.2222 5.2673 5.2673 5.8957 5.8957 6.2493 6.2493 6.2935 6.2935 6.4518 6.4518 6.5123 6.5123 6.6283 6.6283 6.9440 6.9440 6.9617 6.9617 7.0886 7.0886 7.2465 7.2465 7.2599 7.2599 7.5342 7.5342 7.8573 7.8573 7.9337 7.9337 8.1798 8.1798 8.2823 8.2823 8.3220 8.3220 8.6107 8.6107 9.1243 9.1243 9.1410 9.1410 9.2070 9.2070 9.2168 9.2168 9.6672 9.6672 9.9092 9.9092 10.0606 10.0606 10.7416 10.7416 10.7689 10.7689 10.8297 10.8297 11.3519 11.3519 11.3565 11.3565 11.3820 11.3820 11.3907 11.3907 11.4110 11.4110 11.6054 11.6054 11.6206 11.6206 k = 0.0000 0.0000 0.4761 ( 14605 PWs) bands (ev): -3.4472 -3.4472 -2.6710 -2.6710 -0.4998 -0.4998 0.1966 0.1966 0.1996 0.1996 0.3698 0.3698 0.5318 0.5318 0.5419 0.5419 4.2711 4.2711 4.2943 4.2943 4.8781 4.8781 4.9105 4.9105 5.2941 5.2941 5.3280 5.3280 5.9823 5.9823 6.2683 6.2683 6.3031 6.3031 6.4367 6.4367 6.5014 6.5014 6.5638 6.5638 6.9824 6.9824 6.9958 6.9958 7.1212 7.1212 7.3016 7.3016 7.3081 7.3081 7.4163 7.4163 7.8222 7.8222 7.9043 7.9043 8.1476 8.1476 8.2489 8.2489 8.2930 8.2930 8.5138 8.5138 9.1399 9.1399 9.1566 9.1566 9.2179 9.2179 9.2279 9.2279 9.7224 9.7224 9.9354 9.9354 10.1079 10.1079 10.7445 10.7445 10.7638 10.7638 10.8203 10.8203 11.2998 11.2998 11.3040 11.3040 11.3767 11.3767 11.3840 11.3840 11.4312 11.4312 11.5901 11.5901 11.6005 11.6005 k = 0.0000 0.0000 0.5025 ( 14635 PWs) bands (ev): -3.4125 -3.4125 -2.7173 -2.7173 -0.4585 -0.4585 0.2205 0.2205 0.2238 0.2238 0.3224 0.3224 0.5241 0.5241 0.5337 0.5337 4.2666 4.2666 4.2896 4.2896 4.8146 4.8146 4.8462 4.8462 5.3591 5.3591 5.4017 5.4017 6.0671 6.0671 6.2941 6.2941 6.3128 6.3128 6.4173 6.4173 6.4902 6.4902 6.4953 6.4953 6.9990 6.9990 7.0467 7.0467 7.1429 7.1429 7.3198 7.3198 7.3522 7.3522 7.3549 7.3549 7.7884 7.7884 7.8789 7.8789 8.1122 8.1122 8.2125 8.2125 8.2623 8.2623 8.4133 8.4133 9.1550 9.1550 9.1719 9.1719 9.2270 9.2270 9.2374 9.2374 9.7731 9.7731 9.9588 9.9588 10.1667 10.1667 10.7510 10.7510 10.7617 10.7617 10.8139 10.8139 11.2426 11.2426 11.2522 11.2522 11.3745 11.3745 11.3820 11.3820 11.4550 11.4550 11.5755 11.5755 11.5810 11.5810 k = 0.0000 0.0000 0.5290 ( 14635 PWs) bands (ev): -3.3763 -3.3763 -2.7639 -2.7639 -0.4156 -0.4156 0.2447 0.2447 0.2482 0.2482 0.2738 0.2738 0.5147 0.5147 0.5239 0.5239 4.2669 4.2669 4.2898 4.2898 4.7530 4.7530 4.7837 4.7837 5.4203 5.4203 5.4852 5.4852 6.1430 6.1430 6.3226 6.3226 6.3333 6.3333 6.3842 6.3842 6.4363 6.4363 6.4786 6.4786 6.9848 6.9848 7.0961 7.0961 7.1443 7.1443 7.2754 7.2754 7.3907 7.3907 7.4051 7.4051 7.7568 7.7568 7.8588 7.8588 8.0723 8.0723 8.1736 8.1736 8.2298 8.2298 8.3145 8.3145 9.1695 9.1695 9.1865 9.1865 9.2343 9.2343 9.2454 9.2454 9.8192 9.8192 9.9791 9.9791 10.2340 10.2340 10.7598 10.7598 10.7627 10.7627 10.8110 10.8110 11.1867 11.1867 11.2000 11.2000 11.3754 11.3754 11.3829 11.3829 11.4807 11.4807 11.5615 11.5615 11.5623 11.5623 k = 0.0000 0.0000 0.5554 ( 14623 PWs) bands (ev): -3.3387 -3.3387 -2.8108 -2.8108 -0.3712 -0.3712 0.2242 0.2242 0.2689 0.2689 0.2727 0.2727 0.5038 0.5038 0.5126 0.5126 4.2721 4.2721 4.2950 4.2950 4.6938 4.6938 4.7237 4.7237 5.4816 5.4816 5.5739 5.5739 6.2011 6.2011 6.3231 6.3231 6.3326 6.3326 6.3943 6.3943 6.4029 6.4029 6.4669 6.4669 6.9149 6.9149 7.1440 7.1440 7.1499 7.1499 7.2796 7.2796 7.4212 7.4212 7.4502 7.4502 7.7294 7.7294 7.8461 7.8461 8.0266 8.0266 8.1331 8.1331 8.1955 8.1955 8.2232 8.2232 9.1832 9.1832 9.2003 9.2003 9.2400 9.2400 9.2518 9.2518 9.8604 9.8604 9.9957 9.9957 10.3071 10.3071 10.7672 10.7672 10.7692 10.7692 10.8118 10.8118 11.1329 11.1329 11.1489 11.1489 11.3792 11.3792 11.3862 11.3862 11.5052 11.5052 11.5442 11.5442 11.5501 11.5501 k = 0.0000 0.0000 0.5819 ( 14605 PWs) bands (ev): -3.2998 -3.2998 -2.8578 -2.8578 -0.3255 -0.3255 0.1740 0.1740 0.2930 0.2930 0.2972 0.2972 0.4912 0.4912 0.4995 0.4995 4.2822 4.2822 4.3052 4.3052 4.6373 4.6373 4.6663 4.6663 5.5443 5.5443 5.6665 5.6665 6.2406 6.2406 6.2504 6.2504 6.3428 6.3428 6.3792 6.3792 6.4551 6.4551 6.4774 6.4774 6.8139 6.8139 7.1661 7.1661 7.1899 7.1899 7.2973 7.2973 7.4415 7.4415 7.4859 7.4859 7.7102 7.7102 7.8429 7.8429 7.9751 7.9751 8.0920 8.0920 8.1448 8.1448 8.1596 8.1596 9.1959 9.1959 9.2130 9.2130 9.2441 9.2441 9.2567 9.2567 9.8969 9.8969 10.0085 10.0085 10.3832 10.3832 10.7754 10.7754 10.7772 10.7772 10.8165 10.8165 11.0817 11.0817 11.0999 11.0999 11.3855 11.3855 11.3917 11.3917 11.5154 11.5154 11.5265 11.5265 11.5532 11.5532 k = 0.0000 0.0000 0.6083 ( 14569 PWs) bands (ev): -3.2597 -3.2597 -2.9046 -2.9046 -0.2785 -0.2785 0.1232 0.1232 0.3168 0.3168 0.3213 0.3213 0.4770 0.4770 0.4849 0.4849 4.2973 4.2973 4.3206 4.3206 4.5838 4.5838 4.6119 4.6119 5.6085 5.6085 5.7620 5.7620 6.1757 6.1757 6.2696 6.2696 6.3532 6.3532 6.3551 6.3551 6.4434 6.4434 6.5739 6.5739 6.7054 6.7054 7.1762 7.1762 7.2339 7.2339 7.3168 7.3168 7.4498 7.4498 7.5053 7.5053 7.7058 7.7058 7.8507 7.8507 7.9227 7.9227 8.0513 8.0513 8.0808 8.0808 8.1222 8.1222 9.2075 9.2075 9.2246 9.2246 9.2465 9.2465 9.2599 9.2599 9.9287 9.9287 10.0172 10.0172 10.4597 10.4597 10.7816 10.7816 10.7875 10.7875 10.8254 10.8254 11.0337 11.0337 11.0536 11.0536 11.3941 11.3941 11.3993 11.3993 11.5058 11.5058 11.5092 11.5092 11.5754 11.5754 k = 0.0000 0.0000 0.6348 ( 14581 PWs) bands (ev): -3.2183 -3.2183 -2.9513 -2.9513 -0.2305 -0.2305 0.0720 0.0720 0.3401 0.3401 0.3450 0.3450 0.4613 0.4613 0.4688 0.4688 4.3173 4.3173 4.3409 4.3409 4.5337 4.5337 4.5609 4.5609 5.6745 5.6745 5.8599 5.8599 6.1009 6.1009 6.2943 6.2943 6.3265 6.3265 6.3639 6.3639 6.4316 6.4316 6.5997 6.5997 6.6767 6.6767 7.1661 7.1661 7.2755 7.2755 7.3390 7.3390 7.4463 7.4463 7.5039 7.5039 7.7202 7.7202 7.8691 7.8691 7.8783 7.8783 8.0129 8.0129 8.0287 8.0287 8.0836 8.0836 9.2177 9.2177 9.2348 9.2348 9.2472 9.2472 9.2614 9.2614 9.9557 9.9557 10.0217 10.0217 10.5337 10.5337 10.7796 10.7796 10.8038 10.8038 10.8386 10.8386 10.9891 10.9891 11.0106 11.0106 11.4046 11.4046 11.4087 11.4087 11.4915 11.4915 11.4924 11.4924 11.5856 11.5928 k = 0.0000 0.0000 0.6612 ( 14594 PWs) bands (ev): -3.1759 -3.1759 -2.9975 -2.9975 -0.1815 -0.1815 0.0208 0.0208 0.3628 0.3628 0.3681 0.3681 0.4441 0.4441 0.4511 0.4511 4.3421 4.3421 4.3662 4.3662 4.4871 4.4871 4.5136 4.5136 5.7420 5.7420 5.9589 5.9589 6.0268 6.0268 6.2876 6.2876 6.3186 6.3186 6.3747 6.3747 6.4199 6.4199 6.5049 6.5049 6.7812 6.7812 7.1279 7.1279 7.3145 7.3145 7.3659 7.3659 7.4325 7.4325 7.4862 7.4862 7.7479 7.7479 7.8480 7.8480 7.8961 7.8961 7.9791 7.9791 7.9863 7.9863 8.0442 8.0442 9.2266 9.2266 9.2435 9.2435 9.2464 9.2464 9.2613 9.2613 9.9781 9.9781 10.0219 10.0219 10.6022 10.6022 10.7686 10.7686 10.8243 10.8243 10.8562 10.8562 10.9483 10.9483 10.9713 10.9713 11.4169 11.4169 11.4197 11.4197 11.4761 11.4761 11.4761 11.4761 11.5723 11.5740 k = 0.0000 0.0000 0.6877 ( 14582 PWs) bands (ev): -3.1325 -3.1325 -3.0432 -3.0432 -0.1317 -0.1317 -0.0304 -0.0304 0.3847 0.3847 0.3905 0.3905 0.4255 0.4255 0.4321 0.4321 4.3717 4.3717 4.3963 4.3963 4.4444 4.4444 4.4702 4.4702 5.8112 5.8112 5.9537 5.9537 6.0572 6.0572 6.2298 6.2298 6.3456 6.3456 6.3857 6.3857 6.4084 6.4084 6.4305 6.4305 6.8835 6.8835 7.0634 7.0634 7.3505 7.3505 7.3967 7.3967 7.4107 7.4107 7.4595 7.4595 7.7798 7.7798 7.8282 7.8282 7.9291 7.9291 7.9540 7.9540 7.9559 7.9559 8.0047 8.0047 9.2339 9.2339 9.2439 9.2439 9.2505 9.2505 9.2595 9.2595 9.9958 9.9958 10.0177 10.0177 10.6619 10.6619 10.7460 10.7460 10.8491 10.8491 10.8783 10.8783 10.9113 10.9113 10.9360 10.9360 11.4306 11.4306 11.4321 11.4321 11.4605 11.4605 11.4606 11.4606 11.5791 11.5798 k = 0.0000 0.0000 0.7141 ( 14558 PWs) bands (ev): -3.0882 -3.0882 -3.0882 -3.0882 -0.0813 -0.0813 -0.0813 -0.0813 0.4057 0.4057 0.4057 0.4057 0.4118 0.4118 0.4118 0.4118 4.4059 4.4059 4.4059 4.4059 4.4310 4.4310 4.4310 4.4310 5.8817 5.8817 5.8817 5.8817 6.1503 6.1503 6.1503 6.1503 6.3801 6.3801 6.3801 6.3801 6.3970 6.3970 6.3970 6.3970 6.9795 6.9795 6.9795 6.9795 7.3829 7.3829 7.3829 7.3829 7.4286 7.4286 7.4286 7.4286 7.8079 7.8079 7.8079 7.8079 7.9443 7.9443 7.9443 7.9443 7.9659 7.9659 7.9659 7.9659 9.2397 9.2397 9.2397 9.2397 9.2559 9.2559 9.2559 9.2559 10.0090 10.0090 10.0090 10.0090 10.7104 10.7104 10.7104 10.7104 10.8782 10.8782 10.8782 10.8782 10.9050 10.9050 10.9050 10.9050 11.4453 11.4453 11.4453 11.4453 11.4458 11.4458 11.4458 11.4458 11.5969 11.5969 k = 0.0000 0.0000 0.7141 ( 14558 PWs) bands (ev): -3.0882 -3.0882 -3.0882 -3.0882 -0.0813 -0.0813 -0.0813 -0.0813 0.4057 0.4057 0.4057 0.4057 0.4118 0.4118 0.4118 0.4118 4.4059 4.4059 4.4059 4.4059 4.4310 4.4310 4.4310 4.4310 5.8817 5.8817 5.8817 5.8817 6.1503 6.1503 6.1503 6.1503 6.3801 6.3801 6.3801 6.3801 6.3970 6.3970 6.3970 6.3970 6.9795 6.9795 6.9795 6.9795 7.3829 7.3829 7.3829 7.3829 7.4286 7.4286 7.4286 7.4286 7.8079 7.8079 7.8079 7.8079 7.9443 7.9443 7.9443 7.9443 7.9659 7.9659 7.9659 7.9659 9.2397 9.2397 9.2397 9.2397 9.2559 9.2559 9.2559 9.2559 10.0090 10.0090 10.0090 10.0090 10.7104 10.7104 10.7104 10.7104 10.8782 10.8782 10.8782 10.8782 10.9050 10.9050 10.9050 10.9050 11.4453 11.4453 11.4453 11.4453 11.4458 11.4458 11.4458 11.4458 11.5969 11.5969 k = 0.0227 0.0131 0.7141 ( 14562 PWs) bands (ev): -3.0881 -3.0881 -3.0881 -3.0881 -0.0809 -0.0809 -0.0809 -0.0809 0.4052 0.4052 0.4052 0.4052 0.4113 0.4113 0.4113 0.4113 4.4069 4.4069 4.4071 4.4071 4.4323 4.4323 4.4325 4.4325 5.8820 5.8820 5.8820 5.8820 6.1461 6.1461 6.1462 6.1462 6.3773 6.3773 6.3777 6.3777 6.4039 6.4039 6.4042 6.4042 6.9765 6.9765 6.9766 6.9766 7.3832 7.3832 7.3833 7.3833 7.4282 7.4282 7.4284 7.4284 7.7877 7.7877 7.7880 7.7880 7.9252 7.9252 7.9264 7.9264 8.0058 8.0058 8.0067 8.0067 9.2399 9.2399 9.2399 9.2399 9.2560 9.2560 9.2560 9.2560 10.0095 10.0095 10.0095 10.0095 10.7132 10.7132 10.7132 10.7132 10.8754 10.8754 10.8762 10.8762 10.9030 10.9030 10.9040 10.9040 11.4267 11.4267 11.4354 11.4354 11.4423 11.4423 11.4515 11.4515 11.6015 11.6017 k = 0.0455 0.0262 0.7141 ( 14590 PWs) bands (ev): -3.0879 -3.0879 -3.0879 -3.0879 -0.0799 -0.0799 -0.0799 -0.0799 0.4035 0.4035 0.4037 0.4037 0.4097 0.4097 0.4099 0.4099 4.4090 4.4090 4.4103 4.4103 4.4368 4.4368 4.4381 4.4381 5.8826 5.8826 5.8828 5.8828 6.1336 6.1336 6.1344 6.1344 6.3756 6.3756 6.3777 6.3777 6.4172 6.4172 6.4186 6.4186 6.9682 6.9682 6.9683 6.9683 7.3814 7.3814 7.3822 7.3822 7.4269 7.4269 7.4279 7.4279 7.7421 7.7421 7.7435 7.7435 7.9182 7.9182 7.9222 7.9222 8.0628 8.0628 8.0654 8.0654 9.2404 9.2404 9.2405 9.2405 9.2564 9.2564 9.2566 9.2566 10.0108 10.0108 10.0108 10.0108 10.7213 10.7213 10.7213 10.7213 10.8657 10.8657 10.8716 10.8716 10.8960 10.8960 10.9028 10.9028 11.3908 11.3908 11.4087 11.4087 11.4371 11.4371 11.4571 11.4571 11.6122 11.6127 k = 0.0682 0.0394 0.7141 ( 14592 PWs) bands (ev): -3.0874 -3.0874 -3.0874 -3.0874 -0.0781 -0.0781 -0.0781 -0.0781 0.4006 0.4006 0.4014 0.4014 0.4070 0.4070 0.4077 0.4077 4.4104 4.4104 4.4137 4.4137 4.4460 4.4460 4.4496 4.4496 5.8834 5.8834 5.8841 5.8841 6.1139 6.1139 6.1161 6.1161 6.3789 6.3789 6.3839 6.3839 6.4319 6.4319 6.4349 6.4349 6.9560 6.9560 6.9563 6.9563 7.3704 7.3704 7.3722 7.3722 7.4253 7.4253 7.4278 7.4278 7.6952 7.6952 7.6977 7.6977 7.9220 7.9220 7.9290 7.9290 8.1207 8.1207 8.1254 8.1254 9.2412 9.2412 9.2416 9.2416 9.2571 9.2571 9.2575 9.2575 10.0127 10.0127 10.0127 10.0127 10.7341 10.7341 10.7341 10.7341 10.8495 10.8495 10.8653 10.8653 10.8828 10.8828 10.9013 10.9013 11.3492 11.3492 11.3738 11.3738 11.4346 11.4346 11.4628 11.4628 11.6259 11.6261 k = 0.0909 0.0525 0.7141 ( 14596 PWs) bands (ev): -3.0868 -3.0868 -3.0868 -3.0868 -0.0757 -0.0757 -0.0757 -0.0757 0.3963 0.3963 0.3980 0.3980 0.4034 0.4034 0.4050 0.4050 4.4106 4.4106 4.4161 4.4161 4.4615 4.4615 4.4672 4.4672 5.8842 5.8842 5.8858 5.8858 6.0885 6.0885 6.0930 6.0930 6.3872 6.3872 6.3957 6.3957 6.4465 6.4465 6.4513 6.4513 6.9418 6.9418 6.9425 6.9425 7.3410 7.3410 7.3429 7.3429 7.4248 7.4248 7.4282 7.4282 7.6625 7.6625 7.6656 7.6656 7.9325 7.9325 7.9425 7.9425 8.1760 8.1760 8.1832 8.1832 9.2422 9.2422 9.2432 9.2432 9.2579 9.2579 9.2589 9.2589 10.0149 10.0149 10.0150 10.0150 10.7498 10.7498 10.7502 10.7502 10.8294 10.8294 10.8578 10.8578 10.8641 10.8641 10.8982 10.8982 11.3090 11.3090 11.3392 11.3392 11.4351 11.4351 11.4692 11.4692 11.6410 11.6411 k = 0.1136 0.0656 0.7141 ( 14590 PWs) bands (ev): -3.0860 -3.0860 -3.0860 -3.0860 -0.0726 -0.0726 -0.0726 -0.0726 0.3908 0.3908 0.3933 0.3933 0.3991 0.3991 0.4017 0.4017 4.4103 4.4103 4.4174 4.4174 4.4830 4.4830 4.4907 4.4907 5.8844 5.8844 5.8878 5.8878 6.0595 6.0595 6.0670 6.0670 6.3990 6.3990 6.4113 6.4113 6.4611 6.4611 6.4671 6.4671 6.9274 6.9274 6.9286 6.9286 7.2896 7.2896 7.2899 7.2899 7.4255 7.4255 7.4285 7.4285 7.6498 7.6498 7.6529 7.6529 7.9485 7.9485 7.9615 7.9615 8.2272 8.2272 8.2372 8.2372 9.2434 9.2434 9.2454 9.2454 9.2589 9.2589 9.2609 9.2609 10.0168 10.0168 10.0171 10.0171 10.7622 10.7622 10.7657 10.7657 10.8115 10.8115 10.8376 10.8376 10.8549 10.8549 10.8927 10.8927 11.2748 11.2748 11.3089 11.3089 11.4389 11.4389 11.4769 11.4769 11.6554 11.6555 k = 0.1364 0.0787 0.7141 ( 14602 PWs) bands (ev): -3.0851 -3.0851 -3.0851 -3.0851 -0.0688 -0.0688 -0.0688 -0.0688 0.3840 0.3840 0.3873 0.3873 0.3946 0.3946 0.3979 0.3979 4.4098 4.4098 4.4182 4.4182 4.5101 4.5101 4.5196 4.5196 5.8830 5.8830 5.8892 5.8892 6.0287 6.0287 6.0403 6.0403 6.4121 6.4121 6.4266 6.4266 6.4777 6.4777 6.4826 6.4826 6.9142 6.9142 6.9159 6.9159 7.2183 7.2183 7.2204 7.2204 7.4265 7.4265 7.4285 7.4285 7.6529 7.6529 7.6555 7.6555 7.9698 7.9698 7.9857 7.9857 8.2736 8.2736 8.2867 8.2867 9.2447 9.2447 9.2482 9.2482 9.2601 9.2601 9.2634 9.2634 10.0177 10.0177 10.0182 10.0182 10.7545 10.7545 10.7728 10.7728 10.8087 10.8087 10.8095 10.8095 10.8592 10.8592 10.8873 10.8873 11.2495 11.2495 11.2856 11.2856 11.4458 11.4458 11.4860 11.4860 11.6665 11.6670 k = 0.1591 0.0919 0.7141 ( 14604 PWs) bands (ev): -3.0841 -3.0841 -3.0841 -3.0841 -0.0644 -0.0644 -0.0643 -0.0643 0.3761 0.3761 0.3799 0.3799 0.3899 0.3899 0.3937 0.3937 4.4093 4.4093 4.4188 4.4188 4.5425 4.5425 4.5536 4.5536 5.8785 5.8785 5.8886 5.8886 5.9988 5.9988 6.0155 6.0155 6.4234 6.4234 6.4370 6.4370 6.4988 6.4988 6.4997 6.4997 6.9031 6.9031 6.9050 6.9050 7.1351 7.1351 7.1408 7.1408 7.4275 7.4275 7.4284 7.4284 7.6650 7.6650 7.6667 7.6667 7.9961 7.9961 8.0149 8.0149 8.3151 8.3151 8.3315 8.3315 9.2462 9.2462 9.2515 9.2515 9.2614 9.2614 9.2666 9.2666 10.0166 10.0166 10.0176 10.0176 10.7305 10.7305 10.7618 10.7618 10.7810 10.7810 10.8103 10.8103 10.8778 10.8778 10.8915 10.8915 11.2348 11.2348 11.2701 11.2701 11.4555 11.4555 11.4965 11.4965 11.6713 11.6718 k = 0.1818 0.1050 0.7141 ( 14580 PWs) bands (ev): -3.0829 -3.0829 -3.0829 -3.0829 -0.0593 -0.0593 -0.0592 -0.0592 0.3672 0.3672 0.3713 0.3713 0.3850 0.3850 0.3891 0.3891 4.4091 4.4091 4.4194 4.4194 4.5800 4.5800 4.5926 4.5926 5.8685 5.8685 5.8826 5.8826 5.9739 5.9739 5.9958 5.9958 6.4308 6.4308 6.4406 6.4406 6.5160 6.5160 6.5281 6.5281 6.8944 6.8944 6.8950 6.8950 7.0466 7.0466 7.0568 7.0568 7.4283 7.4283 7.4283 7.4283 7.6810 7.6810 7.6814 7.6814 8.0271 8.0271 8.0487 8.0487 8.3516 8.3516 8.3716 8.3716 9.2478 9.2478 9.2554 9.2554 9.2630 9.2630 9.2704 9.2704 10.0124 10.0124 10.0139 10.0139 10.7037 10.7037 10.7323 10.7323 10.7609 10.7609 10.7951 10.7951 10.9068 10.9068 10.9124 10.9124 11.2306 11.2306 11.2626 11.2626 11.4669 11.4669 11.5071 11.5071 11.6650 11.6656 k = 0.2045 0.1181 0.7141 ( 14596 PWs) bands (ev): -3.0817 -3.0817 -3.0817 -3.0817 -0.0535 -0.0535 -0.0534 -0.0534 0.3573 0.3573 0.3616 0.3616 0.3801 0.3801 0.3843 0.3843 4.4093 4.4093 4.4202 4.4202 4.6223 4.6223 4.6363 4.6363 5.8512 5.8512 5.8667 5.8667 5.9591 5.9591 5.9835 5.9835 6.4332 6.4332 6.4389 6.4389 6.5319 6.5319 6.5608 6.5608 6.8792 6.8792 6.8878 6.8878 6.9623 6.9623 6.9742 6.9742 7.4283 7.4283 7.4292 7.4292 7.6970 7.6970 7.6980 7.6980 8.0621 8.0621 8.0865 8.0865 8.3834 8.3834 8.4073 8.4073 9.2494 9.2494 9.2595 9.2595 9.2651 9.2651 9.2750 9.2750 10.0037 10.0037 10.0061 10.0061 10.6787 10.6787 10.6984 10.6984 10.7416 10.7416 10.7688 10.7688 10.9406 10.9406 10.9433 10.9433 11.2354 11.2354 11.2624 11.2624 11.4782 11.4782 11.5152 11.5152 11.6494 11.6555 k = 0.2273 0.1312 0.7141 ( 14608 PWs) bands (ev): -3.0805 -3.0805 -3.0805 -3.0805 -0.0472 -0.0472 -0.0471 -0.0471 0.3466 0.3466 0.3509 0.3509 0.3751 0.3751 0.3793 0.3793 4.4099 4.4099 4.4212 4.4212 4.6693 4.6693 4.6845 4.6845 5.8272 5.8272 5.8411 5.8411 5.9546 5.9546 5.9784 5.9784 6.4313 6.4313 6.4333 6.4333 6.5407 6.5407 6.5958 6.5958 6.8247 6.8247 6.8772 6.8772 6.9056 6.9056 6.9169 6.9169 7.4285 7.4285 7.4302 7.4302 7.7124 7.7124 7.7148 7.7148 8.1000 8.1000 8.1273 8.1273 8.4108 8.4108 8.4388 8.4388 9.2511 9.2511 9.2628 9.2628 9.2690 9.2690 9.2804 9.2804 9.9894 9.9894 9.9929 9.9929 10.6582 10.6582 10.6656 10.6656 10.7229 10.7229 10.7377 10.7377 10.9765 10.9765 10.9780 10.9780 11.2476 11.2476 11.2682 11.2682 11.4856 11.4856 11.5142 11.5142 11.6305 11.6340 k = 0.2500 0.1443 0.7141 ( 14616 PWs) bands (ev): -3.0792 -3.0792 -3.0792 -3.0792 -0.0404 -0.0404 -0.0401 -0.0401 0.3353 0.3353 0.3396 0.3396 0.3701 0.3701 0.3742 0.3742 4.4111 4.4111 4.4224 4.4224 4.7207 4.7207 4.7371 4.7371 5.7991 5.7991 5.8103 5.8103 5.9560 5.9560 5.9783 5.9783 6.4250 6.4250 6.4257 6.4257 6.5325 6.5325 6.6313 6.6313 6.7351 6.7351 6.8330 6.8330 6.8908 6.8908 6.9086 6.9086 7.4289 7.4289 7.4313 7.4313 7.7268 7.7268 7.7306 7.7306 8.1397 8.1397 8.1699 8.1699 8.4343 8.4343 8.4665 8.4665 9.2528 9.2528 9.2649 9.2649 9.2749 9.2749 9.2867 9.2867 9.9686 9.9686 9.9733 9.9733 10.6358 10.6358 10.6439 10.6439 10.7050 10.7050 10.7066 10.7066 11.0127 11.0127 11.0136 11.0136 11.2651 11.2651 11.2786 11.2786 11.4821 11.4821 11.4951 11.4951 11.6156 11.6158 k = 0.2727 0.1575 0.7141 ( 14624 PWs) bands (ev): -3.0779 -3.0779 -3.0779 -3.0779 -0.0330 -0.0330 -0.0327 -0.0327 0.3234 0.3234 0.3276 0.3276 0.3653 0.3653 0.3692 0.3692 4.4127 4.4127 4.4240 4.4240 4.7763 4.7763 4.7939 4.7939 5.7691 5.7691 5.7779 5.7779 5.9598 5.9598 5.9810 5.9810 6.4146 6.4146 6.4162 6.4162 6.4984 6.4984 6.6363 6.6363 6.6687 6.6687 6.8012 6.8012 6.8931 6.8931 6.9096 6.9096 7.4294 7.4294 7.4325 7.4325 7.7402 7.7402 7.7452 7.7452 8.1801 8.1801 8.2133 8.2133 8.4545 8.4545 8.4909 8.4909 9.2546 9.2546 9.2665 9.2665 9.2823 9.2823 9.2939 9.2939 9.9411 9.9411 9.9470 9.9470 10.6091 10.6091 10.6369 10.6369 10.6729 10.6729 10.6950 10.6950 11.0477 11.0477 11.0485 11.0485 11.2861 11.2861 11.2912 11.2912 11.4591 11.4591 11.4622 11.4622 11.6090 11.6091 k = 0.2955 0.1706 0.7141 ( 14634 PWs) bands (ev): -3.0766 -3.0766 -3.0766 -3.0766 -0.0252 -0.0252 -0.0249 -0.0249 0.3112 0.3112 0.3152 0.3152 0.3606 0.3606 0.3643 0.3643 4.4149 4.4149 4.4258 4.4258 4.8360 4.8360 4.8547 4.8547 5.7390 5.7390 5.7459 5.7459 5.9639 5.9639 5.9848 5.9848 6.3944 6.3944 6.4011 6.4011 6.4492 6.4492 6.5437 6.5437 6.6991 6.6991 6.7915 6.7915 6.9007 6.9007 6.9150 6.9150 7.4302 7.4302 7.4337 7.4337 7.7525 7.7525 7.7586 7.7586 8.2199 8.2199 8.2560 8.2560 8.4719 8.4719 8.5123 8.5123 9.2564 9.2564 9.2679 9.2679 9.2911 9.2911 9.3023 9.3023 9.9073 9.9073 9.9143 9.9143 10.5853 10.5853 10.6332 10.6332 10.6467 10.6467 10.6899 10.6899 11.0805 11.0805 11.0814 11.0814 11.3016 11.3016 11.3076 11.3076 11.4162 11.4162 11.4323 11.4323 11.6118 11.6119 k = 0.3182 0.1837 0.7141 ( 14622 PWs) bands (ev): -3.0754 -3.0754 -3.0754 -3.0754 -0.0171 -0.0171 -0.0167 -0.0167 0.2989 0.2989 0.3026 0.3026 0.3562 0.3562 0.3596 0.3596 4.4175 4.4175 4.4278 4.4278 4.8996 4.8996 4.9191 4.9191 5.7099 5.7099 5.7152 5.7152 5.9668 5.9668 5.9883 5.9883 6.3357 6.3357 6.3768 6.3768 6.4216 6.4216 6.4619 6.4619 6.7267 6.7267 6.7925 6.7925 6.9135 6.9135 6.9244 6.9244 7.4312 7.4312 7.4350 7.4350 7.7638 7.7638 7.7706 7.7706 8.2581 8.2581 8.2968 8.2968 8.4875 8.4875 8.5313 8.5313 9.2583 9.2583 9.2692 9.2692 9.3011 9.3011 9.3120 9.3120 9.8683 9.8683 9.8762 9.8762 10.5636 10.5636 10.6095 10.6095 10.6503 10.6503 10.6925 10.6925 11.1104 11.1104 11.1111 11.1111 11.2991 11.2991 11.3178 11.3178 11.3824 11.3824 11.4089 11.4089 11.6150 11.6152 k = 0.3409 0.1968 0.7141 ( 14626 PWs) bands (ev): -3.0742 -3.0742 -3.0742 -3.0742 -0.0089 -0.0089 -0.0085 -0.0085 0.2867 0.2867 0.2901 0.2901 0.3522 0.3522 0.3553 0.3553 4.4203 4.4203 4.4299 4.4299 4.9667 4.9667 4.9870 4.9870 5.6826 5.6826 5.6867 5.6867 5.9665 5.9665 5.9895 5.9895 6.2561 6.2561 6.3192 6.3192 6.4099 6.4099 6.4177 6.4177 6.7486 6.7486 6.7956 6.7956 6.9311 6.9311 6.9378 6.9378 7.4323 7.4323 7.4363 7.4363 7.7740 7.7740 7.7812 7.7812 8.2937 8.2937 8.3342 8.3342 8.5019 8.5019 8.5482 8.5482 9.2604 9.2604 9.2705 9.2705 9.3126 9.3126 9.3230 9.3230 9.8257 9.8257 9.8342 9.8342 10.5439 10.5439 10.5830 10.5830 10.6662 10.6662 10.7027 10.7027 11.1366 11.1366 11.1367 11.1367 11.2726 11.2726 11.2898 11.2898 11.3864 11.3864 11.4068 11.4068 11.6127 11.6129 k = 0.3636 0.2099 0.7141 ( 14628 PWs) bands (ev): -3.0732 -3.0732 -3.0732 -3.0732 -0.0007 -0.0007 -0.0002 -0.0002 0.2749 0.2749 0.2780 0.2780 0.3486 0.3486 0.3513 0.3513 4.4234 4.4234 4.4320 4.4320 5.0370 5.0370 5.0580 5.0580 5.6577 5.6577 5.6610 5.6610 5.9596 5.9596 5.9841 5.9841 6.1766 6.1766 6.2418 6.2418 6.4013 6.4013 6.4019 6.4019 6.7645 6.7645 6.7976 6.7976 6.9518 6.9518 6.9545 6.9545 7.4334 7.4334 7.4374 7.4374 7.7832 7.7832 7.7904 7.7904 8.3259 8.3259 8.3667 8.3667 8.5162 8.5162 8.5630 8.5630 9.2625 9.2625 9.2717 9.2717 9.3256 9.3256 9.3355 9.3355 9.7812 9.7812 9.7899 9.7899 10.5263 10.5263 10.5587 10.5587 10.6887 10.6887 10.7199 10.7199 11.1561 11.1561 11.1583 11.1583 11.2299 11.2299 11.2444 11.2444 11.4091 11.4091 11.4199 11.4199 11.6054 11.6056 k = 0.3864 0.2231 0.7141 ( 14624 PWs) bands (ev): -3.0723 -3.0723 -3.0723 -3.0723 0.0073 0.0073 0.0077 0.0077 0.2638 0.2638 0.2665 0.2665 0.3455 0.3455 0.3478 0.3478 4.4265 4.4265 4.4340 4.4340 5.1101 5.1101 5.1315 5.1315 5.6358 5.6358 5.6384 5.6384 5.9399 5.9399 5.9613 5.9613 6.1124 6.1124 6.1716 6.1716 6.3925 6.3925 6.3957 6.3957 6.7750 6.7750 6.7978 6.7978 6.9732 6.9732 6.9733 6.9733 7.4345 7.4345 7.4383 7.4383 7.7914 7.7914 7.7982 7.7982 8.3541 8.3541 8.3930 8.3930 8.5310 8.5310 8.5758 8.5758 9.2647 9.2647 9.2727 9.2727 9.3403 9.3403 9.3496 9.3496 9.7365 9.7365 9.7452 9.7452 10.5110 10.5110 10.5373 10.5373 10.7166 10.7166 10.7432 10.7432 11.1593 11.1593 11.1677 11.1677 11.1892 11.1892 11.2076 11.2076 11.4342 11.4342 11.4379 11.4379 11.5906 11.5940 k = 0.4091 0.2362 0.7141 ( 14614 PWs) bands (ev): -3.0715 -3.0715 -3.0715 -3.0715 0.0146 0.0146 0.0151 0.0151 0.2538 0.2538 0.2561 0.2561 0.3429 0.3429 0.3448 0.3448 4.4295 4.4295 4.4357 4.4357 5.1853 5.1853 5.2069 5.2069 5.6174 5.6174 5.6195 5.6195 5.8996 5.8996 5.9083 5.9083 6.0784 6.0784 6.1214 6.1214 6.3868 6.3868 6.3906 6.3906 6.7814 6.7814 6.7968 6.7968 6.9919 6.9919 6.9936 6.9936 7.4356 7.4356 7.4390 7.4390 7.7983 7.7983 7.8043 7.8043 8.3779 8.3779 8.4122 8.4122 8.5465 8.5465 8.5862 8.5862 9.2669 9.2669 9.2736 9.2736 9.3565 9.3565 9.3651 9.3651 9.6934 9.6934 9.7018 9.7018 10.4984 10.4984 10.5190 10.5190 10.7489 10.7489 10.7715 10.7715 11.1254 11.1254 11.1255 11.1255 11.1942 11.1942 11.2036 11.2036 11.4564 11.4564 11.4581 11.4581 11.5770 11.5791 k = 0.4318 0.2493 0.7141 ( 14608 PWs) bands (ev): -3.0709 -3.0709 -3.0709 -3.0709 0.0210 0.0210 0.0214 0.0214 0.2454 0.2454 0.2472 0.2472 0.3409 0.3409 0.3423 0.3423 4.4322 4.4322 4.4370 4.4370 5.2615 5.2615 5.2827 5.2827 5.6028 5.6028 5.6047 5.6047 5.8346 5.8346 5.8387 5.8387 6.0671 6.0671 6.0933 6.0933 6.3831 6.3831 6.3867 6.3867 6.7851 6.7851 6.7951 6.7951 7.0087 7.0087 7.0108 7.0108 7.4366 7.4366 7.4394 7.4394 7.8041 7.8041 7.8090 7.8090 8.3972 8.3972 8.4247 8.4247 8.5620 8.5620 8.5939 8.5939 9.2690 9.2690 9.2742 9.2742 9.3737 9.3737 9.3814 9.3814 9.6540 9.6540 9.6616 9.6616 10.4888 10.4888 10.5040 10.5040 10.7847 10.7847 10.8036 10.8036 11.0755 11.0755 11.0788 11.0788 11.2036 11.2036 11.2094 11.2094 11.4735 11.4735 11.4792 11.4792 11.5653 11.5655 k = 0.4545 0.2624 0.7141 ( 14598 PWs) bands (ev): -3.0704 -3.0704 -3.0704 -3.0704 0.0261 0.0261 0.0264 0.0264 0.2390 0.2390 0.2402 0.2402 0.3395 0.3395 0.3405 0.3405 4.4345 4.4345 4.4378 4.4378 5.3361 5.3361 5.3557 5.3557 5.5929 5.5929 5.5946 5.5946 5.7573 5.7573 5.7678 5.7678 6.0646 6.0646 6.0793 6.0793 6.3810 6.3810 6.3837 6.3837 6.7873 6.7873 6.7933 6.7933 7.0219 7.0219 7.0237 7.0237 7.4375 7.4375 7.4395 7.4395 7.8086 7.8086 7.8120 7.8120 8.4122 8.4122 8.4312 8.4312 8.5762 8.5762 8.5983 8.5983 9.2709 9.2709 9.2744 9.2744 9.3909 9.3909 9.3970 9.3970 9.6210 9.6210 9.6272 9.6272 10.4825 10.4825 10.4925 10.4925 10.8228 10.8228 10.8382 10.8382 11.0271 11.0271 11.0324 11.0324 11.2103 11.2103 11.2140 11.2140 11.4882 11.4882 11.4960 11.4960 11.5569 11.5570 k = 0.4773 0.2756 0.7141 ( 14618 PWs) bands (ev): -3.0701 -3.0701 -3.0701 -3.0701 0.0293 0.0293 0.0295 0.0295 0.2351 0.2351 0.2357 0.2357 0.3388 0.3388 0.3393 0.3393 4.4363 4.4363 4.4379 4.4379 5.4020 5.4020 5.4162 5.4162 5.5889 5.5889 5.5900 5.5900 5.6905 5.6905 5.7006 5.7006 6.0654 6.0654 6.0721 6.0721 6.3801 6.3801 6.3816 6.3816 6.7888 6.7888 6.7916 6.7916 7.0306 7.0306 7.0316 7.0316 7.4383 7.4383 7.4393 7.4393 7.8116 7.8116 7.8134 7.8134 8.4231 8.4231 8.4327 8.4327 8.5876 8.5876 8.5989 8.5989 9.2724 9.2724 9.2743 9.2743 9.4051 9.4051 9.4087 9.4087 9.5985 9.5985 9.6022 9.6022 10.4796 10.4796 10.4846 10.4846 10.8605 10.8605 10.8713 10.8713 10.9848 10.9848 10.9906 10.9906 11.2144 11.2144 11.2163 11.2163 11.4999 11.4999 11.5060 11.5060 11.5529 11.5535 k = 0.5000 0.2887 0.7141 ( 14632 PWs) bands (ev): -3.0700 -3.0700 -3.0700 -3.0700 0.0305 0.0305 0.0305 0.0305 0.2339 0.2339 0.2339 0.2339 0.3387 0.3387 0.3387 0.3387 4.4374 4.4374 4.4374 4.4374 5.4378 5.4378 5.4378 5.4378 5.5902 5.5902 5.5902 5.5902 5.6631 5.6631 5.6631 5.6631 6.0679 6.0679 6.0679 6.0679 6.3804 6.3804 6.3804 6.3804 6.7901 6.7901 6.7901 6.7901 7.0339 7.0339 7.0339 7.0339 7.4389 7.4389 7.4389 7.4389 7.8133 7.8133 7.8133 7.8133 8.4299 8.4299 8.4299 8.4299 8.5953 8.5953 8.5953 8.5953 9.2736 9.2736 9.2736 9.2736 9.4121 9.4121 9.4121 9.4121 9.5915 9.5915 9.5915 9.5915 10.4803 10.4803 10.4803 10.4803 10.8854 10.8854 10.8854 10.8854 10.9660 10.9660 10.9660 10.9660 11.2164 11.2164 11.2164 11.2164 11.5068 11.5068 11.5068 11.5068 11.5549 11.5549 k = 0.5000 0.2887 0.7141 ( 14632 PWs) bands (ev): -3.0700 -3.0700 -3.0700 -3.0700 0.0305 0.0305 0.0305 0.0305 0.2339 0.2339 0.2339 0.2339 0.3387 0.3387 0.3387 0.3387 4.4374 4.4374 4.4374 4.4374 5.4378 5.4378 5.4378 5.4378 5.5902 5.5902 5.5902 5.5902 5.6631 5.6631 5.6631 5.6631 6.0679 6.0679 6.0679 6.0679 6.3804 6.3804 6.3804 6.3804 6.7901 6.7901 6.7901 6.7901 7.0339 7.0339 7.0339 7.0339 7.4389 7.4389 7.4389 7.4389 7.8133 7.8133 7.8133 7.8133 8.4299 8.4299 8.4299 8.4299 8.5953 8.5953 8.5953 8.5953 9.2736 9.2736 9.2736 9.2736 9.4121 9.4121 9.4121 9.4121 9.5915 9.5915 9.5915 9.5915 10.4803 10.4803 10.4803 10.4803 10.8854 10.8854 10.8854 10.8854 10.9660 10.9660 10.9660 10.9660 11.2164 11.2164 11.2164 11.2164 11.5068 11.5068 11.5068 11.5068 11.5549 11.5549 k = 0.4872 0.3109 0.7141 ( 14616 PWs) bands (ev): -3.0700 -3.0700 -3.0700 -3.0700 0.0311 0.0311 0.0311 0.0311 0.2331 0.2331 0.2331 0.2331 0.3387 0.3387 0.3387 0.3387 4.4401 4.4401 4.4401 4.4401 5.4198 5.4198 5.4198 5.4198 5.6041 5.6041 5.6041 5.6041 5.6659 5.6659 5.6659 5.6659 6.0684 6.0684 6.0684 6.0684 6.3801 6.3801 6.3801 6.3801 6.7911 6.7911 6.7911 6.7911 7.0337 7.0337 7.0337 7.0337 7.4282 7.4282 7.4282 7.4282 7.8242 7.8242 7.8242 7.8242 8.4294 8.4294 8.4294 8.4294 8.5942 8.5942 8.5942 8.5942 9.2738 9.2738 9.2738 9.2738 9.4107 9.4107 9.4107 9.4107 9.5896 9.5896 9.5896 9.5896 10.4840 10.4840 10.4840 10.4840 10.8879 10.8879 10.8879 10.8879 10.9673 10.9673 10.9673 10.9673 11.2167 11.2167 11.2167 11.2167 11.4997 11.4997 11.4997 11.4997 11.5516 11.5516 k = 0.4744 0.3331 0.7141 ( 14616 PWs) bands (ev): -3.0699 -3.0699 -3.0699 -3.0699 0.0329 0.0329 0.0329 0.0329 0.2306 0.2306 0.2306 0.2306 0.3387 0.3387 0.3387 0.3387 4.4480 4.4480 4.4480 4.4480 5.3786 5.3786 5.3786 5.3786 5.6275 5.6275 5.6275 5.6275 5.6793 5.6793 5.6793 5.6793 6.0700 6.0700 6.0700 6.0700 6.3795 6.3795 6.3795 6.3795 6.7940 6.7940 6.7940 6.7940 7.0329 7.0329 7.0329 7.0329 7.3997 7.3997 7.3997 7.3997 7.8537 7.8537 7.8537 7.8537 8.4277 8.4277 8.4277 8.4277 8.5911 8.5911 8.5911 8.5911 9.2742 9.2742 9.2742 9.2742 9.4066 9.4066 9.4066 9.4066 9.5842 9.5842 9.5842 9.5842 10.4949 10.4949 10.4949 10.4949 10.8954 10.8954 10.8954 10.8954 10.9711 10.9711 10.9711 10.9711 11.2177 11.2177 11.2177 11.2177 11.4801 11.4801 11.4801 11.4801 11.5426 11.5426 k = 0.4615 0.3553 0.7141 ( 14616 PWs) bands (ev): -3.0698 -3.0698 -3.0698 -3.0698 0.0359 0.0359 0.0359 0.0359 0.2265 0.2265 0.2265 0.2265 0.3386 0.3386 0.3386 0.3386 4.4611 4.4611 4.4611 4.4611 5.3286 5.3286 5.3286 5.3286 5.6388 5.6388 5.6388 5.6388 5.7109 5.7109 5.7109 5.7109 6.0724 6.0724 6.0724 6.0724 6.3783 6.3783 6.3783 6.3783 6.7988 6.7988 6.7988 6.7988 7.0315 7.0315 7.0315 7.0315 7.3600 7.3600 7.3600 7.3600 7.8953 7.8953 7.8953 7.8953 8.4250 8.4250 8.4250 8.4250 8.5859 8.5859 8.5859 8.5859 9.2751 9.2751 9.2751 9.2751 9.4001 9.4001 9.4001 9.4001 9.5755 9.5755 9.5755 9.5755 10.5124 10.5124 10.5124 10.5124 10.9074 10.9074 10.9074 10.9074 10.9774 10.9774 10.9774 10.9774 11.2194 11.2194 11.2194 11.2194 11.4523 11.4523 11.4523 11.4523 11.5285 11.5285 k = 0.4487 0.3775 0.7141 ( 14616 PWs) bands (ev): -3.0696 -3.0696 -3.0696 -3.0696 0.0401 0.0401 0.0401 0.0401 0.2209 0.2209 0.2209 0.2209 0.3384 0.3384 0.3384 0.3384 4.4793 4.4793 4.4793 4.4793 5.2752 5.2752 5.2752 5.2752 5.6419 5.6419 5.6419 5.6419 5.7513 5.7513 5.7513 5.7513 6.0752 6.0752 6.0752 6.0752 6.3767 6.3767 6.3767 6.3767 6.8053 6.8053 6.8053 6.8053 7.0293 7.0293 7.0293 7.0293 7.3152 7.3152 7.3152 7.3152 7.9434 7.9434 7.9434 7.9434 8.4211 8.4211 8.4211 8.4211 8.5789 8.5789 8.5789 8.5789 9.2762 9.2762 9.2762 9.2762 9.3918 9.3918 9.3918 9.3918 9.5641 9.5641 9.5641 9.5641 10.5356 10.5356 10.5356 10.5356 10.9231 10.9231 10.9231 10.9231 10.9860 10.9860 10.9860 10.9860 11.2217 11.2217 11.2217 11.2217 11.4205 11.4205 11.4205 11.4205 11.5099 11.5099 k = 0.4359 0.3997 0.7141 ( 14616 PWs) bands (ev): -3.0694 -3.0694 -3.0694 -3.0694 0.0454 0.0454 0.0454 0.0454 0.2139 0.2139 0.2139 0.2139 0.3382 0.3382 0.3382 0.3382 4.5022 4.5022 4.5022 4.5022 5.2205 5.2205 5.2205 5.2205 5.6427 5.6427 5.6427 5.6427 5.7928 5.7928 5.7928 5.7928 6.0778 6.0778 6.0778 6.0778 6.3747 6.3747 6.3747 6.3747 6.8136 6.8136 6.8136 6.8136 7.0256 7.0256 7.0256 7.0256 7.2697 7.2697 7.2697 7.2697 7.9946 7.9946 7.9946 7.9946 8.4163 8.4163 8.4163 8.4163 8.5702 8.5702 8.5702 8.5702 9.2778 9.2778 9.2778 9.2778 9.3821 9.3821 9.3821 9.3821 9.5506 9.5506 9.5506 9.5506 10.5631 10.5631 10.5631 10.5631 10.9416 10.9416 10.9416 10.9416 10.9966 10.9966 10.9966 10.9966 11.2244 11.2244 11.2244 11.2244 11.3875 11.3875 11.3875 11.3875 11.4868 11.4868 k = 0.4231 0.4219 0.7141 ( 14608 PWs) bands (ev): -3.0691 -3.0691 -3.0691 -3.0691 0.0519 0.0519 0.0519 0.0519 0.2056 0.2056 0.2056 0.2056 0.3379 0.3379 0.3379 0.3379 4.5297 4.5297 4.5297 4.5297 5.1656 5.1656 5.1656 5.1656 5.6429 5.6429 5.6429 5.6429 5.8325 5.8325 5.8325 5.8325 6.0797 6.0797 6.0797 6.0797 6.3722 6.3722 6.3722 6.3722 6.8233 6.8233 6.8233 6.8233 7.0198 7.0198 7.0198 7.0198 7.2269 7.2269 7.2269 7.2269 8.0466 8.0466 8.0466 8.0466 8.4105 8.4105 8.4105 8.4105 8.5600 8.5600 8.5600 8.5600 9.2798 9.2798 9.2798 9.2798 9.3716 9.3716 9.3716 9.3716 9.5357 9.5357 9.5357 9.5357 10.5936 10.5936 10.5936 10.5936 10.9614 10.9614 10.9614 10.9614 11.0093 11.0093 11.0093 11.0093 11.2273 11.2273 11.2273 11.2273 11.3556 11.3556 11.3556 11.3556 11.4598 11.4598 k = 0.4103 0.4441 0.7141 ( 14602 PWs) bands (ev): -3.0689 -3.0689 -3.0689 -3.0689 0.0594 0.0594 0.0594 0.0594 0.1962 0.1962 0.1962 0.1962 0.3376 0.3376 0.3376 0.3376 4.5614 4.5614 4.5614 4.5614 5.1111 5.1111 5.1111 5.1111 5.6433 5.6433 5.6433 5.6433 5.8690 5.8690 5.8690 5.8690 6.0801 6.0801 6.0801 6.0801 6.3694 6.3694 6.3694 6.3694 6.8342 6.8342 6.8342 6.8342 7.0107 7.0107 7.0107 7.0107 7.1897 7.1897 7.1897 7.1897 8.0979 8.0979 8.0979 8.0979 8.4038 8.4038 8.4038 8.4038 8.5487 8.5487 8.5487 8.5487 9.2822 9.2822 9.2822 9.2822 9.3608 9.3608 9.3608 9.3608 9.5201 9.5201 9.5201 9.5201 10.6254 10.6254 10.6254 10.6254 10.9811 10.9811 10.9811 10.9811 11.0241 11.0241 11.0241 11.0241 11.2303 11.2303 11.2303 11.2303 11.3267 11.3267 11.3267 11.3267 11.4293 11.4293 k = 0.3974 0.4663 0.7141 ( 14580 PWs) bands (ev): -3.0686 -3.0686 -3.0686 -3.0686 0.0680 0.0680 0.0680 0.0680 0.1858 0.1858 0.1858 0.1858 0.3372 0.3372 0.3372 0.3372 4.5968 4.5968 4.5968 4.5968 5.0575 5.0575 5.0575 5.0575 5.6443 5.6443 5.6443 5.6443 5.9018 5.9018 5.9018 5.9018 6.0786 6.0786 6.0786 6.0786 6.3664 6.3664 6.3664 6.3664 6.8461 6.8461 6.8461 6.8461 6.9974 6.9974 6.9974 6.9974 7.1607 7.1607 7.1607 7.1607 8.1471 8.1471 8.1471 8.1471 8.3964 8.3964 8.3964 8.3964 8.5365 8.5365 8.5365 8.5365 9.2853 9.2853 9.2853 9.2853 9.3503 9.3503 9.3503 9.3503 9.5046 9.5046 9.5046 9.5046 10.6567 10.6567 10.6567 10.6567 10.9990 10.9990 10.9990 10.9990 11.0412 11.0412 11.0412 11.0412 11.2328 11.2328 11.2328 11.2328 11.3024 11.3024 11.3024 11.3024 11.3960 11.3960 k = 0.3846 0.4885 0.7141 ( 14582 PWs) bands (ev): -3.0683 -3.0683 -3.0683 -3.0683 0.0775 0.0775 0.0775 0.0775 0.1746 0.1746 0.1746 0.1746 0.3368 0.3368 0.3368 0.3368 4.6354 4.6354 4.6354 4.6354 5.0052 5.0052 5.0052 5.0052 5.6458 5.6458 5.6458 5.6458 5.9303 5.9303 5.9303 5.9303 6.0747 6.0747 6.0747 6.0747 6.3632 6.3632 6.3632 6.3632 6.8585 6.8585 6.8585 6.8585 6.9801 6.9801 6.9801 6.9801 7.1408 7.1408 7.1408 7.1408 8.1929 8.1929 8.1929 8.1929 8.3887 8.3887 8.3887 8.3887 8.5238 8.5238 8.5238 8.5238 9.2892 9.2892 9.2892 9.2892 9.3403 9.3403 9.3403 9.3403 9.4899 9.4899 9.4899 9.4899 10.6854 10.6854 10.6854 10.6854 11.0145 11.0145 11.0145 11.0145 11.0597 11.0597 11.0597 11.0597 11.2345 11.2345 11.2345 11.2345 11.2840 11.2840 11.2840 11.2840 11.3609 11.3609 k = 0.3718 0.5107 0.7141 ( 14574 PWs) bands (ev): -3.0681 -3.0681 -3.0681 -3.0681 0.0880 0.0880 0.0880 0.0880 0.1627 0.1627 0.1627 0.1627 0.3364 0.3364 0.3364 0.3364 4.6765 4.6765 4.6765 4.6765 4.9546 4.9546 4.9546 4.9546 5.6479 5.6479 5.6479 5.6479 5.9538 5.9538 5.9538 5.9538 6.0685 6.0685 6.0685 6.0685 6.3603 6.3603 6.3603 6.3603 6.8711 6.8711 6.8711 6.8711 6.9608 6.9608 6.9608 6.9608 7.1289 7.1289 7.1289 7.1289 8.2335 8.2335 8.2335 8.2335 8.3814 8.3814 8.3814 8.3814 8.5112 8.5112 8.5112 8.5112 9.2938 9.2938 9.2938 9.2938 9.3312 9.3312 9.3312 9.3312 9.4767 9.4767 9.4767 9.4767 10.7094 10.7094 10.7094 10.7094 11.0288 11.0288 11.0288 11.0288 11.0774 11.0774 11.0774 11.0774 11.2356 11.2356 11.2356 11.2356 11.2716 11.2716 11.2716 11.2716 11.3259 11.3259 k = 0.3590 0.5329 0.7141 ( 14568 PWs) bands (ev): -3.0680 -3.0680 -3.0680 -3.0680 0.0993 0.0993 0.0993 0.0993 0.1503 0.1503 0.1503 0.1503 0.3360 0.3360 0.3360 0.3360 4.7191 4.7191 4.7191 4.7191 4.9062 4.9062 4.9062 4.9062 5.6503 5.6503 5.6503 5.6503 5.9717 5.9717 5.9717 5.9717 6.0610 6.0610 6.0610 6.0610 6.3579 6.3579 6.3579 6.3579 6.8832 6.8832 6.8832 6.8832 6.9425 6.9425 6.9425 6.9425 7.1227 7.1227 7.1227 7.1227 8.2661 8.2661 8.2661 8.2661 8.3756 8.3756 8.3756 8.3756 8.4996 8.4996 8.4996 8.4996 9.2991 9.2991 9.2991 9.2991 9.3231 9.3231 9.3231 9.3231 9.4659 9.4659 9.4659 9.4659 10.7270 10.7270 10.7270 10.7270 11.0436 11.0436 11.0436 11.0436 11.0907 11.0907 11.0907 11.0907 11.2366 11.2366 11.2366 11.2367 11.2641 11.2641 11.2641 11.2641 11.2941 11.2941 k = 0.3462 0.5551 0.7141 ( 14576 PWs) bands (ev): -3.0678 -3.0678 -3.0678 -3.0678 0.1114 0.1114 0.1114 0.1114 0.1375 0.1375 0.1375 0.1375 0.3358 0.3358 0.3358 0.3358 4.7611 4.7611 4.7611 4.7611 4.8612 4.8612 4.8612 4.8612 5.6525 5.6525 5.6525 5.6525 5.9826 5.9826 5.9826 5.9826 6.0546 6.0546 6.0546 6.0546 6.3563 6.3563 6.3563 6.3563 6.8935 6.8935 6.8935 6.8935 6.9281 6.9281 6.9281 6.9281 7.1200 7.1200 7.1200 7.1200 8.2868 8.2868 8.2868 8.2868 8.3734 8.3734 8.3734 8.3734 8.4907 8.4907 8.4907 8.4907 9.3048 9.3048 9.3048 9.3048 9.3163 9.3163 9.3163 9.3163 9.4585 9.4585 9.4585 9.4585 10.7372 10.7372 10.7372 10.7372 11.0606 11.0606 11.0606 11.0606 11.0938 11.0938 11.0938 11.0938 11.2385 11.2385 11.2385 11.2385 11.2591 11.2591 11.2591 11.2594 11.2716 11.2716 k = 0.3333 0.5774 0.7141 ( 14574 PWs) bands (ev): -3.0678 -3.0678 -3.0678 -3.0678 0.1230 0.1230 0.1230 0.1230 0.1257 0.1257 0.1257 0.1257 0.3357 0.3357 0.3357 0.3357 4.7888 4.7888 4.7888 4.7888 4.8329 4.8329 4.8329 4.8329 5.6534 5.6534 5.6534 5.6534 5.9860 5.9860 5.9860 5.9860 6.0522 6.0522 6.0522 6.0522 6.3557 6.3557 6.3557 6.3557 6.8981 6.8981 6.8981 6.8981 6.9221 6.9221 6.9221 6.9221 7.1193 7.1193 7.1193 7.1193 8.2932 8.2932 8.2932 8.2932 8.3738 8.3738 8.3738 8.3738 8.4871 8.4871 8.4871 8.4871 9.3092 9.3092 9.3092 9.3092 9.3118 9.3118 9.3118 9.3118 9.4557 9.4557 9.4557 9.4557 10.7403 10.7403 10.7403 10.7403 11.0784 11.0784 11.0784 11.0784 11.0831 11.0831 11.0831 11.0831 11.2395 11.2395 11.2395 11.2395 11.2570 11.2570 11.2571 11.2571 11.2638 11.2638 k = 0.3333 0.5774 0.7141 ( 14574 PWs) bands (ev): -3.0678 -3.0678 -3.0678 -3.0678 0.1230 0.1230 0.1230 0.1230 0.1257 0.1257 0.1257 0.1257 0.3357 0.3357 0.3357 0.3357 4.7888 4.7888 4.7888 4.7888 4.8329 4.8329 4.8329 4.8329 5.6534 5.6534 5.6534 5.6534 5.9860 5.9860 5.9860 5.9860 6.0522 6.0522 6.0522 6.0522 6.3557 6.3557 6.3557 6.3557 6.8981 6.8981 6.8981 6.8981 6.9221 6.9221 6.9221 6.9221 7.1193 7.1193 7.1193 7.1193 8.2932 8.2932 8.2932 8.2932 8.3738 8.3738 8.3738 8.3738 8.4871 8.4871 8.4871 8.4871 9.3092 9.3092 9.3092 9.3092 9.3118 9.3118 9.3118 9.3118 9.4557 9.4557 9.4557 9.4557 10.7403 10.7403 10.7403 10.7403 11.0784 11.0784 11.0784 11.0784 11.0831 11.0831 11.0831 11.0831 11.2395 11.2395 11.2395 11.2395 11.2570 11.2570 11.2571 11.2572 11.2638 11.2638 k = 0.3200 0.5543 0.7141 ( 14574 PWs) bands (ev): -3.0678 -3.0678 -3.0678 -3.0678 0.1105 0.1105 0.1105 0.1105 0.1384 0.1384 0.1384 0.1384 0.3358 0.3358 0.3358 0.3358 4.7610 4.7610 4.7610 4.7610 4.8610 4.8610 4.8610 4.8610 5.6519 5.6519 5.6519 5.6519 5.9841 5.9841 5.9841 5.9841 6.0543 6.0543 6.0543 6.0543 6.3564 6.3564 6.3564 6.3564 6.8948 6.8948 6.8948 6.8948 6.9266 6.9266 6.9266 6.9266 7.1198 7.1198 7.1198 7.1198 8.2883 8.2883 8.2883 8.2883 8.3709 8.3709 8.3709 8.3709 8.4913 8.4913 8.4913 8.4913 9.3057 9.3057 9.3057 9.3057 9.3151 9.3151 9.3151 9.3151 9.4593 9.4593 9.4593 9.4593 10.7377 10.7377 10.7377 10.7377 11.0509 11.0509 11.0509 11.0509 11.1042 11.1042 11.1042 11.1042 11.2385 11.2385 11.2385 11.2385 11.2577 11.2577 11.2578 11.2580 11.2718 11.2718 k = 0.3067 0.5312 0.7141 ( 14566 PWs) bands (ev): -3.0680 -3.0680 -3.0680 -3.0680 0.0968 0.0968 0.0968 0.0968 0.1530 0.1530 0.1530 0.1530 0.3362 0.3362 0.3362 0.3362 4.7212 4.7212 4.7212 4.7212 4.9006 4.9006 4.9006 4.9006 5.6469 5.6469 5.6469 5.6469 5.9825 5.9825 5.9825 5.9825 6.0592 6.0592 6.0592 6.0592 6.3585 6.3585 6.3585 6.3585 6.8904 6.8904 6.8904 6.8904 6.9340 6.9340 6.9340 6.9340 7.1210 7.1210 7.1210 7.1210 8.2768 8.2768 8.2768 8.2768 8.3606 8.3606 8.3606 8.3606 8.5019 8.5019 8.5019 8.5019 9.3022 9.3022 9.3022 9.3022 9.3172 9.3172 9.3172 9.3172 9.4707 9.4707 9.4707 9.4707 10.7313 10.7313 10.7313 10.7313 11.0107 11.0107 11.0107 11.0107 11.1284 11.1284 11.1284 11.1284 11.2347 11.2347 11.2347 11.2347 11.2620 11.2620 11.2621 11.2623 11.2898 11.2898 k = 0.2933 0.5081 0.7141 ( 14550 PWs) bands (ev): -3.0683 -3.0683 -3.0683 -3.0683 0.0832 0.0832 0.0832 0.0832 0.1681 0.1681 0.1681 0.1681 0.3369 0.3369 0.3369 0.3369 4.6826 4.6826 4.6826 4.6826 4.9365 4.9365 4.9365 4.9365 5.6383 5.6383 5.6383 5.6383 5.9855 5.9855 5.9855 5.9855 6.0660 6.0660 6.0660 6.0660 6.3621 6.3621 6.3621 6.3621 6.8872 6.8872 6.8872 6.8872 6.9403 6.9403 6.9403 6.9403 7.1228 7.1228 7.1228 7.1228 8.2617 8.2617 8.2617 8.2617 8.3440 8.3440 8.3440 8.3440 8.5147 8.5147 8.5147 8.5147 9.2995 9.2995 9.2995 9.2995 9.3168 9.3168 9.3168 9.3168 9.4905 9.4905 9.4905 9.4905 10.7234 10.7234 10.7234 10.7234 10.9657 10.9657 10.9657 10.9657 11.1512 11.1512 11.1512 11.1512 11.2288 11.2288 11.2288 11.2288 11.2700 11.2700 11.2700 11.2701 11.3129 11.3129 k = 0.2800 0.4850 0.7141 ( 14566 PWs) bands (ev): -3.0687 -3.0687 -3.0687 -3.0687 0.0698 0.0698 0.0698 0.0698 0.1835 0.1835 0.1835 0.1835 0.3380 0.3380 0.3380 0.3380 4.6463 4.6463 4.6463 4.6463 4.9653 4.9653 4.9653 4.9653 5.6277 5.6277 5.6277 5.6277 5.9932 5.9932 5.9932 5.9932 6.0763 6.0763 6.0763 6.0763 6.3673 6.3673 6.3673 6.3673 6.8848 6.8848 6.8848 6.8848 6.9441 6.9441 6.9441 6.9441 7.1257 7.1257 7.1257 7.1257 8.2443 8.2443 8.2443 8.2443 8.3229 8.3229 8.3229 8.3229 8.5266 8.5266 8.5266 8.5266 9.2974 9.2974 9.2974 9.2974 9.3144 9.3144 9.3144 9.3144 9.5182 9.5182 9.5182 9.5182 10.7156 10.7156 10.7156 10.7156 10.9189 10.9189 10.9189 10.9189 11.1691 11.1691 11.1691 11.1691 11.2231 11.2231 11.2231 11.2231 11.2810 11.2810 11.2810 11.2810 11.3390 11.3390 k = 0.2667 0.4619 0.7141 ( 14594 PWs) bands (ev): -3.0692 -3.0692 -3.0692 -3.0692 0.0566 0.0566 0.0566 0.0566 0.1992 0.1992 0.1992 0.1992 0.3394 0.3394 0.3394 0.3394 4.6127 4.6127 4.6127 4.6127 4.9841 4.9841 4.9841 4.9841 5.6184 5.6184 5.6184 5.6184 6.0020 6.0020 6.0020 6.0020 6.0942 6.0942 6.0942 6.0942 6.3742 6.3742 6.3742 6.3742 6.8818 6.8818 6.8818 6.8818 6.9454 6.9454 6.9454 6.9454 7.1303 7.1303 7.1303 7.1303 8.2248 8.2248 8.2248 8.2248 8.2987 8.2987 8.2987 8.2987 8.5357 8.5357 8.5357 8.5357 9.2953 9.2953 9.2953 9.2953 9.3109 9.3109 9.3109 9.3109 9.5527 9.5527 9.5527 9.5527 10.7090 10.7090 10.7090 10.7090 10.8726 10.8726 10.8726 10.8726 11.1776 11.1776 11.1776 11.1776 11.2199 11.2199 11.2199 11.2199 11.2963 11.2963 11.2963 11.2963 11.3672 11.3672 k = 0.2533 0.4388 0.7141 ( 14586 PWs) bands (ev): -3.0699 -3.0699 -3.0699 -3.0699 0.0439 0.0439 0.0439 0.0439 0.2151 0.2151 0.2151 0.2151 0.3413 0.3413 0.3413 0.3413 4.5819 4.5819 4.5819 4.5819 4.9907 4.9907 4.9907 4.9907 5.6137 5.6137 5.6137 5.6137 6.0074 6.0074 6.0074 6.0074 6.1234 6.1234 6.1234 6.1234 6.3832 6.3832 6.3832 6.3832 6.8762 6.8762 6.8762 6.8762 6.9446 6.9446 6.9446 6.9446 7.1371 7.1371 7.1371 7.1371 8.2033 8.2033 8.2033 8.2033 8.2724 8.2724 8.2724 8.2724 8.5415 8.5415 8.5415 8.5415 9.2930 9.2930 9.2930 9.2930 9.3069 9.3069 9.3069 9.3069 9.5930 9.5930 9.5930 9.5930 10.7040 10.7040 10.7040 10.7040 10.8282 10.8282 10.8282 10.8282 11.1763 11.1763 11.1763 11.1763 11.2182 11.2182 11.2182 11.2182 11.3172 11.3172 11.3172 11.3172 11.3969 11.3969 k = 0.2400 0.4157 0.7141 ( 14598 PWs) bands (ev): -3.0707 -3.0707 -3.0707 -3.0707 0.0316 0.0316 0.0316 0.0316 0.2310 0.2310 0.2310 0.2310 0.3437 0.3437 0.3437 0.3437 4.5540 4.5540 4.5540 4.5540 4.9841 4.9841 4.9841 4.9841 5.6164 5.6164 5.6164 5.6164 6.0080 6.0080 6.0080 6.0080 6.1638 6.1638 6.1638 6.1638 6.3948 6.3948 6.3948 6.3948 6.8661 6.8661 6.8661 6.8661 6.9430 6.9430 6.9430 6.9430 7.1465 7.1465 7.1465 7.1465 8.1793 8.1793 8.1793 8.1793 8.2448 8.2448 8.2448 8.2448 8.5436 8.5436 8.5436 8.5436 9.2901 9.2901 9.2901 9.2901 9.3029 9.3029 9.3029 9.3029 9.6379 9.6379 9.6379 9.6379 10.7003 10.7003 10.7003 10.7003 10.7878 10.7878 10.7878 10.7878 11.1695 11.1695 11.1695 11.1695 11.2136 11.2136 11.2136 11.2136 11.3436 11.3436 11.3436 11.3436 11.4278 11.4278 k = 0.2267 0.3926 0.7141 ( 14606 PWs) bands (ev): -3.0716 -3.0716 -3.0716 -3.0716 0.0198 0.0198 0.0198 0.0198 0.2469 0.2469 0.2469 0.2469 0.3465 0.3465 0.3465 0.3465 4.5289 4.5289 4.5289 4.5289 4.9650 4.9650 4.9650 4.9650 5.6273 5.6273 5.6273 5.6273 6.0050 6.0050 6.0050 6.0050 6.2122 6.2122 6.2122 6.2122 6.4100 6.4100 6.4100 6.4100 6.8501 6.8501 6.8501 6.8501 6.9421 6.9421 6.9421 6.9421 7.1583 7.1583 7.1583 7.1583 8.1522 8.1522 8.1522 8.1522 8.2169 8.2169 8.2169 8.2169 8.5422 8.5422 8.5422 8.5422 9.2865 9.2865 9.2865 9.2865 9.2992 9.2992 9.2992 9.2992 9.6861 9.6861 9.6861 9.6861 10.6953 10.6953 10.6953 10.6953 10.7550 10.7550 10.7550 10.7550 11.1608 11.1608 11.1608 11.1608 11.2043 11.2043 11.2043 11.2043 11.3741 11.3741 11.3741 11.3741 11.4597 11.4597 k = 0.2133 0.3695 0.7141 ( 14586 PWs) bands (ev): -3.0726 -3.0726 -3.0726 -3.0726 0.0086 0.0086 0.0086 0.0086 0.2625 0.2625 0.2625 0.2625 0.3497 0.3497 0.3497 0.3497 4.5068 4.5068 4.5068 4.5068 4.9353 4.9353 4.9353 4.9353 5.6457 5.6457 5.6457 5.6457 5.9997 5.9997 5.9997 5.9997 6.2640 6.2640 6.2640 6.2640 6.4308 6.4308 6.4308 6.4308 6.8286 6.8286 6.8286 6.8286 6.9421 6.9421 6.9421 6.9421 7.1722 7.1722 7.1722 7.1722 8.1212 8.1212 8.1212 8.1212 8.1897 8.1897 8.1897 8.1897 8.5373 8.5373 8.5373 8.5373 9.2824 9.2824 9.2824 9.2824 9.2956 9.2956 9.2956 9.2956 9.7363 9.7363 9.7363 9.7363 10.6828 10.6828 10.6828 10.6828 10.7369 10.7369 10.7369 10.7369 11.1506 11.1506 11.1506 11.1506 11.1909 11.1909 11.1909 11.1909 11.4077 11.4077 11.4077 11.4078 11.4924 11.4924 k = 0.2000 0.3464 0.7141 ( 14582 PWs) bands (ev): -3.0737 -3.0737 -3.0737 -3.0737 -0.0020 -0.0020 -0.0020 -0.0020 0.2778 0.2778 0.2778 0.2778 0.3534 0.3534 0.3534 0.3534 4.4874 4.4874 4.4874 4.4874 4.8977 4.8977 4.8977 4.8977 5.6702 5.6702 5.6702 5.6702 5.9931 5.9931 5.9931 5.9931 6.3127 6.3127 6.3127 6.3127 6.4612 6.4612 6.4612 6.4612 6.8027 6.8027 6.8027 6.8027 6.9432 6.9432 6.9432 6.9432 7.1879 7.1879 7.1879 7.1879 8.0859 8.0859 8.0859 8.0859 8.1636 8.1636 8.1636 8.1636 8.5290 8.5290 8.5290 8.5290 9.2781 9.2781 9.2781 9.2781 9.2920 9.2920 9.2920 9.2920 9.7869 9.7869 9.7869 9.7869 10.6627 10.6627 10.6627 10.6627 10.7345 10.7345 10.7345 10.7345 11.1371 11.1371 11.1371 11.1371 11.1767 11.1767 11.1767 11.1767 11.4433 11.4433 11.4433 11.4433 11.5257 11.5257 k = 0.1867 0.3233 0.7141 ( 14578 PWs) bands (ev): -3.0750 -3.0750 -3.0750 -3.0750 -0.0121 -0.0121 -0.0121 -0.0121 0.2928 0.2928 0.2928 0.2928 0.3575 0.3575 0.3575 0.3575 4.4708 4.4708 4.4708 4.4708 4.8548 4.8548 4.8548 4.8548 5.6990 5.6990 5.6990 5.6990 5.9858 5.9858 5.9858 5.9858 6.3519 6.3519 6.3519 6.3519 6.5044 6.5044 6.5044 6.5044 6.7751 6.7751 6.7751 6.7751 6.9452 6.9452 6.9452 6.9452 7.2051 7.2051 7.2051 7.2051 8.0468 8.0468 8.0468 8.0468 8.1386 8.1386 8.1386 8.1386 8.5174 8.5174 8.5174 8.5174 9.2738 9.2738 9.2738 9.2738 9.2882 9.2882 9.2882 9.2882 9.8361 9.8361 9.8361 9.8361 10.6436 10.6436 10.6436 10.6436 10.7400 10.7400 10.7400 10.7400 11.1169 11.1169 11.1169 11.1169 11.1664 11.1664 11.1664 11.1664 11.4796 11.4796 11.4796 11.4796 11.5592 11.5592 k = 0.1733 0.3002 0.7141 ( 14576 PWs) bands (ev): -3.0762 -3.0762 -3.0762 -3.0762 -0.0215 -0.0215 -0.0215 -0.0215 0.3071 0.3071 0.3071 0.3071 0.3619 0.3619 0.3619 0.3619 4.4568 4.4568 4.4568 4.4568 4.8089 4.8089 4.8089 4.8089 5.7308 5.7308 5.7308 5.7308 5.9785 5.9785 5.9785 5.9785 6.3801 6.3801 6.3801 6.3801 6.5562 6.5562 6.5562 6.5562 6.7504 6.7504 6.7504 6.7504 6.9489 6.9489 6.9489 6.9489 7.2233 7.2233 7.2233 7.2233 8.0046 8.0046 8.0046 8.0046 8.1146 8.1146 8.1146 8.1146 8.5023 8.5023 8.5023 8.5023 9.2696 9.2696 9.2696 9.2696 9.2844 9.2844 9.2844 9.2844 9.8820 9.8820 9.8820 9.8820 10.6307 10.6307 10.6307 10.6307 10.7492 10.7492 10.7492 10.7492 11.0896 11.0896 11.0896 11.0896 11.1617 11.1617 11.1617 11.1617 11.5146 11.5146 11.5146 11.5146 11.5925 11.5925 k = 0.1600 0.2771 0.7141 ( 14596 PWs) bands (ev): -3.0776 -3.0776 -3.0776 -3.0776 -0.0302 -0.0302 -0.0302 -0.0302 0.3209 0.3209 0.3209 0.3209 0.3667 0.3667 0.3667 0.3667 4.4453 4.4453 4.4453 4.4453 4.7617 4.7617 4.7617 4.7617 5.7640 5.7640 5.7640 5.7640 5.9719 5.9719 5.9719 5.9719 6.4003 6.4003 6.4003 6.4003 6.5987 6.5987 6.5987 6.5987 6.7414 6.7414 6.7414 6.7414 6.9556 6.9556 6.9556 6.9556 7.2423 7.2423 7.2423 7.2423 7.9599 7.9599 7.9599 7.9599 8.0912 8.0912 8.0912 8.0912 8.4838 8.4838 8.4838 8.4838 9.2655 9.2655 9.2655 9.2655 9.2805 9.2805 9.2805 9.2805 9.9226 9.9226 9.9226 9.9226 10.6264 10.6264 10.6264 10.6264 10.7604 10.7604 10.7604 10.7604 11.0575 11.0575 11.0575 11.0575 11.1617 11.1617 11.1617 11.1617 11.5450 11.5450 11.5450 11.5450 11.6238 11.6238 k = 0.1467 0.2540 0.7141 ( 14596 PWs) bands (ev): -3.0789 -3.0789 -3.0789 -3.0789 -0.0383 -0.0383 -0.0383 -0.0383 0.3339 0.3339 0.3339 0.3339 0.3716 0.3716 0.3716 0.3716 4.4360 4.4360 4.4360 4.4360 4.7148 4.7148 4.7148 4.7148 5.7974 5.7974 5.7974 5.7974 5.9669 5.9669 5.9669 5.9669 6.4154 6.4154 6.4154 6.4154 6.6059 6.6059 6.6059 6.6059 6.7677 6.7677 6.7677 6.7677 6.9689 6.9689 6.9689 6.9689 7.2618 7.2618 7.2618 7.2618 7.9136 7.9136 7.9136 7.9136 8.0684 8.0684 8.0684 8.0684 8.4615 8.4615 8.4615 8.4615 9.2617 9.2617 9.2617 9.2617 9.2767 9.2767 9.2767 9.2767 9.9561 9.9561 9.9561 9.9561 10.6317 10.6317 10.6317 10.6317 10.7725 10.7725 10.7725 10.7725 11.0227 11.0227 11.0227 11.0227 11.1656 11.1656 11.1656 11.1656 11.5632 11.5632 11.5632 11.5632 11.6465 11.6465 k = 0.1333 0.2309 0.7141 ( 14594 PWs) bands (ev): -3.0802 -3.0802 -3.0802 -3.0802 -0.0457 -0.0457 -0.0457 -0.0457 0.3461 0.3461 0.3461 0.3461 0.3766 0.3766 0.3766 0.3766 4.4288 4.4288 4.4288 4.4288 4.6692 4.6692 4.6692 4.6692 5.8289 5.8289 5.8289 5.8289 5.9650 5.9650 5.9650 5.9650 6.4264 6.4264 6.4264 6.4264 6.5856 6.5856 6.5856 6.5856 6.8136 6.8136 6.8136 6.8136 6.9953 6.9953 6.9953 6.9953 7.2815 7.2815 7.2815 7.2815 7.8665 7.8665 7.8665 7.8665 8.0461 8.0461 8.0461 8.0461 8.4354 8.4354 8.4354 8.4354 9.2582 9.2582 9.2582 9.2582 9.2731 9.2731 9.2731 9.2731 9.9818 9.9818 9.9818 9.9818 10.6469 10.6469 10.6469 10.6469 10.7848 10.7848 10.7848 10.7848 10.9871 10.9871 10.9871 10.9871 11.1733 11.1733 11.1733 11.1733 11.5598 11.5598 11.5598 11.5598 11.6564 11.6565 k = 0.1200 0.2078 0.7141 ( 14586 PWs) bands (ev): -3.0815 -3.0815 -3.0815 -3.0815 -0.0524 -0.0524 -0.0524 -0.0524 0.3574 0.3574 0.3574 0.3574 0.3817 0.3817 0.3817 0.3817 4.4235 4.4235 4.4235 4.4235 4.6259 4.6259 4.6259 4.6259 5.8556 5.8556 5.8556 5.8556 5.9688 5.9688 5.9688 5.9688 6.4332 6.4332 6.4332 6.4332 6.5572 6.5572 6.5572 6.5572 6.8523 6.8523 6.8523 6.8523 7.0418 7.0418 7.0418 7.0418 7.3011 7.3011 7.3011 7.3011 7.8196 7.8196 7.8196 7.8196 8.0244 8.0244 8.0244 8.0244 8.4050 8.4050 8.4050 8.4050 9.2549 9.2549 9.2549 9.2549 9.2698 9.2698 9.2698 9.2698 9.9996 9.9996 9.9996 9.9996 10.6706 10.6706 10.6706 10.6706 10.7960 10.7960 10.7960 10.7960 10.9523 10.9523 10.9523 10.9523 11.1851 11.1851 11.1851 11.1851 11.5405 11.5405 11.5405 11.5405 11.6674 11.6675 k = 0.1067 0.1848 0.7141 ( 14578 PWs) bands (ev): -3.0828 -3.0828 -3.0828 -3.0828 -0.0584 -0.0584 -0.0584 -0.0584 0.3676 0.3676 0.3676 0.3676 0.3867 0.3867 0.3867 0.3867 4.4197 4.4197 4.4197 4.4197 4.5855 4.5855 4.5855 4.5855 5.8740 5.8740 5.8740 5.8740 5.9815 5.9815 5.9815 5.9815 6.4351 6.4351 6.4351 6.4351 6.5284 6.5284 6.5284 6.5284 6.8777 6.8777 6.8777 6.8777 7.1070 7.1070 7.1070 7.1070 7.3206 7.3206 7.3206 7.3206 7.7743 7.7743 7.7743 7.7743 8.0036 8.0036 8.0036 8.0036 8.3702 8.3702 8.3702 8.3702 9.2518 9.2518 9.2518 9.2518 9.2668 9.2668 9.2668 9.2668 10.0105 10.0105 10.0105 10.0105 10.7004 10.7004 10.7004 10.7004 10.8044 10.8044 10.8044 10.8044 10.9211 10.9211 10.9211 10.9211 11.2013 11.2013 11.2013 11.2013 11.5176 11.5176 11.5176 11.5176 11.6752 11.6752 k = 0.0933 0.1617 0.7141 ( 14578 PWs) bands (ev): -3.0840 -3.0840 -3.0840 -3.0840 -0.0638 -0.0638 -0.0638 -0.0638 0.3768 0.3768 0.3768 0.3768 0.3915 0.3915 0.3915 0.3915 4.4172 4.4172 4.4172 4.4172 4.5488 4.5488 4.5488 4.5488 5.8831 5.8831 5.8831 5.8831 6.0036 6.0036 6.0036 6.0036 6.4309 6.4309 6.4309 6.4309 6.5030 6.5030 6.5030 6.5030 6.8955 6.8955 6.8955 6.8955 7.1811 7.1811 7.1811 7.1811 7.3396 7.3396 7.3396 7.3396 7.7324 7.7324 7.7324 7.7324 7.9838 7.9838 7.9838 7.9838 8.3307 8.3307 8.3307 8.3307 9.2491 9.2491 9.2491 9.2491 9.2642 9.2642 9.2642 9.2642 10.0160 10.0160 10.0160 10.0160 10.7328 10.7328 10.7328 10.7328 10.8069 10.8069 10.8069 10.8069 10.8976 10.8976 10.8976 10.8976 11.2225 11.2225 11.2225 11.2225 11.4963 11.4963 11.4963 11.4963 11.6758 11.6758 k = 0.0800 0.1386 0.7141 ( 14590 PWs) bands (ev): -3.0850 -3.0850 -3.0850 -3.0850 -0.0684 -0.0684 -0.0684 -0.0684 0.3847 0.3847 0.3847 0.3847 0.3961 0.3961 0.3961 0.3961 4.4156 4.4156 4.4156 4.4156 4.5162 4.5162 4.5162 4.5162 5.8861 5.8861 5.8861 5.8861 6.0313 6.0313 6.0313 6.0313 6.4205 6.4205 6.4205 6.4205 6.4825 6.4825 6.4825 6.4825 6.9108 6.9108 6.9108 6.9108 7.2548 7.2548 7.2548 7.2548 7.3585 7.3585 7.3585 7.3585 7.6971 7.6971 7.6971 7.6971 7.9655 7.9655 7.9655 7.9655 8.2864 8.2864 8.2864 8.2864 9.2466 9.2466 9.2466 9.2466 9.2619 9.2619 9.2619 9.2619 10.0177 10.0177 10.0177 10.0177 10.7615 10.7615 10.7615 10.7615 10.8030 10.8030 10.8030 10.8030 10.8861 10.8861 10.8861 10.8861 11.2488 11.2488 11.2488 11.2488 11.4787 11.4787 11.4787 11.4787 11.6693 11.6693 k = 0.0667 0.1155 0.7141 ( 14594 PWs) bands (ev): -3.0860 -3.0860 -3.0860 -3.0860 -0.0723 -0.0723 -0.0723 -0.0723 0.3914 0.3914 0.3914 0.3914 0.4003 0.4003 0.4003 0.4003 4.4145 4.4145 4.4145 4.4145 4.4882 4.4882 4.4882 4.4882 5.8862 5.8862 5.8862 5.8862 6.0607 6.0607 6.0607 6.0607 6.4062 6.4062 6.4062 6.4062 6.4657 6.4657 6.4657 6.4657 6.9257 6.9257 6.9257 6.9257 7.3179 7.3179 7.3179 7.3179 7.3785 7.3785 7.3785 7.3785 7.6739 7.6739 7.6739 7.6739 7.9492 7.9492 7.9492 7.9492 8.2373 8.2373 8.2373 8.2373 9.2445 9.2445 9.2445 9.2445 9.2600 9.2600 9.2600 9.2600 10.0170 10.0170 10.0170 10.0170 10.7667 10.7667 10.7667 10.7667 10.8118 10.8118 10.8118 10.8118 10.8851 10.8851 10.8851 10.8851 11.2806 11.2806 11.2806 11.2806 11.4654 11.4654 11.4654 11.4654 11.6574 11.6574 k = 0.0533 0.0924 0.7141 ( 14596 PWs) bands (ev): -3.0868 -3.0868 -3.0868 -3.0868 -0.0755 -0.0755 -0.0755 -0.0755 0.3968 0.3968 0.3968 0.3968 0.4040 0.4040 0.4040 0.4040 4.4136 4.4136 4.4136 4.4136 4.4654 4.4654 4.4654 4.4654 5.8851 5.8851 5.8851 5.8851 6.0890 6.0890 6.0890 6.0890 6.3922 6.3922 6.3922 6.3922 6.4500 6.4500 6.4500 6.4500 6.9409 6.9409 6.9409 6.9409 7.3578 7.3578 7.3578 7.3578 7.4020 7.4020 7.4020 7.4020 7.6716 7.6716 7.6716 7.6716 7.9353 7.9353 7.9353 7.9353 8.1837 8.1837 8.1837 8.1837 9.2428 9.2428 9.2428 9.2428 9.2585 9.2585 9.2585 9.2585 10.0151 10.0151 10.0151 10.0151 10.7515 10.7515 10.7515 10.7515 10.8343 10.8343 10.8343 10.8343 10.8891 10.8891 10.8891 10.8891 11.3172 11.3172 11.3172 11.3172 11.4565 11.4565 11.4565 11.4565 11.6426 11.6426 k = 0.0400 0.0693 0.7141 ( 14594 PWs) bands (ev): -3.0874 -3.0874 -3.0874 -3.0874 -0.0780 -0.0780 -0.0780 -0.0780 0.4008 0.4008 0.4008 0.4008 0.4072 0.4072 0.4072 0.4072 4.4121 4.4121 4.4121 4.4121 4.4485 4.4485 4.4485 4.4485 5.8838 5.8838 5.8838 5.8838 6.1139 6.1139 6.1139 6.1139 6.3817 6.3817 6.3817 6.3817 6.4342 6.4342 6.4342 6.4342 6.9554 6.9554 6.9554 6.9554 7.3755 7.3755 7.3755 7.3755 7.4202 7.4202 7.4202 7.4202 7.6965 7.6965 7.6965 7.6965 7.9250 7.9250 7.9250 7.9250 8.1261 8.1261 8.1261 8.1261 9.2415 9.2415 9.2415 9.2415 9.2573 9.2573 9.2573 9.2573 10.0128 10.0128 10.0128 10.0128 10.7349 10.7349 10.7349 10.7349 10.8540 10.8540 10.8540 10.8540 10.8945 10.8945 10.8945 10.8945 11.3570 11.3570 11.3570 11.3570 11.4514 11.4514 11.4514 11.4514 11.6271 11.6271 k = 0.0267 0.0462 0.7141 ( 14578 PWs) bands (ev): -3.0879 -3.0879 -3.0879 -3.0879 -0.0798 -0.0798 -0.0798 -0.0798 0.4036 0.4036 0.4036 0.4036 0.4097 0.4097 0.4097 0.4097 4.4097 4.4097 4.4097 4.4097 4.4377 4.4377 4.4377 4.4377 5.8827 5.8827 5.8827 5.8827 6.1335 6.1335 6.1335 6.1335 6.3767 6.3767 6.3767 6.3767 6.4184 6.4184 6.4184 6.4184 6.9679 6.9679 6.9679 6.9679 7.3822 7.3822 7.3822 7.3822 7.4267 7.4267 7.4267 7.4267 7.7414 7.7414 7.7414 7.7414 7.9200 7.9200 7.9200 7.9200 8.0660 8.0660 8.0660 8.0660 9.2405 9.2405 9.2405 9.2405 9.2565 9.2565 9.2565 9.2565 10.0108 10.0108 10.0108 10.0108 10.7216 10.7216 10.7216 10.7216 10.8679 10.8679 10.8679 10.8679 10.8996 10.8996 10.8996 10.8996 11.3966 11.3966 11.3966 11.3966 11.4490 11.4490 11.4490 11.4490 11.6129 11.6129 k = 0.0133 0.0231 0.7141 ( 14566 PWs) bands (ev): -3.0881 -3.0881 -3.0881 -3.0881 -0.0809 -0.0809 -0.0809 -0.0809 0.4052 0.4052 0.4052 0.4052 0.4113 0.4113 0.4113 0.4113 4.4071 4.4071 4.4071 4.4071 4.4325 4.4325 4.4325 4.4325 5.8820 5.8820 5.8820 5.8820 6.1460 6.1460 6.1460 6.1460 6.3775 6.3775 6.3775 6.3775 6.4043 6.4043 6.4043 6.4043 6.9764 6.9764 6.9764 6.9764 7.3833 7.3833 7.3833 7.3833 7.4283 7.4283 7.4283 7.4283 7.7873 7.7873 7.7873 7.7873 7.9255 7.9255 7.9255 7.9255 8.0071 8.0071 8.0071 8.0071 9.2399 9.2399 9.2399 9.2399 9.2560 9.2560 9.2560 9.2560 10.0095 10.0095 10.0095 10.0095 10.7133 10.7133 10.7133 10.7133 10.8757 10.8757 10.8757 10.8757 10.9035 10.9035 10.9035 10.9035 11.4294 11.4295 11.4295 11.4295 11.4481 11.4481 11.4481 11.4481 11.6017 11.6017 k = 0.0000 0.0000 0.7141 ( 14558 PWs) bands (ev): -3.0882 -3.0882 -3.0882 -3.0882 -0.0813 -0.0813 -0.0813 -0.0813 0.4057 0.4057 0.4057 0.4057 0.4118 0.4118 0.4118 0.4118 4.4059 4.4059 4.4059 4.4059 4.4310 4.4310 4.4310 4.4310 5.8817 5.8817 5.8817 5.8817 6.1503 6.1503 6.1503 6.1503 6.3801 6.3801 6.3801 6.3801 6.3970 6.3970 6.3970 6.3970 6.9795 6.9795 6.9795 6.9795 7.3829 7.3829 7.3829 7.3829 7.4286 7.4286 7.4286 7.4286 7.8079 7.8079 7.8079 7.8079 7.9443 7.9443 7.9443 7.9443 7.9659 7.9659 7.9659 7.9659 9.2397 9.2397 9.2397 9.2397 9.2559 9.2559 9.2559 9.2559 10.0090 10.0090 10.0090 10.0090 10.7104 10.7104 10.7104 10.7104 10.8782 10.8782 10.8782 10.8782 10.9050 10.9050 10.9050 10.9050 11.4453 11.4453 11.4453 11.4453 11.4458 11.4458 11.4458 11.4458 11.5969 11.5969 k = 0.5000 0.2887 0.7141 ( 14632 PWs) bands (ev): -3.0700 -3.0700 -3.0700 -3.0700 0.0305 0.0305 0.0305 0.0305 0.2339 0.2339 0.2339 0.2339 0.3387 0.3387 0.3387 0.3387 4.4374 4.4374 4.4374 4.4374 5.4378 5.4378 5.4378 5.4378 5.5902 5.5902 5.5902 5.5902 5.6631 5.6631 5.6631 5.6631 6.0679 6.0679 6.0679 6.0679 6.3804 6.3804 6.3804 6.3804 6.7901 6.7901 6.7901 6.7901 7.0339 7.0339 7.0339 7.0339 7.4389 7.4389 7.4389 7.4389 7.8133 7.8133 7.8133 7.8133 8.4299 8.4299 8.4299 8.4299 8.5953 8.5953 8.5953 8.5953 9.2736 9.2736 9.2736 9.2736 9.4121 9.4121 9.4121 9.4121 9.5915 9.5915 9.5915 9.5915 10.4803 10.4803 10.4803 10.4803 10.8854 10.8854 10.8854 10.8854 10.9660 10.9660 10.9660 10.9660 11.2164 11.2164 11.2164 11.2164 11.5068 11.5068 11.5068 11.5068 11.5549 11.5549 k = 0.5000 0.2887 0.6877 ( 14636 PWs) bands (ev): -3.1131 -3.1131 -3.0261 -3.0261 -0.0216 -0.0216 0.0829 0.0829 0.2020 0.2020 0.2622 0.2622 0.3167 0.3167 0.3629 0.3629 4.4131 4.4131 4.4643 4.4643 5.4187 5.4187 5.4402 5.4402 5.5847 5.5847 5.6119 5.6119 5.6448 5.6448 5.6778 5.6778 6.0418 6.0418 6.0914 6.0914 6.2894 6.2894 6.4819 6.4819 6.7884 6.7884 6.7939 6.7939 7.0269 7.0269 7.0424 7.0424 7.4080 7.4080 7.4675 7.4675 7.7704 7.7704 7.8593 7.8593 8.4202 8.4202 8.4334 8.4334 8.5659 8.5659 8.6198 8.6198 9.2557 9.2557 9.2917 9.2917 9.4051 9.4051 9.4260 9.4260 9.5518 9.5518 9.6332 9.6332 10.4199 10.4199 10.5403 10.5403 10.8169 10.8169 10.9119 10.9119 10.9707 10.9707 10.9890 10.9890 11.1575 11.1575 11.2771 11.2771 11.4894 11.4894 11.5073 11.5073 11.5262 11.5262 k = 0.5000 0.2887 0.6612 ( 14616 PWs) bands (ev): -3.1554 -3.1554 -2.9816 -2.9816 -0.0733 -0.0733 0.1353 0.1353 0.1690 0.1690 0.2702 0.2702 0.3137 0.3137 0.3870 0.3870 4.3917 4.3917 4.4933 4.4933 5.3904 5.3904 5.4248 5.4248 5.5981 5.5981 5.6200 5.6200 5.6463 5.6463 5.6832 5.6832 6.0126 6.0126 6.1125 6.1125 6.2184 6.2184 6.5873 6.5873 6.7888 6.7888 6.8004 6.8004 7.0216 7.0216 7.0525 7.0525 7.3764 7.3764 7.4897 7.4897 7.7355 7.7355 7.9060 7.9060 8.4052 8.4052 8.4296 8.4296 8.5339 8.5339 8.6374 8.6374 9.2378 9.2378 9.3099 9.3099 9.4073 9.4073 9.4444 9.4444 9.5145 9.5145 9.6767 9.6767 10.3606 10.3606 10.5962 10.5962 10.7458 10.7458 10.8804 10.8804 10.9928 10.9928 11.0120 11.0120 11.1220 11.1220 11.3345 11.3345 11.4630 11.4630 11.4845 11.4845 11.5322 11.5322 k = 0.5000 0.2887 0.6348 ( 14608 PWs) bands (ev): -3.1966 -3.1966 -2.9365 -2.9365 -0.1243 -0.1243 0.1353 0.1353 0.1877 0.1877 0.2501 0.2501 0.3373 0.3373 0.4104 0.4104 4.3736 4.3736 4.5241 4.5241 5.3581 5.3581 5.3998 5.3998 5.6009 5.6009 5.6228 5.6228 5.6560 5.6560 5.6914 5.6914 5.9822 5.9822 6.1289 6.1289 6.1783 6.1783 6.6898 6.6898 6.7909 6.7909 6.8120 6.8120 7.0183 7.0183 7.0643 7.0643 7.3452 7.3452 7.4984 7.4984 7.7163 7.7163 7.9518 7.9518 8.3858 8.3858 8.4178 8.4178 8.5017 8.5017 8.6468 8.6468 9.2200 9.2200 9.3281 9.3281 9.4203 9.4203 9.4620 9.4620 9.4826 9.4826 9.7217 9.7217 10.3033 10.3033 10.6281 10.6281 10.6903 10.6903 10.8436 10.8436 10.9609 10.9609 11.0206 11.0206 11.1403 11.1403 11.3844 11.3844 11.4433 11.4433 11.4708 11.4708 11.5362 11.5362 k = 0.5000 0.2887 0.6083 ( 14606 PWs) bands (ev): -3.2368 -3.2368 -2.8910 -2.8910 -0.1745 -0.1745 0.1015 0.1015 0.2242 0.2242 0.2398 0.2398 0.3650 0.3650 0.4328 0.4328 4.3590 4.3590 4.5562 4.5562 5.3243 5.3243 5.3713 5.3713 5.5752 5.5752 5.6241 5.6241 5.6531 5.6531 5.7235 5.7235 5.9555 5.9555 6.1361 6.1361 6.1755 6.1755 6.7706 6.7706 6.7947 6.7947 6.8430 6.8430 7.0181 7.0181 7.0778 7.0778 7.3148 7.3148 7.4870 7.4870 7.7203 7.7203 7.9955 7.9955 8.3628 8.3628 8.3980 8.3980 8.4708 8.4708 8.6483 8.6483 9.2022 9.2022 9.3459 9.3459 9.4413 9.4413 9.4455 9.4455 9.4913 9.4913 9.7681 9.7681 10.2487 10.2487 10.5839 10.5839 10.6834 10.6834 10.8268 10.8268 10.8963 10.8963 11.0272 11.0272 11.1639 11.1639 11.4151 11.4151 11.4466 11.4466 11.4769 11.4769 11.5350 11.5350 k = 0.5000 0.2887 0.5819 ( 14612 PWs) bands (ev): -3.2758 -3.2758 -2.8452 -2.8452 -0.2236 -0.2236 0.0678 0.0678 0.1973 0.1973 0.2911 0.2911 0.3925 0.3925 0.4540 0.4540 4.3482 4.3482 4.5892 4.5892 5.2905 5.2905 5.3421 5.3421 5.5213 5.5213 5.5979 5.5979 5.6846 5.6846 5.7579 5.7579 5.9346 5.9346 6.1450 6.1450 6.1942 6.1942 6.7987 6.7987 6.8035 6.8035 6.9132 6.9132 7.0257 7.0257 7.0930 7.0930 7.2858 7.2858 7.4584 7.4584 7.7452 7.7452 8.0358 8.0358 8.3370 8.3370 8.3719 8.3719 8.4410 8.4410 8.6435 8.6435 9.1843 9.1843 9.3617 9.3617 9.4129 9.4129 9.4785 9.4785 9.5136 9.5136 9.8154 9.8154 10.1972 10.1972 10.5190 10.5190 10.6505 10.6505 10.8143 10.8143 10.8616 10.8616 11.0317 11.0317 11.1628 11.1628 11.4150 11.4150 11.4829 11.4829 11.5113 11.5113 11.5282 11.5282 k = 0.5000 0.2887 0.5554 ( 14606 PWs) bands (ev): -3.3136 -3.3136 -2.7993 -2.7993 -0.2716 -0.2716 0.0343 0.0343 0.1701 0.1701 0.3418 0.3418 0.4189 0.4189 0.4740 0.4740 4.3413 4.3413 4.6227 4.6227 5.2572 5.2572 5.3130 5.3130 5.4410 5.4410 5.5878 5.5878 5.7167 5.7167 5.7907 5.7907 5.9176 5.9176 6.1599 6.1599 6.2233 6.2233 6.8045 6.8045 6.8181 6.8181 6.9687 6.9687 7.0607 7.0607 7.1096 7.1096 7.2590 7.2590 7.4210 7.4210 7.7831 7.7831 8.0717 8.0717 8.3095 8.3095 8.3425 8.3425 8.4111 8.4111 8.6354 8.6354 9.1664 9.1664 9.3646 9.3646 9.3961 9.3961 9.5147 9.5147 9.5419 9.5419 9.8633 9.8633 10.1496 10.1496 10.4556 10.4556 10.5922 10.5922 10.7408 10.7408 10.9059 10.9059 11.0355 11.0355 11.1420 11.1420 11.4033 11.4033 11.5157 11.5157 11.5463 11.5463 11.5518 11.5518 k = 0.5000 0.2887 0.5290 ( 14600 PWs) bands (ev): -3.3500 -3.3500 -2.7535 -2.7535 -0.3183 -0.3183 0.0012 0.0012 0.1429 0.1429 0.3914 0.3914 0.4439 0.4439 0.4927 0.4927 4.3384 4.3384 4.6562 4.6562 5.2238 5.2238 5.2835 5.2835 5.3532 5.3532 5.5859 5.5859 5.7479 5.7479 5.8208 5.8208 5.9037 5.9037 6.1741 6.1741 6.2632 6.2632 6.8100 6.8100 6.8301 6.8301 6.9866 6.9866 7.1193 7.1193 7.1352 7.1352 7.2359 7.2359 7.3818 7.3818 7.8278 7.8278 8.1014 8.1014 8.2810 8.2810 8.3123 8.3123 8.3803 8.3803 8.6281 8.6281 9.1486 9.1486 9.3422 9.3422 9.4039 9.4039 9.5380 9.5380 9.5882 9.5882 9.9110 9.9110 10.1063 10.1063 10.3964 10.3964 10.5240 10.5240 10.6642 10.6642 10.9554 10.9554 11.0405 11.0405 11.1125 11.1125 11.3904 11.3904 11.5003 11.5003 11.5879 11.5879 11.6228 11.6228 k = 0.5000 0.2887 0.5025 ( 14594 PWs) bands (ev): -3.3851 -3.3851 -2.7079 -2.7079 -0.3636 -0.3636 -0.0314 -0.0314 0.1159 0.1159 0.4398 0.4398 0.4673 0.4673 0.5101 0.5101 4.3395 4.3395 4.6895 4.6895 5.1843 5.1843 5.2466 5.2466 5.2789 5.2789 5.5897 5.5897 5.7762 5.7762 5.8479 5.8479 5.8941 5.8941 6.1839 6.1839 6.3126 6.3126 6.8152 6.8152 6.8409 6.8409 6.9927 6.9927 7.1335 7.1335 7.2004 7.2004 7.2200 7.2200 7.3481 7.3481 7.8749 7.8749 8.1228 8.1228 8.2520 8.2520 8.2841 8.2841 8.3494 8.3494 8.6261 8.6261 9.1308 9.1308 9.3145 9.3145 9.4152 9.4152 9.5516 9.5516 9.6462 9.6462 9.9574 9.9574 10.0684 10.0684 10.3430 10.3430 10.4514 10.4514 10.5892 10.5892 10.9983 10.9983 11.0472 11.0472 11.0832 11.0832 11.3780 11.3780 11.4845 11.4845 11.6172 11.6172 11.7042 11.7042 k = 0.5000 0.2887 0.4761 ( 14598 PWs) bands (ev): -3.4187 -3.4187 -2.6626 -2.6626 -0.4073 -0.4073 -0.0631 -0.0631 0.0894 0.0894 0.4862 0.4862 0.4894 0.4894 0.5260 0.5260 4.3444 4.3444 4.7221 4.7221 5.1200 5.1200 5.2007 5.2007 5.2426 5.2426 5.5985 5.5985 5.7981 5.7981 5.8721 5.8721 5.8925 5.8925 6.1887 6.1887 6.3687 6.3687 6.8198 6.8198 6.8505 6.8505 6.9961 6.9961 7.1326 7.1326 7.2059 7.2059 7.2572 7.2572 7.3346 7.3346 7.9206 7.9206 8.1327 8.1327 8.2219 8.2219 8.2601 8.2601 8.3212 8.3212 8.6348 8.6348 9.1132 9.1132 9.2864 9.2864 9.4241 9.4241 9.5586 9.5586 9.7097 9.7097 10.0000 10.0000 10.0376 10.0376 10.2962 10.2962 10.3772 10.3772 10.5191 10.5191 11.0279 11.0279 11.0372 11.0372 11.0783 11.0783 11.3665 11.3665 11.4726 11.4726 11.6360 11.6360 11.7846 11.7846 k = 0.5000 0.2887 0.4496 ( 14590 PWs) bands (ev): -3.4508 -3.4508 -2.6180 -2.6180 -0.4492 -0.4492 -0.0939 -0.0939 0.0634 0.0634 0.5087 0.5087 0.5322 0.5322 0.5405 0.5405 4.3528 4.3528 4.7536 4.7536 5.0348 5.0348 5.1705 5.1705 5.2183 5.2183 5.6115 5.6115 5.8101 5.8101 5.8930 5.8930 5.9032 5.9032 6.1884 6.1884 6.4286 6.4286 6.8234 6.8234 6.8588 6.8588 6.9980 6.9980 7.1202 7.1202 7.1893 7.1893 7.2885 7.2885 7.3574 7.3574 7.9616 7.9616 8.1285 8.1285 8.1903 8.1903 8.2401 8.2401 8.3006 8.3006 8.6588 8.6588 9.0959 9.0959 9.2585 9.2585 9.4286 9.4286 9.5587 9.5587 9.7758 9.7758 10.0116 10.0116 10.0385 10.0385 10.2561 10.2561 10.3037 10.3037 10.4585 10.4585 11.0086 11.0086 11.0473 11.0473 11.0937 11.0937 11.3564 11.3564 11.4701 11.4701 11.6407 11.6407 11.8336 11.8336 k = 0.5000 0.2887 0.4232 ( 14618 PWs) bands (ev): -3.4813 -3.4813 -2.5741 -2.5741 -0.4894 -0.4894 -0.1237 -0.1237 0.0382 0.0382 0.5268 0.5268 0.5536 0.5536 0.5756 0.5756 4.3639 4.3639 4.7839 4.7839 4.9472 4.9472 5.1476 5.1476 5.1982 5.1982 5.6280 5.6280 5.8147 5.8147 5.9084 5.9084 5.9270 5.9270 6.1827 6.1827 6.4903 6.4903 6.8255 6.8255 6.8662 6.8662 6.9972 6.9972 7.1018 7.1018 7.1659 7.1659 7.3173 7.3173 7.3924 7.3924 7.9959 7.9959 8.1102 8.1102 8.1599 8.1599 8.2197 8.2197 8.2912 8.2912 8.7008 8.7008 9.0789 9.0789 9.2311 9.2311 9.4281 9.4281 9.5514 9.5514 9.8415 9.8415 9.9982 9.9982 10.0596 10.0596 10.2144 10.2144 10.2418 10.2418 10.4155 10.4155 10.9799 10.9799 11.0627 11.0627 11.1022 11.1022 11.3481 11.3481 11.4807 11.4807 11.6300 11.6300 11.8182 11.8182 k = 0.5000 0.2887 0.3967 ( 14626 PWs) bands (ev): -3.5102 -3.5102 -2.5312 -2.5312 -0.5276 -0.5276 -0.1523 -0.1523 0.0139 0.0139 0.5432 0.5432 0.5654 0.5654 0.6171 0.6171 4.3764 4.3764 4.8125 4.8125 4.8638 4.8638 5.1275 5.1275 5.1823 5.1823 5.6469 5.6469 5.8179 5.8179 5.9211 5.9211 5.9561 5.9561 6.1715 6.1715 6.5516 6.5516 6.8255 6.8255 6.8733 6.8733 6.9909 6.9909 7.0807 7.0807 7.1453 7.1453 7.3505 7.3505 7.4211 7.4211 8.0236 8.0236 8.0799 8.0799 8.1349 8.1349 8.1982 8.1982 8.2901 8.2901 8.7607 8.7607 9.0624 9.0624 9.2042 9.2042 9.4218 9.4218 9.5363 9.5363 9.9020 9.9020 9.9954 9.9954 10.0581 10.0581 10.1514 10.1514 10.2141 10.2141 10.3997 10.3997 10.9534 10.9534 11.0693 11.0693 11.1077 11.1077 11.3422 11.3422 11.5044 11.5044 11.6055 11.6055 11.7932 11.7932 k = 0.5000 0.2887 0.3703 ( 14620 PWs) bands (ev): -3.5375 -3.5375 -2.4896 -2.4896 -0.5638 -0.5638 -0.1796 -0.1796 -0.0095 -0.0095 0.5577 0.5577 0.5758 0.5758 0.6565 0.6565 4.3878 4.3878 4.7889 4.7889 4.8394 4.8394 5.1088 5.1088 5.1710 5.1710 5.6671 5.6671 5.8241 5.8241 5.9317 5.9317 5.9869 5.9869 6.1547 6.1547 6.6101 6.6101 6.8226 6.8226 6.8815 6.8815 6.9758 6.9758 7.0615 7.0615 7.1323 7.1323 7.3819 7.3819 7.4430 7.4430 8.0316 8.0316 8.0571 8.0571 8.1167 8.1167 8.1777 8.1777 8.2925 8.2925 8.8358 8.8358 9.0464 9.0464 9.1779 9.1779 9.4099 9.4099 9.5141 9.5141 9.9442 9.9442 10.0044 10.0044 10.0329 10.0329 10.0938 10.0938 10.2035 10.2035 10.4137 10.4137 10.9295 10.9295 11.0563 11.0563 11.1247 11.1247 11.3391 11.3391 11.5348 11.5348 11.5730 11.5730 11.7705 11.7705 k = 0.5000 0.2887 0.3438 ( 14628 PWs) bands (ev): -3.5630 -3.5630 -2.4494 -2.4494 -0.5978 -0.5978 -0.2054 -0.2054 -0.0317 -0.0317 0.5706 0.5706 0.5850 0.5850 0.6935 0.6935 4.3936 4.3936 4.7277 4.7277 4.8640 4.8640 5.0907 5.0907 5.1645 5.1645 5.6876 5.6876 5.8354 5.8354 5.9405 5.9405 6.0182 6.0182 6.1322 6.1322 6.6631 6.6631 6.8155 6.8155 6.8925 6.8925 6.9521 6.9521 7.0477 7.0477 7.1261 7.1261 7.3983 7.3983 7.4684 7.4684 7.9930 7.9930 8.0728 8.0728 8.1073 8.1073 8.1598 8.1598 8.2961 8.2961 8.9217 8.9217 9.0312 9.0312 9.1524 9.1524 9.3929 9.3929 9.4862 9.4862 9.9484 9.9484 9.9853 9.9853 10.0054 10.0054 10.0916 10.0916 10.2043 10.2043 10.4498 10.4498 10.9084 10.9084 11.0322 11.0322 11.1493 11.1493 11.3397 11.3397 11.5192 11.5192 11.5837 11.5837 11.7517 11.7517 k = 0.5000 0.2887 0.3174 ( 14640 PWs) bands (ev): -3.5868 -3.5868 -2.4108 -2.4108 -0.6297 -0.6297 -0.2298 -0.2298 -0.0527 -0.0527 0.5818 0.5818 0.5930 0.5930 0.7280 0.7280 4.3871 4.3871 4.6874 4.6874 4.8863 4.8863 5.0731 5.0731 5.1627 5.1627 5.7078 5.7078 5.8522 5.8522 5.9481 5.9481 6.0491 6.0491 6.1045 6.1045 6.7068 6.7068 6.8026 6.8026 6.9083 6.9083 6.9252 6.9252 7.0392 7.0392 7.1245 7.1245 7.3927 7.3927 7.5034 7.5034 7.9497 7.9497 8.0778 8.0778 8.1172 8.1172 8.1455 8.1455 8.3010 8.3010 9.0078 9.0078 9.0226 9.0226 9.1280 9.1280 9.3717 9.3717 9.4542 9.4542 9.9063 9.9063 9.9305 9.9305 10.0085 10.0085 10.1340 10.1340 10.2153 10.2153 10.4992 10.4992 10.8900 10.8900 11.0053 11.0053 11.1765 11.1765 11.3451 11.3451 11.4701 11.4701 11.6243 11.6243 11.7372 11.7372 k = 0.5000 0.2887 0.2909 ( 14648 PWs) bands (ev): -3.6088 -3.6088 -2.3742 -2.3742 -0.6593 -0.6593 -0.2525 -0.2525 -0.0724 -0.0724 0.5915 0.5915 0.5999 0.5999 0.7600 0.7600 4.3631 4.3631 4.6731 4.6731 4.9060 4.9060 5.0562 5.0562 5.1650 5.1650 5.7280 5.7280 5.8729 5.8729 5.9558 5.9558 6.0723 6.0723 6.0793 6.0793 6.7363 6.7363 6.7834 6.7834 6.9011 6.9011 6.9297 6.9297 7.0351 7.0351 7.1256 7.1256 7.3719 7.3719 7.5416 7.5416 7.9072 7.9072 8.0747 8.0747 8.1296 8.1296 8.1455 8.1455 8.3084 8.3084 9.0015 9.0015 9.0989 9.0989 9.1144 9.1144 9.3475 9.3475 9.4198 9.4198 9.8493 9.8493 9.8739 9.8739 10.0242 10.0242 10.1768 10.1768 10.2368 10.2368 10.5563 10.5563 10.8742 10.8742 10.9803 10.9803 11.2033 11.2033 11.3555 11.3555 11.4172 11.4172 11.6661 11.6661 11.7271 11.7271 k = 0.5000 0.2887 0.2645 ( 14650 PWs) bands (ev): -3.6291 -3.6291 -2.3397 -2.3397 -0.6865 -0.6865 -0.2735 -0.2735 -0.0907 -0.0907 0.5998 0.5998 0.6058 0.6058 0.7894 0.7894 4.3242 4.3242 4.6824 4.6824 4.9230 4.9230 5.0403 5.0403 5.1709 5.1709 5.7493 5.7493 5.8935 5.8935 5.9658 5.9658 6.0374 6.0374 6.1082 6.1082 6.7374 6.7374 6.7712 6.7712 6.8825 6.8825 6.9537 6.9537 7.0365 7.0365 7.1283 7.1283 7.3419 7.3419 7.5780 7.5780 7.8671 7.8671 8.0737 8.0737 8.1231 8.1231 8.1685 8.1685 8.3211 8.3211 8.9885 8.9885 9.0811 9.0811 9.1999 9.1999 9.3215 9.3215 9.3847 9.3847 9.7905 9.7905 9.8235 9.8235 10.0429 10.0429 10.2118 10.2118 10.2664 10.2664 10.6180 10.6180 10.8605 10.8605 10.9605 10.9605 11.2271 11.2271 11.3442 11.3442 11.3916 11.3916 11.7066 11.7066 11.7215 11.7215 k = 0.5000 0.2887 0.2380 ( 14622 PWs) bands (ev): -3.6474 -3.6474 -2.3076 -2.3076 -0.7113 -0.7113 -0.2928 -0.2928 -0.1074 -0.1074 0.6068 0.6068 0.6108 0.6108 0.8160 0.8160 4.2779 4.2779 4.7076 4.7076 4.9373 4.9373 5.0254 5.0254 5.1798 5.1798 5.7723 5.7723 5.9060 5.9060 5.9782 5.9782 6.0070 6.0070 6.1357 6.1357 6.7059 6.7059 6.7736 6.7736 6.8692 6.8692 6.9736 6.9736 7.0457 7.0457 7.1325 7.1325 7.3068 7.3068 7.6100 7.6100 7.8305 7.8305 8.0767 8.0767 8.1187 8.1187 8.1888 8.1888 8.3415 8.3415 8.9761 8.9761 9.0604 9.0604 9.2776 9.2776 9.2961 9.2961 9.3501 9.3501 9.7329 9.7329 9.7858 9.7858 10.0623 10.0623 10.2415 10.2415 10.2973 10.2973 10.6822 10.6822 10.8487 10.8487 10.9481 10.9481 11.2460 11.2460 11.2887 11.2887 11.4182 11.4182 11.7202 11.7202 11.7448 11.7448 k = 0.5000 0.2887 0.2116 ( 14628 PWs) bands (ev): -3.6639 -3.6639 -2.2781 -2.2781 -0.7337 -0.7337 -0.3102 -0.3102 -0.1227 -0.1227 0.6125 0.6125 0.6150 0.6150 0.8399 0.8399 4.2300 4.2300 4.7424 4.7424 4.9491 4.9491 5.0119 5.0119 5.1909 5.1909 5.7975 5.7975 5.9005 5.9005 5.9659 5.9659 6.0180 6.0180 6.1614 6.1614 6.6661 6.6661 6.7714 6.7714 6.8601 6.8601 6.9849 6.9849 7.0596 7.0596 7.1400 7.1400 7.2703 7.2703 7.6361 7.6361 7.7982 7.7982 8.0829 8.0829 8.1187 8.1187 8.2029 8.2029 8.3709 8.3709 8.9644 8.9644 9.0411 9.0411 9.2676 9.2676 9.3169 9.3169 9.3383 9.3383 9.6779 9.6779 9.7696 9.7696 10.0814 10.0814 10.2672 10.2672 10.3258 10.3258 10.7474 10.7474 10.8384 10.8384 10.9441 10.9441 11.2224 11.2224 11.2667 11.2667 11.4566 11.4566 11.7233 11.7233 11.7797 11.7797 k = 0.5000 0.2887 0.1851 ( 14646 PWs) bands (ev): -3.6786 -3.6786 -2.2515 -2.2515 -0.7535 -0.7535 -0.3257 -0.3257 -0.1362 -0.1362 0.6172 0.6172 0.6185 0.6185 0.8610 0.8610 4.1843 4.1843 4.7828 4.7828 4.9584 4.9584 4.9997 4.9997 5.2036 5.2036 5.8245 5.8245 5.8718 5.8718 5.9549 5.9549 6.0502 6.0502 6.1851 6.1851 6.6235 6.6235 6.7631 6.7631 6.8541 6.8541 6.9905 6.9905 7.0676 7.0676 7.1534 7.1534 7.2369 7.2369 7.6554 7.6554 7.7711 7.7711 8.0896 8.0896 8.1254 8.1254 8.2114 8.2114 8.4072 8.4072 8.9536 8.9536 9.0237 9.0237 9.2423 9.2423 9.2865 9.2865 9.3663 9.3663 9.6266 9.6266 9.7832 9.7832 10.0994 10.0994 10.2855 10.2855 10.3547 10.3547 10.8120 10.8120 10.8296 10.8296 10.9479 10.9479 11.1592 11.1592 11.2812 11.2812 11.4999 11.4999 11.7300 11.7300 11.8108 11.8108 k = 0.5000 0.2887 0.1587 ( 14638 PWs) bands (ev): -3.6913 -3.6913 -2.2279 -2.2279 -0.7708 -0.7708 -0.3392 -0.3392 -0.1481 -0.1481 0.6206 0.6206 0.6217 0.6217 0.8793 0.8793 4.1426 4.1426 4.8261 4.8261 4.9657 4.9657 4.9889 4.9889 5.2171 5.2171 5.8269 5.8269 5.8567 5.8567 5.9518 5.9518 6.0866 6.0866 6.2064 6.2064 6.5801 6.5801 6.7500 6.7500 6.8503 6.8503 6.9935 6.9935 7.0631 7.0631 7.1695 7.1695 7.2131 7.2131 7.6676 7.6676 7.7500 7.7500 8.0942 8.0942 8.1394 8.1394 8.2164 8.2164 8.4474 8.4474 8.9437 8.9437 9.0082 9.0082 9.2186 9.2186 9.2593 9.2593 9.3647 9.3647 9.5798 9.5798 9.8247 9.8247 10.1156 10.1156 10.2925 10.2925 10.3883 10.3883 10.8222 10.8222 10.8745 10.8745 10.9573 10.9573 11.0949 11.0949 11.2963 11.2963 11.5436 11.5436 11.7393 11.7393 11.8377 11.8377 k = 0.5000 0.2887 0.1322 ( 14620 PWs) bands (ev): -3.7021 -3.7021 -2.2076 -2.2076 -0.7855 -0.7855 -0.3507 -0.3507 -0.1583 -0.1583 0.6230 0.6230 0.6245 0.6245 0.8948 0.8948 4.1062 4.1062 4.8700 4.8700 4.9712 4.9712 4.9798 4.9798 5.2305 5.2305 5.7826 5.7826 5.8856 5.8856 5.9512 5.9512 6.1240 6.1240 6.2251 6.2251 6.5371 6.5371 6.7340 6.7340 6.8480 6.8480 6.9949 6.9949 7.0480 7.0480 7.1726 7.1726 7.2122 7.2122 7.6728 7.6728 7.7356 7.7356 8.0974 8.0974 8.1580 8.1580 8.2193 8.2193 8.4887 8.4887 8.9347 8.9347 8.9948 8.9948 9.1973 9.1973 9.2359 9.2359 9.3441 9.3441 9.5383 9.5383 9.8828 9.8828 10.1296 10.1296 10.2888 10.2888 10.4273 10.4273 10.8162 10.8162 10.9329 10.9329 10.9699 10.9699 11.0310 11.0310 11.3117 11.3117 11.5832 11.5832 11.7494 11.7494 11.8602 11.8602 k = 0.5000 0.2887 0.1058 ( 14622 PWs) bands (ev): -3.7109 -3.7109 -2.1907 -2.1907 -0.7976 -0.7976 -0.3602 -0.3602 -0.1666 -0.1666 0.6247 0.6247 0.6268 0.6268 0.9074 0.9074 4.0756 4.0756 4.9122 4.9122 4.9721 4.9721 4.9756 4.9756 5.2431 5.2431 5.7382 5.7382 5.9142 5.9142 5.9520 5.9520 6.1605 6.1605 6.2410 6.2410 6.4955 6.4955 6.7170 6.7170 6.8465 6.8465 6.9933 6.9933 7.0293 7.0293 7.1650 7.1650 7.2277 7.2277 7.6720 7.6720 7.7278 7.7278 8.0999 8.0999 8.1778 8.1778 8.2211 8.2211 8.5282 8.5282 8.9269 8.9269 8.9836 8.9836 9.1790 9.1790 9.2165 9.2165 9.3155 9.3155 9.5031 9.5031 9.9459 9.9459 10.1413 10.1413 10.2773 10.2773 10.4701 10.4701 10.8114 10.8114 10.9677 10.9677 10.9800 10.9800 10.9885 10.9885 11.3270 11.3270 11.6143 11.6143 11.7570 11.7570 11.8787 11.8788 k = 0.5000 0.2887 0.0793 ( 14618 PWs) bands (ev): -3.7178 -3.7178 -2.1774 -2.1774 -0.8070 -0.8070 -0.3676 -0.3676 -0.1731 -0.1731 0.6260 0.6260 0.6284 0.6284 0.9173 0.9173 4.0515 4.0515 4.9492 4.9492 4.9663 4.9663 4.9795 4.9795 5.2541 5.2541 5.6979 5.6979 5.9364 5.9364 5.9572 5.9572 6.1947 6.1947 6.2537 6.2537 6.4566 6.4566 6.7008 6.7008 6.8455 6.8455 6.9845 6.9845 7.0169 7.0169 7.1585 7.1585 7.2433 7.2433 7.6680 7.6680 7.7245 7.7245 8.1021 8.1021 8.1961 8.1961 8.2222 8.2222 8.5634 8.5634 8.9205 8.9205 8.9748 8.9748 9.1643 9.1643 9.2013 9.2013 9.2864 9.2864 9.4748 9.4748 10.0069 10.0069 10.1504 10.1504 10.2601 10.2601 10.5151 10.5151 10.8077 10.8077 10.9082 10.9082 10.9928 10.9928 11.0307 11.0307 11.3415 11.3415 11.6342 11.6342 11.7592 11.7592 11.8947 11.9005 k = 0.5000 0.2887 0.0529 ( 14624 PWs) bands (ev): -3.7227 -3.7227 -2.1678 -2.1678 -0.8137 -0.8137 -0.3729 -0.3729 -0.1778 -0.1778 0.6268 0.6268 0.6296 0.6296 0.9243 0.9243 4.0340 4.0340 4.9617 4.9617 4.9726 4.9726 4.9895 4.9895 5.2626 5.2626 5.6650 5.6650 5.9439 5.9439 5.9724 5.9724 6.2246 6.2246 6.2633 6.2633 6.4225 6.4225 6.6873 6.6873 6.8448 6.8448 6.9704 6.9704 7.0131 7.0131 7.1544 7.1544 7.2553 7.2553 7.6637 7.6637 7.7233 7.7233 8.1039 8.1039 8.2107 8.2107 8.2229 8.2229 8.5916 8.5916 8.9156 8.9156 8.9685 8.9685 9.1534 9.1534 9.1904 9.1904 9.2616 9.2616 9.4540 9.4540 10.0614 10.0614 10.1568 10.1568 10.2390 10.2390 10.5597 10.5597 10.8044 10.8044 10.8538 10.8538 11.0013 11.0013 11.0644 11.0644 11.3537 11.3537 11.6441 11.6441 11.7560 11.7560 11.9078 11.9224 k = 0.5000 0.2887 0.0264 ( 14646 PWs) bands (ev): -3.7257 -3.7257 -2.1620 -2.1620 -0.8177 -0.8177 -0.3761 -0.3761 -0.1807 -0.1807 0.6273 0.6273 0.6303 0.6303 0.9285 0.9285 4.0235 4.0235 4.9592 4.9592 4.9772 4.9772 5.0064 5.0064 5.2681 5.2681 5.6431 5.6431 5.9453 5.9453 5.9863 5.9863 6.2465 6.2465 6.2700 6.2700 6.3968 6.3968 6.6782 6.6782 6.8445 6.8445 6.9593 6.9593 7.0124 7.0124 7.1521 7.1521 7.2626 7.2626 7.6608 7.6608 7.7228 7.7228 8.1051 8.1051 8.2200 8.2200 8.2233 8.2233 8.6100 8.6100 8.9126 8.9126 8.9647 8.9647 9.1467 9.1467 9.1838 9.1838 9.2450 9.2450 9.4413 9.4413 10.1049 10.1049 10.1603 10.1603 10.2165 10.2165 10.5979 10.5979 10.7964 10.7964 10.8155 10.8155 11.0064 11.0064 11.0857 11.0857 11.3620 11.3620 11.6478 11.6478 11.7514 11.7514 11.9163 11.9289 k = 0.5000 0.2887-0.0000 ( 14634 PWs) bands (ev): -3.7267 -3.7267 -2.1601 -2.1601 -0.8191 -0.8191 -0.3772 -0.3772 -0.1816 -0.1816 0.6275 0.6275 0.6305 0.6305 0.9299 0.9299 4.0199 4.0199 4.9584 4.9584 4.9779 4.9779 5.0132 5.0132 5.2700 5.2700 5.6355 5.6355 5.9456 5.9456 5.9914 5.9914 6.2546 6.2546 6.2729 6.2729 6.3866 6.3866 6.6749 6.6749 6.8444 6.8444 6.9552 6.9552 7.0124 7.0124 7.1514 7.1514 7.2651 7.2651 7.6597 7.6597 7.7227 7.7227 8.1055 8.1055 8.2229 8.2229 8.2238 8.2238 8.6164 8.6164 8.9116 8.9116 8.9634 8.9634 9.1445 9.1445 9.1816 9.1816 9.2392 9.2392 9.4371 9.4371 10.1253 10.1253 10.1607 10.1607 10.2040 10.2040 10.6152 10.6152 10.7833 10.7833 10.8088 10.8088 11.0081 11.0081 11.0930 11.0930 11.3649 11.3649 11.6485 11.6485 11.7493 11.7493 11.9185 11.9279 k = 0.3333 0.5774-0.0000 ( 14676 PWs) bands (ev): -3.7218 -3.7218 -2.1602 -2.1602 -0.6569 -0.6569 -0.6529 -0.6529 -0.1134 -0.1134 0.5587 0.5587 0.8305 0.8305 0.8334 0.8334 4.0125 4.0125 4.8097 4.8097 4.8112 4.8112 5.4106 5.4106 5.4171 5.4171 5.6450 5.6450 5.7289 5.7289 6.1700 6.1700 6.1824 6.1824 6.2177 6.2177 6.3671 6.3671 6.7464 6.7464 6.7735 6.7735 6.8657 6.8657 7.0790 7.0790 7.2061 7.2061 7.4851 7.4851 7.6820 7.6820 7.7593 7.7593 7.7621 7.7621 8.2106 8.2106 8.2746 8.2746 8.3065 8.3065 8.9657 8.9657 9.0838 9.0838 9.1407 9.1407 9.1833 9.1833 9.6890 9.6890 9.7525 9.7525 9.8047 9.8047 9.8393 9.8393 10.1511 10.1511 10.4823 10.4823 10.5676 10.5676 10.9195 10.9195 11.0549 11.0549 11.3322 11.3322 11.4293 11.4293 11.6403 11.6403 11.7673 11.7673 11.7727 11.7727 k = 0.3333 0.5774 0.0264 ( 14673 PWs) bands (ev): -3.7208 -3.7208 -2.1621 -2.1621 -0.6556 -0.6556 -0.6517 -0.6517 -0.1125 -0.1125 0.5587 0.5587 0.8296 0.8296 0.8325 0.8325 4.0163 4.0163 4.8075 4.8075 4.8086 4.8086 5.4109 5.4109 5.4176 5.4176 5.6464 5.6464 5.7293 5.7293 6.1517 6.1517 6.1819 6.1819 6.2157 6.2157 6.3832 6.3832 6.7469 6.7469 6.7736 6.7736 6.8668 6.8668 7.0832 7.0832 7.2103 7.2103 7.4832 7.4832 7.6819 7.6819 7.7569 7.7569 7.7613 7.7613 8.2098 8.2098 8.2725 8.2725 8.3039 8.3039 8.9665 8.9665 9.0862 9.0862 9.1428 9.1428 9.1852 9.1852 9.6907 9.6907 9.7541 9.7541 9.8051 9.8051 9.8394 9.8394 10.1425 10.1425 10.4828 10.4828 10.5676 10.5676 10.9209 10.9209 11.0557 11.0557 11.3234 11.3234 11.4286 11.4286 11.6502 11.6502 11.7558 11.7558 11.7597 11.7597 k = 0.3333 0.5774 0.0529 ( 14664 PWs) bands (ev): -3.7179 -3.7179 -2.1679 -2.1679 -0.6518 -0.6518 -0.6479 -0.6479 -0.1100 -0.1100 0.5586 0.5586 0.8269 0.8269 0.8298 0.8298 4.0276 4.0276 4.8008 4.8008 4.8009 4.8009 5.4117 5.4117 5.4190 5.4190 5.6502 5.6502 5.7304 5.7304 6.1116 6.1116 6.1764 6.1764 6.2099 6.2099 6.4211 6.4211 6.7485 6.7485 6.7743 6.7743 6.8700 6.8700 7.0955 7.0955 7.2229 7.2229 7.4776 7.4776 7.6815 7.6815 7.7497 7.7497 7.7588 7.7588 8.2074 8.2074 8.2663 8.2663 8.2966 8.2966 8.9689 8.9689 9.0932 9.0932 9.1487 9.1487 9.1907 9.1907 9.6961 9.6961 9.7592 9.7592 9.8063 9.8063 9.8399 9.8399 10.1171 10.1171 10.4844 10.4844 10.5674 10.5674 10.9240 10.9240 11.0584 11.0584 11.3001 11.3001 11.4262 11.4262 11.6771 11.6771 11.7217 11.7217 11.7249 11.7249 k = 0.3333 0.5774 0.0793 ( 14664 PWs) bands (ev): -3.7130 -3.7130 -2.1775 -2.1775 -0.6454 -0.6454 -0.6415 -0.6415 -0.1059 -0.1059 0.5583 0.5583 0.8224 0.8224 0.8253 0.8253 4.0464 4.0464 4.7883 4.7883 4.7902 4.7902 5.4132 5.4132 5.4215 5.4215 5.6558 5.6558 5.7317 5.7317 6.0626 6.0626 6.1667 6.1667 6.2007 6.2007 6.4669 6.4669 6.7510 6.7510 6.7757 6.7757 6.8748 6.8748 7.1156 7.1156 7.2435 7.2435 7.4684 7.4684 7.6805 7.6805 7.7383 7.7383 7.7546 7.7546 8.2038 8.2038 8.2566 8.2566 8.2848 8.2848 8.9728 8.9728 9.1047 9.1047 9.1581 9.1581 9.1993 9.1993 9.7051 9.7051 9.7675 9.7675 9.8083 9.8083 9.8410 9.8410 10.0764 10.0764 10.4868 10.4868 10.5670 10.5670 10.9264 10.9264 11.0646 11.0646 11.2683 11.2683 11.4221 11.4221 11.6707 11.6707 11.6749 11.6749 11.7158 11.7158 k = 0.3333 0.5774 0.1058 ( 14658 PWs) bands (ev): -3.7061 -3.7061 -2.1907 -2.1907 -0.6366 -0.6366 -0.6327 -0.6327 -0.1001 -0.1001 0.5579 0.5579 0.8161 0.8161 0.8189 0.8189 4.0725 4.0725 4.7717 4.7717 4.7760 4.7760 5.4154 5.4154 5.4252 5.4252 5.6626 5.6626 5.7326 5.7326 6.0107 6.0107 6.1539 6.1539 6.1890 6.1890 6.5139 6.5139 6.7542 6.7542 6.7784 6.7784 6.8808 6.8808 7.1426 7.1426 7.2716 7.2716 7.4560 7.4560 7.6781 7.6781 7.7236 7.7236 7.7483 7.7483 8.1994 8.1994 8.2440 8.2440 8.2693 8.2693 8.9782 8.9782 9.1206 9.1206 9.1702 9.1702 9.2102 9.2102 9.7178 9.7178 9.7790 9.7790 9.8113 9.8113 9.8430 9.8430 10.0223 10.0223 10.4899 10.4899 10.5663 10.5663 10.9247 10.9247 11.0756 11.0756 11.2326 11.2326 11.4172 11.4172 11.6103 11.6103 11.6167 11.6167 11.7613 11.7613 k = 0.3333 0.5774 0.1322 ( 14637 PWs) bands (ev): -3.6973 -3.6973 -2.2076 -2.2076 -0.6252 -0.6252 -0.6213 -0.6213 -0.0926 -0.0926 0.5573 0.5573 0.8079 0.8079 0.8106 0.8106 4.1058 4.1058 4.7520 4.7520 4.7589 4.7589 5.4184 5.4184 5.4301 5.4301 5.6695 5.6695 5.7323 5.7323 5.9585 5.9585 6.1390 6.1390 6.1756 6.1756 6.5585 6.5585 6.7577 6.7577 6.7828 6.7828 6.8875 6.8875 7.1753 7.1753 7.3065 7.3065 7.4410 7.4410 7.6720 7.6720 7.7083 7.7083 7.7397 7.7397 8.1946 8.1946 8.2298 8.2298 8.2509 8.2509 8.9853 8.9853 9.1403 9.1403 9.1840 9.1840 9.2222 9.2222 9.7341 9.7341 9.7930 9.7930 9.8155 9.8155 9.8470 9.8470 9.9576 9.9576 10.4934 10.4934 10.5652 10.5652 10.9164 10.9164 11.0910 11.0910 11.1970 11.1970 11.4126 11.4126 11.5467 11.5467 11.5553 11.5553 11.8099 11.8099 k = 0.3333 0.5774 0.1587 ( 14625 PWs) bands (ev): -3.6866 -3.6866 -2.2279 -2.2279 -0.6114 -0.6114 -0.6075 -0.6075 -0.0836 -0.0836 0.5564 0.5564 0.7977 0.7977 0.8004 0.8004 4.1462 4.1462 4.7300 4.7300 4.7398 4.7398 5.4218 5.4218 5.4360 5.4360 5.6759 5.6759 5.7301 5.7301 5.9075 5.9075 6.1230 6.1230 6.1615 6.1615 6.5982 6.5982 6.7613 6.7613 6.7892 6.7892 6.8947 6.8947 7.2120 7.2120 7.3474 7.3474 7.4246 7.4246 7.6583 7.6583 7.6968 7.6968 7.7282 7.7282 8.1893 8.1893 8.2149 8.2149 8.2309 8.2309 8.9939 8.9939 9.1635 9.1635 9.1985 9.1985 9.2344 9.2344 9.7523 9.7523 9.8077 9.8077 9.8213 9.8213 9.8552 9.8552 9.8859 9.8859 10.4971 10.4971 10.5633 10.5633 10.9009 10.9009 11.1036 11.1036 11.1688 11.1688 11.4101 11.4101 11.4839 11.4839 11.4953 11.4953 11.8546 11.8547 k = 0.3333 0.5774 0.1851 ( 14631 PWs) bands (ev): -3.6739 -3.6739 -2.2514 -2.2514 -0.5951 -0.5951 -0.5913 -0.5913 -0.0731 -0.0731 0.5551 0.5551 0.7855 0.7855 0.7882 0.7882 4.1935 4.1935 4.7066 4.7066 4.7194 4.7194 5.4251 5.4251 5.4426 5.4426 5.6813 5.6813 5.7252 5.7252 5.8589 5.8589 6.1070 6.1070 6.1477 6.1477 6.6310 6.6310 6.7648 6.7648 6.7974 6.7974 6.9017 6.9017 7.2497 7.2497 7.3934 7.3934 7.4096 7.4096 7.6375 7.6375 7.6898 7.6898 7.7136 7.7136 8.1835 8.1835 8.2008 8.2008 8.2104 8.2104 9.0041 9.0041 9.1899 9.1899 9.2126 9.2126 9.2454 9.2454 9.7596 9.7596 9.8156 9.8156 9.8194 9.8194 9.8360 9.8360 9.8714 9.8714 10.5007 10.5007 10.5607 10.5607 10.8788 10.8788 11.0934 11.0934 11.1655 11.1655 11.4098 11.4098 11.4250 11.4250 11.4418 11.4418 11.8855 11.8856 k = 0.3333 0.5774 0.2116 ( 14649 PWs) bands (ev): -3.6594 -3.6594 -2.2780 -2.2780 -0.5765 -0.5765 -0.5727 -0.5727 -0.0611 -0.0611 0.5534 0.5534 0.7713 0.7713 0.7739 0.7739 4.2473 4.2473 4.6828 4.6828 4.6986 4.6986 5.4273 5.4273 5.4494 5.4494 5.6856 5.6856 5.7167 5.7167 5.8138 5.8138 6.0919 6.0919 6.1351 6.1351 6.6557 6.6557 6.7679 6.7679 6.8066 6.8066 6.9080 6.9080 7.2821 7.2821 7.4023 7.4023 7.4436 7.4436 7.6140 7.6140 7.6838 7.6838 7.6953 7.6953 8.1762 8.1762 8.1887 8.1887 8.1913 8.1913 9.0159 9.0159 9.2187 9.2187 9.2253 9.2253 9.2544 9.2544 9.7030 9.7030 9.8077 9.8077 9.8262 9.8262 9.8538 9.8538 9.8976 9.8976 10.5043 10.5043 10.5574 10.5574 10.8512 10.8512 11.0641 11.0641 11.1799 11.1799 11.3719 11.3719 11.3822 11.3822 11.4298 11.4298 11.9103 11.9104 k = 0.3333 0.5774 0.2380 ( 14649 PWs) bands (ev): -3.6430 -3.6430 -2.3074 -2.3074 -0.5555 -0.5555 -0.5517 -0.5517 -0.0476 -0.0476 0.5511 0.5511 0.7549 0.7549 0.7575 0.7575 4.3074 4.3074 4.6595 4.6595 4.6782 4.6782 5.4273 5.4273 5.4553 5.4553 5.6895 5.6895 5.7035 5.7035 5.7743 5.7743 6.0786 6.0786 6.1244 6.1244 6.6721 6.6721 6.7705 6.7705 6.8150 6.8150 6.9127 6.9127 7.2986 7.2986 7.4131 7.4131 7.4967 7.4967 7.5916 7.5916 7.6733 7.6733 7.6768 7.6768 8.1651 8.1651 8.1767 8.1767 8.1800 8.1800 9.0293 9.0293 9.2355 9.2355 9.2491 9.2491 9.2608 9.2608 9.6197 9.6197 9.8150 9.8150 9.8295 9.8295 9.8867 9.8867 9.9324 9.9324 10.5079 10.5079 10.5537 10.5537 10.8193 10.8193 11.0315 11.0315 11.1930 11.1930 11.3263 11.3263 11.3402 11.3402 11.4505 11.4505 11.9344 11.9345 k = 0.3333 0.5774 0.2645 ( 14625 PWs) bands (ev): -3.6247 -3.6247 -2.3394 -2.3394 -0.5322 -0.5322 -0.5284 -0.5284 -0.0327 -0.0327 0.5482 0.5482 0.7364 0.7364 0.7389 0.7389 4.3733 4.3733 4.6374 4.6374 4.6592 4.6592 5.4236 5.4236 5.4589 5.4589 5.6839 5.6839 5.6940 5.6940 5.7436 5.7436 6.0674 6.0674 6.1160 6.1160 6.6801 6.6801 6.7724 6.7724 6.8205 6.8205 6.9149 6.9149 7.2984 7.2984 7.4407 7.4407 7.5498 7.5498 7.5744 7.5744 7.6493 7.6493 7.6681 7.6681 8.1501 8.1501 8.1674 8.1674 8.1756 8.1756 9.0443 9.0443 9.2427 9.2427 9.2620 9.2620 9.2824 9.2824 9.5340 9.5340 9.8195 9.8195 9.8301 9.8301 9.9299 9.9299 9.9743 9.9743 10.5120 10.5120 10.5501 10.5501 10.7845 10.7845 10.9999 10.9999 11.1995 11.1995 11.2891 11.2891 11.3052 11.3052 11.4842 11.4842 11.9576 11.9576 k = 0.3333 0.5774 0.2909 ( 14616 PWs) bands (ev): -3.6045 -3.6045 -2.3738 -2.3738 -0.5067 -0.5067 -0.5030 -0.5030 -0.0166 -0.0166 0.5446 0.5446 0.7156 0.7156 0.7181 0.7181 4.4444 4.4444 4.6172 4.6172 4.6427 4.6427 5.4148 5.4148 5.4581 5.4581 5.6580 5.6580 5.7002 5.7002 5.7238 5.7238 6.0586 6.0586 6.1100 6.1100 6.6791 6.6791 6.7737 6.7737 6.8220 6.8220 6.9147 6.9147 7.2916 7.2916 7.4678 7.4678 7.5689 7.5689 7.5841 7.5841 7.6412 7.6412 7.6587 7.6587 8.1334 8.1334 8.1619 8.1619 8.1763 8.1763 9.0608 9.0608 9.2463 9.2463 9.2600 9.2600 9.3151 9.3151 9.4507 9.4507 9.8207 9.8207 9.8280 9.8280 9.9808 9.9808 10.0225 10.0225 10.5173 10.5173 10.5475 10.5475 10.7482 10.7482 10.9705 10.9705 11.1992 11.1992 11.2606 11.2606 11.2784 11.2784 11.5280 11.5280 11.9761 11.9790 k = 0.3333 0.5774 0.3174 ( 14613 PWs) bands (ev): -3.5826 -3.5826 -2.4104 -2.4104 -0.4790 -0.4790 -0.4753 -0.4753 0.0008 0.0008 0.5402 0.5402 0.6926 0.6926 0.6950 0.6950 4.5185 4.5185 4.5996 4.5996 4.6309 4.6309 5.3998 5.3998 5.4509 5.4509 5.6296 5.6296 5.7094 5.7094 5.7138 5.7138 6.0519 6.0519 6.1063 6.1063 6.6672 6.6672 6.7743 6.7743 6.8200 6.8200 6.9135 6.9135 7.2829 7.2829 7.4789 7.4789 7.5636 7.5636 7.5768 7.5768 7.6558 7.6558 7.6845 7.6845 8.1141 8.1141 8.1618 8.1618 8.1825 8.1825 9.0788 9.0788 9.2461 9.2461 9.2518 9.2518 9.3477 9.3477 9.3737 9.3737 9.8182 9.8182 9.8228 9.8228 10.0379 10.0379 10.0765 10.0765 10.5248 10.5248 10.5472 10.5472 10.7121 10.7121 10.9441 10.9441 11.1935 11.1935 11.2410 11.2410 11.2601 11.2601 11.5785 11.5785 11.9784 11.9785 k = 0.3333 0.5774 0.3438 ( 14601 PWs) bands (ev): -3.5589 -3.5589 -2.4488 -2.4488 -0.4493 -0.4493 -0.4456 -0.4456 0.0193 0.0193 0.5348 0.5348 0.6673 0.6673 0.6697 0.6697 4.5806 4.5806 4.5849 4.5849 4.6391 4.6391 5.3783 5.3783 5.4354 5.4354 5.6027 5.6027 5.7120 5.7120 5.7222 5.7222 6.0471 6.0471 6.1046 6.1046 6.6426 6.6426 6.7744 6.7744 6.8170 6.8170 6.9128 6.9128 7.2720 7.2720 7.4771 7.4771 7.5257 7.5257 7.5758 7.5758 7.6755 7.6755 7.7412 7.7412 8.0918 8.0918 8.1685 8.1685 8.1943 8.1943 9.0983 9.0983 9.2325 9.2325 9.2422 9.2422 9.3084 9.3084 9.3809 9.3809 9.8114 9.8114 9.8137 9.8137 10.1003 10.1003 10.1359 10.1359 10.5357 10.5357 10.5502 10.5502 10.6779 10.6779 10.9215 10.9215 11.1837 11.1837 11.2297 11.2297 11.2497 11.2497 11.6328 11.6328 11.9544 11.9545 k = 0.3333 0.5774 0.3703 ( 14607 PWs) bands (ev): -3.5335 -3.5335 -2.4890 -2.4890 -0.4175 -0.4175 -0.4139 -0.4139 0.0389 0.0389 0.5284 0.5284 0.6398 0.6398 0.6422 0.6422 4.5736 4.5736 4.5924 4.5924 4.7057 4.7057 5.3506 5.3506 5.4113 5.4113 5.5792 5.5792 5.7174 5.7174 5.7386 5.7386 6.0437 6.0437 6.1045 6.1045 6.6052 6.6052 6.7740 6.7740 6.8153 6.8153 6.9135 6.9135 7.2573 7.2573 7.4695 7.4695 7.4825 7.4825 7.5571 7.5571 7.7158 7.7158 7.7993 7.7993 8.0684 8.0684 8.1822 8.1822 8.2115 8.2115 9.1192 9.1192 9.1913 9.1913 9.2349 9.2349 9.2687 9.2687 9.4119 9.4119 9.7996 9.7996 9.8001 9.8001 10.1673 10.1673 10.2002 10.2002 10.5510 10.5510 10.5570 10.5570 10.6480 10.6480 10.9031 10.9031 11.1705 11.1705 11.2259 11.2259 11.2464 11.2464 11.6879 11.6879 11.9163 11.9163 k = 0.3333 0.5774 0.3967 ( 14613 PWs) bands (ev): -3.5063 -3.5063 -2.5305 -2.5305 -0.3838 -0.3838 -0.3803 -0.3803 0.0594 0.0594 0.5208 0.5208 0.6101 0.6101 0.6124 0.6124 4.5661 4.5661 4.5903 4.5903 4.7939 4.7939 5.3175 5.3175 5.3797 5.3797 5.5601 5.5601 5.7290 5.7290 5.7584 5.7584 6.0412 6.0412 6.1054 6.1054 6.5575 6.5575 6.7735 6.7735 6.8153 6.8153 6.9157 6.9157 7.2379 7.2379 7.4360 7.4360 7.4565 7.4565 7.5289 7.5289 7.7631 7.7631 7.8564 7.8564 8.0479 8.0479 8.2021 8.2021 8.2337 8.2337 9.1355 9.1355 9.1420 9.1420 9.2248 9.2248 9.2464 9.2464 9.4407 9.4407 9.7817 9.7817 9.7825 9.7825 10.2382 10.2382 10.2688 10.2688 10.5654 10.5654 10.5715 10.5715 10.6265 10.6265 10.8897 10.8897 11.1543 11.1543 11.2285 11.2285 11.2493 11.2493 11.7411 11.7411 11.8730 11.8730 k = 0.3333 0.5774 0.4232 ( 14619 PWs) bands (ev): -3.4775 -3.4775 -2.5733 -2.5733 -0.3484 -0.3484 -0.3449 -0.3449 0.0807 0.0807 0.5121 0.5121 0.5782 0.5782 0.5805 0.5805 4.5625 4.5625 4.5897 4.5897 4.8883 4.8883 5.2800 5.2800 5.3422 5.3422 5.5457 5.5457 5.7451 5.7451 5.7809 5.7809 6.0391 6.0391 6.1069 6.1069 6.5028 6.5028 6.7732 6.7732 6.8168 6.8168 6.9195 6.9195 7.2140 7.2140 7.3875 7.3875 7.4352 7.4352 7.4934 7.4934 7.8117 7.8117 7.9117 7.9117 8.0355 8.0355 8.2270 8.2270 8.2603 8.2603 9.0799 9.0799 9.1651 9.1651 9.2126 9.2126 9.2287 9.2287 9.4666 9.4666 9.7585 9.7585 9.7601 9.7601 10.3121 10.3121 10.3410 10.3410 10.5675 10.5675 10.5978 10.5978 10.6234 10.6234 10.8818 10.8818 11.1351 11.1351 11.2362 11.2362 11.2570 11.2570 11.7869 11.7869 11.8303 11.8313 k = 0.3333 0.5774 0.4496 ( 14613 PWs) bands (ev): -3.4471 -3.4471 -2.6171 -2.6171 -0.3112 -0.3112 -0.3078 -0.3078 0.1028 0.1028 0.5022 0.5022 0.5442 0.5442 0.5465 0.5465 4.5631 4.5631 4.5925 4.5925 4.9863 4.9863 5.2391 5.2391 5.3004 5.3004 5.5362 5.5362 5.7645 5.7645 5.8056 5.8056 6.0370 6.0370 6.1085 6.1085 6.4443 6.4443 6.7734 6.7734 6.8193 6.8193 6.9246 6.9246 7.1861 7.1861 7.3376 7.3376 7.4031 7.4031 7.4510 7.4510 7.8598 7.8598 7.9647 7.9647 8.0357 8.0357 8.2552 8.2552 8.2899 8.2899 9.0260 9.0260 9.1895 9.1895 9.1994 9.1994 9.2125 9.2125 9.4888 9.4888 9.7307 9.7307 9.7327 9.7327 10.3879 10.3879 10.4162 10.4162 10.5612 10.5612 10.6297 10.6297 10.6420 10.6420 10.8800 10.8800 11.1132 11.1132 11.2477 11.2477 11.2682 11.2682 11.7726 11.7726 11.8088 11.8088 k = 0.3333 0.5774 0.4761 ( 14604 PWs) bands (ev): -3.4152 -3.4152 -2.6616 -2.6616 -0.2725 -0.2725 -0.2691 -0.2691 0.1255 0.1255 0.4910 0.4910 0.5083 0.5083 0.5107 0.5107 4.5679 4.5679 4.5991 4.5991 5.0864 5.0864 5.1955 5.1955 5.2560 5.2560 5.5321 5.5321 5.7860 5.7860 5.8318 5.8318 6.0344 6.0344 6.1099 6.1099 6.3847 6.3847 6.7745 6.7745 6.8225 6.8225 6.9309 6.9309 7.1543 7.1543 7.2871 7.2871 7.3561 7.3561 7.4063 7.4063 7.9069 7.9069 8.0153 8.0153 8.0498 8.0498 8.2849 8.2849 8.3211 8.3211 8.9740 8.9740 9.1865 9.1865 9.1964 9.1964 9.2163 9.2163 9.5067 9.5067 9.6985 9.6985 9.7006 9.7006 10.4628 10.4628 10.4937 10.4937 10.5585 10.5585 10.6670 10.6670 10.6729 10.6729 10.8847 10.8847 11.0885 11.0885 11.2611 11.2611 11.2811 11.2811 11.7245 11.7245 11.7574 11.7574 k = 0.3333 0.5774 0.5025 ( 14580 PWs) bands (ev): -3.3817 -3.3817 -2.7067 -2.7067 -0.2323 -0.2323 -0.2290 -0.2290 0.1487 0.1487 0.4705 0.4705 0.4724 0.4724 0.4790 0.4790 4.5769 4.5769 4.6098 4.6098 5.1500 5.1500 5.1808 5.1808 5.2163 5.2163 5.5335 5.5335 5.8087 5.8087 5.8589 5.8589 6.0308 6.0308 6.1106 6.1106 6.3267 6.3267 6.7769 6.7769 6.8264 6.8264 6.9374 6.9374 7.1180 7.1180 7.2366 7.2366 7.2926 7.2926 7.3657 7.3657 7.9535 7.9535 8.0635 8.0635 8.0761 8.0761 8.3139 8.3139 8.3519 8.3519 8.9229 8.9229 9.1755 9.1755 9.1844 9.1844 9.2425 9.2425 9.5198 9.5198 9.6625 9.6625 9.6647 9.6647 10.5218 10.5218 10.5726 10.5726 10.5781 10.5781 10.7092 10.7092 10.7109 10.7109 10.8962 10.8962 11.0614 11.0614 11.2747 11.2747 11.2940 11.2940 11.6736 11.6736 11.7047 11.7047 k = 0.3333 0.5774 0.5290 ( 14583 PWs) bands (ev): -3.3468 -3.3468 -2.7522 -2.7522 -0.1908 -0.1908 -0.1876 -0.1876 0.1723 0.1723 0.4310 0.4310 0.4333 0.4333 0.4650 0.4650 4.5902 4.5902 4.6245 4.6245 5.1034 5.1034 5.1573 5.1573 5.2920 5.2920 5.5412 5.5412 5.8321 5.8321 5.8864 5.8864 6.0256 6.0256 6.1102 6.1102 6.2727 6.2727 6.7813 6.7813 6.8311 6.8311 6.9411 6.9411 7.0758 7.0758 7.1868 7.1868 7.2222 7.2222 7.3284 7.3284 8.0002 8.0002 8.1096 8.1096 8.1113 8.1113 8.3400 8.3400 8.3801 8.3801 8.8717 8.8717 9.1681 9.1681 9.1760 9.1760 9.2697 9.2697 9.5276 9.5276 9.6233 9.6233 9.6254 9.6254 10.5436 10.5436 10.6420 10.6420 10.6521 10.6521 10.7539 10.7539 10.7557 10.7557 10.9139 10.9139 11.0330 11.0330 11.2863 11.2863 11.3045 11.3045 11.6212 11.6212 11.6509 11.6509 k = 0.3333 0.5774 0.5554 ( 14586 PWs) bands (ev): -3.3105 -3.3105 -2.7979 -2.7979 -0.1481 -0.1481 -0.1450 -0.1450 0.1961 0.1961 0.3900 0.3900 0.3923 0.3923 0.4499 0.4499 4.6076 4.6076 4.6434 4.6434 5.0563 5.0563 5.1093 5.1093 5.3864 5.3864 5.5567 5.5567 5.8557 5.8557 5.9139 5.9139 6.0185 6.0185 6.1084 6.1084 6.2259 6.2259 6.7879 6.7879 6.8369 6.8369 6.9306 6.9306 7.0315 7.0315 7.1382 7.1382 7.1585 7.1585 7.2931 7.2931 8.0471 8.0471 8.1524 8.1524 8.1537 8.1537 8.3610 8.3610 8.4032 8.4032 8.8197 8.8197 9.1661 9.1661 9.1733 9.1733 9.2973 9.2973 9.5298 9.5298 9.5813 9.5813 9.5839 9.5839 10.5589 10.5589 10.7187 10.7187 10.7312 10.7312 10.8000 10.8000 10.8057 10.8057 10.9347 10.9347 11.0073 11.0073 11.2936 11.2936 11.3105 11.3105 11.5673 11.5673 11.5959 11.5959 k = 0.3333 0.5774 0.5819 ( 14583 PWs) bands (ev): -3.2728 -3.2728 -2.8437 -2.8437 -0.1045 -0.1045 -0.1014 -0.1014 0.2199 0.2199 0.3477 0.3477 0.3501 0.3501 0.4336 0.4336 4.6290 4.6290 4.6662 4.6662 5.0091 5.0091 5.0606 5.0606 5.4682 5.4682 5.5833 5.5833 5.8797 5.8797 5.9407 5.9407 6.0095 6.0095 6.1048 6.1048 6.1900 6.1900 6.7973 6.7973 6.8411 6.8411 6.8810 6.8810 7.0080 7.0080 7.0912 7.0912 7.1110 7.1110 7.2594 7.2594 8.0940 8.0940 8.1961 8.1961 8.1973 8.1973 8.3754 8.3754 8.4194 8.4194 8.7664 8.7664 9.1710 9.1710 9.1776 9.1776 9.3251 9.3251 9.5239 9.5239 9.5372 9.5372 9.5433 9.5433 10.5784 10.5784 10.7962 10.7962 10.8086 10.8086 10.8453 10.8453 10.8585 10.8585 10.9428 10.9428 11.0029 11.0029 11.2944 11.2944 11.3095 11.3095 11.5121 11.5121 11.5397 11.5398 k = 0.3333 0.5774 0.6083 ( 14592 PWs) bands (ev): -3.2340 -3.2340 -2.8893 -2.8893 -0.0599 -0.0599 -0.0570 -0.0570 0.2437 0.2437 0.3042 0.3042 0.3067 0.3067 0.4161 0.4161 4.6543 4.6543 4.6928 4.6928 4.9624 4.9624 5.0124 5.0124 5.5268 5.5268 5.6232 5.6232 5.9050 5.9050 5.9666 5.9666 6.0006 6.0006 6.0991 6.0991 6.1694 6.1694 6.7822 6.7822 6.8100 6.8100 6.8593 6.8593 7.0009 7.0009 7.0465 7.0465 7.0818 7.0818 7.2275 7.2275 8.1399 8.1399 8.2367 8.2367 8.2440 8.2440 8.3829 8.3829 8.4270 8.4270 8.7117 8.7117 9.1840 9.1840 9.1899 9.1899 9.3529 9.3529 9.4904 9.4904 9.4915 9.4915 9.5242 9.5242 10.6030 10.6030 10.8652 10.8652 10.8791 10.8791 10.8821 10.8821 10.9140 10.9140 10.9415 10.9415 11.0328 11.0328 11.2874 11.2874 11.3000 11.3000 11.4555 11.4555 11.4823 11.4823 k = 0.3333 0.5774 0.6348 ( 14568 PWs) bands (ev): -3.1940 -3.1940 -2.9347 -2.9347 -0.0148 -0.0148 -0.0118 -0.0118 0.2598 0.2598 0.2619 0.2619 0.2677 0.2677 0.3975 0.3975 4.6831 4.6831 4.7230 4.7230 4.9166 4.9166 4.9650 4.9650 5.5660 5.5660 5.6613 5.6613 5.9322 5.9322 5.9910 5.9910 5.9949 5.9949 6.0912 6.0912 6.1702 6.1702 6.6784 6.6784 6.8262 6.8262 6.8701 6.8701 6.9883 6.9883 7.0045 7.0045 7.0736 7.0736 7.1974 7.1974 8.1839 8.1839 8.2753 8.2753 8.2886 8.2886 8.3861 8.3861 8.4257 8.4257 8.6559 8.6559 9.2051 9.2051 9.2104 9.2104 9.3802 9.3802 9.4450 9.4450 9.4453 9.4453 9.5116 9.5116 10.6323 10.6323 10.8531 10.8531 10.9455 10.9455 10.9480 10.9480 10.9727 10.9727 10.9756 10.9756 11.0774 11.0774 11.2729 11.2729 11.2822 11.2822 11.3981 11.3981 11.4239 11.4240 k = 0.3333 0.5774 0.6612 ( 14580 PWs) bands (ev): -3.1529 -3.1529 -2.9796 -2.9796 0.0309 0.0309 0.0338 0.0338 0.2147 0.2147 0.2172 0.2172 0.2907 0.2907 0.3778 0.3778 4.7153 4.7153 4.7566 4.7566 4.8721 4.8721 4.9191 4.9191 5.5979 5.5979 5.6782 5.6782 5.9574 5.9574 5.9934 5.9934 6.0136 6.0136 6.0808 6.0808 6.2013 6.2013 6.5685 6.5685 6.8462 6.8462 6.8847 6.8847 6.9655 6.9655 6.9674 6.9674 7.0819 7.0819 7.1692 7.1692 8.2250 8.2250 8.3115 8.3115 8.3177 8.3177 8.3983 8.3983 8.4156 8.4156 8.5992 8.5992 9.2339 9.2339 9.2383 9.2383 9.3984 9.3984 9.3988 9.3988 9.4073 9.4073 9.4959 9.4959 10.6656 10.6656 10.8183 10.8183 11.0037 11.0037 11.0090 11.0090 11.0239 11.0239 11.0308 11.0308 11.1294 11.1294 11.2548 11.2548 11.2587 11.2587 11.3407 11.3407 11.3656 11.3667 k = 0.3333 0.5774 0.6877 ( 14586 PWs) bands (ev): -3.1108 -3.1108 -3.0240 -3.0240 0.0769 0.0769 0.0797 0.0797 0.1690 0.1690 0.1716 0.1716 0.3135 0.3135 0.3572 0.3572 4.7507 4.7507 4.7933 4.7933 4.8294 4.8294 4.8749 4.8749 5.6272 5.6272 5.6728 5.6728 5.9750 5.9750 5.9918 5.9918 6.0341 6.0341 6.0678 6.0678 6.2660 6.2660 6.4591 6.4591 6.8702 6.8702 6.9021 6.9021 6.9300 6.9300 6.9443 6.9443 7.0984 7.0984 7.1431 7.1431 8.2620 8.2620 8.3151 8.3151 8.3446 8.3446 8.3979 8.3979 8.4358 8.4358 8.5426 8.5426 9.2691 9.2691 9.2726 9.2726 9.3528 9.3528 9.3545 9.3545 9.4321 9.4321 9.4771 9.4771 10.7019 10.7019 10.7796 10.7796 11.0495 11.0495 11.0574 11.0574 11.0687 11.0687 11.0730 11.0730 11.1868 11.1868 11.2391 11.2391 11.2450 11.2450 11.2870 11.2870 11.3096 11.3105 k = 0.3333 0.5774 0.7141 ( 14574 PWs) bands (ev): -3.0678 -3.0678 -3.0678 -3.0678 0.1230 0.1230 0.1230 0.1230 0.1257 0.1257 0.1257 0.1257 0.3357 0.3357 0.3357 0.3357 4.7888 4.7888 4.7888 4.7888 4.8329 4.8329 4.8329 4.8329 5.6534 5.6534 5.6534 5.6534 5.9860 5.9860 5.9860 5.9860 6.0522 6.0522 6.0522 6.0522 6.3557 6.3557 6.3557 6.3557 6.8981 6.8981 6.8981 6.8981 6.9221 6.9221 6.9221 6.9221 7.1193 7.1193 7.1193 7.1193 8.2932 8.2932 8.2932 8.2932 8.3738 8.3738 8.3738 8.3738 8.4871 8.4871 8.4871 8.4871 9.3092 9.3092 9.3092 9.3092 9.3118 9.3118 9.3118 9.3118 9.4557 9.4557 9.4557 9.4557 10.7403 10.7403 10.7403 10.7403 11.0784 11.0784 11.0784 11.0784 11.0831 11.0831 11.0831 11.0831 11.2395 11.2395 11.2395 11.2395 11.2570 11.2570 11.2570 11.2572 11.2638 11.2638 Writing output data file Zr5Sb3S.save init_run : 0.39s CPU 0.72s WALL ( 1 calls) electrons : 1362.69s CPU 1373.24s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.03s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 1362.68s CPU 1373.23s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.12s CPU 0.15s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.10s CPU 0.17s WALL ( 210 calls) cegterg : 1286.83s CPU 1296.17s WALL ( 1094 calls) Called by sum_band: Called by *egterg: h_psi : 654.42s CPU 662.65s WALL ( 22017 calls) s_psi : 69.41s CPU 69.12s WALL ( 22017 calls) g_psi : 1.18s CPU 1.25s WALL ( 20713 calls) cdiaghg : 472.80s CPU 473.75s WALL ( 20923 calls) cegterg:over : 59.84s CPU 60.09s WALL ( 20713 calls) cegterg:upda : 51.43s CPU 51.63s WALL ( 20713 calls) cegterg:last : 23.41s CPU 23.23s WALL ( 2137 calls) cdiaghg:chol : 21.14s CPU 21.31s WALL ( 20923 calls) cdiaghg:inve : 15.67s CPU 15.69s WALL ( 20923 calls) cdiaghg:para : 30.84s CPU 30.90s WALL ( 41846 calls) Called by h_psi: h_psi:vloc : 510.96s CPU 518.89s WALL ( 22017 calls) h_psi:vnl : 141.87s CPU 142.07s WALL ( 22017 calls) add_vuspsi : 73.01s CPU 72.84s WALL ( 22017 calls) General routines calbec : 68.73s CPU 69.16s WALL ( 22017 calls) fft : 0.02s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 491.61s CPU 499.26s WALL ( 2453036 calls) interpolate : 0.00s CPU 0.01s WALL ( 4 calls) davcio : 0.28s CPU 0.48s WALL ( 420 calls) Parallel routines fft_scatter : 287.82s CPU 293.55s WALL ( 2453059 calls) PWSCF : 23m39.51s CPU 24m 9.73s WALL This run was terminated on: 9:53: 4 1Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=