Program PWSCF v.5.3.0 (svn rev. 11974) starts on 1Feb2017 at 9:28: 8 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Tl2S.save/ file Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D 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 27 23 6 1287 1003 148 Max 28 24 7 1296 1028 157 Sum 1969 1675 475 92867 73091 10937 bravais-lattice index = 14 lattice parameter (alat) = 11.6596 a.u. unit-cell volume = 1793.2156 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 45.0000 Ry charge density cutoff = 211.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.659609 celldm(2)= 1.000000 celldm(3)= 1.306321 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 1.306321 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 0.765509 ) 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 Tl read from file: /users/gautes/Pseudo/Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: cd969aa200d2b9b89aab382fbbb9d684 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 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) Tl 13.00 204.38330 Tl( 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 ) ( 0.6531605 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6531605 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 60 deg rotation - cryst. axis [0,0,1] cryst. s( 5) = ( 1 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 5) = ( 0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.6531605 ) 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 ) ( 0.6531605 ) isym = 7 120 deg rotation - cryst. axis [0,0,1] cryst. s( 7) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 8) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 9) = ( 0 -1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 9) = ( 0.5000000 -0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6531605 ) isym = 10 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( 1 1 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(10) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6531605 ) isym = 11 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(11) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 12 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(12) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 13 inversion cryst. s(13) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(13) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(14) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(14) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6531605 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.6531605 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s(16) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 17 inv. 60 deg rotation - cryst. axis [0,0,1] cryst. s(17) = ( -1 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(17) = ( -0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6531605 ) 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 ) ( 0.6531605 ) isym = 19 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s(19) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s(19) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 20 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(20) = ( 1 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(20) = ( 0.5000000 -0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 21 inv. 180 deg rotation - cryst. axis [1,-1,0] cryst. s(21) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(21) = ( -0.5000000 0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.6531605 ) isym = 22 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(22) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(22) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.6531605 ) isym = 23 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(23) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(23) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 24 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(24) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(24) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_6h(6/mmm) there are 18 classes and 6 irreducible representations the character table: E -E 2C6 -2C6 2C3 -2C3 C2 3C2' 3C2'' i -i 2S3 -C2 -3C2' -3C2' G_7+ 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 1.73 G_8+ 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 -1.73 G_9+ 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 2.00 -2.00 0.00 G_7- 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 -1.73 G_8- 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 1.73 G_9- 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 -2.00 2.00 0.00 -2S3 2S6 -2S6 s_h 3s_v 3s_d -s_h -3s_v -3s_d G_7+ -1.73 1.00 -1.00 0.00 0.00 0.00 G_8+ 1.73 1.00 -1.00 0.00 0.00 0.00 G_9+ 0.00 -2.00 2.00 0.00 0.00 0.00 G_7- 1.73 -1.00 1.00 0.00 0.00 0.00 G_8- -1.73 -1.00 1.00 0.00 0.00 0.00 G_9- 0.00 2.00 -2.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C6 5 6 60 deg rotation - cryst. axis [0,0,1] -2C6 -5 -6 60 deg rotation - cryst. axis [0,0,1] E 2C3 7 8 120 deg rotation - cryst. axis [0,0,1] -2C3 -7 -8 120 deg rotation - cryst. axis [0,0,1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 3C2'-3C2' 4 -4 12 -11 11 -12 180 deg rotation - cart. axis [1,0,0] 3C2''-3C2' 3 -3 9 10 -10 -9 180 deg rotation - cart. axis [0,1,0] i 13 inversion -i -13 inversion E 2S3 17 18 inv. 60 deg rotation - cryst. axis [0,0,1] -2S3 -17 -18 inv. 60 deg rotation - cryst. axis [0,0,1] E 2S6 19 20 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -19 -20 inv. 120 deg rotation - cryst. axis [0,0,1] E s_h -s_h 14 -14 inv. 180 deg rotation - cart. axis [0,0,1] 3s_v-3s_v 16 -16 24 -23 23 -24 inv. 180 deg rotation - cart. axis [1,0,0] 3s_d-3s_d 15 -15 21 22 -22 -21 inv. 180 deg rotation - cart. axis [0,1,0] Cartesian axes number of k points= 231 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 2) = ( 0.0166667 0.0096225 -0.0000000), wk = 0.0043290 k( 3) = ( 0.0333333 0.0192450 -0.0000000), wk = 0.0043290 k( 4) = ( 0.0500000 0.0288675 -0.0000000), wk = 0.0043290 k( 5) = ( 0.0666667 0.0384900 -0.0000000), wk = 0.0043290 k( 6) = ( 0.0833333 0.0481125 -0.0000000), wk = 0.0043290 k( 7) = ( 0.1000000 0.0577350 -0.0000000), wk = 0.0043290 k( 8) = ( 0.1166667 0.0673575 -0.0000000), wk = 0.0043290 k( 9) = ( 0.1333333 0.0769800 -0.0000000), wk = 0.0043290 k( 10) = ( 0.1500000 0.0866025 -0.0000000), wk = 0.0043290 k( 11) = ( 0.1666667 0.0962250 -0.0000000), wk = 0.0043290 k( 12) = ( 0.1833333 0.1058475 -0.0000000), wk = 0.0043290 k( 13) = ( 0.2000000 0.1154701 -0.0000000), wk = 0.0043290 k( 14) = ( 0.2166667 0.1250926 -0.0000000), wk = 0.0043290 k( 15) = ( 0.2333333 0.1347151 -0.0000000), wk = 0.0043290 k( 16) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0043290 k( 17) = ( 0.2666667 0.1539601 -0.0000000), wk = 0.0043290 k( 18) = ( 0.2833333 0.1635826 -0.0000000), wk = 0.0043290 k( 19) = ( 0.3000000 0.1732051 -0.0000000), wk = 0.0043290 k( 20) = ( 0.3166667 0.1828276 -0.0000000), wk = 0.0043290 k( 21) = ( 0.3333333 0.1924501 -0.0000000), wk = 0.0043290 k( 22) = ( 0.3500000 0.2020726 -0.0000000), wk = 0.0043290 k( 23) = ( 0.3666667 0.2116951 -0.0000000), wk = 0.0043290 k( 24) = ( 0.3833333 0.2213176 -0.0000000), wk = 0.0043290 k( 25) = ( 0.4000000 0.2309401 -0.0000000), wk = 0.0043290 k( 26) = ( 0.4166667 0.2405626 -0.0000000), wk = 0.0043290 k( 27) = ( 0.4333333 0.2501851 -0.0000000), wk = 0.0043290 k( 28) = ( 0.4500000 0.2598076 -0.0000000), wk = 0.0043290 k( 29) = ( 0.4666667 0.2694301 -0.0000000), wk = 0.0043290 k( 30) = ( 0.4833333 0.2790526 -0.0000000), wk = 0.0043290 k( 31) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0043290 k( 32) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0043290 k( 33) = ( 0.4901961 0.3056560 -0.0000000), wk = 0.0043290 k( 34) = ( 0.4803922 0.3226369 -0.0000000), wk = 0.0043290 k( 35) = ( 0.4705882 0.3396178 -0.0000000), wk = 0.0043290 k( 36) = ( 0.4607843 0.3565987 -0.0000000), wk = 0.0043290 k( 37) = ( 0.4509804 0.3735796 -0.0000000), wk = 0.0043290 k( 38) = ( 0.4411765 0.3905605 -0.0000000), wk = 0.0043290 k( 39) = ( 0.4313726 0.4075414 -0.0000000), wk = 0.0043290 k( 40) = ( 0.4215686 0.4245223 -0.0000000), wk = 0.0043290 k( 41) = ( 0.4117647 0.4415032 -0.0000000), wk = 0.0043290 k( 42) = ( 0.4019608 0.4584840 -0.0000000), wk = 0.0043290 k( 43) = ( 0.3921569 0.4754649 -0.0000000), wk = 0.0043290 k( 44) = ( 0.3823529 0.4924458 -0.0000000), wk = 0.0043290 k( 45) = ( 0.3725490 0.5094267 -0.0000000), wk = 0.0043290 k( 46) = ( 0.3627451 0.5264076 -0.0000000), wk = 0.0043290 k( 47) = ( 0.3529412 0.5433885 -0.0000000), wk = 0.0043290 k( 48) = ( 0.3431373 0.5603694 -0.0000000), wk = 0.0043290 k( 49) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0043290 k( 50) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0043290 k( 51) = ( 0.3235294 0.5603694 -0.0000000), wk = 0.0043290 k( 52) = ( 0.3137255 0.5433885 -0.0000000), wk = 0.0043290 k( 53) = ( 0.3039216 0.5264076 -0.0000000), wk = 0.0043290 k( 54) = ( 0.2941177 0.5094267 -0.0000000), wk = 0.0043290 k( 55) = ( 0.2843137 0.4924458 -0.0000000), wk = 0.0043290 k( 56) = ( 0.2745098 0.4754649 -0.0000000), wk = 0.0043290 k( 57) = ( 0.2647059 0.4584840 -0.0000000), wk = 0.0043290 k( 58) = ( 0.2549020 0.4415031 -0.0000000), wk = 0.0043290 k( 59) = ( 0.2450980 0.4245223 -0.0000000), wk = 0.0043290 k( 60) = ( 0.2352941 0.4075414 -0.0000000), wk = 0.0043290 k( 61) = ( 0.2254902 0.3905605 -0.0000000), wk = 0.0043290 k( 62) = ( 0.2156863 0.3735796 -0.0000000), wk = 0.0043290 k( 63) = ( 0.2058823 0.3565987 -0.0000000), wk = 0.0043290 k( 64) = ( 0.1960784 0.3396178 -0.0000000), wk = 0.0043290 k( 65) = ( 0.1862745 0.3226369 -0.0000000), wk = 0.0043290 k( 66) = ( 0.1764706 0.3056560 -0.0000000), wk = 0.0043290 k( 67) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0043290 k( 68) = ( 0.1568627 0.2716943 -0.0000000), wk = 0.0043290 k( 69) = ( 0.1470588 0.2547133 -0.0000000), wk = 0.0043290 k( 70) = ( 0.1372549 0.2377325 -0.0000000), wk = 0.0043290 k( 71) = ( 0.1274510 0.2207516 -0.0000000), wk = 0.0043290 k( 72) = ( 0.1176471 0.2037707 -0.0000000), wk = 0.0043290 k( 73) = ( 0.1078431 0.1867898 -0.0000000), wk = 0.0043290 k( 74) = ( 0.0980392 0.1698089 -0.0000000), wk = 0.0043290 k( 75) = ( 0.0882353 0.1528280 -0.0000000), wk = 0.0043290 k( 76) = ( 0.0784314 0.1358471 -0.0000000), wk = 0.0043290 k( 77) = ( 0.0686275 0.1188662 -0.0000000), wk = 0.0043290 k( 78) = ( 0.0588235 0.1018853 -0.0000000), wk = 0.0043290 k( 79) = ( 0.0490196 0.0849045 -0.0000000), wk = 0.0043290 k( 80) = ( 0.0392157 0.0679236 -0.0000000), wk = 0.0043290 k( 81) = ( 0.0294118 0.0509427 -0.0000000), wk = 0.0043290 k( 82) = ( 0.0196078 0.0339618 -0.0000000), wk = 0.0043290 k( 83) = ( 0.0098039 0.0169809 -0.0000000), wk = 0.0043290 k( 84) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 85) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 86) = ( 0.0000000 0.0000000 0.0191377), wk = 0.0043290 k( 87) = ( 0.0000000 0.0000000 0.0382754), wk = 0.0043290 k( 88) = ( 0.0000000 0.0000000 0.0574132), wk = 0.0043290 k( 89) = ( 0.0000000 0.0000000 0.0765509), wk = 0.0043290 k( 90) = ( 0.0000000 0.0000000 0.0956886), wk = 0.0043290 k( 91) = ( 0.0000000 0.0000000 0.1148263), wk = 0.0043290 k( 92) = ( 0.0000000 0.0000000 0.1339640), wk = 0.0043290 k( 93) = ( 0.0000000 0.0000000 0.1531017), wk = 0.0043290 k( 94) = ( 0.0000000 0.0000000 0.1722395), wk = 0.0043290 k( 95) = ( 0.0000000 0.0000000 0.1913772), wk = 0.0043290 k( 96) = ( 0.0000000 0.0000000 0.2105149), wk = 0.0043290 k( 97) = ( 0.0000000 0.0000000 0.2296526), wk = 0.0043290 k( 98) = ( 0.0000000 0.0000000 0.2487903), wk = 0.0043290 k( 99) = ( 0.0000000 0.0000000 0.2679280), wk = 0.0043290 k( 100) = ( 0.0000000 0.0000000 0.2870658), wk = 0.0043290 k( 101) = ( 0.0000000 0.0000000 0.3062035), wk = 0.0043290 k( 102) = ( 0.0000000 0.0000000 0.3253412), wk = 0.0043290 k( 103) = ( 0.0000000 0.0000000 0.3444789), wk = 0.0043290 k( 104) = ( 0.0000000 0.0000000 0.3636166), wk = 0.0043290 k( 105) = ( 0.0000000 0.0000000 0.3827543), wk = 0.0043290 k( 106) = ( 0.0000000 0.0000000 0.3827543), wk = 0.0043290 k( 107) = ( 0.0166667 0.0096225 0.3827543), wk = 0.0043290 k( 108) = ( 0.0333333 0.0192450 0.3827543), wk = 0.0043290 k( 109) = ( 0.0500000 0.0288675 0.3827543), wk = 0.0043290 k( 110) = ( 0.0666667 0.0384900 0.3827543), wk = 0.0043290 k( 111) = ( 0.0833333 0.0481125 0.3827543), wk = 0.0043290 k( 112) = ( 0.1000000 0.0577350 0.3827543), wk = 0.0043290 k( 113) = ( 0.1166667 0.0673575 0.3827543), wk = 0.0043290 k( 114) = ( 0.1333333 0.0769800 0.3827543), wk = 0.0043290 k( 115) = ( 0.1500000 0.0866025 0.3827543), wk = 0.0043290 k( 116) = ( 0.1666667 0.0962250 0.3827543), wk = 0.0043290 k( 117) = ( 0.1833333 0.1058475 0.3827543), wk = 0.0043290 k( 118) = ( 0.2000000 0.1154701 0.3827543), wk = 0.0043290 k( 119) = ( 0.2166667 0.1250926 0.3827543), wk = 0.0043290 k( 120) = ( 0.2333333 0.1347151 0.3827543), wk = 0.0043290 k( 121) = ( 0.2500000 0.1443376 0.3827543), wk = 0.0043290 k( 122) = ( 0.2666667 0.1539601 0.3827543), wk = 0.0043290 k( 123) = ( 0.2833333 0.1635826 0.3827543), wk = 0.0043290 k( 124) = ( 0.3000000 0.1732051 0.3827543), wk = 0.0043290 k( 125) = ( 0.3166667 0.1828276 0.3827543), wk = 0.0043290 k( 126) = ( 0.3333333 0.1924501 0.3827543), wk = 0.0043290 k( 127) = ( 0.3500000 0.2020726 0.3827543), wk = 0.0043290 k( 128) = ( 0.3666667 0.2116951 0.3827543), wk = 0.0043290 k( 129) = ( 0.3833333 0.2213176 0.3827543), wk = 0.0043290 k( 130) = ( 0.4000000 0.2309401 0.3827543), wk = 0.0043290 k( 131) = ( 0.4166667 0.2405626 0.3827543), wk = 0.0043290 k( 132) = ( 0.4333333 0.2501851 0.3827543), wk = 0.0043290 k( 133) = ( 0.4500000 0.2598076 0.3827543), wk = 0.0043290 k( 134) = ( 0.4666667 0.2694301 0.3827543), wk = 0.0043290 k( 135) = ( 0.4833333 0.2790526 0.3827543), wk = 0.0043290 k( 136) = ( 0.5000000 0.2886751 0.3827543), wk = 0.0043290 k( 137) = ( 0.5000000 0.2886751 0.3827543), wk = 0.0043290 k( 138) = ( 0.4901961 0.3056560 0.3827543), wk = 0.0043290 k( 139) = ( 0.4803922 0.3226369 0.3827543), wk = 0.0043290 k( 140) = ( 0.4705882 0.3396178 0.3827543), wk = 0.0043290 k( 141) = ( 0.4607843 0.3565987 0.3827543), wk = 0.0043290 k( 142) = ( 0.4509804 0.3735796 0.3827543), wk = 0.0043290 k( 143) = ( 0.4411765 0.3905605 0.3827543), wk = 0.0043290 k( 144) = ( 0.4313726 0.4075414 0.3827543), wk = 0.0043290 k( 145) = ( 0.4215686 0.4245223 0.3827543), wk = 0.0043290 k( 146) = ( 0.4117647 0.4415032 0.3827543), wk = 0.0043290 k( 147) = ( 0.4019608 0.4584840 0.3827543), wk = 0.0043290 k( 148) = ( 0.3921569 0.4754649 0.3827543), wk = 0.0043290 k( 149) = ( 0.3823529 0.4924458 0.3827543), wk = 0.0043290 k( 150) = ( 0.3725490 0.5094267 0.3827543), wk = 0.0043290 k( 151) = ( 0.3627451 0.5264076 0.3827543), wk = 0.0043290 k( 152) = ( 0.3529412 0.5433885 0.3827543), wk = 0.0043290 k( 153) = ( 0.3431373 0.5603694 0.3827543), wk = 0.0043290 k( 154) = ( 0.3333333 0.5773503 0.3827543), wk = 0.0043290 k( 155) = ( 0.3333333 0.5773503 0.3827543), wk = 0.0043290 k( 156) = ( 0.3235294 0.5603694 0.3827543), wk = 0.0043290 k( 157) = ( 0.3137255 0.5433885 0.3827543), wk = 0.0043290 k( 158) = ( 0.3039216 0.5264076 0.3827543), wk = 0.0043290 k( 159) = ( 0.2941177 0.5094267 0.3827543), wk = 0.0043290 k( 160) = ( 0.2843137 0.4924458 0.3827543), wk = 0.0043290 k( 161) = ( 0.2745098 0.4754649 0.3827543), wk = 0.0043290 k( 162) = ( 0.2647059 0.4584840 0.3827543), wk = 0.0043290 k( 163) = ( 0.2549020 0.4415031 0.3827543), wk = 0.0043290 k( 164) = ( 0.2450980 0.4245223 0.3827543), wk = 0.0043290 k( 165) = ( 0.2352941 0.4075414 0.3827543), wk = 0.0043290 k( 166) = ( 0.2254902 0.3905605 0.3827543), wk = 0.0043290 k( 167) = ( 0.2156863 0.3735796 0.3827543), wk = 0.0043290 k( 168) = ( 0.2058823 0.3565987 0.3827543), wk = 0.0043290 k( 169) = ( 0.1960784 0.3396178 0.3827543), wk = 0.0043290 k( 170) = ( 0.1862745 0.3226369 0.3827543), wk = 0.0043290 k( 171) = ( 0.1764706 0.3056560 0.3827543), wk = 0.0043290 k( 172) = ( 0.1666667 0.2886751 0.3827543), wk = 0.0043290 k( 173) = ( 0.1568627 0.2716943 0.3827543), wk = 0.0043290 k( 174) = ( 0.1470588 0.2547133 0.3827543), wk = 0.0043290 k( 175) = ( 0.1372549 0.2377325 0.3827543), wk = 0.0043290 k( 176) = ( 0.1274510 0.2207516 0.3827543), wk = 0.0043290 k( 177) = ( 0.1176471 0.2037707 0.3827543), wk = 0.0043290 k( 178) = ( 0.1078431 0.1867898 0.3827543), wk = 0.0043290 k( 179) = ( 0.0980392 0.1698089 0.3827543), wk = 0.0043290 k( 180) = ( 0.0882353 0.1528280 0.3827543), wk = 0.0043290 k( 181) = ( 0.0784314 0.1358471 0.3827543), wk = 0.0043290 k( 182) = ( 0.0686275 0.1188662 0.3827543), wk = 0.0043290 k( 183) = ( 0.0588235 0.1018853 0.3827543), wk = 0.0043290 k( 184) = ( 0.0490196 0.0849045 0.3827543), wk = 0.0043290 k( 185) = ( 0.0392157 0.0679236 0.3827543), wk = 0.0043290 k( 186) = ( 0.0294118 0.0509427 0.3827543), wk = 0.0043290 k( 187) = ( 0.0196078 0.0339618 0.3827543), wk = 0.0043290 k( 188) = ( 0.0098039 0.0169809 0.3827543), wk = 0.0043290 k( 189) = ( 0.0000000 0.0000000 0.3827543), wk = 0.0043290 k( 190) = ( 0.5000000 0.2886751 0.3827543), wk = 0.0043290 k( 191) = ( 0.5000000 0.2886751 0.3636166), wk = 0.0043290 k( 192) = ( 0.5000000 0.2886751 0.3444789), wk = 0.0043290 k( 193) = ( 0.5000000 0.2886751 0.3253412), wk = 0.0043290 k( 194) = ( 0.5000000 0.2886751 0.3062035), wk = 0.0043290 k( 195) = ( 0.5000000 0.2886751 0.2870658), wk = 0.0043290 k( 196) = ( 0.5000000 0.2886751 0.2679280), wk = 0.0043290 k( 197) = ( 0.5000000 0.2886751 0.2487903), wk = 0.0043290 k( 198) = ( 0.5000000 0.2886751 0.2296526), wk = 0.0043290 k( 199) = ( 0.5000000 0.2886751 0.2105149), wk = 0.0043290 k( 200) = ( 0.5000000 0.2886751 0.1913772), wk = 0.0043290 k( 201) = ( 0.5000000 0.2886751 0.1722395), wk = 0.0043290 k( 202) = ( 0.5000000 0.2886751 0.1531017), wk = 0.0043290 k( 203) = ( 0.5000000 0.2886751 0.1339640), wk = 0.0043290 k( 204) = ( 0.5000000 0.2886751 0.1148263), wk = 0.0043290 k( 205) = ( 0.5000000 0.2886751 0.0956886), wk = 0.0043290 k( 206) = ( 0.5000000 0.2886751 0.0765509), wk = 0.0043290 k( 207) = ( 0.5000000 0.2886751 0.0574132), wk = 0.0043290 k( 208) = ( 0.5000000 0.2886751 0.0382754), wk = 0.0043290 k( 209) = ( 0.5000000 0.2886751 0.0191377), wk = 0.0043290 k( 210) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0043290 k( 211) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0043290 k( 212) = ( 0.3333333 0.5773503 0.0191377), wk = 0.0043290 k( 213) = ( 0.3333333 0.5773503 0.0382754), wk = 0.0043290 k( 214) = ( 0.3333333 0.5773503 0.0574132), wk = 0.0043290 k( 215) = ( 0.3333333 0.5773503 0.0765509), wk = 0.0043290 k( 216) = ( 0.3333333 0.5773503 0.0956886), wk = 0.0043290 k( 217) = ( 0.3333333 0.5773503 0.1148263), wk = 0.0043290 k( 218) = ( 0.3333333 0.5773503 0.1339640), wk = 0.0043290 k( 219) = ( 0.3333333 0.5773503 0.1531017), wk = 0.0043290 k( 220) = ( 0.3333333 0.5773503 0.1722395), wk = 0.0043290 k( 221) = ( 0.3333333 0.5773503 0.1913772), wk = 0.0043290 k( 222) = ( 0.3333333 0.5773503 0.2105149), wk = 0.0043290 k( 223) = ( 0.3333333 0.5773503 0.2296526), wk = 0.0043290 k( 224) = ( 0.3333333 0.5773503 0.2487903), wk = 0.0043290 k( 225) = ( 0.3333333 0.5773503 0.2679280), wk = 0.0043290 k( 226) = ( 0.3333333 0.5773503 0.2870658), wk = 0.0043290 k( 227) = ( 0.3333333 0.5773503 0.3062035), wk = 0.0043290 k( 228) = ( 0.3333333 0.5773503 0.3253412), wk = 0.0043290 k( 229) = ( 0.3333333 0.5773503 0.3444789), wk = 0.0043290 k( 230) = ( 0.3333333 0.5773503 0.3636166), wk = 0.0043290 k( 231) = ( 0.3333333 0.5773503 0.3827543), wk = 0.0043290 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 2) = ( 0.0166667 -0.0000000 0.0000000), wk = 0.0043290 k( 3) = ( 0.0333333 -0.0000000 0.0000000), wk = 0.0043290 k( 4) = ( 0.0500000 -0.0000000 -0.0000000), wk = 0.0043290 k( 5) = ( 0.0666667 -0.0000000 0.0000000), wk = 0.0043290 k( 6) = ( 0.0833333 -0.0000000 -0.0000000), wk = 0.0043290 k( 7) = ( 0.1000000 -0.0000000 -0.0000000), wk = 0.0043290 k( 8) = ( 0.1166667 -0.0000000 0.0000000), wk = 0.0043290 k( 9) = ( 0.1333333 -0.0000000 0.0000000), wk = 0.0043290 k( 10) = ( 0.1500000 -0.0000000 -0.0000000), wk = 0.0043290 k( 11) = ( 0.1666667 -0.0000000 0.0000000), wk = 0.0043290 k( 12) = ( 0.1833333 -0.0000000 0.0000000), wk = 0.0043290 k( 13) = ( 0.2000000 -0.0000000 -0.0000000), wk = 0.0043290 k( 14) = ( 0.2166667 -0.0000000 0.0000000), wk = 0.0043290 k( 15) = ( 0.2333333 -0.0000000 0.0000000), wk = 0.0043290 k( 16) = ( 0.2500000 -0.0000000 0.0000000), wk = 0.0043290 k( 17) = ( 0.2666667 0.0000000 -0.0000000), wk = 0.0043290 k( 18) = ( 0.2833333 -0.0000000 0.0000000), wk = 0.0043290 k( 19) = ( 0.3000000 -0.0000000 -0.0000000), wk = 0.0043290 k( 20) = ( 0.3166667 -0.0000000 0.0000000), wk = 0.0043290 k( 21) = ( 0.3333333 -0.0000000 0.0000000), wk = 0.0043290 k( 22) = ( 0.3500000 -0.0000000 0.0000000), wk = 0.0043290 k( 23) = ( 0.3666667 -0.0000000 0.0000000), wk = 0.0043290 k( 24) = ( 0.3833333 -0.0000000 0.0000000), wk = 0.0043290 k( 25) = ( 0.4000000 -0.0000000 -0.0000000), wk = 0.0043290 k( 26) = ( 0.4166667 -0.0000000 0.0000000), wk = 0.0043290 k( 27) = ( 0.4333333 -0.0000000 -0.0000000), wk = 0.0043290 k( 28) = ( 0.4500000 -0.0000000 0.0000000), wk = 0.0043290 k( 29) = ( 0.4666667 -0.0000000 -0.0000000), wk = 0.0043290 k( 30) = ( 0.4833333 -0.0000000 -0.0000000), wk = 0.0043290 k( 31) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0043290 k( 32) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0043290 k( 33) = ( 0.4901961 0.0196078 -0.0000000), wk = 0.0043290 k( 34) = ( 0.4803922 0.0392157 0.0000000), wk = 0.0043290 k( 35) = ( 0.4705882 0.0588235 0.0000000), wk = 0.0043290 k( 36) = ( 0.4607843 0.0784314 0.0000000), wk = 0.0043290 k( 37) = ( 0.4509804 0.0980392 0.0000000), wk = 0.0043290 k( 38) = ( 0.4411765 0.1176471 -0.0000000), wk = 0.0043290 k( 39) = ( 0.4313726 0.1372549 0.0000000), wk = 0.0043290 k( 40) = ( 0.4215686 0.1568627 0.0000000), wk = 0.0043290 k( 41) = ( 0.4117647 0.1764706 0.0000000), wk = 0.0043290 k( 42) = ( 0.4019608 0.1960784 0.0000000), wk = 0.0043290 k( 43) = ( 0.3921569 0.2156863 0.0000000), wk = 0.0043290 k( 44) = ( 0.3823529 0.2352941 0.0000000), wk = 0.0043290 k( 45) = ( 0.3725490 0.2549020 0.0000000), wk = 0.0043290 k( 46) = ( 0.3627451 0.2745098 0.0000000), wk = 0.0043290 k( 47) = ( 0.3529412 0.2941177 0.0000000), wk = 0.0043290 k( 48) = ( 0.3431373 0.3137255 -0.0000000), wk = 0.0043290 k( 49) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0043290 k( 50) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0043290 k( 51) = ( 0.3235294 0.3235294 -0.0000000), wk = 0.0043290 k( 52) = ( 0.3137255 0.3137255 0.0000000), wk = 0.0043290 k( 53) = ( 0.3039216 0.3039216 0.0000000), wk = 0.0043290 k( 54) = ( 0.2941177 0.2941177 0.0000000), wk = 0.0043290 k( 55) = ( 0.2843137 0.2843137 0.0000000), wk = 0.0043290 k( 56) = ( 0.2745098 0.2745098 0.0000000), wk = 0.0043290 k( 57) = ( 0.2647059 0.2647059 0.0000000), wk = 0.0043290 k( 58) = ( 0.2549020 0.2549020 0.0000000), wk = 0.0043290 k( 59) = ( 0.2450980 0.2450980 -0.0000000), wk = 0.0043290 k( 60) = ( 0.2352941 0.2352941 0.0000000), wk = 0.0043290 k( 61) = ( 0.2254902 0.2254902 0.0000000), wk = 0.0043290 k( 62) = ( 0.2156863 0.2156863 0.0000000), wk = 0.0043290 k( 63) = ( 0.2058823 0.2058823 -0.0000000), wk = 0.0043290 k( 64) = ( 0.1960784 0.1960784 0.0000000), wk = 0.0043290 k( 65) = ( 0.1862745 0.1862745 -0.0000000), wk = 0.0043290 k( 66) = ( 0.1764706 0.1764706 0.0000000), wk = 0.0043290 k( 67) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0043290 k( 68) = ( 0.1568627 0.1568627 0.0000000), wk = 0.0043290 k( 69) = ( 0.1470588 0.1470588 -0.0000000), wk = 0.0043290 k( 70) = ( 0.1372549 0.1372549 0.0000000), wk = 0.0043290 k( 71) = ( 0.1274510 0.1274510 0.0000000), wk = 0.0043290 k( 72) = ( 0.1176471 0.1176471 0.0000000), wk = 0.0043290 k( 73) = ( 0.1078431 0.1078431 -0.0000000), wk = 0.0043290 k( 74) = ( 0.0980392 0.0980392 0.0000000), wk = 0.0043290 k( 75) = ( 0.0882353 0.0882353 -0.0000000), wk = 0.0043290 k( 76) = ( 0.0784314 0.0784314 0.0000000), wk = 0.0043290 k( 77) = ( 0.0686275 0.0686274 0.0000000), wk = 0.0043290 k( 78) = ( 0.0588235 0.0588235 0.0000000), wk = 0.0043290 k( 79) = ( 0.0490196 0.0490196 0.0000000), wk = 0.0043290 k( 80) = ( 0.0392157 0.0392157 -0.0000000), wk = 0.0043290 k( 81) = ( 0.0294118 0.0294118 0.0000000), wk = 0.0043290 k( 82) = ( 0.0196078 0.0196078 0.0000000), wk = 0.0043290 k( 83) = ( 0.0098039 0.0098039 0.0000000), wk = 0.0043290 k( 84) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 85) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043290 k( 86) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0043290 k( 87) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0043290 k( 88) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0043290 k( 89) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0043290 k( 90) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0043290 k( 91) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0043290 k( 92) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0043290 k( 93) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0043290 k( 94) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0043290 k( 95) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0043290 k( 96) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0043290 k( 97) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0043290 k( 98) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0043290 k( 99) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0043290 k( 100) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0043290 k( 101) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0043290 k( 102) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0043290 k( 103) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0043290 k( 104) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0043290 k( 105) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0043290 k( 106) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0043290 k( 107) = ( 0.0166667 -0.0000000 0.5000000), wk = 0.0043290 k( 108) = ( 0.0333333 -0.0000000 0.5000000), wk = 0.0043290 k( 109) = ( 0.0500000 -0.0000000 0.5000000), wk = 0.0043290 k( 110) = ( 0.0666667 -0.0000000 0.5000000), wk = 0.0043290 k( 111) = ( 0.0833333 -0.0000000 0.5000000), wk = 0.0043290 k( 112) = ( 0.1000000 -0.0000000 0.5000000), wk = 0.0043290 k( 113) = ( 0.1166667 -0.0000000 0.5000000), wk = 0.0043290 k( 114) = ( 0.1333333 -0.0000000 0.5000000), wk = 0.0043290 k( 115) = ( 0.1500000 -0.0000000 0.5000000), wk = 0.0043290 k( 116) = ( 0.1666667 -0.0000000 0.5000000), wk = 0.0043290 k( 117) = ( 0.1833333 -0.0000000 0.5000000), wk = 0.0043290 k( 118) = ( 0.2000000 -0.0000000 0.5000000), wk = 0.0043290 k( 119) = ( 0.2166667 -0.0000000 0.5000000), wk = 0.0043290 k( 120) = ( 0.2333333 -0.0000000 0.5000000), wk = 0.0043290 k( 121) = ( 0.2500000 -0.0000000 0.5000000), wk = 0.0043290 k( 122) = ( 0.2666667 0.0000000 0.5000000), wk = 0.0043290 k( 123) = ( 0.2833333 -0.0000000 0.5000000), wk = 0.0043290 k( 124) = ( 0.3000000 -0.0000000 0.5000000), wk = 0.0043290 k( 125) = ( 0.3166667 -0.0000000 0.5000000), wk = 0.0043290 k( 126) = ( 0.3333333 -0.0000000 0.5000000), wk = 0.0043290 k( 127) = ( 0.3500000 -0.0000000 0.5000000), wk = 0.0043290 k( 128) = ( 0.3666667 -0.0000000 0.5000000), wk = 0.0043290 k( 129) = ( 0.3833333 -0.0000000 0.5000000), wk = 0.0043290 k( 130) = ( 0.4000000 -0.0000000 0.5000000), wk = 0.0043290 k( 131) = ( 0.4166667 -0.0000000 0.5000000), wk = 0.0043290 k( 132) = ( 0.4333333 -0.0000000 0.5000000), wk = 0.0043290 k( 133) = ( 0.4500000 -0.0000000 0.5000000), wk = 0.0043290 k( 134) = ( 0.4666667 -0.0000000 0.5000000), wk = 0.0043290 k( 135) = ( 0.4833333 -0.0000000 0.5000000), wk = 0.0043290 k( 136) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0043290 k( 137) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0043290 k( 138) = ( 0.4901961 0.0196078 0.5000000), wk = 0.0043290 k( 139) = ( 0.4803922 0.0392157 0.5000000), wk = 0.0043290 k( 140) = ( 0.4705882 0.0588235 0.5000000), wk = 0.0043290 k( 141) = ( 0.4607843 0.0784314 0.5000000), wk = 0.0043290 k( 142) = ( 0.4509804 0.0980392 0.5000000), wk = 0.0043290 k( 143) = ( 0.4411765 0.1176471 0.5000000), wk = 0.0043290 k( 144) = ( 0.4313726 0.1372549 0.5000000), wk = 0.0043290 k( 145) = ( 0.4215686 0.1568627 0.5000000), wk = 0.0043290 k( 146) = ( 0.4117647 0.1764706 0.5000000), wk = 0.0043290 k( 147) = ( 0.4019608 0.1960784 0.5000000), wk = 0.0043290 k( 148) = ( 0.3921569 0.2156863 0.5000000), wk = 0.0043290 k( 149) = ( 0.3823529 0.2352941 0.5000000), wk = 0.0043290 k( 150) = ( 0.3725490 0.2549020 0.5000000), wk = 0.0043290 k( 151) = ( 0.3627451 0.2745098 0.5000000), wk = 0.0043290 k( 152) = ( 0.3529412 0.2941177 0.5000000), wk = 0.0043290 k( 153) = ( 0.3431373 0.3137255 0.5000000), wk = 0.0043290 k( 154) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0043290 k( 155) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0043290 k( 156) = ( 0.3235294 0.3235294 0.5000000), wk = 0.0043290 k( 157) = ( 0.3137255 0.3137255 0.5000000), wk = 0.0043290 k( 158) = ( 0.3039216 0.3039216 0.5000000), wk = 0.0043290 k( 159) = ( 0.2941177 0.2941177 0.5000000), wk = 0.0043290 k( 160) = ( 0.2843137 0.2843137 0.5000000), wk = 0.0043290 k( 161) = ( 0.2745098 0.2745098 0.5000000), wk = 0.0043290 k( 162) = ( 0.2647059 0.2647059 0.5000000), wk = 0.0043290 k( 163) = ( 0.2549020 0.2549020 0.5000000), wk = 0.0043290 k( 164) = ( 0.2450980 0.2450980 0.5000000), wk = 0.0043290 k( 165) = ( 0.2352941 0.2352941 0.5000000), wk = 0.0043290 k( 166) = ( 0.2254902 0.2254902 0.5000000), wk = 0.0043290 k( 167) = ( 0.2156863 0.2156863 0.5000000), wk = 0.0043290 k( 168) = ( 0.2058823 0.2058823 0.5000000), wk = 0.0043290 k( 169) = ( 0.1960784 0.1960784 0.5000000), wk = 0.0043290 k( 170) = ( 0.1862745 0.1862745 0.5000000), wk = 0.0043290 k( 171) = ( 0.1764706 0.1764706 0.5000000), wk = 0.0043290 k( 172) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0043290 k( 173) = ( 0.1568627 0.1568627 0.5000000), wk = 0.0043290 k( 174) = ( 0.1470588 0.1470588 0.5000000), wk = 0.0043290 k( 175) = ( 0.1372549 0.1372549 0.5000000), wk = 0.0043290 k( 176) = ( 0.1274510 0.1274510 0.5000000), wk = 0.0043290 k( 177) = ( 0.1176471 0.1176471 0.5000000), wk = 0.0043290 k( 178) = ( 0.1078431 0.1078431 0.5000000), wk = 0.0043290 k( 179) = ( 0.0980392 0.0980392 0.5000000), wk = 0.0043290 k( 180) = ( 0.0882353 0.0882353 0.5000000), wk = 0.0043290 k( 181) = ( 0.0784314 0.0784314 0.5000000), wk = 0.0043290 k( 182) = ( 0.0686275 0.0686274 0.5000000), wk = 0.0043290 k( 183) = ( 0.0588235 0.0588235 0.5000000), wk = 0.0043290 k( 184) = ( 0.0490196 0.0490196 0.5000000), wk = 0.0043290 k( 185) = ( 0.0392157 0.0392157 0.5000000), wk = 0.0043290 k( 186) = ( 0.0294118 0.0294118 0.5000000), wk = 0.0043290 k( 187) = ( 0.0196078 0.0196078 0.5000000), wk = 0.0043290 k( 188) = ( 0.0098039 0.0098039 0.5000000), wk = 0.0043290 k( 189) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0043290 k( 190) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0043290 k( 191) = ( 0.5000000 -0.0000000 0.4750000), wk = 0.0043290 k( 192) = ( 0.5000000 -0.0000000 0.4500000), wk = 0.0043290 k( 193) = ( 0.5000000 -0.0000000 0.4250000), wk = 0.0043290 k( 194) = ( 0.5000000 -0.0000000 0.4000000), wk = 0.0043290 k( 195) = ( 0.5000000 -0.0000000 0.3750000), wk = 0.0043290 k( 196) = ( 0.5000000 -0.0000000 0.3500000), wk = 0.0043290 k( 197) = ( 0.5000000 -0.0000000 0.3250000), wk = 0.0043290 k( 198) = ( 0.5000000 -0.0000000 0.3000000), wk = 0.0043290 k( 199) = ( 0.5000000 -0.0000000 0.2750000), wk = 0.0043290 k( 200) = ( 0.5000000 -0.0000000 0.2500000), wk = 0.0043290 k( 201) = ( 0.5000000 -0.0000000 0.2250000), wk = 0.0043290 k( 202) = ( 0.5000000 -0.0000000 0.2000000), wk = 0.0043290 k( 203) = ( 0.5000000 -0.0000000 0.1750000), wk = 0.0043290 k( 204) = ( 0.5000000 -0.0000000 0.1500000), wk = 0.0043290 k( 205) = ( 0.5000000 -0.0000000 0.1250000), wk = 0.0043290 k( 206) = ( 0.5000000 -0.0000000 0.1000000), wk = 0.0043290 k( 207) = ( 0.5000000 -0.0000000 0.0750000), wk = 0.0043290 k( 208) = ( 0.5000000 -0.0000000 0.0500000), wk = 0.0043290 k( 209) = ( 0.5000000 -0.0000000 0.0250000), wk = 0.0043290 k( 210) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0043290 k( 211) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0043290 k( 212) = ( 0.3333333 0.3333333 0.0250000), wk = 0.0043290 k( 213) = ( 0.3333333 0.3333333 0.0500000), wk = 0.0043290 k( 214) = ( 0.3333333 0.3333333 0.0750000), wk = 0.0043290 k( 215) = ( 0.3333333 0.3333333 0.1000000), wk = 0.0043290 k( 216) = ( 0.3333333 0.3333333 0.1250000), wk = 0.0043290 k( 217) = ( 0.3333333 0.3333333 0.1500000), wk = 0.0043290 k( 218) = ( 0.3333333 0.3333333 0.1750000), wk = 0.0043290 k( 219) = ( 0.3333333 0.3333333 0.2000000), wk = 0.0043290 k( 220) = ( 0.3333333 0.3333333 0.2250000), wk = 0.0043290 k( 221) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0043290 k( 222) = ( 0.3333333 0.3333333 0.2750000), wk = 0.0043290 k( 223) = ( 0.3333333 0.3333333 0.3000000), wk = 0.0043290 k( 224) = ( 0.3333333 0.3333333 0.3250000), wk = 0.0043290 k( 225) = ( 0.3333333 0.3333333 0.3500000), wk = 0.0043290 k( 226) = ( 0.3333333 0.3333333 0.3750000), wk = 0.0043290 k( 227) = ( 0.3333333 0.3333333 0.4000000), wk = 0.0043290 k( 228) = ( 0.3333333 0.3333333 0.4250000), wk = 0.0043290 k( 229) = ( 0.3333333 0.3333333 0.4500000), wk = 0.0043290 k( 230) = ( 0.3333333 0.3333333 0.4750000), wk = 0.0043290 k( 231) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0043290 Dense grid: 92867 G-vectors FFT dimensions: ( 54, 54, 72) Smooth grid: 73091 G-vectors FFT dimensions: ( 50, 50, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.30 Mb ( 258, 76) NL pseudopotentials 0.40 Mb ( 129, 204) Each V/rho on FFT grid 0.04 Mb ( 2916) Each G-vector array 0.01 Mb ( 1291) G-vector shells 0.00 Mb ( 632) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.20 Mb ( 258, 304) Each subspace H/S matrix 0.04 Mb ( 50, 50) Each matrix 0.47 Mb ( 204, 2, 76) The potential is recalculated from file : ./Tl2S.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.2 secs Computing kpt #: 2 total cpu time spent up to now is 5.9 secs Computing kpt #: 3 total cpu time spent up to now is 7.2 secs Computing kpt #: 4 total cpu time spent up to now is 8.4 secs Computing kpt #: 5 total cpu time spent up to now is 9.6 secs Computing kpt #: 6 total cpu time spent up to now is 10.8 secs Computing kpt #: 7 total cpu time spent up to now is 12.0 secs Computing kpt #: 8 total cpu time spent up to now is 13.1 secs Computing kpt #: 9 total cpu time spent up to now is 14.2 secs Computing kpt #: 10 total cpu time spent up to now is 15.3 secs Computing kpt #: 11 total cpu time spent up to now is 16.4 secs Computing kpt #: 12 total cpu time spent up to now is 17.5 secs Computing kpt #: 13 total cpu time spent up to now is 18.7 secs Computing kpt #: 14 total cpu time spent up to now is 19.6 secs Computing kpt #: 15 total cpu time spent up to now is 20.6 secs Computing kpt #: 16 total cpu time spent up to now is 21.6 secs Computing kpt #: 17 total cpu time spent up to now is 22.5 secs Computing kpt #: 18 total cpu time spent up to now is 23.5 secs Computing kpt #: 19 total cpu time spent up to now is 24.5 secs Computing kpt #: 20 total cpu time spent up to now is 25.4 secs Computing kpt #: 21 total cpu time spent up to now is 26.3 secs Computing kpt #: 22 total cpu time spent up to now is 27.2 secs Computing kpt #: 23 total cpu time spent up to now is 28.1 secs Computing kpt #: 24 total cpu time spent up to now is 28.9 secs Computing kpt #: 25 total cpu time spent up to now is 29.8 secs Computing kpt #: 26 total cpu time spent up to now is 30.7 secs Computing kpt #: 27 total cpu time spent up to now is 31.5 secs Computing kpt #: 28 total cpu time spent up to now is 32.4 secs Computing kpt #: 29 total cpu time spent up to now is 33.3 secs Computing kpt #: 30 total cpu time spent up to now is 34.1 secs Computing kpt #: 31 total cpu time spent up to now is 35.0 secs Computing kpt #: 32 total cpu time spent up to now is 35.8 secs Computing kpt #: 33 total cpu time spent up to now is 36.7 secs Computing kpt #: 34 total cpu time spent up to now is 37.5 secs Computing kpt #: 35 total cpu time spent up to now is 38.4 secs Computing kpt #: 36 total cpu time spent up to now is 39.2 secs Computing kpt #: 37 total cpu time spent up to now is 40.1 secs Computing kpt #: 38 total cpu time spent up to now is 41.0 secs Computing kpt #: 39 total cpu time spent up to now is 41.9 secs Computing kpt #: 40 total cpu time spent up to now is 42.8 secs Computing kpt #: 41 total cpu time spent up to now is 43.7 secs Computing kpt #: 42 total cpu time spent up to now is 44.6 secs Computing kpt #: 43 total cpu time spent up to now is 45.5 secs Computing kpt #: 44 total cpu time spent up to now is 46.4 secs Computing kpt #: 45 total cpu time spent up to now is 47.2 secs Computing kpt #: 46 total cpu time spent up to now is 48.1 secs Computing kpt #: 47 total cpu time spent up to now is 49.0 secs Computing kpt #: 48 total cpu time spent up to now is 49.9 secs Computing kpt #: 49 total cpu time spent up to now is 50.8 secs Computing kpt #: 50 total cpu time spent up to now is 51.7 secs Computing kpt #: 51 total cpu time spent up to now is 52.5 secs Computing kpt #: 52 total cpu time spent up to now is 53.4 secs Computing kpt #: 53 total cpu time spent up to now is 54.4 secs Computing kpt #: 54 total cpu time spent up to now is 55.3 secs Computing kpt #: 55 total cpu time spent up to now is 56.3 secs Computing kpt #: 56 total cpu time spent up to now is 57.2 secs Computing kpt #: 57 total cpu time spent up to now is 58.1 secs Computing kpt #: 58 total cpu time spent up to now is 59.0 secs Computing kpt #: 59 total cpu time spent up to now is 60.0 secs Computing kpt #: 60 total cpu time spent up to now is 60.9 secs Computing kpt #: 61 total cpu time spent up to now is 61.9 secs Computing kpt #: 62 total cpu time spent up to now is 62.8 secs Computing kpt #: 63 total cpu time spent up to now is 63.8 secs Computing kpt #: 64 total cpu time spent up to now is 64.8 secs Computing kpt #: 65 total cpu time spent up to now is 65.7 secs Computing kpt #: 66 total cpu time spent up to now is 66.7 secs Computing kpt #: 67 total cpu time spent up to now is 67.7 secs Computing kpt #: 68 total cpu time spent up to now is 68.7 secs Computing kpt #: 69 total cpu time spent up to now is 69.8 secs Computing kpt #: 70 total cpu time spent up to now is 71.0 secs Computing kpt #: 71 total cpu time spent up to now is 72.1 secs Computing kpt #: 72 total cpu time spent up to now is 73.2 secs Computing kpt #: 73 total cpu time spent up to now is 74.4 secs Computing kpt #: 74 total cpu time spent up to now is 75.5 secs Computing kpt #: 75 total cpu time spent up to now is 76.6 secs Computing kpt #: 76 total cpu time spent up to now is 77.8 secs Computing kpt #: 77 total cpu time spent up to now is 78.9 secs Computing kpt #: 78 total cpu time spent up to now is 80.1 secs Computing kpt #: 79 total cpu time spent up to now is 81.2 secs Computing kpt #: 80 total cpu time spent up to now is 82.4 secs Computing kpt #: 81 total cpu time spent up to now is 83.6 secs Computing kpt #: 82 total cpu time spent up to now is 85.1 secs Computing kpt #: 83 total cpu time spent up to now is 86.7 secs Computing kpt #: 84 total cpu time spent up to now is 88.4 secs Computing kpt #: 85 total cpu time spent up to now is 90.1 secs Computing kpt #: 86 total cpu time spent up to now is 91.3 secs Computing kpt #: 87 total cpu time spent up to now is 92.5 secs Computing kpt #: 88 total cpu time spent up to now is 93.6 secs Computing kpt #: 89 total cpu time spent up to now is 94.6 secs Computing kpt #: 90 total cpu time spent up to now is 95.5 secs Computing kpt #: 91 total cpu time spent up to now is 96.5 secs Computing kpt #: 92 total cpu time spent up to now is 97.6 secs Computing kpt #: 93 total cpu time spent up to now is 98.7 secs Computing kpt #: 94 total cpu time spent up to now is 99.8 secs Computing kpt #: 95 total cpu time spent up to now is 100.8 secs Computing kpt #: 96 total cpu time spent up to now is 101.7 secs Computing kpt #: 97 total cpu time spent up to now is 102.7 secs Computing kpt #: 98 total cpu time spent up to now is 103.6 secs Computing kpt #: 99 total cpu time spent up to now is 104.5 secs Computing kpt #: 100 total cpu time spent up to now is 105.4 secs Computing kpt #: 101 total cpu time spent up to now is 106.3 secs Computing kpt #: 102 total cpu time spent up to now is 107.2 secs Computing kpt #: 103 total cpu time spent up to now is 108.1 secs Computing kpt #: 104 total cpu time spent up to now is 109.0 secs Computing kpt #: 105 total cpu time spent up to now is 109.9 secs Computing kpt #: 106 total cpu time spent up to now is 110.8 secs Computing kpt #: 107 total cpu time spent up to now is 111.7 secs Computing kpt #: 108 total cpu time spent up to now is 112.6 secs Computing kpt #: 109 total cpu time spent up to now is 113.4 secs Computing kpt #: 110 total cpu time spent up to now is 114.4 secs Computing kpt #: 111 total cpu time spent up to now is 115.3 secs Computing kpt #: 112 total cpu time spent up to now is 116.2 secs Computing kpt #: 113 total cpu time spent up to now is 117.2 secs Computing kpt #: 114 total cpu time spent up to now is 118.2 secs Computing kpt #: 115 total cpu time spent up to now is 119.2 secs Computing kpt #: 116 total cpu time spent up to now is 120.1 secs Computing kpt #: 117 total cpu time spent up to now is 121.0 secs Computing kpt #: 118 total cpu time spent up to now is 122.0 secs Computing kpt #: 119 total cpu time spent up to now is 123.0 secs Computing kpt #: 120 total cpu time spent up to now is 123.9 secs Computing kpt #: 121 total cpu time spent up to now is 124.8 secs Computing kpt #: 122 total cpu time spent up to now is 125.7 secs Computing kpt #: 123 total cpu time spent up to now is 126.6 secs Computing kpt #: 124 total cpu time spent up to now is 127.5 secs Computing kpt #: 125 total cpu time spent up to now is 128.3 secs Computing kpt #: 126 total cpu time spent up to now is 129.2 secs Computing kpt #: 127 total cpu time spent up to now is 130.0 secs Computing kpt #: 128 total cpu time spent up to now is 130.9 secs Computing kpt #: 129 total cpu time spent up to now is 131.7 secs Computing kpt #: 130 total cpu time spent up to now is 132.6 secs Computing kpt #: 131 total cpu time spent up to now is 133.5 secs Computing kpt #: 132 total cpu time spent up to now is 134.3 secs Computing kpt #: 133 total cpu time spent up to now is 135.2 secs Computing kpt #: 134 total cpu time spent up to now is 136.1 secs Computing kpt #: 135 total cpu time spent up to now is 136.9 secs Computing kpt #: 136 total cpu time spent up to now is 137.8 secs Computing kpt #: 137 total cpu time spent up to now is 138.6 secs Computing kpt #: 138 total cpu time spent up to now is 139.5 secs Computing kpt #: 139 total cpu time spent up to now is 140.4 secs Computing kpt #: 140 total cpu time spent up to now is 141.2 secs Computing kpt #: 141 total cpu time spent up to now is 142.1 secs Computing kpt #: 142 total cpu time spent up to now is 143.0 secs Computing kpt #: 143 total cpu time spent up to now is 143.9 secs Computing kpt #: 144 total cpu time spent up to now is 145.2 secs Computing kpt #: 145 total cpu time spent up to now is 146.1 secs Computing kpt #: 146 total cpu time spent up to now is 147.0 secs Computing kpt #: 147 total cpu time spent up to now is 147.9 secs Computing kpt #: 148 total cpu time spent up to now is 148.8 secs Computing kpt #: 149 total cpu time spent up to now is 149.8 secs Computing kpt #: 150 total cpu time spent up to now is 150.7 secs Computing kpt #: 151 total cpu time spent up to now is 151.7 secs Computing kpt #: 152 total cpu time spent up to now is 152.8 secs Computing kpt #: 153 total cpu time spent up to now is 154.0 secs Computing kpt #: 154 total cpu time spent up to now is 155.1 secs Computing kpt #: 155 total cpu time spent up to now is 156.3 secs Computing kpt #: 156 total cpu time spent up to now is 157.4 secs Computing kpt #: 157 total cpu time spent up to now is 158.6 secs Computing kpt #: 158 total cpu time spent up to now is 159.6 secs Computing kpt #: 159 total cpu time spent up to now is 160.5 secs Computing kpt #: 160 total cpu time spent up to now is 161.5 secs Computing kpt #: 161 total cpu time spent up to now is 162.4 secs Computing kpt #: 162 total cpu time spent up to now is 163.3 secs Computing kpt #: 163 total cpu time spent up to now is 164.3 secs Computing kpt #: 164 total cpu time spent up to now is 165.2 secs Computing kpt #: 165 total cpu time spent up to now is 166.1 secs Computing kpt #: 166 total cpu time spent up to now is 167.0 secs Computing kpt #: 167 total cpu time spent up to now is 168.0 secs Computing kpt #: 168 total cpu time spent up to now is 168.9 secs Computing kpt #: 169 total cpu time spent up to now is 169.8 secs Computing kpt #: 170 total cpu time spent up to now is 170.8 secs Computing kpt #: 171 total cpu time spent up to now is 171.7 secs Computing kpt #: 172 total cpu time spent up to now is 172.6 secs Computing kpt #: 173 total cpu time spent up to now is 173.6 secs Computing kpt #: 174 total cpu time spent up to now is 174.5 secs Computing kpt #: 175 total cpu time spent up to now is 175.4 secs Computing kpt #: 176 total cpu time spent up to now is 176.3 secs Computing kpt #: 177 total cpu time spent up to now is 177.5 secs Computing kpt #: 178 total cpu time spent up to now is 178.6 secs Computing kpt #: 179 total cpu time spent up to now is 179.6 secs Computing kpt #: 180 total cpu time spent up to now is 180.6 secs Computing kpt #: 181 total cpu time spent up to now is 181.6 secs Computing kpt #: 182 total cpu time spent up to now is 182.6 secs Computing kpt #: 183 total cpu time spent up to now is 183.6 secs Computing kpt #: 184 total cpu time spent up to now is 184.5 secs Computing kpt #: 185 total cpu time spent up to now is 185.4 secs Computing kpt #: 186 total cpu time spent up to now is 186.3 secs Computing kpt #: 187 total cpu time spent up to now is 187.2 secs Computing kpt #: 188 total cpu time spent up to now is 188.0 secs Computing kpt #: 189 total cpu time spent up to now is 188.9 secs Computing kpt #: 190 total cpu time spent up to now is 189.8 secs Computing kpt #: 191 total cpu time spent up to now is 190.6 secs Computing kpt #: 192 total cpu time spent up to now is 191.5 secs Computing kpt #: 193 total cpu time spent up to now is 192.4 secs Computing kpt #: 194 total cpu time spent up to now is 193.3 secs Computing kpt #: 195 total cpu time spent up to now is 194.2 secs Computing kpt #: 196 total cpu time spent up to now is 195.1 secs Computing kpt #: 197 total cpu time spent up to now is 196.0 secs Computing kpt #: 198 total cpu time spent up to now is 196.9 secs Computing kpt #: 199 total cpu time spent up to now is 197.8 secs Computing kpt #: 200 total cpu time spent up to now is 198.7 secs Computing kpt #: 201 total cpu time spent up to now is 199.6 secs Computing kpt #: 202 total cpu time spent up to now is 200.4 secs Computing kpt #: 203 total cpu time spent up to now is 201.3 secs Computing kpt #: 204 total cpu time spent up to now is 202.2 secs Computing kpt #: 205 total cpu time spent up to now is 203.0 secs Computing kpt #: 206 total cpu time spent up to now is 203.9 secs Computing kpt #: 207 total cpu time spent up to now is 204.8 secs Computing kpt #: 208 total cpu time spent up to now is 205.7 secs Computing kpt #: 209 total cpu time spent up to now is 206.5 secs Computing kpt #: 210 total cpu time spent up to now is 207.4 secs Computing kpt #: 211 total cpu time spent up to now is 208.2 secs Computing kpt #: 212 total cpu time spent up to now is 209.2 secs Computing kpt #: 213 total cpu time spent up to now is 210.1 secs Computing kpt #: 214 total cpu time spent up to now is 211.0 secs Computing kpt #: 215 total cpu time spent up to now is 212.0 secs Computing kpt #: 216 total cpu time spent up to now is 212.9 secs Computing kpt #: 217 total cpu time spent up to now is 214.0 secs Computing kpt #: 218 total cpu time spent up to now is 215.5 secs Computing kpt #: 219 total cpu time spent up to now is 216.6 secs Computing kpt #: 220 total cpu time spent up to now is 217.7 secs Computing kpt #: 221 total cpu time spent up to now is 218.8 secs Computing kpt #: 222 total cpu time spent up to now is 220.1 secs Computing kpt #: 223 total cpu time spent up to now is 221.4 secs Computing kpt #: 224 total cpu time spent up to now is 222.7 secs Computing kpt #: 225 total cpu time spent up to now is 223.9 secs Computing kpt #: 226 total cpu time spent up to now is 225.2 secs Computing kpt #: 227 total cpu time spent up to now is 226.4 secs Computing kpt #: 228 total cpu time spent up to now is 227.8 secs Computing kpt #: 229 total cpu time spent up to now is 229.0 secs Computing kpt #: 230 total cpu time spent up to now is 230.4 secs Computing kpt #: 231 total cpu time spent up to now is 231.5 secs ethr = 1.56E-08, avg # of iterations = 19.3 total cpu time spent up to now is 231.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 9189 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8832 -8.8832 -8.8821 -8.8821 -8.8655 -8.8655 -8.8636 -8.8636 -7.3381 -7.3381 -7.3018 -7.3018 -7.2766 -7.2766 -7.2650 -7.2650 -7.2593 -7.2593 -7.2585 -7.2585 -7.0903 -7.0903 -7.0432 -7.0432 -6.6842 -6.6842 -6.6820 -6.6820 -6.6722 -6.6722 -6.6701 -6.6701 -6.6635 -6.6635 -6.5980 -6.5980 -2.9075 -2.9075 -1.8401 -1.8401 -1.5023 -1.5023 -0.7818 -0.7818 2.3344 2.3344 2.4528 2.4528 2.4958 2.4958 2.5386 2.5386 2.5994 2.5994 2.9901 2.9901 3.8236 3.8236 3.8733 3.8733 4.7321 4.7321 5.5780 5.5780 5.7678 5.7678 6.4628 6.4628 k = 0.0167 0.0096-0.0000 ( 9161 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8832 -8.8832 -8.8821 -8.8821 -8.8655 -8.8655 -8.8636 -8.8636 -7.3381 -7.3381 -7.3019 -7.3019 -7.2766 -7.2766 -7.2650 -7.2650 -7.2593 -7.2593 -7.2585 -7.2585 -7.0902 -7.0902 -7.0431 -7.0431 -6.6842 -6.6842 -6.6819 -6.6819 -6.6726 -6.6726 -6.6697 -6.6697 -6.6635 -6.6635 -6.5980 -6.5980 -2.9073 -2.9073 -1.8396 -1.8396 -1.5028 -1.5028 -0.7838 -0.7838 2.3325 2.3325 2.4449 2.4449 2.5024 2.5024 2.5373 2.5373 2.6010 2.6010 2.9898 2.9898 3.8288 3.8288 3.8699 3.8699 4.7367 4.7367 5.5753 5.5753 5.7726 5.7726 6.4661 6.4662 k = 0.0333 0.0192-0.0000 ( 9161 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8832 -8.8832 -8.8820 -8.8820 -8.8655 -8.8655 -8.8636 -8.8636 -7.3381 -7.3381 -7.3020 -7.3020 -7.2765 -7.2765 -7.2650 -7.2650 -7.2595 -7.2595 -7.2585 -7.2585 -7.0898 -7.0898 -7.0426 -7.0426 -6.6843 -6.6843 -6.6819 -6.6819 -6.6733 -6.6733 -6.6688 -6.6688 -6.6636 -6.6636 -6.5979 -6.5979 -2.9067 -2.9067 -1.8384 -1.8384 -1.5044 -1.5044 -0.7898 -0.7898 2.3268 2.3268 2.4282 2.4282 2.5152 2.5152 2.5334 2.5334 2.6055 2.6055 2.9887 2.9887 3.8444 3.8444 3.8601 3.8601 4.7503 4.7503 5.5681 5.5681 5.7863 5.7863 6.4751 6.4751 k = 0.0500 0.0289-0.0000 ( 9167 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8831 -8.8831 -8.8820 -8.8820 -8.8655 -8.8655 -8.8636 -8.8636 -7.3381 -7.3381 -7.3023 -7.3023 -7.2765 -7.2765 -7.2650 -7.2650 -7.2598 -7.2598 -7.2585 -7.2585 -7.0890 -7.0890 -7.0418 -7.0418 -6.6843 -6.6843 -6.6818 -6.6818 -6.6742 -6.6742 -6.6677 -6.6677 -6.6637 -6.6637 -6.5978 -6.5978 -2.9055 -2.9055 -1.8363 -1.8363 -1.5071 -1.5071 -0.7998 -0.7998 2.3177 2.3177 2.4090 2.4090 2.5268 2.5268 2.5286 2.5286 2.6126 2.6126 2.9869 2.9869 3.8439 3.8439 3.8703 3.8703 4.7730 4.7730 5.5580 5.5580 5.8066 5.8066 6.4838 6.4838 k = 0.0667 0.0385-0.0000 ( 9159 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8831 -8.8831 -8.8819 -8.8819 -8.8655 -8.8655 -8.8637 -8.8637 -7.3381 -7.3381 -7.3026 -7.3026 -7.2764 -7.2764 -7.2651 -7.2651 -7.2601 -7.2601 -7.2584 -7.2584 -7.0880 -7.0880 -7.0407 -7.0407 -6.6844 -6.6844 -6.6818 -6.6818 -6.6750 -6.6750 -6.6666 -6.6666 -6.6639 -6.6639 -6.5976 -6.5976 -2.9040 -2.9040 -1.8334 -1.8334 -1.5108 -1.5108 -0.8136 -0.8136 2.3051 2.3051 2.3901 2.3901 2.5181 2.5181 2.5403 2.5403 2.6216 2.6216 2.9843 2.9843 3.8232 3.8232 3.9047 3.9047 4.8043 4.8043 5.5463 5.5463 5.8313 5.8313 6.4747 6.4747 k = 0.0833 0.0481-0.0000 ( 9173 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8831 -8.8831 -8.8819 -8.8819 -8.8655 -8.8655 -8.8638 -8.8638 -7.3381 -7.3381 -7.3030 -7.3030 -7.2764 -7.2764 -7.2651 -7.2651 -7.2606 -7.2606 -7.2584 -7.2584 -7.0867 -7.0867 -7.0393 -7.0393 -6.6845 -6.6845 -6.6817 -6.6817 -6.6758 -6.6758 -6.6654 -6.6654 -6.6641 -6.6641 -6.5973 -6.5973 -2.9019 -2.9019 -1.8298 -1.8298 -1.5154 -1.5154 -0.8311 -0.8311 2.2888 2.2888 2.3738 2.3738 2.5072 2.5072 2.5501 2.5501 2.6320 2.6320 2.9809 2.9809 3.7989 3.7989 3.9472 3.9472 4.8440 4.8440 5.5339 5.5339 5.8586 5.8586 6.4509 6.4509 k = 0.1000 0.0577-0.0000 ( 9165 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4660 -9.4660 -9.4617 -9.4617 -8.8831 -8.8831 -8.8818 -8.8818 -8.8655 -8.8655 -8.8638 -8.8638 -7.3381 -7.3381 -7.3035 -7.3035 -7.2763 -7.2763 -7.2651 -7.2651 -7.2611 -7.2611 -7.2583 -7.2583 -7.0852 -7.0852 -7.0377 -7.0377 -6.6847 -6.6847 -6.6816 -6.6816 -6.6766 -6.6766 -6.6649 -6.6649 -6.6637 -6.6637 -6.5971 -6.5971 -2.8994 -2.8994 -1.8254 -1.8254 -1.5211 -1.5211 -0.8522 -0.8522 2.2682 2.2682 2.3621 2.3621 2.4942 2.4942 2.5577 2.5577 2.6431 2.6431 2.9766 2.9766 3.7726 3.7726 3.9965 3.9965 4.8915 4.8915 5.5213 5.5213 5.8870 5.8870 6.4222 6.4222 k = 0.1167 0.0674-0.0000 ( 9157 PWs) bands (ev): -9.5042 -9.5042 -9.4819 -9.4819 -9.4660 -9.4660 -9.4617 -9.4617 -8.8830 -8.8830 -8.8817 -8.8817 -8.8655 -8.8655 -8.8639 -8.8639 -7.3381 -7.3381 -7.3041 -7.3041 -7.2762 -7.2762 -7.2652 -7.2652 -7.2616 -7.2616 -7.2583 -7.2583 -7.0834 -7.0834 -7.0359 -7.0359 -6.6849 -6.6849 -6.6814 -6.6814 -6.6774 -6.6774 -6.6651 -6.6651 -6.6624 -6.6624 -6.5967 -6.5967 -2.8964 -2.8964 -1.8203 -1.8203 -1.5276 -1.5276 -0.8766 -0.8766 2.2437 2.2437 2.3557 2.3557 2.4797 2.4797 2.5629 2.5629 2.6540 2.6540 2.9714 2.9714 3.7459 3.7459 4.0513 4.0513 4.9462 4.9462 5.5085 5.5085 5.9156 5.9156 6.3914 6.3914 k = 0.1333 0.0770-0.0000 ( 9167 PWs) bands (ev): -9.5042 -9.5042 -9.4819 -9.4819 -9.4660 -9.4660 -9.4618 -9.4618 -8.8830 -8.8830 -8.8816 -8.8816 -8.8655 -8.8655 -8.8640 -8.8640 -7.3382 -7.3382 -7.3047 -7.3047 -7.2761 -7.2761 -7.2654 -7.2654 -7.2622 -7.2622 -7.2582 -7.2582 -7.0814 -7.0814 -7.0338 -7.0338 -6.6851 -6.6851 -6.6813 -6.6813 -6.6781 -6.6781 -6.6654 -6.6654 -6.6609 -6.6609 -6.5964 -6.5964 -2.8928 -2.8928 -1.8145 -1.8145 -1.5350 -1.5350 -0.9041 -0.9041 2.2164 2.2164 2.3546 2.3546 2.4639 2.4639 2.5659 2.5659 2.6636 2.6636 2.9654 2.9654 3.7206 3.7206 4.1106 4.1106 5.0073 5.0073 5.4957 5.4957 5.9436 5.9436 6.3597 6.3597 k = 0.1500 0.0866-0.0000 ( 9171 PWs) bands (ev): -9.5042 -9.5042 -9.4819 -9.4819 -9.4660 -9.4660 -9.4618 -9.4618 -8.8829 -8.8829 -8.8815 -8.8815 -8.8655 -8.8655 -8.8641 -8.8641 -7.3382 -7.3382 -7.3055 -7.3055 -7.2759 -7.2759 -7.2656 -7.2656 -7.2627 -7.2627 -7.2581 -7.2581 -7.0791 -7.0791 -7.0316 -7.0316 -6.6853 -6.6853 -6.6812 -6.6812 -6.6788 -6.6788 -6.6658 -6.6658 -6.6594 -6.6594 -6.5961 -6.5961 -2.8887 -2.8887 -1.8082 -1.8082 -1.5432 -1.5432 -0.9344 -0.9344 2.1872 2.1872 2.3581 2.3581 2.4475 2.4475 2.5669 2.5669 2.6712 2.6712 2.9583 2.9583 3.6982 3.6982 4.1732 4.1732 5.0736 5.0736 5.4830 5.4830 5.9704 5.9704 6.3279 6.3279 k = 0.1667 0.0962-0.0000 ( 9173 PWs) bands (ev): -9.5042 -9.5042 -9.4819 -9.4819 -9.4660 -9.4660 -9.4618 -9.4618 -8.8829 -8.8829 -8.8814 -8.8814 -8.8655 -8.8655 -8.8643 -8.8643 -7.3382 -7.3382 -7.3062 -7.3062 -7.2758 -7.2758 -7.2660 -7.2660 -7.2631 -7.2631 -7.2580 -7.2580 -7.0767 -7.0767 -7.0293 -7.0293 -6.6855 -6.6855 -6.6811 -6.6811 -6.6794 -6.6794 -6.6662 -6.6662 -6.6578 -6.6578 -6.5958 -6.5958 -2.8841 -2.8841 -1.8013 -1.8013 -1.5522 -1.5522 -0.9671 -0.9671 2.1570 2.1570 2.3649 2.3649 2.4321 2.4321 2.5663 2.5663 2.6756 2.6756 2.9504 2.9504 3.6803 3.6803 4.2383 4.2383 5.1435 5.1435 5.4709 5.4709 5.9954 5.9954 6.2968 6.2968 k = 0.1833 0.1058-0.0000 ( 9177 PWs) bands (ev): -9.5042 -9.5042 -9.4820 -9.4820 -9.4659 -9.4659 -9.4618 -9.4618 -8.8828 -8.8828 -8.8813 -8.8813 -8.8655 -8.8655 -8.8644 -8.8644 -7.3382 -7.3382 -7.3071 -7.3071 -7.2756 -7.2756 -7.2665 -7.2665 -7.2634 -7.2634 -7.2580 -7.2580 -7.0742 -7.0742 -7.0269 -7.0269 -6.6857 -6.6857 -6.6810 -6.6810 -6.6800 -6.6800 -6.6666 -6.6666 -6.6560 -6.6560 -6.5955 -6.5955 -2.8788 -2.8788 -1.7939 -1.7939 -1.5620 -1.5620 -1.0018 -1.0018 2.1264 2.1264 2.3702 2.3702 2.4226 2.4226 2.5642 2.5642 2.6761 2.6761 2.9416 2.9416 3.6682 3.6682 4.3049 4.3049 5.2147 5.2147 5.4603 5.4603 6.0178 6.0178 6.2669 6.2669 k = 0.2000 0.1155-0.0000 ( 9177 PWs) bands (ev): -9.5042 -9.5042 -9.4820 -9.4820 -9.4659 -9.4659 -9.4618 -9.4618 -8.8827 -8.8827 -8.8812 -8.8812 -8.8655 -8.8655 -8.8646 -8.8646 -7.3382 -7.3382 -7.3080 -7.3080 -7.2755 -7.2755 -7.2671 -7.2671 -7.2636 -7.2636 -7.2579 -7.2579 -7.0715 -7.0715 -7.0244 -7.0244 -6.6859 -6.6859 -6.6811 -6.6811 -6.6803 -6.6803 -6.6670 -6.6670 -6.6542 -6.6542 -6.5953 -6.5953 -2.8730 -2.8730 -1.7861 -1.7861 -1.5724 -1.5724 -1.0381 -1.0381 2.0959 2.0959 2.3650 2.3650 2.4281 2.4281 2.5609 2.5609 2.6723 2.6723 2.9320 2.9320 3.6626 3.6626 4.3724 4.3724 5.2824 5.2824 5.4544 5.4544 6.0368 6.0368 6.2388 6.2388 k = 0.2167 0.1251-0.0000 ( 9187 PWs) bands (ev): -9.5041 -9.5041 -9.4820 -9.4820 -9.4659 -9.4659 -9.4618 -9.4618 -8.8827 -8.8827 -8.8811 -8.8811 -8.8656 -8.8656 -8.8647 -8.8647 -7.3382 -7.3382 -7.3089 -7.3089 -7.2753 -7.2753 -7.2678 -7.2678 -7.2637 -7.2637 -7.2578 -7.2578 -7.0687 -7.0687 -7.0219 -7.0219 -6.6861 -6.6861 -6.6815 -6.6815 -6.6803 -6.6803 -6.6674 -6.6674 -6.6523 -6.6523 -6.5950 -6.5950 -2.8666 -2.8666 -1.7780 -1.7780 -1.5835 -1.5835 -1.0755 -1.0755 2.0657 2.0657 2.3499 2.3499 2.4482 2.4482 2.5565 2.5565 2.6638 2.6638 2.9218 2.9218 3.6641 3.6641 4.4400 4.4400 5.3349 5.3349 5.4632 5.4632 6.0511 6.0511 6.2129 6.2129 k = 0.2333 0.1347-0.0000 ( 9176 PWs) bands (ev): -9.5041 -9.5041 -9.4821 -9.4821 -9.4659 -9.4659 -9.4618 -9.4618 -8.8826 -8.8826 -8.8809 -8.8809 -8.8656 -8.8656 -8.8648 -8.8648 -7.3383 -7.3383 -7.3099 -7.3099 -7.2752 -7.2752 -7.2685 -7.2685 -7.2637 -7.2637 -7.2577 -7.2577 -7.0659 -7.0659 -7.0194 -7.0194 -6.6863 -6.6863 -6.6820 -6.6820 -6.6802 -6.6802 -6.6677 -6.6677 -6.6504 -6.6504 -6.5949 -6.5949 -2.8597 -2.8597 -1.7697 -1.7697 -1.5953 -1.5953 -1.1136 -1.1136 2.0363 2.0363 2.3309 2.3309 2.4765 2.4765 2.5513 2.5513 2.6509 2.6509 2.9111 2.9111 3.6727 3.6727 4.5071 4.5071 5.3560 5.3560 5.5005 5.5005 6.0590 6.0590 6.1892 6.1892 k = 0.2500 0.1443-0.0000 ( 9176 PWs) bands (ev): -9.5041 -9.5041 -9.4821 -9.4821 -9.4658 -9.4658 -9.4618 -9.4618 -8.8825 -8.8825 -8.8808 -8.8808 -8.8656 -8.8656 -8.8650 -8.8650 -7.3383 -7.3383 -7.3108 -7.3108 -7.2750 -7.2750 -7.2693 -7.2693 -7.2637 -7.2637 -7.2576 -7.2576 -7.0630 -7.0630 -7.0169 -7.0169 -6.6865 -6.6865 -6.6825 -6.6825 -6.6801 -6.6801 -6.6680 -6.6680 -6.6484 -6.6484 -6.5948 -6.5948 -2.8522 -2.8522 -1.7612 -1.7612 -1.6078 -1.6078 -1.1517 -1.1517 2.0078 2.0078 2.3107 2.3107 2.5102 2.5102 2.5458 2.5458 2.6341 2.6341 2.9001 2.9001 3.6877 3.6877 4.5733 4.5733 5.3535 5.3535 5.5567 5.5567 6.0597 6.0597 6.1665 6.1665 k = 0.2667 0.1540-0.0000 ( 9172 PWs) bands (ev): -9.5041 -9.5041 -9.4821 -9.4821 -9.4658 -9.4658 -9.4618 -9.4618 -8.8824 -8.8824 -8.8807 -8.8807 -8.8657 -8.8657 -8.8651 -8.8651 -7.3383 -7.3383 -7.3118 -7.3118 -7.2748 -7.2748 -7.2701 -7.2701 -7.2637 -7.2637 -7.2575 -7.2575 -7.0602 -7.0602 -7.0144 -7.0144 -6.6867 -6.6867 -6.6830 -6.6830 -6.6801 -6.6801 -6.6683 -6.6683 -6.6463 -6.6463 -6.5947 -6.5947 -2.8441 -2.8441 -1.7527 -1.7527 -1.6210 -1.6210 -1.1893 -1.1893 1.9804 1.9804 2.2902 2.2902 2.5343 2.5343 2.5537 2.5537 2.6145 2.6145 2.8890 2.8890 3.7083 3.7083 4.6379 4.6379 5.3417 5.3417 5.6150 5.6150 6.0535 6.0535 6.1423 6.1423 k = 0.2833 0.1636-0.0000 ( 9184 PWs) bands (ev): -9.5041 -9.5041 -9.4822 -9.4822 -9.4658 -9.4658 -9.4618 -9.4618 -8.8823 -8.8823 -8.8806 -8.8806 -8.8657 -8.8657 -8.8653 -8.8653 -7.3383 -7.3383 -7.3127 -7.3127 -7.2747 -7.2747 -7.2708 -7.2708 -7.2637 -7.2637 -7.2574 -7.2574 -7.0574 -7.0574 -7.0121 -7.0121 -6.6868 -6.6868 -6.6834 -6.6834 -6.6800 -6.6800 -6.6686 -6.6686 -6.6441 -6.6441 -6.5948 -6.5948 -2.8356 -2.8356 -1.7441 -1.7441 -1.6350 -1.6350 -1.2260 -1.2260 1.9543 1.9543 2.2699 2.2699 2.5286 2.5286 2.5873 2.5873 2.6004 2.6004 2.8778 2.8778 3.7336 3.7336 4.7006 4.7006 5.3262 5.3262 5.6679 5.6679 6.0424 6.0424 6.1137 6.1137 k = 0.3000 0.1732-0.0000 ( 9180 PWs) bands (ev): -9.5041 -9.5041 -9.4822 -9.4822 -9.4658 -9.4658 -9.4619 -9.4619 -8.8822 -8.8822 -8.8804 -8.8804 -8.8658 -8.8658 -8.8654 -8.8654 -7.3384 -7.3384 -7.3137 -7.3137 -7.2745 -7.2745 -7.2715 -7.2715 -7.2637 -7.2637 -7.2574 -7.2574 -7.0547 -7.0547 -7.0098 -7.0098 -6.6869 -6.6869 -6.6838 -6.6838 -6.6800 -6.6800 -6.6688 -6.6688 -6.6419 -6.6419 -6.5949 -6.5949 -2.8268 -2.8268 -1.7357 -1.7357 -1.6496 -1.6496 -1.2612 -1.2612 1.9297 1.9297 2.2500 2.2500 2.5197 2.5197 2.5692 2.5692 2.6430 2.6430 2.8668 2.8668 3.7621 3.7621 4.7606 4.7606 5.3085 5.3085 5.7124 5.7124 6.0285 6.0285 6.0796 6.0796 k = 0.3167 0.1828-0.0000 ( 9162 PWs) bands (ev): -9.5041 -9.5041 -9.4822 -9.4822 -9.4658 -9.4658 -9.4619 -9.4619 -8.8821 -8.8821 -8.8803 -8.8803 -8.8658 -8.8658 -8.8655 -8.8655 -7.3384 -7.3384 -7.3146 -7.3146 -7.2743 -7.2743 -7.2722 -7.2722 -7.2637 -7.2637 -7.2573 -7.2573 -7.0521 -7.0521 -7.0076 -7.0076 -6.6870 -6.6870 -6.6842 -6.6842 -6.6799 -6.6799 -6.6689 -6.6689 -6.6397 -6.6397 -6.5952 -6.5952 -2.8176 -2.8176 -1.7275 -1.7275 -1.6649 -1.6649 -1.2943 -1.2943 1.9066 1.9066 2.2308 2.2308 2.5080 2.5080 2.5490 2.5490 2.6926 2.6926 2.8560 2.8560 3.7927 3.7927 4.8176 4.8176 5.2894 5.2894 5.7467 5.7467 6.0129 6.0129 6.0422 6.0422 k = 0.3333 0.1925-0.0000 ( 9146 PWs) bands (ev): -9.5041 -9.5041 -9.4822 -9.4822 -9.4657 -9.4657 -9.4619 -9.4619 -8.8820 -8.8820 -8.8802 -8.8802 -8.8659 -8.8659 -8.8656 -8.8656 -7.3384 -7.3384 -7.3154 -7.3154 -7.2742 -7.2742 -7.2728 -7.2728 -7.2636 -7.2636 -7.2572 -7.2572 -7.0497 -7.0497 -7.0055 -7.0055 -6.6870 -6.6870 -6.6845 -6.6845 -6.6799 -6.6799 -6.6691 -6.6691 -6.6374 -6.6374 -6.5955 -6.5955 -2.8082 -2.8082 -1.7197 -1.7197 -1.6809 -1.6809 -1.3249 -1.3249 1.8851 1.8851 2.2126 2.2126 2.4923 2.4923 2.5328 2.5328 2.7447 2.7447 2.8457 2.8457 3.8240 3.8240 4.8707 4.8707 5.2692 5.2692 5.7703 5.7703 5.9928 5.9928 6.0084 6.0084 k = 0.3500 0.2021-0.0000 ( 9150 PWs) bands (ev): -9.5040 -9.5040 -9.4822 -9.4822 -9.4657 -9.4657 -9.4619 -9.4619 -8.8819 -8.8819 -8.8801 -8.8801 -8.8660 -8.8660 -8.8657 -8.8657 -7.3384 -7.3384 -7.3163 -7.3163 -7.2740 -7.2740 -7.2733 -7.2733 -7.2636 -7.2636 -7.2571 -7.2571 -7.0474 -7.0474 -7.0035 -7.0035 -6.6870 -6.6870 -6.6848 -6.6848 -6.6800 -6.6800 -6.6692 -6.6692 -6.6352 -6.6352 -6.5959 -6.5959 -2.7987 -2.7987 -1.7122 -1.7122 -1.6973 -1.6973 -1.3527 -1.3527 1.8655 1.8655 2.1956 2.1956 2.4730 2.4730 2.5211 2.5211 2.7983 2.7983 2.8360 2.8360 3.8547 3.8547 4.9192 4.9192 5.2484 5.2484 5.7831 5.7831 5.9613 5.9613 5.9895 5.9895 k = 0.3667 0.2117-0.0000 ( 9140 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4657 -9.4657 -9.4619 -9.4619 -8.8818 -8.8818 -8.8800 -8.8800 -8.8661 -8.8661 -8.8657 -8.8657 -7.3385 -7.3385 -7.3170 -7.3170 -7.2740 -7.2740 -7.2737 -7.2737 -7.2635 -7.2635 -7.2570 -7.2570 -7.0454 -7.0454 -7.0018 -7.0018 -6.6870 -6.6870 -6.6851 -6.6851 -6.6801 -6.6801 -6.6692 -6.6692 -6.6330 -6.6330 -6.5964 -6.5964 -2.7894 -2.7894 -1.7139 -1.7139 -1.7053 -1.7053 -1.3775 -1.3775 1.8477 1.8477 2.1798 2.1798 2.4523 2.4523 2.5124 2.5124 2.8263 2.8263 2.8530 2.8530 3.8835 3.8835 4.9621 4.9621 5.2277 5.2277 5.7858 5.7858 5.9312 5.9312 5.9758 5.9758 k = 0.3833 0.2213-0.0000 ( 9146 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4657 -9.4657 -9.4619 -9.4619 -8.8817 -8.8817 -8.8799 -8.8799 -8.8662 -8.8662 -8.8658 -8.8658 -7.3385 -7.3385 -7.3177 -7.3177 -7.2744 -7.2744 -7.2737 -7.2737 -7.2635 -7.2635 -7.2570 -7.2570 -7.0436 -7.0436 -7.0001 -7.0001 -6.6870 -6.6870 -6.6853 -6.6853 -6.6801 -6.6801 -6.6693 -6.6693 -6.6308 -6.6308 -6.5970 -6.5970 -2.7804 -2.7804 -1.7304 -1.7304 -1.6989 -1.6989 -1.3990 -1.3990 1.8318 1.8318 2.1655 2.1655 2.4320 2.4320 2.5055 2.5055 2.8180 2.8180 2.9065 2.9065 3.9095 3.9095 4.9978 4.9978 5.2086 5.2086 5.7807 5.7807 5.9073 5.9073 5.9641 5.9641 k = 0.4000 0.2309-0.0000 ( 9132 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4657 -9.4657 -9.4619 -9.4619 -8.8817 -8.8817 -8.8798 -8.8798 -8.8663 -8.8663 -8.8658 -8.8658 -7.3385 -7.3385 -7.3183 -7.3183 -7.2748 -7.2748 -7.2736 -7.2736 -7.2635 -7.2635 -7.2569 -7.2569 -7.0419 -7.0419 -6.9987 -6.9987 -6.6870 -6.6870 -6.6855 -6.6855 -6.6802 -6.6802 -6.6693 -6.6693 -6.6288 -6.6288 -6.5977 -6.5977 -2.7719 -2.7719 -1.7462 -1.7462 -1.6932 -1.6932 -1.4174 -1.4174 1.8179 1.8179 2.1528 2.1528 2.4134 2.4134 2.4998 2.4998 2.8105 2.8105 2.9583 2.9583 3.9317 3.9317 5.0245 5.0245 5.1935 5.1935 5.7716 5.7716 5.8884 5.8884 5.9538 5.9538 k = 0.4167 0.2406-0.0000 ( 9132 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4657 -9.4657 -9.4619 -9.4619 -8.8816 -8.8816 -8.8797 -8.8797 -8.8664 -8.8664 -8.8658 -8.8658 -7.3385 -7.3385 -7.3188 -7.3188 -7.2752 -7.2752 -7.2735 -7.2735 -7.2634 -7.2634 -7.2569 -7.2569 -7.0406 -7.0406 -6.9975 -6.9975 -6.6869 -6.6869 -6.6856 -6.6856 -6.6803 -6.6803 -6.6693 -6.6693 -6.6269 -6.6269 -6.5984 -6.5984 -2.7642 -2.7642 -1.7609 -1.7609 -1.6883 -1.6883 -1.4326 -1.4326 1.8061 1.8061 2.1418 2.1418 2.3969 2.3969 2.4950 2.4950 2.8039 2.8039 3.0069 3.0069 3.9495 3.9495 5.0400 5.0400 5.1852 5.1852 5.7631 5.7631 5.8721 5.8721 5.9451 5.9451 k = 0.4333 0.2502-0.0000 ( 9130 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8815 -8.8815 -8.8797 -8.8797 -8.8664 -8.8664 -8.8659 -8.8659 -7.3386 -7.3386 -7.3193 -7.3193 -7.2754 -7.2754 -7.2734 -7.2734 -7.2634 -7.2634 -7.2568 -7.2568 -7.0394 -7.0394 -6.9964 -6.9964 -6.6869 -6.6869 -6.6858 -6.6858 -6.6804 -6.6804 -6.6693 -6.6693 -6.6251 -6.6251 -6.5991 -6.5991 -2.7575 -2.7575 -1.7738 -1.7738 -1.6841 -1.6841 -1.4447 -1.4447 1.7964 1.7964 2.1327 2.1327 2.3830 2.3830 2.4911 2.4911 2.7984 2.7984 3.0504 3.0504 3.9627 3.9627 5.0443 5.0443 5.1847 5.1847 5.7579 5.7579 5.8564 5.8564 5.9381 5.9381 k = 0.4500 0.2598-0.0000 ( 9126 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8815 -8.8815 -8.8796 -8.8796 -8.8665 -8.8665 -8.8659 -8.8659 -7.3386 -7.3386 -7.3196 -7.3196 -7.2757 -7.2757 -7.2733 -7.2733 -7.2634 -7.2634 -7.2568 -7.2568 -7.0385 -7.0385 -6.9956 -6.9956 -6.6869 -6.6869 -6.6859 -6.6859 -6.6805 -6.6805 -6.6693 -6.6693 -6.6237 -6.6237 -6.5998 -6.5998 -2.7519 -2.7519 -1.7846 -1.7846 -1.6808 -1.6808 -1.4540 -1.4540 1.7888 1.7888 2.1255 2.1255 2.3719 2.3719 2.4881 2.4881 2.7940 2.7940 3.0871 3.0871 3.9717 3.9717 5.0412 5.0412 5.1894 5.1894 5.7573 5.7573 5.8407 5.8407 5.9327 5.9327 k = 0.4667 0.2694-0.0000 ( 9124 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8814 -8.8814 -8.8796 -8.8796 -8.8665 -8.8665 -8.8659 -8.8659 -7.3386 -7.3386 -7.3199 -7.3199 -7.2758 -7.2758 -7.2733 -7.2733 -7.2634 -7.2634 -7.2567 -7.2567 -7.0379 -7.0379 -6.9950 -6.9950 -6.6868 -6.6868 -6.6859 -6.6859 -6.6806 -6.6806 -6.6693 -6.6693 -6.6225 -6.6225 -6.6004 -6.6004 -2.7478 -2.7478 -1.7926 -1.7926 -1.6785 -1.6785 -1.4605 -1.4605 1.7833 1.7833 2.1203 2.1203 2.3639 2.3639 2.4859 2.4859 2.7909 2.7909 3.1151 3.1151 3.9771 3.9771 5.0357 5.0357 5.1952 5.1952 5.7608 5.7608 5.8255 5.8255 5.9288 5.9288 k = 0.4833 0.2791-0.0000 ( 9118 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8814 -8.8814 -8.8796 -8.8796 -8.8666 -8.8666 -8.8659 -8.8659 -7.3386 -7.3386 -7.3200 -7.3200 -7.2759 -7.2759 -7.2732 -7.2732 -7.2634 -7.2634 -7.2567 -7.2567 -7.0375 -7.0375 -6.9947 -6.9947 -6.6868 -6.6868 -6.6859 -6.6859 -6.6806 -6.6806 -6.6693 -6.6693 -6.6218 -6.6218 -6.6007 -6.6007 -2.7453 -2.7453 -1.7976 -1.7976 -1.6770 -1.6770 -1.4643 -1.4643 1.7800 1.7800 2.1171 2.1171 2.3590 2.3590 2.4846 2.4846 2.7889 2.7889 3.1326 3.1326 3.9798 3.9798 5.0312 5.0312 5.1996 5.1996 5.7668 5.7668 5.8127 5.8127 5.9266 5.9266 k = 0.5000 0.2887-0.0000 ( 9114 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8814 -8.8814 -8.8796 -8.8796 -8.8666 -8.8666 -8.8659 -8.8659 -7.3386 -7.3386 -7.3201 -7.3201 -7.2760 -7.2760 -7.2732 -7.2732 -7.2634 -7.2634 -7.2567 -7.2567 -7.0374 -7.0374 -6.9945 -6.9945 -6.6868 -6.6868 -6.6860 -6.6860 -6.6807 -6.6807 -6.6693 -6.6693 -6.6215 -6.6215 -6.6009 -6.6009 -2.7444 -2.7444 -1.7992 -1.7992 -1.6765 -1.6765 -1.4656 -1.4656 1.7789 1.7789 2.1161 2.1161 2.3574 2.3574 2.4842 2.4842 2.7883 2.7883 3.1386 3.1386 3.9806 3.9806 5.0295 5.0295 5.2012 5.2012 5.7703 5.7703 5.8068 5.8068 5.9258 5.9258 k = 0.5000 0.2887-0.0000 ( 9114 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8814 -8.8814 -8.8796 -8.8796 -8.8666 -8.8666 -8.8659 -8.8659 -7.3386 -7.3386 -7.3201 -7.3201 -7.2760 -7.2760 -7.2732 -7.2732 -7.2634 -7.2634 -7.2567 -7.2567 -7.0374 -7.0374 -6.9945 -6.9945 -6.6868 -6.6868 -6.6860 -6.6860 -6.6807 -6.6807 -6.6693 -6.6693 -6.6215 -6.6215 -6.6009 -6.6009 -2.7444 -2.7444 -1.7992 -1.7992 -1.6765 -1.6765 -1.4656 -1.4656 1.7789 1.7789 2.1161 2.1161 2.3574 2.3574 2.4842 2.4842 2.7883 2.7883 3.1386 3.1386 3.9806 3.9806 5.0295 5.0295 5.2012 5.2012 5.7703 5.7703 5.8068 5.8068 5.9258 5.9258 k = 0.4902 0.3057-0.0000 ( 9110 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8814 -8.8814 -8.8796 -8.8796 -8.8667 -8.8667 -8.8658 -8.8658 -7.3386 -7.3386 -7.3201 -7.3201 -7.2760 -7.2760 -7.2732 -7.2732 -7.2634 -7.2634 -7.2567 -7.2567 -7.0375 -7.0375 -6.9943 -6.9943 -6.6868 -6.6868 -6.6859 -6.6859 -6.6806 -6.6806 -6.6693 -6.6693 -6.6221 -6.6221 -6.6004 -6.6004 -2.7438 -2.7438 -1.7991 -1.7991 -1.6764 -1.6764 -1.4679 -1.4679 1.7837 1.7837 2.1169 2.1169 2.3320 2.3320 2.5107 2.5107 2.7868 2.7868 3.1371 3.1371 3.9804 3.9804 5.0257 5.0257 5.1973 5.1973 5.7074 5.7074 5.8579 5.8579 5.9379 5.9379 k = 0.4804 0.3226-0.0000 ( 9116 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8814 -8.8814 -8.8796 -8.8796 -8.8669 -8.8669 -8.8656 -8.8656 -7.3386 -7.3386 -7.3200 -7.3200 -7.2760 -7.2760 -7.2732 -7.2732 -7.2636 -7.2636 -7.2567 -7.2567 -7.0377 -7.0377 -6.9936 -6.9936 -6.6869 -6.6869 -6.6859 -6.6859 -6.6806 -6.6806 -6.6693 -6.6693 -6.6235 -6.6235 -6.5990 -6.5990 -2.7419 -2.7419 -1.7988 -1.7988 -1.6760 -1.6760 -1.4747 -1.4747 1.7979 1.7979 2.1193 2.1193 2.2830 2.2830 2.5628 2.5628 2.7828 2.7828 3.1324 3.1324 3.9797 3.9797 5.0144 5.0144 5.1858 5.1858 5.6310 5.6310 5.8770 5.8770 5.9962 5.9962 k = 0.4706 0.3396-0.0000 ( 9120 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4619 -9.4619 -8.8814 -8.8814 -8.8796 -8.8796 -8.8672 -8.8672 -8.8653 -8.8653 -7.3386 -7.3386 -7.3200 -7.3200 -7.2761 -7.2761 -7.2732 -7.2732 -7.2638 -7.2638 -7.2567 -7.2567 -7.0382 -7.0382 -6.9925 -6.9925 -6.6870 -6.6870 -6.6858 -6.6858 -6.6806 -6.6806 -6.6693 -6.6693 -6.6255 -6.6255 -6.5970 -6.5970 -2.7387 -2.7387 -1.7982 -1.7982 -1.6752 -1.6752 -1.4858 -1.4858 1.8213 1.8213 2.1227 2.1227 2.2308 2.2308 2.6188 2.6188 2.7779 2.7779 3.1247 3.1247 3.9788 3.9788 4.9956 4.9956 5.1660 5.1660 5.5596 5.5596 5.8683 5.8683 6.0807 6.0807 k = 0.4608 0.3566-0.0000 ( 9126 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4619 -9.4619 -8.8813 -8.8813 -8.8796 -8.8796 -8.8675 -8.8675 -8.8651 -8.8651 -7.3386 -7.3386 -7.3199 -7.3199 -7.2762 -7.2762 -7.2732 -7.2732 -7.2641 -7.2641 -7.2567 -7.2567 -7.0387 -7.0387 -6.9910 -6.9910 -6.6871 -6.6871 -6.6856 -6.6856 -6.6805 -6.6805 -6.6693 -6.6693 -6.6278 -6.6278 -6.5946 -6.5946 -2.7344 -2.7344 -1.7974 -1.7974 -1.6742 -1.6742 -1.5009 -1.5009 1.8532 1.8532 2.1239 2.1239 2.1834 2.1834 2.6673 2.6673 2.7786 2.7786 3.1140 3.1140 3.9781 3.9781 4.9697 4.9697 5.1373 5.1373 5.4960 5.4960 5.8518 5.8518 6.1712 6.1712 k = 0.4510 0.3736-0.0000 ( 9110 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8813 -8.8813 -8.8796 -8.8796 -8.8678 -8.8678 -8.8648 -8.8648 -7.3386 -7.3386 -7.3198 -7.3198 -7.2763 -7.2763 -7.2732 -7.2732 -7.2644 -7.2644 -7.2567 -7.2567 -7.0393 -7.0393 -6.9893 -6.9893 -6.6872 -6.6872 -6.6855 -6.6855 -6.6804 -6.6804 -6.6693 -6.6693 -6.6303 -6.6303 -6.5922 -6.5922 -2.7290 -2.7290 -1.7964 -1.7964 -1.6730 -1.6730 -1.5194 -1.5194 1.8929 1.8929 2.1065 2.1065 2.1593 2.1593 2.6908 2.6908 2.7999 2.7999 3.1006 3.1006 3.9783 3.9783 4.9374 4.9374 5.0991 5.0991 5.4423 5.4423 5.8322 5.8322 6.2634 6.2634 k = 0.4412 0.3906-0.0000 ( 9114 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8812 -8.8812 -8.8796 -8.8796 -8.8681 -8.8681 -8.8646 -8.8646 -7.3386 -7.3386 -7.3197 -7.3197 -7.2765 -7.2765 -7.2731 -7.2731 -7.2648 -7.2648 -7.2568 -7.2568 -7.0399 -7.0399 -6.9874 -6.9874 -6.6873 -6.6873 -6.6854 -6.6854 -6.6803 -6.6803 -6.6693 -6.6693 -6.6329 -6.6329 -6.5897 -6.5897 -2.7225 -2.7225 -1.7951 -1.7951 -1.6715 -1.6715 -1.5408 -1.5408 1.9389 1.9389 2.0675 2.0675 2.1627 2.1627 2.6863 2.6863 2.8438 2.8438 3.0847 3.0847 3.9802 3.9802 4.8996 4.8996 5.0517 5.0517 5.3995 5.3995 5.8116 5.8116 6.3556 6.3556 k = 0.4314 0.4075-0.0000 ( 9110 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8811 -8.8811 -8.8796 -8.8796 -8.8683 -8.8683 -8.8643 -8.8643 -7.3386 -7.3386 -7.3196 -7.3196 -7.2766 -7.2766 -7.2731 -7.2731 -7.2653 -7.2653 -7.2568 -7.2568 -7.0406 -7.0406 -6.9853 -6.9853 -6.6875 -6.6875 -6.6852 -6.6852 -6.6802 -6.6802 -6.6693 -6.6693 -6.6354 -6.6354 -6.5872 -6.5872 -2.7153 -2.7153 -1.7937 -1.7937 -1.6699 -1.6699 -1.5645 -1.5645 1.9836 1.9836 2.0333 2.0333 2.1744 2.1744 2.6688 2.6688 2.8939 2.8939 3.0667 3.0667 3.9848 3.9848 4.8574 4.8574 4.9968 4.9968 5.3665 5.3665 5.7913 5.7913 6.4468 6.4468 k = 0.4216 0.4245-0.0000 ( 9112 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8810 -8.8810 -8.8796 -8.8796 -8.8686 -8.8686 -8.8641 -8.8641 -7.3386 -7.3386 -7.3195 -7.3195 -7.2768 -7.2768 -7.2731 -7.2731 -7.2657 -7.2657 -7.2568 -7.2568 -7.0411 -7.0411 -6.9832 -6.9832 -6.6876 -6.6876 -6.6851 -6.6851 -6.6801 -6.6801 -6.6692 -6.6692 -6.6378 -6.6378 -6.5849 -6.5849 -2.7074 -2.7074 -1.7920 -1.7920 -1.6682 -1.6682 -1.5897 -1.5897 1.9742 1.9742 2.0600 2.0600 2.1905 2.1905 2.6455 2.6455 2.9416 2.9416 3.0468 3.0468 3.9935 3.9935 4.8118 4.8118 4.9368 4.9368 5.3415 5.3415 5.7721 5.7721 6.5357 6.5357 k = 0.4118 0.4415-0.0000 ( 9108 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8809 -8.8809 -8.8796 -8.8796 -8.8688 -8.8688 -8.8639 -8.8639 -7.3386 -7.3386 -7.3194 -7.3194 -7.2771 -7.2771 -7.2730 -7.2730 -7.2661 -7.2661 -7.2568 -7.2568 -7.0417 -7.0417 -6.9811 -6.9811 -6.6877 -6.6877 -6.6850 -6.6850 -6.6800 -6.6800 -6.6691 -6.6691 -6.6402 -6.6402 -6.5828 -6.5828 -2.6990 -2.6990 -1.7901 -1.7901 -1.6664 -1.6664 -1.6157 -1.6157 1.9402 1.9402 2.1161 2.1161 2.2117 2.2117 2.6189 2.6189 2.9833 2.9833 3.0259 3.0259 4.0074 4.0074 4.7642 4.7642 4.8743 4.8743 5.3226 5.3226 5.7546 5.7546 6.6209 6.6209 k = 0.4020 0.4585-0.0000 ( 9114 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8808 -8.8808 -8.8797 -8.8797 -8.8691 -8.8691 -8.8638 -8.8638 -7.3386 -7.3386 -7.3193 -7.3193 -7.2773 -7.2773 -7.2730 -7.2730 -7.2665 -7.2665 -7.2568 -7.2568 -7.0421 -7.0421 -6.9791 -6.9791 -6.6878 -6.6878 -6.6848 -6.6848 -6.6799 -6.6799 -6.6689 -6.6689 -6.6423 -6.6423 -6.5808 -6.5808 -2.6903 -2.6903 -1.7880 -1.7880 -1.6645 -1.6645 -1.6417 -1.6417 1.9079 1.9079 2.1693 2.1693 2.2428 2.2428 2.5901 2.5901 3.0032 3.0032 3.0179 3.0179 4.0278 4.0278 4.7156 4.7156 4.8113 4.8113 5.3083 5.3083 5.7390 5.7390 6.7009 6.7009 k = 0.3922 0.4755-0.0000 ( 9122 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8807 -8.8807 -8.8797 -8.8797 -8.8693 -8.8693 -8.8636 -8.8636 -7.3386 -7.3386 -7.3193 -7.3193 -7.2776 -7.2776 -7.2729 -7.2729 -7.2668 -7.2668 -7.2568 -7.2568 -7.0425 -7.0425 -6.9772 -6.9772 -6.6879 -6.6879 -6.6847 -6.6847 -6.6798 -6.6798 -6.6687 -6.6687 -6.6443 -6.6443 -6.5790 -6.5790 -2.6818 -2.6818 -1.7856 -1.7856 -1.6673 -1.6673 -1.6626 -1.6626 1.8792 1.8792 2.2090 2.2090 2.2904 2.2904 2.5601 2.5601 2.9828 2.9828 3.0411 3.0411 4.0553 4.0553 4.6672 4.6672 4.7493 4.7493 5.2973 5.2973 5.7255 5.7255 6.7741 6.7741 k = 0.3824 0.4924-0.0000 ( 9108 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8806 -8.8806 -8.8798 -8.8798 -8.8694 -8.8694 -8.8635 -8.8635 -7.3386 -7.3386 -7.3192 -7.3192 -7.2778 -7.2778 -7.2729 -7.2729 -7.2671 -7.2671 -7.2567 -7.2567 -7.0428 -7.0428 -6.9755 -6.9755 -6.6880 -6.6880 -6.6845 -6.6845 -6.6797 -6.6797 -6.6685 -6.6685 -6.6460 -6.6460 -6.5775 -6.5775 -2.6736 -2.6736 -1.7831 -1.7831 -1.6912 -1.6912 -1.6610 -1.6610 1.8547 1.8547 2.2380 2.2380 2.3491 2.3491 2.5295 2.5295 2.9638 2.9638 3.0545 3.0545 4.0900 4.0900 4.6200 4.6200 4.6896 4.6896 5.2890 5.2890 5.7141 5.7141 6.8387 6.8387 k = 0.3725 0.5094-0.0000 ( 9118 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8805 -8.8805 -8.8798 -8.8798 -8.8696 -8.8696 -8.8634 -8.8634 -7.3387 -7.3387 -7.3192 -7.3192 -7.2780 -7.2780 -7.2729 -7.2729 -7.2673 -7.2673 -7.2567 -7.2567 -7.0430 -7.0430 -6.9741 -6.9741 -6.6880 -6.6880 -6.6844 -6.6844 -6.6796 -6.6796 -6.6682 -6.6682 -6.6475 -6.6475 -6.5762 -6.5762 -2.6662 -2.6662 -1.7803 -1.7803 -1.7129 -1.7129 -1.6595 -1.6595 1.8345 1.8345 2.2632 2.2632 2.4081 2.4081 2.4990 2.4990 2.9490 2.9490 3.0576 3.0576 4.1311 4.1311 4.5753 4.5753 4.6335 4.6335 5.2829 5.2829 5.7049 5.7049 6.8931 6.8931 k = 0.3627 0.5264-0.0000 ( 9114 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8804 -8.8804 -8.8798 -8.8798 -8.8697 -8.8697 -8.8633 -8.8633 -7.3387 -7.3387 -7.3191 -7.3191 -7.2782 -7.2782 -7.2728 -7.2728 -7.2675 -7.2675 -7.2567 -7.2567 -7.0432 -7.0432 -6.9729 -6.9729 -6.6881 -6.6881 -6.6843 -6.6843 -6.6795 -6.6795 -6.6680 -6.6680 -6.6487 -6.6487 -6.5753 -6.5753 -2.6598 -2.6598 -1.7772 -1.7772 -1.7317 -1.7317 -1.6581 -1.6581 1.8188 1.8188 2.2873 2.2873 2.4569 2.4569 2.4730 2.4730 2.9414 2.9414 3.0511 3.0511 4.1765 4.1765 4.5341 4.5341 4.5825 4.5825 5.2785 5.2785 5.6977 5.6977 6.9359 6.9359 k = 0.3529 0.5434-0.0000 ( 9118 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8804 -8.8804 -8.8799 -8.8799 -8.8698 -8.8698 -8.8633 -8.8633 -7.3387 -7.3387 -7.3191 -7.3191 -7.2784 -7.2784 -7.2728 -7.2728 -7.2676 -7.2676 -7.2567 -7.2567 -7.0433 -7.0433 -6.9720 -6.9720 -6.6881 -6.6881 -6.6843 -6.6843 -6.6795 -6.6795 -6.6677 -6.6677 -6.6496 -6.6496 -6.5746 -6.5746 -2.6549 -2.6549 -1.7741 -1.7741 -1.7468 -1.7468 -1.6571 -1.6571 1.8075 1.8075 2.3106 2.3106 2.4395 2.4395 2.5027 2.5027 2.9441 2.9441 3.0361 3.0361 4.2221 4.2221 4.4980 4.4980 4.5393 4.5393 5.2757 5.2757 5.6926 5.6926 6.9663 6.9663 k = 0.3431 0.5604-0.0000 ( 9114 PWs) bands (ev): -9.5039 -9.5039 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8803 -8.8803 -8.8799 -8.8799 -8.8698 -8.8698 -8.8633 -8.8633 -7.3387 -7.3387 -7.3191 -7.3191 -7.2785 -7.2785 -7.2728 -7.2728 -7.2677 -7.2677 -7.2567 -7.2567 -7.0433 -7.0433 -6.9715 -6.9715 -6.6881 -6.6881 -6.6842 -6.6842 -6.6795 -6.6795 -6.6676 -6.6676 -6.6502 -6.6502 -6.5741 -6.5741 -2.6518 -2.6518 -1.7711 -1.7711 -1.7573 -1.7573 -1.6565 -1.6565 1.8008 1.8008 2.3310 2.3310 2.4163 2.4163 2.5265 2.5265 2.9594 2.9594 3.0139 3.0139 4.2597 4.2597 4.4716 4.4716 4.5077 4.5077 5.2741 5.2741 5.6895 5.6895 6.9841 6.9841 k = 0.3333 0.5774-0.0000 ( 9108 PWs) bands (ev): -9.5039 -9.5039 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8803 -8.8803 -8.8799 -8.8799 -8.8698 -8.8698 -8.8633 -8.8633 -7.3387 -7.3387 -7.3191 -7.3191 -7.2785 -7.2785 -7.2728 -7.2728 -7.2677 -7.2677 -7.2567 -7.2567 -7.0433 -7.0433 -6.9713 -6.9713 -6.6882 -6.6882 -6.6842 -6.6842 -6.6795 -6.6795 -6.6675 -6.6675 -6.6503 -6.6503 -6.5740 -6.5740 -2.6507 -2.6507 -1.7698 -1.7698 -1.7612 -1.7612 -1.6563 -1.6563 1.7986 1.7986 2.3407 2.3407 2.4055 2.4055 2.5340 2.5340 2.9844 2.9844 2.9872 2.9872 4.2752 4.2752 4.4630 4.4630 4.4941 4.4941 5.2737 5.2737 5.6885 5.6885 6.9899 6.9899 k = 0.3333 0.5774-0.0000 ( 9108 PWs) bands (ev): -9.5039 -9.5039 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8803 -8.8803 -8.8799 -8.8799 -8.8698 -8.8698 -8.8633 -8.8633 -7.3387 -7.3387 -7.3191 -7.3191 -7.2785 -7.2785 -7.2728 -7.2728 -7.2677 -7.2677 -7.2567 -7.2567 -7.0433 -7.0433 -6.9713 -6.9713 -6.6882 -6.6882 -6.6842 -6.6842 -6.6795 -6.6795 -6.6675 -6.6675 -6.6503 -6.6503 -6.5740 -6.5740 -2.6507 -2.6507 -1.7698 -1.7698 -1.7612 -1.7612 -1.6563 -1.6563 1.7986 1.7986 2.3407 2.3407 2.4055 2.4055 2.5340 2.5340 2.9844 2.9844 2.9872 2.9872 4.2752 4.2752 4.4630 4.4630 4.4941 4.4941 5.2737 5.2737 5.6885 5.6885 6.9899 6.9899 k = 0.3235 0.5604-0.0000 ( 9112 PWs) bands (ev): -9.5039 -9.5039 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8803 -8.8803 -8.8799 -8.8799 -8.8698 -8.8698 -8.8633 -8.8633 -7.3387 -7.3387 -7.3191 -7.3191 -7.2785 -7.2785 -7.2728 -7.2728 -7.2677 -7.2677 -7.2567 -7.2567 -7.0433 -7.0433 -6.9715 -6.9715 -6.6881 -6.6881 -6.6842 -6.6842 -6.6795 -6.6795 -6.6676 -6.6676 -6.6502 -6.6502 -6.5741 -6.5741 -2.6518 -2.6518 -1.7695 -1.7695 -1.7589 -1.7589 -1.6565 -1.6565 1.8008 1.8008 2.3313 2.3313 2.4160 2.4160 2.5279 2.5279 2.9531 2.9531 3.0187 3.0187 4.2612 4.2612 4.4655 4.4655 4.5124 4.5124 5.2741 5.2741 5.6895 5.6895 6.9845 6.9845 k = 0.3137 0.5434-0.0000 ( 9120 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8804 -8.8804 -8.8799 -8.8799 -8.8698 -8.8698 -8.8633 -8.8633 -7.3387 -7.3387 -7.3191 -7.3191 -7.2784 -7.2784 -7.2728 -7.2728 -7.2676 -7.2676 -7.2567 -7.2567 -7.0433 -7.0433 -6.9721 -6.9721 -6.6881 -6.6881 -6.6843 -6.6843 -6.6795 -6.6795 -6.6677 -6.6677 -6.6497 -6.6497 -6.5745 -6.5745 -2.6552 -2.6552 -1.7658 -1.7658 -1.7543 -1.7543 -1.6573 -1.6573 1.8074 1.8074 2.3127 2.3127 2.4380 2.4380 2.5123 2.5123 2.9170 2.9170 3.0522 3.0522 4.2287 4.2287 4.4748 4.4748 4.5562 4.5562 5.2752 5.2752 5.6926 5.6926 6.9693 6.9693 k = 0.3039 0.5264-0.0000 ( 9128 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8804 -8.8804 -8.8798 -8.8798 -8.8697 -8.8697 -8.8633 -8.8633 -7.3387 -7.3387 -7.3191 -7.3191 -7.2782 -7.2782 -7.2728 -7.2728 -7.2676 -7.2676 -7.2568 -7.2568 -7.0433 -7.0433 -6.9730 -6.9730 -6.6881 -6.6881 -6.6843 -6.6843 -6.6795 -6.6795 -6.6680 -6.6680 -6.6490 -6.6490 -6.5752 -6.5752 -2.6609 -2.6609 -1.7580 -1.7580 -1.7484 -1.7484 -1.6586 -1.6586 1.8182 1.8182 2.2928 2.2928 2.4621 2.4621 2.4924 2.4924 2.8784 2.8784 3.0818 3.0818 4.1886 4.1886 4.4963 4.4963 4.6089 4.6089 5.2768 5.2768 5.6978 5.6978 6.9456 6.9456 k = 0.2941 0.5094-0.0000 ( 9132 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8805 -8.8805 -8.8798 -8.8798 -8.8696 -8.8696 -8.8634 -8.8634 -7.3387 -7.3387 -7.3190 -7.3190 -7.2780 -7.2780 -7.2729 -7.2729 -7.2674 -7.2674 -7.2568 -7.2568 -7.0434 -7.0434 -6.9742 -6.9742 -6.6880 -6.6880 -6.6845 -6.6845 -6.6795 -6.6795 -6.6682 -6.6682 -6.6480 -6.6480 -6.5761 -6.5761 -2.6686 -2.6686 -1.7480 -1.7480 -1.7391 -1.7391 -1.6606 -1.6606 1.8332 1.8332 2.2740 2.2740 2.4603 2.4603 2.4964 2.4964 2.8382 2.8382 3.1044 3.1044 4.1458 4.1458 4.5313 4.5313 4.6635 4.6635 5.2788 5.2788 5.7050 5.7050 6.9147 6.9147 k = 0.2843 0.4924-0.0000 ( 9132 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8807 -8.8807 -8.8798 -8.8798 -8.8694 -8.8694 -8.8635 -8.8635 -7.3386 -7.3386 -7.3189 -7.3189 -7.2777 -7.2777 -7.2729 -7.2729 -7.2673 -7.2673 -7.2568 -7.2568 -7.0435 -7.0435 -6.9758 -6.9758 -6.6879 -6.6879 -6.6846 -6.6846 -6.6795 -6.6795 -6.6685 -6.6685 -6.6470 -6.6470 -6.5772 -6.5772 -2.6781 -2.6781 -1.7399 -1.7399 -1.7225 -1.7225 -1.6632 -1.6632 1.8522 1.8522 2.2572 2.2572 2.4344 2.4344 2.5232 2.5232 2.7972 2.7972 3.1185 3.1185 4.1021 4.1021 4.5789 4.5789 4.7175 4.7175 5.2811 5.2811 5.7143 5.7143 6.8778 6.8778 k = 0.2745 0.4755-0.0000 ( 9126 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4620 -9.4620 -8.8808 -8.8808 -8.8798 -8.8798 -8.8693 -8.8693 -8.8636 -8.8636 -7.3386 -7.3386 -7.3187 -7.3187 -7.2773 -7.2773 -7.2730 -7.2730 -7.2671 -7.2671 -7.2568 -7.2568 -7.0437 -7.0437 -6.9776 -6.9776 -6.6878 -6.6878 -6.6848 -6.6848 -6.6795 -6.6795 -6.6688 -6.6688 -6.6460 -6.6460 -6.5784 -6.5784 -2.6891 -2.6891 -1.7327 -1.7327 -1.7002 -1.7002 -1.6665 -1.6665 1.8750 1.8750 2.2427 2.2427 2.4066 2.4066 2.5516 2.5516 2.7559 2.7559 3.1240 3.1240 4.0584 4.0584 4.6366 4.6366 4.7700 4.7700 5.2835 5.2835 5.7256 5.7256 6.8358 6.8358 k = 0.2647 0.4585-0.0000 ( 9120 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4620 -9.4620 -8.8809 -8.8809 -8.8798 -8.8798 -8.8691 -8.8691 -8.8636 -8.8636 -7.3386 -7.3386 -7.3185 -7.3185 -7.2769 -7.2769 -7.2731 -7.2731 -7.2670 -7.2670 -7.2568 -7.2568 -7.0440 -7.0440 -6.9798 -6.9798 -6.6877 -6.6877 -6.6849 -6.6849 -6.6794 -6.6794 -6.6690 -6.6690 -6.6449 -6.6449 -6.5798 -6.5798 -2.7012 -2.7012 -1.7253 -1.7253 -1.6738 -1.6738 -1.6702 -1.6702 1.9013 1.9013 2.2307 2.2307 2.3789 2.3789 2.5803 2.5803 2.7150 2.7150 3.1214 3.1214 4.0154 4.0154 4.6995 4.6995 4.8228 4.8228 5.2862 5.2862 5.7389 5.7389 6.7898 6.7898 k = 0.2549 0.4415-0.0000 ( 9114 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4620 -9.4620 -8.8810 -8.8810 -8.8798 -8.8798 -8.8689 -8.8689 -8.8637 -8.8637 -7.3386 -7.3386 -7.3182 -7.3182 -7.2764 -7.2764 -7.2732 -7.2732 -7.2668 -7.2668 -7.2569 -7.2569 -7.0445 -7.0445 -6.9822 -6.9822 -6.6876 -6.6876 -6.6851 -6.6851 -6.6794 -6.6794 -6.6693 -6.6693 -6.6440 -6.6440 -6.5813 -6.5813 -2.7142 -2.7142 -1.7174 -1.7174 -1.6751 -1.6751 -1.6430 -1.6430 1.9310 1.9310 2.2210 2.2210 2.3522 2.3522 2.6088 2.6088 2.6749 2.6749 3.1120 3.1120 3.9734 3.9734 4.7590 4.7590 4.8807 4.8807 5.2894 5.2894 5.7540 5.7540 6.7403 6.7403 k = 0.2451 0.4245-0.0000 ( 9122 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8811 -8.8811 -8.8799 -8.8799 -8.8686 -8.8686 -8.8638 -8.8638 -7.3386 -7.3386 -7.3179 -7.3179 -7.2759 -7.2759 -7.2733 -7.2733 -7.2666 -7.2666 -7.2569 -7.2569 -7.0451 -7.0451 -6.9848 -6.9848 -6.6875 -6.6875 -6.6852 -6.6852 -6.6794 -6.6794 -6.6694 -6.6694 -6.6432 -6.6432 -6.5828 -6.5828 -2.7278 -2.7278 -1.7091 -1.7091 -1.6804 -1.6804 -1.6092 -1.6092 1.9636 1.9636 2.2136 2.2136 2.3272 2.3272 2.6340 2.6340 2.6390 2.6390 3.0970 3.0970 3.9325 3.9325 4.8051 4.8051 4.9499 4.9499 5.2937 5.2937 5.7707 5.7707 6.6879 6.6879 k = 0.2353 0.4075-0.0000 ( 9126 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8813 -8.8813 -8.8799 -8.8799 -8.8684 -8.8684 -8.8639 -8.8639 -7.3385 -7.3385 -7.3175 -7.3175 -7.2753 -7.2753 -7.2734 -7.2734 -7.2664 -7.2664 -7.2570 -7.2570 -7.0459 -7.0459 -6.9876 -6.9876 -6.6874 -6.6874 -6.6852 -6.6852 -6.6794 -6.6794 -6.6695 -6.6695 -6.6426 -6.6426 -6.5843 -6.5843 -2.7415 -2.7415 -1.7004 -1.7004 -1.6863 -1.6863 -1.5725 -1.5725 1.9989 1.9989 2.2081 2.2081 2.3048 2.3048 2.5988 2.5988 2.6646 2.6646 3.0777 3.0777 3.8931 3.8931 4.8346 4.8346 5.0295 5.0295 5.3003 5.3003 5.7887 5.7887 6.6331 6.6331 k = 0.2255 0.3906-0.0000 ( 9130 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4657 -9.4657 -9.4619 -9.4619 -8.8814 -8.8814 -8.8800 -8.8800 -8.8681 -8.8681 -8.8640 -8.8640 -7.3385 -7.3385 -7.3170 -7.3170 -7.2748 -7.2748 -7.2735 -7.2735 -7.2662 -7.2662 -7.2570 -7.2570 -7.0469 -7.0469 -6.9905 -6.9905 -6.6873 -6.6873 -6.6852 -6.6852 -6.6794 -6.6794 -6.6696 -6.6696 -6.6423 -6.6423 -6.5858 -6.5858 -2.7553 -2.7553 -1.6928 -1.6928 -1.6911 -1.6911 -1.5335 -1.5335 2.0364 2.0364 2.2039 2.2039 2.2860 2.2860 2.5638 2.5638 2.6912 2.6912 3.0553 3.0553 3.8554 3.8554 4.8492 4.8492 5.1124 5.1124 5.3120 5.3120 5.8074 5.8074 6.5764 6.5764 k = 0.2157 0.3736-0.0000 ( 9133 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4657 -9.4657 -9.4619 -9.4619 -8.8815 -8.8815 -8.8800 -8.8800 -8.8679 -8.8679 -8.8641 -8.8641 -7.3385 -7.3385 -7.3164 -7.3164 -7.2742 -7.2742 -7.2736 -7.2736 -7.2659 -7.2659 -7.2571 -7.2571 -7.0481 -7.0481 -6.9935 -6.9935 -6.6873 -6.6873 -6.6851 -6.6851 -6.6794 -6.6794 -6.6696 -6.6696 -6.6422 -6.6422 -6.5872 -6.5872 -2.7688 -2.7688 -1.6998 -1.6998 -1.6814 -1.6814 -1.4924 -1.4924 2.0753 2.0753 2.2000 2.2000 2.2721 2.2721 2.5313 2.5313 2.7169 2.7169 3.0307 3.0307 3.8196 3.8196 4.8510 4.8510 5.1878 5.1878 5.3348 5.3348 5.8259 5.8259 6.5187 6.5187 k = 0.2059 0.3566-0.0000 ( 9133 PWs) bands (ev): -9.5040 -9.5040 -9.4822 -9.4822 -9.4657 -9.4657 -9.4619 -9.4619 -8.8817 -8.8817 -8.8801 -8.8801 -8.8676 -8.8676 -8.8642 -8.8642 -7.3384 -7.3384 -7.3158 -7.3158 -7.2740 -7.2740 -7.2733 -7.2733 -7.2657 -7.2657 -7.2572 -7.2572 -7.0495 -7.0495 -6.9966 -6.9966 -6.6872 -6.6872 -6.6849 -6.6849 -6.6794 -6.6794 -6.6695 -6.6695 -6.6424 -6.6424 -6.5885 -6.5885 -2.7820 -2.7820 -1.7073 -1.7073 -1.6713 -1.6713 -1.4497 -1.4497 2.1147 2.1147 2.1959 2.1959 2.2642 2.2642 2.5017 2.5017 2.7413 2.7413 3.0048 3.0048 3.7861 3.7861 4.8408 4.8408 5.2421 5.2421 5.3790 5.3790 5.8424 5.8424 6.4621 6.4621 k = 0.1961 0.3396-0.0000 ( 9125 PWs) bands (ev): -9.5040 -9.5040 -9.4822 -9.4822 -9.4657 -9.4657 -9.4619 -9.4619 -8.8818 -8.8818 -8.8802 -8.8802 -8.8673 -8.8673 -8.8643 -8.8643 -7.3384 -7.3384 -7.3151 -7.3151 -7.2741 -7.2741 -7.2727 -7.2727 -7.2655 -7.2655 -7.2572 -7.2572 -7.0512 -7.0512 -6.9997 -6.9997 -6.6871 -6.6871 -6.6846 -6.6846 -6.6795 -6.6795 -6.6694 -6.6694 -6.6429 -6.6429 -6.5896 -6.5896 -2.7947 -2.7947 -1.7152 -1.7152 -1.6609 -1.6609 -1.4058 -1.4058 2.1506 2.1506 2.1942 2.1942 2.2627 2.2627 2.4756 2.4756 2.7642 2.7642 2.9783 2.9783 3.7551 3.7551 4.8197 4.8197 5.2735 5.2735 5.4431 5.4431 5.8544 5.8544 6.4096 6.4096 k = 0.1863 0.3226-0.0000 ( 9125 PWs) bands (ev): -9.5040 -9.5040 -9.4822 -9.4822 -9.4657 -9.4657 -9.4619 -9.4619 -8.8819 -8.8819 -8.8803 -8.8803 -8.8671 -8.8671 -8.8644 -8.8644 -7.3384 -7.3384 -7.3143 -7.3143 -7.2742 -7.2742 -7.2720 -7.2720 -7.2654 -7.2654 -7.2573 -7.2573 -7.0531 -7.0531 -7.0028 -7.0028 -6.6871 -6.6871 -6.6843 -6.6843 -6.6796 -6.6796 -6.6693 -6.6693 -6.6437 -6.6437 -6.5907 -6.5907 -2.8068 -2.8068 -1.7235 -1.7235 -1.6502 -1.6502 -1.3609 -1.3609 2.1671 2.1671 2.2111 2.2111 2.2664 2.2664 2.4537 2.4537 2.7850 2.7850 2.9522 2.9522 3.7270 3.7270 4.7885 4.7885 5.2940 5.2940 5.5114 5.5114 5.8583 5.8583 6.3664 6.3664 k = 0.1765 0.3057-0.0000 ( 9125 PWs) bands (ev): -9.5041 -9.5041 -9.4822 -9.4822 -9.4657 -9.4657 -9.4619 -9.4619 -8.8821 -8.8821 -8.8804 -8.8804 -8.8668 -8.8668 -8.8644 -8.8644 -7.3384 -7.3384 -7.3135 -7.3135 -7.2744 -7.2744 -7.2713 -7.2713 -7.2652 -7.2652 -7.2573 -7.2573 -7.0553 -7.0553 -7.0059 -7.0059 -6.6870 -6.6870 -6.6840 -6.6840 -6.6796 -6.6796 -6.6691 -6.6691 -6.6447 -6.6447 -6.5915 -6.5915 -2.8182 -2.8182 -1.7321 -1.7321 -1.6392 -1.6392 -1.3156 -1.3156 2.1657 2.1657 2.2448 2.2448 2.2737 2.2737 2.4373 2.4373 2.8031 2.8031 2.9276 2.9276 3.7021 3.7021 4.7484 4.7484 5.3107 5.3107 5.5714 5.5714 5.8520 5.8520 6.3376 6.3376 k = 0.1667 0.2887-0.0000 ( 9137 PWs) bands (ev): -9.5041 -9.5041 -9.4821 -9.4821 -9.4658 -9.4658 -9.4618 -9.4618 -8.8822 -8.8822 -8.8805 -8.8805 -8.8666 -8.8666 -8.8645 -8.8645 -7.3383 -7.3383 -7.3127 -7.3127 -7.2746 -7.2746 -7.2705 -7.2705 -7.2650 -7.2650 -7.2574 -7.2574 -7.0576 -7.0576 -7.0090 -7.0090 -6.6868 -6.6868 -6.6836 -6.6836 -6.6797 -6.6797 -6.6689 -6.6689 -6.6460 -6.6460 -6.5923 -6.5923 -2.8289 -2.8289 -1.7408 -1.7408 -1.6281 -1.6281 -1.2700 -1.2700 2.1624 2.1624 2.2773 2.2773 2.2837 2.2837 2.4285 2.4285 2.8160 2.8160 2.9071 2.9071 3.6810 3.6810 4.7007 4.7007 5.3256 5.3256 5.6116 5.6116 5.8406 5.8406 6.3250 6.3250 k = 0.1569 0.2717-0.0000 ( 9143 PWs) bands (ev): -9.5041 -9.5041 -9.4821 -9.4821 -9.4658 -9.4658 -9.4618 -9.4618 -8.8823 -8.8823 -8.8806 -8.8806 -8.8663 -8.8663 -8.8645 -8.8645 -7.3383 -7.3383 -7.3118 -7.3118 -7.2747 -7.2747 -7.2698 -7.2698 -7.2648 -7.2648 -7.2575 -7.2575 -7.0601 -7.0601 -7.0120 -7.0120 -6.6867 -6.6867 -6.6831 -6.6831 -6.6799 -6.6799 -6.6686 -6.6686 -6.6474 -6.6474 -6.5929 -6.5929 -2.8388 -2.8388 -1.7497 -1.7497 -1.6169 -1.6169 -1.2247 -1.2247 2.1606 2.1606 2.2907 2.2907 2.3073 2.3073 2.4302 2.4302 2.8193 2.8193 2.8954 2.8954 3.6640 3.6640 4.6466 4.6466 5.3390 5.3390 5.6171 5.6171 5.8399 5.8399 6.3251 6.3251 k = 0.1471 0.2547-0.0000 ( 9153 PWs) bands (ev): -9.5041 -9.5041 -9.4821 -9.4821 -9.4658 -9.4658 -9.4618 -9.4618 -8.8824 -8.8824 -8.8808 -8.8808 -8.8661 -8.8661 -8.8645 -8.8645 -7.3383 -7.3383 -7.3109 -7.3109 -7.2749 -7.2749 -7.2690 -7.2690 -7.2647 -7.2647 -7.2576 -7.2576 -7.0628 -7.0628 -7.0150 -7.0150 -6.6865 -6.6865 -6.6827 -6.6827 -6.6800 -6.6800 -6.6683 -6.6683 -6.6490 -6.6490 -6.5935 -6.5935 -2.8480 -2.8480 -1.7585 -1.7585 -1.6057 -1.6057 -1.1798 -1.1798 2.1612 2.1612 2.2972 2.2972 2.3293 2.3293 2.4434 2.4434 2.8097 2.8097 2.8960 2.8960 3.6517 3.6517 4.5874 4.5874 5.3494 5.3494 5.5849 5.5849 5.8587 5.8587 6.3305 6.3305 k = 0.1373 0.2377-0.0000 ( 9159 PWs) bands (ev): -9.5041 -9.5041 -9.4820 -9.4820 -9.4659 -9.4659 -9.4618 -9.4618 -8.8825 -8.8825 -8.8809 -8.8809 -8.8659 -8.8659 -8.8645 -8.8645 -7.3383 -7.3383 -7.3099 -7.3099 -7.2751 -7.2751 -7.2683 -7.2683 -7.2645 -7.2645 -7.2577 -7.2577 -7.0655 -7.0655 -7.0179 -7.0179 -6.6864 -6.6864 -6.6822 -6.6822 -6.6801 -6.6801 -6.6679 -6.6679 -6.6507 -6.6507 -6.5940 -6.5940 -2.8564 -2.8564 -1.7673 -1.7673 -1.5946 -1.5946 -1.1359 -1.1359 2.1647 2.1647 2.3001 2.3001 2.3482 2.3482 2.4649 2.4649 2.7918 2.7918 2.9045 2.9045 3.6445 3.6445 4.5241 4.5241 5.3529 5.3529 5.5337 5.5337 5.8875 5.8875 6.3342 6.3342 k = 0.1275 0.2208-0.0000 ( 9171 PWs) bands (ev): -9.5041 -9.5041 -9.4820 -9.4820 -9.4659 -9.4659 -9.4618 -9.4618 -8.8826 -8.8826 -8.8810 -8.8810 -8.8658 -8.8658 -8.8645 -8.8645 -7.3382 -7.3382 -7.3090 -7.3090 -7.2753 -7.2753 -7.2676 -7.2676 -7.2643 -7.2643 -7.2578 -7.2578 -7.0683 -7.0683 -7.0207 -7.0207 -6.6862 -6.6862 -6.6817 -6.6817 -6.6802 -6.6802 -6.6676 -6.6676 -6.6524 -6.6524 -6.5944 -6.5944 -2.8641 -2.8641 -1.7759 -1.7759 -1.5838 -1.5838 -1.0931 -1.0931 2.1709 2.1709 2.3011 2.3011 2.3667 2.3667 2.4891 2.4891 2.7710 2.7710 2.9155 2.9155 3.6427 3.6427 4.4580 4.4580 5.3389 5.3389 5.4876 5.4876 5.9163 5.9163 6.3338 6.3338 k = 0.1176 0.2038-0.0000 ( 9167 PWs) bands (ev): -9.5041 -9.5041 -9.4820 -9.4820 -9.4659 -9.4659 -9.4618 -9.4618 -8.8827 -8.8827 -8.8812 -8.8812 -8.8657 -8.8657 -8.8644 -8.8644 -7.3382 -7.3382 -7.3081 -7.3081 -7.2755 -7.2755 -7.2669 -7.2669 -7.2641 -7.2641 -7.2579 -7.2579 -7.0710 -7.0710 -7.0235 -7.0235 -6.6860 -6.6860 -6.6812 -6.6812 -6.6803 -6.6803 -6.6672 -6.6672 -6.6541 -6.6541 -6.5949 -6.5949 -2.8711 -2.8711 -1.7843 -1.7843 -1.5732 -1.5732 -1.0519 -1.0519 2.1800 2.1800 2.3019 2.3019 2.3856 2.3856 2.5123 2.5123 2.7498 2.7498 2.9269 2.9269 3.6467 3.6467 4.3901 4.3901 5.2951 5.2951 5.4663 5.4663 5.9396 5.9396 6.3312 6.3312 k = 0.1078 0.1868-0.0000 ( 9177 PWs) bands (ev): -9.5042 -9.5042 -9.4820 -9.4820 -9.4659 -9.4659 -9.4618 -9.4618 -8.8828 -8.8828 -8.8813 -8.8813 -8.8656 -8.8656 -8.8644 -8.8644 -7.3382 -7.3382 -7.3072 -7.3072 -7.2756 -7.2756 -7.2663 -7.2663 -7.2638 -7.2638 -7.2580 -7.2580 -7.0737 -7.0737 -7.0262 -7.0262 -6.6857 -6.6857 -6.6810 -6.6810 -6.6800 -6.6800 -6.6668 -6.6668 -6.6558 -6.6558 -6.5953 -6.5953 -2.8774 -2.8774 -1.7923 -1.7923 -1.5631 -1.5631 -1.0126 -1.0126 2.1918 2.1918 2.3040 2.3040 2.4047 2.4047 2.5322 2.5322 2.7291 2.7291 2.9376 2.9376 3.6564 3.6564 4.3214 4.3214 5.2299 5.2299 5.4653 5.4653 5.9541 5.9541 6.3312 6.3312 k = 0.0980 0.1698-0.0000 ( 9189 PWs) bands (ev): -9.5042 -9.5042 -9.4819 -9.4819 -9.4660 -9.4660 -9.4618 -9.4618 -8.8829 -8.8829 -8.8814 -8.8814 -8.8656 -8.8656 -8.8643 -8.8643 -7.3382 -7.3382 -7.3064 -7.3064 -7.2758 -7.2758 -7.2659 -7.2659 -7.2634 -7.2634 -7.2580 -7.2580 -7.0763 -7.0763 -7.0287 -7.0287 -6.6855 -6.6855 -6.6810 -6.6810 -6.6795 -6.6795 -6.6664 -6.6664 -6.6575 -6.6575 -6.5956 -6.5956 -2.8829 -2.8829 -1.7999 -1.7999 -1.5534 -1.5534 -0.9755 -0.9755 2.2059 2.2059 2.3080 2.3080 2.4238 2.4238 2.5475 2.5475 2.7095 2.7095 2.9475 2.9475 3.6715 3.6715 4.2529 4.2529 5.1578 5.1578 5.4728 5.4728 5.9580 5.9580 6.3377 6.3377 k = 0.0882 0.1528-0.0000 ( 9169 PWs) bands (ev): -9.5042 -9.5042 -9.4819 -9.4819 -9.4660 -9.4660 -9.4618 -9.4618 -8.8829 -8.8829 -8.8815 -8.8815 -8.8655 -8.8655 -8.8641 -8.8641 -7.3382 -7.3382 -7.3056 -7.3056 -7.2759 -7.2759 -7.2655 -7.2655 -7.2629 -7.2629 -7.2581 -7.2581 -7.0788 -7.0788 -7.0312 -7.0312 -6.6853 -6.6853 -6.6811 -6.6811 -6.6789 -6.6789 -6.6659 -6.6659 -6.6592 -6.6592 -6.5960 -6.5960 -2.8879 -2.8879 -1.8070 -1.8070 -1.5444 -1.5444 -0.9409 -0.9409 2.2219 2.2219 2.3144 2.3144 2.4425 2.4425 2.5579 2.5579 2.6912 2.6912 2.9563 2.9563 3.6914 3.6914 4.1858 4.1858 5.0858 5.0858 5.4834 5.4834 5.9513 5.9513 6.3519 6.3519 k = 0.0784 0.1358-0.0000 ( 9169 PWs) bands (ev): -9.5042 -9.5042 -9.4819 -9.4819 -9.4660 -9.4660 -9.4618 -9.4618 -8.8830 -8.8830 -8.8816 -8.8816 -8.8655 -8.8655 -8.8640 -8.8640 -7.3382 -7.3382 -7.3048 -7.3048 -7.2760 -7.2760 -7.2653 -7.2653 -7.2623 -7.2623 -7.2582 -7.2582 -7.0811 -7.0811 -7.0335 -7.0335 -6.6851 -6.6851 -6.6813 -6.6813 -6.6782 -6.6782 -6.6655 -6.6655 -6.6607 -6.6607 -6.5964 -6.5964 -2.8922 -2.8922 -1.8136 -1.8136 -1.5360 -1.5360 -0.9091 -0.9091 2.2392 2.2392 2.3236 2.3236 2.4604 2.4604 2.5631 2.5631 2.6745 2.6745 2.9639 2.9639 3.7152 3.7152 4.1209 4.1209 5.0173 5.0173 5.4952 5.4952 5.9356 5.9356 6.3730 6.3730 k = 0.0686 0.1189-0.0000 ( 9167 PWs) bands (ev): -9.5042 -9.5042 -9.4819 -9.4819 -9.4660 -9.4660 -9.4617 -9.4617 -8.8830 -8.8830 -8.8817 -8.8817 -8.8655 -8.8655 -8.8639 -8.8639 -7.3381 -7.3381 -7.3042 -7.3042 -7.2762 -7.2762 -7.2652 -7.2652 -7.2617 -7.2617 -7.2583 -7.2583 -7.0831 -7.0831 -7.0356 -7.0356 -6.6849 -6.6849 -6.6814 -6.6814 -6.6775 -6.6775 -6.6651 -6.6651 -6.6622 -6.6622 -6.5967 -6.5967 -2.8959 -2.8959 -1.8196 -1.8196 -1.5285 -1.5285 -0.8803 -0.8803 2.2570 2.2570 2.3355 2.3355 2.4771 2.4771 2.5635 2.5635 2.6592 2.6592 2.9705 2.9705 3.7416 3.7416 4.0595 4.0595 4.9541 4.9541 5.5076 5.5076 5.9137 5.9137 6.3987 6.3987 k = 0.0588 0.1019-0.0000 ( 9167 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4660 -9.4660 -9.4617 -9.4617 -8.8831 -8.8831 -8.8818 -8.8818 -8.8655 -8.8655 -8.8638 -8.8638 -7.3381 -7.3381 -7.3035 -7.3035 -7.2763 -7.2763 -7.2651 -7.2651 -7.2612 -7.2612 -7.2583 -7.2583 -7.0850 -7.0850 -7.0375 -7.0375 -6.6847 -6.6847 -6.6815 -6.6815 -6.6767 -6.6767 -6.6649 -6.6649 -6.6635 -6.6635 -6.5970 -6.5970 -2.8991 -2.8991 -1.8249 -1.8249 -1.5217 -1.5217 -0.8549 -0.8549 2.2744 2.2744 2.3504 2.3504 2.4924 2.4924 2.5595 2.5595 2.6455 2.6455 2.9760 2.9760 3.7692 3.7692 4.0027 4.0027 4.8974 4.8974 5.5202 5.5202 5.8879 5.8879 6.4266 6.4266 k = 0.0490 0.0849-0.0000 ( 9163 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4660 -9.4660 -9.4617 -9.4617 -8.8831 -8.8831 -8.8819 -8.8819 -8.8655 -8.8655 -8.8638 -8.8638 -7.3381 -7.3381 -7.3030 -7.3030 -7.2764 -7.2764 -7.2651 -7.2651 -7.2606 -7.2606 -7.2584 -7.2584 -7.0866 -7.0866 -7.0392 -7.0392 -6.6846 -6.6846 -6.6817 -6.6817 -6.6759 -6.6759 -6.6653 -6.6653 -6.6641 -6.6641 -6.5973 -6.5973 -2.9017 -2.9017 -1.8294 -1.8294 -1.5159 -1.5159 -0.8330 -0.8330 2.2907 2.2907 2.3678 2.3678 2.5059 2.5059 2.5520 2.5520 2.6332 2.6332 2.9805 2.9805 3.7964 3.7964 3.9517 3.9517 4.8481 4.8481 5.5329 5.5329 5.8604 5.8604 6.4542 6.4542 k = 0.0392 0.0679-0.0000 ( 9159 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8831 -8.8831 -8.8819 -8.8819 -8.8655 -8.8655 -8.8637 -8.8637 -7.3381 -7.3381 -7.3026 -7.3026 -7.2764 -7.2764 -7.2651 -7.2651 -7.2602 -7.2602 -7.2584 -7.2584 -7.0879 -7.0879 -7.0406 -7.0406 -6.6844 -6.6844 -6.6818 -6.6818 -6.6751 -6.6751 -6.6665 -6.6665 -6.6639 -6.6639 -6.5976 -6.5976 -2.9038 -2.9038 -1.8332 -1.8332 -1.5111 -1.5111 -0.8148 -0.8148 2.3052 2.3052 2.3872 2.3872 2.5173 2.5173 2.5417 2.5417 2.6223 2.6223 2.9840 2.9840 3.8214 3.8214 3.9077 3.9077 4.8070 4.8070 5.5454 5.5454 5.8331 5.8331 6.4782 6.4782 k = 0.0294 0.0509-0.0000 ( 9161 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8831 -8.8831 -8.8820 -8.8820 -8.8655 -8.8655 -8.8636 -8.8636 -7.3381 -7.3381 -7.3023 -7.3023 -7.2765 -7.2765 -7.2650 -7.2650 -7.2598 -7.2598 -7.2585 -7.2585 -7.0890 -7.0890 -7.0417 -7.0417 -6.6843 -6.6843 -6.6818 -6.6818 -6.6742 -6.6742 -6.6676 -6.6676 -6.6638 -6.6638 -6.5978 -6.5978 -2.9055 -2.9055 -1.8362 -1.8362 -1.5073 -1.5073 -0.8005 -0.8005 2.3173 2.3173 2.4075 2.4075 2.5262 2.5262 2.5295 2.5295 2.6130 2.6130 2.9868 2.9868 3.8428 3.8428 3.8720 3.8720 4.7745 4.7745 5.5574 5.5574 5.8079 5.8079 6.4857 6.4857 k = 0.0196 0.0340-0.0000 ( 9157 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8832 -8.8832 -8.8820 -8.8820 -8.8655 -8.8655 -8.8636 -8.8636 -7.3381 -7.3381 -7.3020 -7.3020 -7.2765 -7.2765 -7.2650 -7.2650 -7.2595 -7.2595 -7.2585 -7.2585 -7.0897 -7.0897 -7.0426 -7.0426 -6.6843 -6.6843 -6.6819 -6.6819 -6.6734 -6.6734 -6.6687 -6.6687 -6.6636 -6.6636 -6.5979 -6.5979 -2.9066 -2.9066 -1.8383 -1.8383 -1.5045 -1.5045 -0.7901 -0.7901 2.3265 2.3265 2.4274 2.4274 2.5157 2.5157 2.5332 2.5332 2.6057 2.6057 2.9886 2.9886 3.8452 3.8452 3.8596 3.8596 4.7510 4.7510 5.5678 5.5678 5.7870 5.7870 6.4755 6.4755 k = 0.0098 0.0170-0.0000 ( 9165 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8832 -8.8832 -8.8821 -8.8821 -8.8655 -8.8655 -8.8636 -8.8636 -7.3381 -7.3381 -7.3019 -7.3019 -7.2766 -7.2766 -7.2650 -7.2650 -7.2593 -7.2593 -7.2585 -7.2585 -7.0902 -7.0902 -7.0431 -7.0431 -6.6842 -6.6842 -6.6819 -6.6819 -6.6726 -6.6726 -6.6697 -6.6697 -6.6635 -6.6635 -6.5980 -6.5980 -2.9073 -2.9073 -1.8396 -1.8396 -1.5029 -1.5029 -0.7839 -0.7839 2.3324 2.3324 2.4446 2.4446 2.5026 2.5026 2.5372 2.5372 2.6010 2.6010 2.9898 2.9898 3.8290 3.8290 3.8698 3.8698 4.7368 4.7368 5.5752 5.5752 5.7728 5.7728 6.4663 6.4663 k = 0.0000 0.0000 0.0000 ( 9189 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8832 -8.8832 -8.8821 -8.8821 -8.8655 -8.8655 -8.8636 -8.8636 -7.3381 -7.3381 -7.3018 -7.3018 -7.2766 -7.2766 -7.2650 -7.2650 -7.2593 -7.2593 -7.2585 -7.2585 -7.0903 -7.0903 -7.0432 -7.0432 -6.6842 -6.6842 -6.6820 -6.6820 -6.6722 -6.6722 -6.6701 -6.6701 -6.6635 -6.6635 -6.5980 -6.5980 -2.9075 -2.9075 -1.8401 -1.8401 -1.5023 -1.5023 -0.7818 -0.7818 2.3344 2.3344 2.4528 2.4528 2.4958 2.4958 2.5386 2.5386 2.5994 2.5994 2.9901 2.9901 3.8236 3.8236 3.8733 3.8733 4.7321 4.7321 5.5780 5.5780 5.7678 5.7678 6.4628 6.4628 k = 0.0000 0.0000 0.0000 ( 9189 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4617 -9.4617 -8.8832 -8.8832 -8.8821 -8.8821 -8.8655 -8.8655 -8.8636 -8.8636 -7.3381 -7.3381 -7.3018 -7.3018 -7.2766 -7.2766 -7.2650 -7.2650 -7.2593 -7.2593 -7.2585 -7.2585 -7.0903 -7.0903 -7.0432 -7.0432 -6.6842 -6.6842 -6.6820 -6.6820 -6.6722 -6.6722 -6.6701 -6.6701 -6.6635 -6.6635 -6.5980 -6.5980 -2.9075 -2.9075 -1.8401 -1.8401 -1.5023 -1.5023 -0.7818 -0.7818 2.3344 2.3344 2.4528 2.4528 2.4958 2.4958 2.5386 2.5386 2.5994 2.5994 2.9901 2.9901 3.8236 3.8236 3.8733 3.8733 4.7321 4.7321 5.5780 5.5780 5.7678 5.7678 6.4628 6.4628 k = 0.0000 0.0000 0.0191 ( 9183 PWs) bands (ev): -9.5042 -9.5042 -9.4818 -9.4818 -9.4661 -9.4661 -9.4618 -9.4618 -8.8832 -8.8832 -8.8821 -8.8821 -8.8655 -8.8655 -8.8636 -8.8636 -7.3380 -7.3380 -7.3018 -7.3018 -7.2766 -7.2766 -7.2651 -7.2651 -7.2593 -7.2593 -7.2585 -7.2585 -7.0902 -7.0902 -7.0433 -7.0433 -6.6842 -6.6842 -6.6819 -6.6819 -6.6722 -6.6722 -6.6701 -6.6701 -6.6635 -6.6635 -6.5982 -6.5982 -2.9068 -2.9068 -1.8479 -1.8479 -1.4949 -1.4949 -0.7822 -0.7822 2.3348 2.3348 2.4531 2.4531 2.4958 2.4958 2.5384 2.5384 2.5993 2.5993 2.9907 2.9907 3.8240 3.8240 3.8782 3.8782 4.7329 4.7329 5.5545 5.5545 5.7915 5.7915 6.4040 6.4040 k = 0.0000 0.0000 0.0383 ( 9189 PWs) bands (ev): -9.5041 -9.5041 -9.4819 -9.4819 -9.4661 -9.4661 -9.4618 -9.4618 -8.8832 -8.8832 -8.8821 -8.8821 -8.8655 -8.8655 -8.8636 -8.8636 -7.3377 -7.3377 -7.3016 -7.3016 -7.2769 -7.2769 -7.2653 -7.2653 -7.2594 -7.2594 -7.2586 -7.2586 -7.0898 -7.0898 -7.0433 -7.0433 -6.6842 -6.6842 -6.6820 -6.6820 -6.6721 -6.6721 -6.6700 -6.6700 -6.6635 -6.6635 -6.5988 -6.5988 -2.9045 -2.9045 -1.8697 -1.8697 -1.4745 -1.4745 -0.7832 -0.7832 2.3360 2.3360 2.4541 2.4541 2.4956 2.4956 2.5382 2.5382 2.5990 2.5990 2.9924 2.9924 3.8254 3.8254 3.8925 3.8925 4.7352 4.7352 5.5034 5.5034 5.8437 5.8437 6.3197 6.3197 k = 0.0000 0.0000 0.0574 ( 9171 PWs) bands (ev): -9.5039 -9.5039 -9.4821 -9.4821 -9.4660 -9.4660 -9.4618 -9.4618 -8.8831 -8.8831 -8.8820 -8.8820 -8.8655 -8.8655 -8.8636 -8.8636 -7.3372 -7.3372 -7.3013 -7.3013 -7.2772 -7.2772 -7.2655 -7.2655 -7.2595 -7.2595 -7.2586 -7.2586 -7.0891 -7.0891 -7.0433 -7.0433 -6.6842 -6.6842 -6.6820 -6.6820 -6.6720 -6.6720 -6.6697 -6.6697 -6.6636 -6.6636 -6.5996 -6.5996 -2.9007 -2.9007 -1.9013 -1.9013 -1.4451 -1.4451 -0.7850 -0.7850 2.3380 2.3380 2.4556 2.4556 2.4954 2.4954 2.5380 2.5380 2.5985 2.5985 2.9951 2.9951 3.8277 3.8277 3.9158 3.9158 4.7390 4.7390 5.4439 5.4439 5.9045 5.9045 6.2347 6.2347 k = 0.0000 0.0000 0.0766 ( 9183 PWs) bands (ev): -9.5036 -9.5036 -9.4823 -9.4823 -9.4660 -9.4660 -9.4618 -9.4618 -8.8831 -8.8831 -8.8820 -8.8820 -8.8655 -8.8655 -8.8636 -8.8636 -7.3366 -7.3366 -7.3010 -7.3010 -7.2777 -7.2777 -7.2660 -7.2660 -7.2597 -7.2597 -7.2587 -7.2587 -7.0882 -7.0882 -7.0434 -7.0434 -6.6842 -6.6842 -6.6820 -6.6820 -6.6719 -6.6719 -6.6695 -6.6695 -6.6636 -6.6636 -6.6009 -6.6009 -2.8953 -2.8953 -1.9392 -1.9392 -1.4104 -1.4104 -0.7874 -0.7874 2.3408 2.3408 2.4578 2.4578 2.4951 2.4951 2.5382 2.5382 2.5978 2.5978 2.9986 2.9986 3.8310 3.8310 3.9474 3.9474 4.7445 4.7445 5.3831 5.3831 5.9668 5.9668 6.1507 6.1507 k = 0.0000 0.0000 0.0957 ( 9177 PWs) bands (ev): -9.5033 -9.5033 -9.4825 -9.4825 -9.4659 -9.4659 -9.4619 -9.4619 -8.8831 -8.8831 -8.8820 -8.8820 -8.8654 -8.8654 -8.8636 -8.8636 -7.3357 -7.3357 -7.3005 -7.3005 -7.2784 -7.2784 -7.2665 -7.2665 -7.2599 -7.2599 -7.2587 -7.2587 -7.0870 -7.0870 -7.0436 -7.0436 -6.6841 -6.6841 -6.6820 -6.6820 -6.6717 -6.6717 -6.6691 -6.6691 -6.6637 -6.6637 -6.6024 -6.6024 -2.8884 -2.8884 -1.9809 -1.9809 -1.3728 -1.3728 -0.7905 -0.7905 2.3443 2.3443 2.4606 2.4606 2.4947 2.4947 2.5394 2.5394 2.5969 2.5969 3.0025 3.0025 3.8355 3.8355 3.9859 3.9859 4.7516 4.7516 5.3240 5.3240 6.0270 6.0270 6.0684 6.0684 k = 0.0000 0.0000 0.1148 ( 9189 PWs) bands (ev): -9.5029 -9.5029 -9.4829 -9.4829 -9.4658 -9.4658 -9.4620 -9.4620 -8.8830 -8.8830 -8.8820 -8.8820 -8.8654 -8.8654 -8.8637 -8.8637 -7.3347 -7.3347 -7.2999 -7.2999 -7.2792 -7.2792 -7.2671 -7.2671 -7.2602 -7.2602 -7.2588 -7.2588 -7.0857 -7.0857 -7.0437 -7.0437 -6.6841 -6.6841 -6.6821 -6.6821 -6.6716 -6.6716 -6.6686 -6.6686 -6.6638 -6.6638 -6.6043 -6.6043 -2.8800 -2.8800 -2.0248 -2.0248 -1.3341 -1.3341 -0.7943 -0.7943 2.3486 2.3486 2.4639 2.4639 2.4940 2.4940 2.5421 2.5421 2.5957 2.5957 3.0066 3.0066 3.8411 3.8411 4.0300 4.0300 4.7604 4.7604 5.2685 5.2685 5.9878 5.9878 6.0827 6.0827 k = 0.0000 0.0000 0.1340 ( 9177 PWs) bands (ev): -9.5024 -9.5024 -9.4833 -9.4833 -9.4658 -9.4658 -9.4620 -9.4620 -8.8830 -8.8830 -8.8820 -8.8820 -8.8654 -8.8654 -8.8637 -8.8637 -7.3335 -7.3335 -7.2992 -7.2992 -7.2802 -7.2802 -7.2678 -7.2678 -7.2604 -7.2604 -7.2589 -7.2589 -7.0841 -7.0841 -7.0439 -7.0439 -6.6841 -6.6841 -6.6821 -6.6821 -6.6713 -6.6713 -6.6680 -6.6680 -6.6640 -6.6640 -6.6064 -6.6064 -2.8700 -2.8700 -2.0697 -2.0697 -1.2953 -1.2953 -0.7987 -0.7987 2.3536 2.3536 2.4677 2.4677 2.4931 2.4931 2.5466 2.5466 2.5942 2.5942 3.0103 3.0103 3.8482 3.8482 4.0778 4.0778 4.7710 4.7710 5.2183 5.2183 5.9093 5.9093 6.1315 6.1315 k = 0.0000 0.0000 0.1531 ( 9171 PWs) bands (ev): -9.5018 -9.5018 -9.4837 -9.4837 -9.4657 -9.4657 -9.4621 -9.4621 -8.8829 -8.8829 -8.8820 -8.8820 -8.8653 -8.8653 -8.8637 -8.8637 -7.3321 -7.3321 -7.2984 -7.2984 -7.2814 -7.2814 -7.2686 -7.2686 -7.2606 -7.2606 -7.2590 -7.2590 -7.0823 -7.0823 -7.0442 -7.0442 -6.6840 -6.6840 -6.6822 -6.6822 -6.6711 -6.6711 -6.6673 -6.6673 -6.6641 -6.6641 -6.6088 -6.6088 -2.8584 -2.8584 -2.1151 -2.1151 -1.2571 -1.2571 -0.8038 -0.8038 2.3592 2.3592 2.4721 2.4721 2.4920 2.4920 2.5535 2.5535 2.5925 2.5925 3.0133 3.0133 3.8568 3.8568 4.1268 4.1268 4.7835 4.7835 5.1754 5.1754 5.8330 5.8330 6.1713 6.1713 k = 0.0000 0.0000 0.1722 ( 9147 PWs) bands (ev): -9.5012 -9.5012 -9.4842 -9.4842 -9.4655 -9.4655 -9.4622 -9.4622 -8.8828 -8.8828 -8.8820 -8.8820 -8.8653 -8.8653 -8.8638 -8.8638 -7.3306 -7.3306 -7.2975 -7.2975 -7.2827 -7.2827 -7.2695 -7.2695 -7.2608 -7.2608 -7.2592 -7.2592 -7.0803 -7.0803 -7.0445 -7.0445 -6.6839 -6.6839 -6.6822 -6.6822 -6.6708 -6.6708 -6.6665 -6.6665 -6.6643 -6.6643 -6.6114 -6.6114 -2.8453 -2.8453 -2.1604 -2.1604 -1.2199 -1.2199 -0.8096 -0.8096 2.3654 2.3654 2.4769 2.4769 2.4905 2.4905 2.5632 2.5632 2.5904 2.5904 3.0149 3.0149 3.8671 3.8671 4.1744 4.1744 4.7980 4.7980 5.1423 5.1423 5.7589 5.7589 6.1578 6.1578 k = 0.0000 0.0000 0.1914 ( 9153 PWs) bands (ev): -9.5006 -9.5006 -9.4847 -9.4847 -9.4654 -9.4654 -9.4623 -9.4623 -8.8828 -8.8828 -8.8820 -8.8820 -8.8652 -8.8652 -8.8638 -8.8638 -7.3289 -7.3289 -7.2965 -7.2965 -7.2843 -7.2843 -7.2705 -7.2705 -7.2610 -7.2610 -7.2593 -7.2593 -7.0783 -7.0783 -7.0450 -7.0450 -6.6839 -6.6839 -6.6823 -6.6823 -6.6705 -6.6705 -6.6655 -6.6655 -6.6645 -6.6645 -6.6143 -6.6143 -2.8306 -2.8306 -2.2053 -2.2053 -1.1842 -1.1842 -0.8161 -0.8161 2.3720 2.3720 2.4821 2.4821 2.4887 2.4887 2.5758 2.5758 2.5880 2.5880 3.0145 3.0145 3.8793 3.8793 4.2169 4.2169 4.8145 4.8145 5.1219 5.1219 5.6872 5.6872 6.0974 6.0974 k = 0.0000 0.0000 0.2105 ( 9128 PWs) bands (ev): -9.4999 -9.4999 -9.4853 -9.4853 -9.4653 -9.4653 -9.4625 -9.4625 -8.8827 -8.8827 -8.8820 -8.8820 -8.8652 -8.8652 -8.8639 -8.8639 -7.3271 -7.3271 -7.2954 -7.2954 -7.2860 -7.2860 -7.2715 -7.2715 -7.2611 -7.2611 -7.2594 -7.2594 -7.0761 -7.0761 -7.0455 -7.0455 -6.6838 -6.6838 -6.6824 -6.6824 -6.6701 -6.6701 -6.6647 -6.6647 -6.6644 -6.6644 -6.6172 -6.6172 -2.8142 -2.8142 -2.2496 -2.2496 -1.1501 -1.1501 -0.8233 -0.8233 2.3791 2.3791 2.4864 2.4864 2.4876 2.4876 2.5852 2.5852 2.5915 2.5915 3.0118 3.0118 3.8937 3.8937 4.2509 4.2509 4.8333 4.8333 5.1170 5.1170 5.6178 5.6178 6.0397 6.0397 k = 0.0000 0.0000 0.2297 ( 9140 PWs) bands (ev): -9.4991 -9.4991 -9.4859 -9.4859 -9.4651 -9.4651 -9.4626 -9.4626 -8.8827 -8.8827 -8.8820 -8.8820 -8.8651 -8.8651 -8.8639 -8.8639 -7.3251 -7.3251 -7.2943 -7.2943 -7.2878 -7.2878 -7.2727 -7.2727 -7.2612 -7.2612 -7.2596 -7.2596 -7.0738 -7.0738 -7.0462 -7.0462 -6.6838 -6.6838 -6.6824 -6.6824 -6.6698 -6.6698 -6.6649 -6.6649 -6.6631 -6.6631 -6.6204 -6.6204 -2.7963 -2.7963 -2.2929 -2.2929 -1.1178 -1.1178 -0.8312 -0.8312 2.3863 2.3863 2.4837 2.4837 2.4935 2.4935 2.5821 2.5821 2.6104 2.6104 3.0062 3.0062 3.9102 3.9102 4.2733 4.2733 4.8543 4.8543 5.1301 5.1301 5.5511 5.5511 5.9858 5.9858 k = 0.0000 0.0000 0.2488 ( 9140 PWs) bands (ev): -9.4983 -9.4983 -9.4866 -9.4866 -9.4650 -9.4650 -9.4627 -9.4627 -8.8826 -8.8826 -8.8820 -8.8820 -8.8650 -8.8650 -8.8640 -8.8640 -7.3230 -7.3230 -7.2931 -7.2931 -7.2898 -7.2898 -7.2739 -7.2739 -7.2613 -7.2613 -7.2598 -7.2598 -7.0715 -7.0715 -7.0469 -7.0469 -6.6837 -6.6837 -6.6825 -6.6825 -6.6695 -6.6695 -6.6651 -6.6651 -6.6616 -6.6616 -6.6236 -6.6236 -2.7768 -2.7768 -2.3353 -2.3353 -1.0875 -1.0875 -0.8399 -0.8399 2.3938 2.3938 2.4806 2.4806 2.4996 2.4996 2.5786 2.5786 2.6324 2.6324 2.9972 2.9972 3.9291 3.9291 4.2827 4.2827 4.8776 4.8776 5.1619 5.1619 5.4869 5.4869 5.9363 5.9363 k = 0.0000 0.0000 0.2679 ( 9128 PWs) bands (ev): -9.4975 -9.4975 -9.4873 -9.4873 -9.4649 -9.4649 -9.4629 -9.4629 -8.8825 -8.8825 -8.8820 -8.8820 -8.8650 -8.8650 -8.8641 -8.8641 -7.3209 -7.3209 -7.2919 -7.2919 -7.2919 -7.2919 -7.2752 -7.2752 -7.2613 -7.2613 -7.2599 -7.2599 -7.0692 -7.0692 -7.0478 -7.0478 -6.6836 -6.6836 -6.6826 -6.6826 -6.6691 -6.6691 -6.6654 -6.6654 -6.6599 -6.6599 -6.6268 -6.6268 -2.7556 -2.7556 -2.3765 -2.3765 -1.0591 -1.0591 -0.8494 -0.8494 2.4014 2.4014 2.4769 2.4769 2.5058 2.5058 2.5747 2.5747 2.6572 2.6572 2.9848 2.9848 3.9503 3.9503 4.2795 4.2795 4.9035 4.9035 5.2109 5.2109 5.4253 5.4253 5.8915 5.8915 k = 0.0000 0.0000 0.2871 ( 9110 PWs) bands (ev): -9.4966 -9.4966 -9.4881 -9.4881 -9.4647 -9.4647 -9.4630 -9.4630 -8.8824 -8.8824 -8.8820 -8.8820 -8.8649 -8.8649 -8.8641 -8.8641 -7.3186 -7.3186 -7.2942 -7.2942 -7.2906 -7.2906 -7.2764 -7.2764 -7.2613 -7.2613 -7.2601 -7.2601 -7.0669 -7.0669 -7.0489 -7.0489 -6.6835 -6.6835 -6.6827 -6.6827 -6.6688 -6.6688 -6.6656 -6.6656 -6.6580 -6.6580 -6.6301 -6.6301 -2.7328 -2.7328 -2.4164 -2.4164 -1.0326 -1.0326 -0.8598 -0.8598 2.4090 2.4090 2.4728 2.4728 2.5122 2.5122 2.5704 2.5704 2.6846 2.6846 2.9686 2.9686 3.9740 3.9740 4.2657 4.2657 4.9319 4.9319 5.2740 5.2740 5.3665 5.3665 5.8510 5.8510 k = 0.0000 0.0000 0.3062 ( 9134 PWs) bands (ev): -9.4958 -9.4958 -9.4889 -9.4889 -9.4645 -9.4645 -9.4632 -9.4632 -8.8824 -8.8824 -8.8820 -8.8820 -8.8648 -8.8648 -8.8642 -8.8642 -7.3162 -7.3162 -7.2965 -7.2965 -7.2892 -7.2892 -7.2778 -7.2778 -7.2612 -7.2612 -7.2603 -7.2603 -7.0646 -7.0646 -7.0501 -7.0501 -6.6835 -6.6835 -6.6828 -6.6828 -6.6684 -6.6684 -6.6659 -6.6659 -6.6559 -6.6559 -6.6334 -6.6334 -2.7084 -2.7084 -2.4549 -2.4549 -1.0081 -1.0081 -0.8711 -0.8711 2.4165 2.4165 2.4681 2.4681 2.5187 2.5187 2.5658 2.5658 2.7140 2.7140 2.9488 2.9488 3.9999 3.9999 4.2441 4.2441 4.9629 4.9629 5.3104 5.3104 5.3468 5.3468 5.8136 5.8136 k = 0.0000 0.0000 0.3253 ( 9164 PWs) bands (ev): -9.4949 -9.4949 -9.4897 -9.4897 -9.4644 -9.4644 -9.4634 -9.4634 -8.8823 -8.8823 -8.8821 -8.8821 -8.8648 -8.8648 -8.8643 -8.8643 -7.3138 -7.3138 -7.2989 -7.2989 -7.2878 -7.2878 -7.2792 -7.2792 -7.2612 -7.2612 -7.2604 -7.2604 -7.0624 -7.0624 -7.0514 -7.0514 -6.6834 -6.6834 -6.6829 -6.6829 -6.6681 -6.6681 -6.6662 -6.6662 -6.6537 -6.6537 -6.6366 -6.6366 -2.6823 -2.6823 -2.4920 -2.4920 -0.9855 -0.9855 -0.8835 -0.8835 2.4240 2.4240 2.4630 2.4630 2.5251 2.5251 2.5608 2.5608 2.7450 2.7450 2.9257 2.9257 4.0280 4.0280 4.2170 4.2170 4.9965 4.9965 5.2571 5.2571 5.4248 5.4248 5.7774 5.7774 k = 0.0000 0.0000 0.3445 ( 9164 PWs) bands (ev): -9.4940 -9.4940 -9.4905 -9.4905 -9.4642 -9.4642 -9.4635 -9.4635 -8.8823 -8.8823 -8.8821 -8.8821 -8.8647 -8.8647 -8.8644 -8.8644 -7.3114 -7.3114 -7.3013 -7.3013 -7.2864 -7.2864 -7.2807 -7.2807 -7.2611 -7.2611 -7.2606 -7.2606 -7.0603 -7.0603 -7.0529 -7.0529 -6.6833 -6.6833 -6.6830 -6.6830 -6.6678 -6.6678 -6.6665 -6.6665 -6.6512 -6.6512 -6.6398 -6.6398 -2.6546 -2.6546 -2.5277 -2.5277 -0.9646 -0.9646 -0.8970 -0.8970 2.4312 2.4312 2.4574 2.4574 2.5315 2.5315 2.5554 2.5554 2.7768 2.7768 2.8996 2.8996 4.0580 4.0580 4.1866 4.1866 5.0329 5.0329 5.2066 5.2066 5.5031 5.5031 5.7392 5.7392 k = 0.0000 0.0000 0.3636 ( 9158 PWs) bands (ev): -9.4931 -9.4931 -9.4914 -9.4914 -9.4640 -9.4640 -9.4637 -9.4637 -8.8822 -8.8822 -8.8821 -8.8821 -8.8646 -8.8646 -8.8645 -8.8645 -7.3088 -7.3088 -7.3038 -7.3038 -7.2850 -7.2850 -7.2821 -7.2821 -7.2610 -7.2610 -7.2607 -7.2607 -7.0582 -7.0582 -7.0545 -7.0545 -6.6832 -6.6832 -6.6831 -6.6831 -6.6675 -6.6675 -6.6668 -6.6668 -6.6486 -6.6486 -6.6429 -6.6429 -2.6252 -2.6252 -2.5618 -2.5618 -0.9455 -0.9455 -0.9118 -0.9118 2.4383 2.4383 2.4514 2.4514 2.5378 2.5378 2.5498 2.5498 2.8089 2.8089 2.8710 2.8710 4.0894 4.0894 4.1545 4.1545 5.0721 5.0721 5.1590 5.1590 5.5767 5.5767 5.6951 5.6951 k = 0.0000 0.0000 0.3828 ( 9152 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8822 -8.8822 -8.8822 -8.8822 -8.8645 -8.8645 -8.8645 -8.8645 -7.3063 -7.3063 -7.3063 -7.3063 -7.2835 -7.2835 -7.2835 -7.2835 -7.2609 -7.2609 -7.2609 -7.2609 -7.0563 -7.0563 -7.0563 -7.0563 -6.6831 -6.6831 -6.6831 -6.6831 -6.6671 -6.6671 -6.6671 -6.6671 -6.6458 -6.6458 -6.6458 -6.6458 -2.5943 -2.5943 -2.5943 -2.5943 -0.9279 -0.9279 -0.9279 -0.9279 2.4450 2.4450 2.4450 2.4450 2.5439 2.5439 2.5439 2.5439 2.8406 2.8406 2.8406 2.8406 4.1218 4.1218 4.1218 4.1218 5.1141 5.1141 5.1141 5.1141 5.6413 5.6413 5.6413 5.6413 k = 0.0000 0.0000 0.3828 ( 9152 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8822 -8.8822 -8.8822 -8.8822 -8.8645 -8.8645 -8.8645 -8.8645 -7.3063 -7.3063 -7.3063 -7.3063 -7.2835 -7.2835 -7.2835 -7.2835 -7.2609 -7.2609 -7.2609 -7.2609 -7.0563 -7.0563 -7.0563 -7.0563 -6.6831 -6.6831 -6.6831 -6.6831 -6.6671 -6.6671 -6.6671 -6.6671 -6.6458 -6.6458 -6.6458 -6.6458 -2.5943 -2.5943 -2.5943 -2.5943 -0.9279 -0.9279 -0.9279 -0.9279 2.4450 2.4450 2.4450 2.4450 2.5439 2.5439 2.5439 2.5439 2.8406 2.8406 2.8406 2.8406 4.1218 4.1218 4.1218 4.1218 5.1141 5.1141 5.1141 5.1141 5.6413 5.6413 5.6413 5.6413 k = 0.0167 0.0096 0.3828 ( 9170 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8822 -8.8822 -8.8822 -8.8822 -8.8645 -8.8645 -8.8645 -8.8645 -7.3063 -7.3063 -7.3063 -7.3063 -7.2836 -7.2836 -7.2836 -7.2836 -7.2609 -7.2609 -7.2609 -7.2609 -7.0562 -7.0562 -7.0562 -7.0562 -6.6832 -6.6832 -6.6832 -6.6832 -6.6672 -6.6672 -6.6672 -6.6672 -6.6457 -6.6457 -6.6457 -6.6457 -2.5940 -2.5940 -2.5940 -2.5940 -0.9293 -0.9293 -0.9293 -0.9293 2.4445 2.4445 2.4445 2.4445 2.5426 2.5426 2.5426 2.5426 2.8407 2.8407 2.8407 2.8407 4.1249 4.1249 4.1249 4.1249 5.1164 5.1164 5.1164 5.1164 5.6437 5.6437 5.6437 5.6437 k = 0.0333 0.0192 0.3828 ( 9154 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8821 -8.8821 -8.8821 -8.8821 -8.8645 -8.8645 -8.8645 -8.8645 -7.3064 -7.3064 -7.3064 -7.3064 -7.2837 -7.2837 -7.2837 -7.2837 -7.2609 -7.2609 -7.2609 -7.2609 -7.0557 -7.0557 -7.0557 -7.0557 -6.6832 -6.6832 -6.6832 -6.6832 -6.6674 -6.6674 -6.6674 -6.6674 -6.6454 -6.6454 -6.6454 -6.6454 -2.5930 -2.5930 -2.5930 -2.5930 -0.9337 -0.9337 -0.9337 -0.9337 2.4430 2.4430 2.4430 2.4430 2.5388 2.5388 2.5388 2.5388 2.8412 2.8412 2.8412 2.8412 4.1343 4.1343 4.1343 4.1343 5.1230 5.1230 5.1230 5.1230 5.6507 5.6507 5.6507 5.6507 k = 0.0500 0.0289 0.3828 ( 9138 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8821 -8.8821 -8.8821 -8.8821 -8.8646 -8.8646 -8.8646 -8.8646 -7.3064 -7.3064 -7.3064 -7.3064 -7.2838 -7.2838 -7.2838 -7.2838 -7.2610 -7.2610 -7.2610 -7.2610 -7.0549 -7.0549 -7.0549 -7.0549 -6.6832 -6.6832 -6.6832 -6.6832 -6.6677 -6.6677 -6.6677 -6.6677 -6.6449 -6.6449 -6.6449 -6.6449 -2.5915 -2.5915 -2.5915 -2.5915 -0.9410 -0.9410 -0.9410 -0.9410 2.4403 2.4403 2.4403 2.4403 2.5327 2.5327 2.5327 2.5327 2.8422 2.8422 2.8422 2.8422 4.1494 4.1494 4.1494 4.1494 5.1336 5.1336 5.1336 5.1336 5.6623 5.6623 5.6623 5.6623 k = 0.0667 0.0385 0.3828 ( 9142 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8821 -8.8821 -8.8821 -8.8821 -8.8646 -8.8646 -8.8646 -8.8646 -7.3064 -7.3064 -7.3064 -7.3064 -7.2840 -7.2840 -7.2840 -7.2840 -7.2611 -7.2611 -7.2611 -7.2611 -7.0538 -7.0538 -7.0538 -7.0538 -6.6832 -6.6832 -6.6832 -6.6832 -6.6682 -6.6682 -6.6682 -6.6682 -6.6443 -6.6443 -6.6443 -6.6443 -2.5892 -2.5892 -2.5892 -2.5892 -0.9510 -0.9510 -0.9510 -0.9510 2.4363 2.4363 2.4363 2.4363 2.5248 2.5248 2.5248 2.5248 2.8440 2.8440 2.8440 2.8440 4.1697 4.1697 4.1697 4.1697 5.1478 5.1478 5.1478 5.1478 5.6782 5.6782 5.6782 5.6782 k = 0.0833 0.0481 0.3828 ( 9134 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8820 -8.8820 -8.8820 -8.8820 -8.8646 -8.8646 -8.8646 -8.8646 -7.3065 -7.3065 -7.3065 -7.3065 -7.2842 -7.2842 -7.2842 -7.2842 -7.2613 -7.2613 -7.2613 -7.2613 -7.0525 -7.0525 -7.0525 -7.0525 -6.6833 -6.6833 -6.6833 -6.6833 -6.6687 -6.6687 -6.6687 -6.6687 -6.6435 -6.6435 -6.6435 -6.6435 -2.5864 -2.5864 -2.5864 -2.5864 -0.9639 -0.9639 -0.9639 -0.9639 2.4307 2.4307 2.4307 2.4307 2.5158 2.5158 2.5158 2.5158 2.8469 2.8469 2.8469 2.8469 4.1944 4.1944 4.1944 4.1944 5.1648 5.1648 5.1648 5.1648 5.6976 5.6976 5.6976 5.6976 k = 0.1000 0.0577 0.3828 ( 9146 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8820 -8.8820 -8.8820 -8.8820 -8.8647 -8.8647 -8.8647 -8.8647 -7.3066 -7.3066 -7.3066 -7.3066 -7.2845 -7.2845 -7.2845 -7.2845 -7.2614 -7.2614 -7.2614 -7.2614 -7.0509 -7.0509 -7.0509 -7.0509 -6.6834 -6.6834 -6.6834 -6.6834 -6.6692 -6.6692 -6.6692 -6.6692 -6.6426 -6.6426 -6.6426 -6.6426 -2.5829 -2.5829 -2.5829 -2.5829 -0.9795 -0.9795 -0.9795 -0.9795 2.4232 2.4232 2.4232 2.4232 2.5066 2.5066 2.5066 2.5066 2.8511 2.8511 2.8511 2.8511 4.2227 4.2227 4.2227 4.2227 5.1839 5.1839 5.1839 5.1839 5.7182 5.7182 5.7182 5.7182 k = 0.1167 0.0674 0.3828 ( 9148 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8819 -8.8819 -8.8819 -8.8819 -8.8647 -8.8647 -8.8647 -8.8647 -7.3066 -7.3066 -7.3066 -7.3066 -7.2849 -7.2849 -7.2849 -7.2849 -7.2616 -7.2616 -7.2616 -7.2616 -7.0490 -7.0490 -7.0490 -7.0490 -6.6835 -6.6835 -6.6835 -6.6835 -6.6699 -6.6699 -6.6699 -6.6699 -6.6416 -6.6416 -6.6416 -6.6416 -2.5787 -2.5787 -2.5787 -2.5787 -0.9976 -0.9976 -0.9976 -0.9976 2.4134 2.4134 2.4134 2.4134 2.4982 2.4982 2.4982 2.4982 2.8568 2.8568 2.8568 2.8568 4.2539 4.2539 4.2539 4.2539 5.2044 5.2044 5.2044 5.2044 5.7354 5.7354 5.7354 5.7354 k = 0.1333 0.0770 0.3828 ( 9144 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8818 -8.8818 -8.8818 -8.8818 -8.8648 -8.8648 -8.8648 -8.8648 -7.3067 -7.3067 -7.3067 -7.3067 -7.2852 -7.2852 -7.2852 -7.2852 -7.2618 -7.2618 -7.2618 -7.2618 -7.0470 -7.0470 -7.0470 -7.0470 -6.6836 -6.6836 -6.6836 -6.6836 -6.6705 -6.6705 -6.6705 -6.6705 -6.6405 -6.6405 -6.6405 -6.6405 -2.5738 -2.5738 -2.5738 -2.5738 -1.0183 -1.0183 -1.0183 -1.0183 2.4010 2.4010 2.4010 2.4010 2.4914 2.4914 2.4914 2.4914 2.8641 2.8641 2.8641 2.8641 4.2869 4.2869 4.2869 4.2869 5.2256 5.2256 5.2256 5.2256 5.7409 5.7409 5.7409 5.7409 k = 0.1500 0.0866 0.3828 ( 9146 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4638 -9.4638 -9.4638 -9.4638 -8.8818 -8.8818 -8.8818 -8.8818 -8.8648 -8.8648 -8.8648 -8.8648 -7.3068 -7.3068 -7.3068 -7.3068 -7.2857 -7.2857 -7.2857 -7.2857 -7.2620 -7.2620 -7.2620 -7.2620 -7.0447 -7.0447 -7.0447 -7.0447 -6.6837 -6.6837 -6.6837 -6.6837 -6.6712 -6.6712 -6.6712 -6.6712 -6.6393 -6.6393 -6.6393 -6.6393 -2.5682 -2.5682 -2.5682 -2.5682 -1.0412 -1.0412 -1.0412 -1.0412 2.3862 2.3862 2.3862 2.3862 2.4867 2.4867 2.4867 2.4867 2.8730 2.8730 2.8730 2.8730 4.3211 4.3211 4.3211 4.3211 5.2467 5.2467 5.2467 5.2467 5.7265 5.7265 5.7265 5.7265 k = 0.1667 0.0962 0.3828 ( 9142 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4638 -9.4638 -9.4638 -9.4638 -8.8817 -8.8817 -8.8817 -8.8817 -8.8649 -8.8649 -8.8649 -8.8649 -7.3069 -7.3069 -7.3069 -7.3069 -7.2861 -7.2861 -7.2861 -7.2861 -7.2622 -7.2622 -7.2622 -7.2622 -7.0424 -7.0424 -7.0424 -7.0424 -6.6838 -6.6838 -6.6838 -6.6838 -6.6718 -6.6718 -6.6718 -6.6718 -6.6380 -6.6380 -6.6380 -6.6380 -2.5620 -2.5620 -2.5620 -2.5620 -1.0663 -1.0663 -1.0663 -1.0663 2.3693 2.3693 2.3693 2.3693 2.4845 2.4845 2.4845 2.4845 2.8834 2.8834 2.8834 2.8834 4.3558 4.3558 4.3558 4.3558 5.2669 5.2669 5.2669 5.2669 5.6925 5.6925 5.6925 5.6925 k = 0.1833 0.1058 0.3828 ( 9146 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4638 -9.4638 -9.4638 -9.4638 -8.8816 -8.8816 -8.8816 -8.8816 -8.8650 -8.8650 -8.8650 -8.8650 -7.3070 -7.3070 -7.3070 -7.3070 -7.2866 -7.2866 -7.2866 -7.2866 -7.2624 -7.2624 -7.2624 -7.2624 -7.0399 -7.0399 -7.0399 -7.0399 -6.6839 -6.6839 -6.6839 -6.6839 -6.6724 -6.6724 -6.6724 -6.6724 -6.6367 -6.6367 -6.6367 -6.6367 -2.5550 -2.5550 -2.5550 -2.5550 -1.0934 -1.0934 -1.0934 -1.0934 2.3510 2.3510 2.3510 2.3510 2.4847 2.4847 2.4847 2.4847 2.8952 2.8952 2.8952 2.8952 4.3903 4.3903 4.3903 4.3903 5.2852 5.2852 5.2852 5.2852 5.6465 5.6465 5.6465 5.6465 k = 0.2000 0.1155 0.3828 ( 9140 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4638 -9.4638 -9.4638 -9.4638 -8.8815 -8.8815 -8.8815 -8.8815 -8.8651 -8.8651 -8.8651 -8.8651 -7.3072 -7.3072 -7.3072 -7.3072 -7.2870 -7.2870 -7.2870 -7.2870 -7.2627 -7.2627 -7.2627 -7.2627 -7.0373 -7.0373 -7.0373 -7.0373 -6.6840 -6.6840 -6.6840 -6.6840 -6.6731 -6.6731 -6.6731 -6.6731 -6.6354 -6.6354 -6.6354 -6.6354 -2.5474 -2.5474 -2.5474 -2.5474 -1.1222 -1.1222 -1.1222 -1.1222 2.3318 2.3318 2.3318 2.3318 2.4873 2.4873 2.4873 2.4873 2.9081 2.9081 2.9081 2.9081 4.4242 4.4242 4.4242 4.4242 5.2991 5.2991 5.2991 5.2991 5.5966 5.5966 5.5966 5.5966 k = 0.2167 0.1251 0.3828 ( 9132 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4638 -9.4638 -9.4638 -9.4638 -8.8814 -8.8814 -8.8814 -8.8814 -8.8651 -8.8651 -8.8651 -8.8651 -7.3073 -7.3073 -7.3073 -7.3073 -7.2875 -7.2875 -7.2875 -7.2875 -7.2628 -7.2628 -7.2628 -7.2628 -7.0346 -7.0346 -7.0346 -7.0346 -6.6841 -6.6841 -6.6841 -6.6841 -6.6736 -6.6736 -6.6736 -6.6736 -6.6340 -6.6340 -6.6340 -6.6340 -2.5391 -2.5391 -2.5391 -2.5391 -1.1525 -1.1525 -1.1525 -1.1525 2.3120 2.3120 2.3120 2.3120 2.4924 2.4924 2.4924 2.4924 2.9218 2.9218 2.9218 2.9218 4.4570 4.4570 4.4570 4.4570 5.3046 5.3046 5.3046 5.3046 5.5512 5.5512 5.5512 5.5512 k = 0.2333 0.1347 0.3828 ( 9132 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4638 -9.4638 -9.4638 -9.4638 -8.8813 -8.8813 -8.8813 -8.8813 -8.8652 -8.8652 -8.8652 -8.8652 -7.3074 -7.3074 -7.3074 -7.3074 -7.2880 -7.2880 -7.2880 -7.2880 -7.2630 -7.2630 -7.2630 -7.2630 -7.0320 -7.0320 -7.0320 -7.0320 -6.6842 -6.6842 -6.6842 -6.6842 -6.6742 -6.6742 -6.6742 -6.6742 -6.6327 -6.6327 -6.6327 -6.6327 -2.5301 -2.5301 -2.5301 -2.5301 -1.1840 -1.1840 -1.1840 -1.1840 2.2921 2.2921 2.2921 2.2921 2.4998 2.4998 2.4998 2.4998 2.9361 2.9361 2.9361 2.9361 4.4883 4.4883 4.4883 4.4883 5.2949 5.2949 5.2949 5.2949 5.5194 5.5194 5.5194 5.5194 k = 0.2500 0.1443 0.3828 ( 9148 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8812 -8.8812 -8.8812 -8.8812 -8.8653 -8.8653 -8.8653 -8.8653 -7.3075 -7.3075 -7.3075 -7.3075 -7.2885 -7.2885 -7.2885 -7.2885 -7.2632 -7.2632 -7.2632 -7.2632 -7.0293 -7.0293 -7.0293 -7.0293 -6.6844 -6.6844 -6.6844 -6.6844 -6.6747 -6.6747 -6.6747 -6.6747 -6.6313 -6.6313 -6.6313 -6.6313 -2.5205 -2.5205 -2.5205 -2.5205 -1.2165 -1.2165 -1.2165 -1.2165 2.2725 2.2725 2.2725 2.2725 2.5097 2.5097 2.5097 2.5097 2.9507 2.9507 2.9507 2.9507 4.5176 4.5176 4.5176 4.5176 5.2654 5.2654 5.2654 5.2654 5.5075 5.5075 5.5075 5.5075 k = 0.2667 0.1540 0.3828 ( 9138 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8810 -8.8810 -8.8810 -8.8810 -8.8654 -8.8654 -8.8654 -8.8654 -7.3077 -7.3077 -7.3077 -7.3077 -7.2890 -7.2890 -7.2890 -7.2890 -7.2634 -7.2634 -7.2634 -7.2634 -7.0267 -7.0267 -7.0267 -7.0267 -6.6845 -6.6845 -6.6845 -6.6845 -6.6752 -6.6752 -6.6752 -6.6752 -6.6299 -6.6299 -6.6299 -6.6299 -2.5103 -2.5103 -2.5103 -2.5103 -1.2496 -1.2496 -1.2496 -1.2496 2.2532 2.2532 2.2532 2.2532 2.5219 2.5219 2.5219 2.5219 2.9653 2.9653 2.9653 2.9653 4.5445 4.5445 4.5445 4.5445 5.2205 5.2205 5.2205 5.2205 5.5124 5.5124 5.5124 5.5124 k = 0.2833 0.1636 0.3828 ( 9138 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8809 -8.8809 -8.8809 -8.8809 -8.8655 -8.8655 -8.8655 -8.8655 -7.3078 -7.3078 -7.3078 -7.3078 -7.2895 -7.2895 -7.2895 -7.2895 -7.2636 -7.2636 -7.2636 -7.2636 -7.0241 -7.0241 -7.0241 -7.0241 -6.6846 -6.6846 -6.6846 -6.6846 -6.6757 -6.6757 -6.6757 -6.6757 -6.6286 -6.6286 -6.6286 -6.6286 -2.4995 -2.4995 -2.4995 -2.4995 -1.2831 -1.2831 -1.2831 -1.2831 2.2346 2.2346 2.2346 2.2346 2.5363 2.5363 2.5363 2.5363 2.9796 2.9796 2.9796 2.9796 4.5685 4.5685 4.5685 4.5685 5.1684 5.1684 5.1684 5.1684 5.5273 5.5273 5.5273 5.5273 k = 0.3000 0.1732 0.3828 ( 9146 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8808 -8.8808 -8.8808 -8.8808 -8.8656 -8.8656 -8.8656 -8.8656 -7.3079 -7.3079 -7.3079 -7.3079 -7.2900 -7.2900 -7.2900 -7.2900 -7.2638 -7.2638 -7.2638 -7.2638 -7.0217 -7.0217 -7.0217 -7.0217 -6.6847 -6.6847 -6.6847 -6.6847 -6.6761 -6.6761 -6.6761 -6.6761 -6.6272 -6.6272 -6.6272 -6.6272 -2.4884 -2.4884 -2.4884 -2.4884 -1.3165 -1.3165 -1.3165 -1.3165 2.2167 2.2167 2.2167 2.2167 2.5526 2.5526 2.5526 2.5526 2.9932 2.9932 2.9932 2.9932 4.5886 4.5886 4.5886 4.5886 5.1152 5.1152 5.1152 5.1152 5.5473 5.5473 5.5473 5.5473 k = 0.3167 0.1828 0.3828 ( 9142 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8807 -8.8807 -8.8807 -8.8807 -8.8657 -8.8657 -8.8657 -8.8657 -7.3080 -7.3080 -7.3080 -7.3080 -7.2904 -7.2904 -7.2904 -7.2904 -7.2639 -7.2639 -7.2639 -7.2639 -7.0193 -7.0193 -7.0193 -7.0193 -6.6848 -6.6848 -6.6848 -6.6848 -6.6765 -6.6765 -6.6765 -6.6765 -6.6260 -6.6260 -6.6260 -6.6260 -2.4769 -2.4769 -2.4769 -2.4769 -1.3495 -1.3495 -1.3495 -1.3495 2.1999 2.1999 2.1999 2.1999 2.5708 2.5708 2.5708 2.5708 3.0060 3.0060 3.0060 3.0060 4.6040 4.6040 4.6040 4.6040 5.0651 5.0651 5.0651 5.0651 5.5697 5.5697 5.5697 5.5697 k = 0.3333 0.1925 0.3828 ( 9146 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8806 -8.8806 -8.8806 -8.8806 -8.8658 -8.8658 -8.8658 -8.8658 -7.3082 -7.3082 -7.3082 -7.3082 -7.2908 -7.2908 -7.2908 -7.2908 -7.2640 -7.2640 -7.2640 -7.2640 -7.0171 -7.0171 -7.0171 -7.0171 -6.6849 -6.6849 -6.6849 -6.6849 -6.6769 -6.6769 -6.6769 -6.6769 -6.6247 -6.6247 -6.6247 -6.6247 -2.4651 -2.4651 -2.4651 -2.4651 -1.3818 -1.3818 -1.3818 -1.3818 2.1841 2.1841 2.1841 2.1841 2.5904 2.5904 2.5904 2.5904 3.0176 3.0176 3.0176 3.0176 4.6131 4.6131 4.6131 4.6131 5.0212 5.0212 5.0212 5.0212 5.5930 5.5930 5.5930 5.5930 k = 0.3500 0.2021 0.3828 ( 9132 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8805 -8.8805 -8.8805 -8.8805 -8.8658 -8.8658 -8.8658 -8.8658 -7.3083 -7.3083 -7.3083 -7.3083 -7.2912 -7.2912 -7.2912 -7.2912 -7.2642 -7.2642 -7.2642 -7.2642 -7.0151 -7.0151 -7.0151 -7.0151 -6.6850 -6.6850 -6.6850 -6.6850 -6.6772 -6.6772 -6.6772 -6.6772 -6.6236 -6.6236 -6.6236 -6.6236 -2.4534 -2.4534 -2.4534 -2.4534 -1.4129 -1.4129 -1.4129 -1.4129 2.1695 2.1695 2.1695 2.1695 2.6111 2.6111 2.6111 2.6111 3.0278 3.0278 3.0278 3.0278 4.6147 4.6147 4.6147 4.6147 4.9860 4.9860 4.9860 4.9860 5.6162 5.6162 5.6162 5.6162 k = 0.3667 0.2117 0.3828 ( 9138 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8804 -8.8804 -8.8804 -8.8804 -8.8659 -8.8659 -8.8659 -8.8659 -7.3084 -7.3084 -7.3084 -7.3084 -7.2915 -7.2915 -7.2915 -7.2915 -7.2643 -7.2643 -7.2643 -7.2643 -7.0132 -7.0132 -7.0132 -7.0132 -6.6851 -6.6851 -6.6851 -6.6851 -6.6774 -6.6774 -6.6774 -6.6774 -6.6225 -6.6225 -6.6225 -6.6225 -2.4417 -2.4417 -2.4417 -2.4417 -1.4425 -1.4425 -1.4425 -1.4425 2.1562 2.1562 2.1562 2.1562 2.6325 2.6325 2.6325 2.6325 3.0364 3.0364 3.0364 3.0364 4.6080 4.6080 4.6080 4.6080 4.9611 4.9611 4.9611 4.9611 5.6386 5.6386 5.6386 5.6386 k = 0.3833 0.2213 0.3828 ( 9132 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8803 -8.8803 -8.8803 -8.8803 -8.8660 -8.8660 -8.8660 -8.8660 -7.3085 -7.3085 -7.3085 -7.3085 -7.2919 -7.2919 -7.2919 -7.2919 -7.2644 -7.2644 -7.2644 -7.2644 -7.0115 -7.0115 -7.0115 -7.0115 -6.6851 -6.6851 -6.6851 -6.6851 -6.6777 -6.6777 -6.6777 -6.6777 -6.6215 -6.6215 -6.6215 -6.6215 -2.4305 -2.4305 -2.4305 -2.4305 -1.4700 -1.4700 -1.4700 -1.4700 2.1443 2.1443 2.1443 2.1443 2.6539 2.6539 2.6539 2.6539 3.0434 3.0434 3.0434 3.0434 4.5938 4.5938 4.5938 4.5938 4.9463 4.9463 4.9463 4.9463 5.6597 5.6597 5.6597 5.6597 k = 0.4000 0.2309 0.3828 ( 9128 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8802 -8.8802 -8.8802 -8.8802 -8.8661 -8.8661 -8.8661 -8.8661 -7.3085 -7.3085 -7.3085 -7.3085 -7.2921 -7.2921 -7.2921 -7.2921 -7.2644 -7.2644 -7.2644 -7.2644 -7.0100 -7.0100 -7.0100 -7.0100 -6.6852 -6.6852 -6.6852 -6.6852 -6.6779 -6.6779 -6.6779 -6.6779 -6.6206 -6.6206 -6.6206 -6.6206 -2.4199 -2.4199 -2.4199 -2.4199 -1.4952 -1.4952 -1.4952 -1.4952 2.1338 2.1338 2.1338 2.1338 2.6749 2.6749 2.6749 2.6749 3.0487 3.0487 3.0487 3.0487 4.5742 4.5742 4.5742 4.5742 4.9399 4.9399 4.9399 4.9399 5.6789 5.6789 5.6789 5.6789 k = 0.4167 0.2406 0.3828 ( 9112 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4637 -9.4637 -9.4637 -9.4637 -8.8801 -8.8801 -8.8801 -8.8801 -8.8661 -8.8661 -8.8661 -8.8661 -7.3086 -7.3086 -7.3086 -7.3086 -7.2924 -7.2924 -7.2924 -7.2924 -7.2645 -7.2645 -7.2645 -7.2645 -7.0087 -7.0087 -7.0087 -7.0087 -6.6852 -6.6852 -6.6852 -6.6852 -6.6781 -6.6781 -6.6781 -6.6781 -6.6198 -6.6198 -6.6198 -6.6198 -2.4101 -2.4101 -2.4101 -2.4101 -1.5174 -1.5174 -1.5174 -1.5174 2.1249 2.1249 2.1249 2.1249 2.6946 2.6946 2.6946 2.6946 3.0525 3.0525 3.0525 3.0525 4.5525 4.5525 4.5525 4.5525 4.9392 4.9392 4.9392 4.9392 5.6959 5.6959 5.6959 5.6959 k = 0.4333 0.2502 0.3828 ( 9132 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8801 -8.8801 -8.8801 -8.8801 -8.8662 -8.8662 -8.8662 -8.8662 -7.3087 -7.3087 -7.3087 -7.3087 -7.2926 -7.2926 -7.2926 -7.2926 -7.2646 -7.2646 -7.2646 -7.2646 -7.0077 -7.0077 -7.0077 -7.0077 -6.6853 -6.6853 -6.6853 -6.6853 -6.6782 -6.6782 -6.6782 -6.6782 -6.6192 -6.6192 -6.6192 -6.6192 -2.4016 -2.4016 -2.4016 -2.4016 -1.5364 -1.5364 -1.5364 -1.5364 2.1175 2.1175 2.1175 2.1175 2.7124 2.7124 2.7124 2.7124 3.0548 3.0548 3.0548 3.0548 4.5312 4.5312 4.5312 4.5312 4.9417 4.9417 4.9417 4.9417 5.7103 5.7103 5.7103 5.7103 k = 0.4500 0.2598 0.3828 ( 9118 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4637 -9.4637 -9.4637 -9.4637 -8.8800 -8.8800 -8.8800 -8.8800 -8.8662 -8.8662 -8.8662 -8.8662 -7.3087 -7.3087 -7.3087 -7.3087 -7.2927 -7.2927 -7.2927 -7.2927 -7.2646 -7.2646 -7.2646 -7.2646 -7.0069 -7.0069 -7.0069 -7.0069 -6.6853 -6.6853 -6.6853 -6.6853 -6.6783 -6.6783 -6.6783 -6.6783 -6.6186 -6.6186 -6.6186 -6.6186 -2.3947 -2.3947 -2.3947 -2.3947 -1.5517 -1.5517 -1.5517 -1.5517 2.1117 2.1117 2.1117 2.1117 2.7274 2.7274 2.7274 2.7274 3.0561 3.0561 3.0561 3.0561 4.5128 4.5128 4.5128 4.5128 4.9454 4.9454 4.9454 4.9454 5.7219 5.7219 5.7219 5.7219 k = 0.4667 0.2694 0.3828 ( 9126 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8800 -8.8800 -8.8800 -8.8800 -8.8662 -8.8662 -8.8662 -8.8662 -7.3088 -7.3088 -7.3088 -7.3088 -7.2928 -7.2928 -7.2928 -7.2928 -7.2646 -7.2646 -7.2646 -7.2646 -7.0063 -7.0063 -7.0063 -7.0063 -6.6854 -6.6854 -6.6854 -6.6854 -6.6784 -6.6784 -6.6784 -6.6784 -6.6183 -6.6183 -6.6183 -6.6183 -2.3894 -2.3894 -2.3894 -2.3894 -1.5629 -1.5629 -1.5629 -1.5629 2.1075 2.1075 2.1075 2.1075 2.7389 2.7389 2.7389 2.7389 3.0566 3.0566 3.0566 3.0566 4.4986 4.4986 4.4986 4.4986 4.9489 4.9489 4.9489 4.9489 5.7303 5.7303 5.7303 5.7303 k = 0.4833 0.2791 0.3828 ( 9124 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8800 -8.8800 -8.8800 -8.8800 -8.8663 -8.8663 -8.8663 -8.8663 -7.3088 -7.3088 -7.3088 -7.3088 -7.2929 -7.2929 -7.2929 -7.2929 -7.2647 -7.2647 -7.2647 -7.2647 -7.0059 -7.0059 -7.0059 -7.0059 -6.6854 -6.6854 -6.6854 -6.6854 -6.6784 -6.6784 -6.6784 -6.6784 -6.6180 -6.6180 -6.6180 -6.6180 -2.3862 -2.3862 -2.3862 -2.3862 -1.5697 -1.5697 -1.5697 -1.5697 2.1050 2.1050 2.1050 2.1050 2.7461 2.7461 2.7461 2.7461 3.0567 3.0567 3.0567 3.0567 4.4897 4.4897 4.4897 4.4897 4.9514 4.9514 4.9514 4.9514 5.7354 5.7354 5.7354 5.7354 k = 0.5000 0.2887 0.3828 ( 9136 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8800 -8.8800 -8.8800 -8.8800 -8.8663 -8.8663 -8.8663 -8.8663 -7.3088 -7.3088 -7.3088 -7.3088 -7.2929 -7.2929 -7.2929 -7.2929 -7.2647 -7.2647 -7.2647 -7.2647 -7.0058 -7.0058 -7.0058 -7.0058 -6.6854 -6.6854 -6.6854 -6.6854 -6.6785 -6.6785 -6.6785 -6.6785 -6.6180 -6.6180 -6.6180 -6.6180 -2.3851 -2.3851 -2.3851 -2.3851 -1.5720 -1.5720 -1.5720 -1.5720 2.1041 2.1041 2.1041 2.1041 2.7485 2.7485 2.7485 2.7485 3.0567 3.0567 3.0567 3.0567 4.4866 4.4866 4.4866 4.4866 4.9523 4.9523 4.9523 4.9523 5.7371 5.7371 5.7371 5.7371 k = 0.5000 0.2887 0.3828 ( 9136 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8800 -8.8800 -8.8800 -8.8800 -8.8663 -8.8663 -8.8663 -8.8663 -7.3088 -7.3088 -7.3088 -7.3088 -7.2929 -7.2929 -7.2929 -7.2929 -7.2647 -7.2647 -7.2647 -7.2647 -7.0058 -7.0058 -7.0058 -7.0058 -6.6854 -6.6854 -6.6854 -6.6854 -6.6785 -6.6785 -6.6785 -6.6785 -6.6180 -6.6180 -6.6180 -6.6180 -2.3851 -2.3851 -2.3851 -2.3851 -1.5720 -1.5720 -1.5720 -1.5720 2.1041 2.1041 2.1041 2.1041 2.7485 2.7485 2.7485 2.7485 3.0567 3.0567 3.0567 3.0567 4.4866 4.4866 4.4866 4.4866 4.9523 4.9523 4.9523 4.9523 5.7371 5.7371 5.7371 5.7371 k = 0.4902 0.3057 0.3828 ( 9140 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4637 -9.4637 -8.8800 -8.8800 -8.8800 -8.8800 -8.8666 -8.8666 -8.8660 -8.8660 -7.3090 -7.3090 -7.3086 -7.3086 -7.2937 -7.2937 -7.2922 -7.2922 -7.2653 -7.2653 -7.2641 -7.2641 -7.0091 -7.0091 -7.0023 -7.0023 -6.6854 -6.6854 -6.6853 -6.6853 -6.6789 -6.6789 -6.6780 -6.6780 -6.6217 -6.6217 -6.6143 -6.6143 -2.3843 -2.3843 -2.3842 -2.3842 -1.5740 -1.5740 -1.5733 -1.5733 2.1036 2.1036 2.1092 2.1092 2.7483 2.7483 2.7506 2.7506 3.0544 3.0544 3.0576 3.0576 4.4454 4.4454 4.5152 4.5152 4.9194 4.9194 4.9896 4.9896 5.7243 5.7243 5.7596 5.7596 k = 0.4804 0.3226 0.3828 ( 9128 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4637 -9.4637 -8.8800 -8.8800 -8.8800 -8.8800 -8.8669 -8.8669 -8.8657 -8.8657 -7.3091 -7.3091 -7.3084 -7.3084 -7.2944 -7.2944 -7.2915 -7.2915 -7.2658 -7.2658 -7.2636 -7.2636 -7.0123 -7.0123 -6.9988 -6.9988 -6.6855 -6.6855 -6.6852 -6.6852 -6.6793 -6.6793 -6.6776 -6.6776 -6.6253 -6.6253 -6.6107 -6.6107 -2.3819 -2.3819 -2.3816 -2.3816 -1.5792 -1.5792 -1.5779 -1.5779 2.1076 2.1076 2.1186 2.1186 2.7498 2.7498 2.7544 2.7544 3.0509 3.0509 3.0573 3.0573 4.3955 4.3955 4.5259 4.5259 4.8963 4.8963 5.0277 5.0277 5.7208 5.7208 5.7913 5.7913 k = 0.4706 0.3396 0.3828 ( 9142 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4638 -9.4638 -9.4637 -9.4637 -8.8800 -8.8800 -8.8799 -8.8799 -8.8672 -8.8672 -8.8654 -8.8654 -7.3093 -7.3093 -7.3082 -7.3082 -7.2952 -7.2952 -7.2908 -7.2908 -7.2664 -7.2664 -7.2631 -7.2631 -7.0153 -7.0153 -6.9952 -6.9952 -6.6856 -6.6856 -6.6851 -6.6851 -6.6797 -6.6797 -6.6772 -6.6772 -6.6289 -6.6289 -6.6071 -6.6071 -2.3779 -2.3779 -2.3775 -2.3775 -1.5876 -1.5876 -1.5857 -1.5857 2.1158 2.1158 2.1323 2.1323 2.7531 2.7531 2.7600 2.7600 3.0462 3.0462 3.0557 3.0557 4.3397 4.3397 4.5151 4.5151 4.8875 4.8875 5.0645 5.0645 5.7259 5.7259 5.8312 5.8312 k = 0.4608 0.3566 0.3828 ( 9144 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4638 -9.4638 -9.4637 -9.4637 -8.8800 -8.8800 -8.8799 -8.8799 -8.8675 -8.8675 -8.8651 -8.8651 -7.3094 -7.3094 -7.3080 -7.3080 -7.2959 -7.2959 -7.2902 -7.2902 -7.2670 -7.2670 -7.2626 -7.2626 -7.0182 -7.0182 -6.9917 -6.9917 -6.6856 -6.6856 -6.6850 -6.6850 -6.6800 -6.6800 -6.6768 -6.6768 -6.6325 -6.6325 -6.6036 -6.6036 -2.3722 -2.3722 -2.3717 -2.3717 -1.5989 -1.5989 -1.5964 -1.5964 2.1280 2.1280 2.1498 2.1498 2.7583 2.7583 2.7674 2.7674 3.0404 3.0404 3.0529 3.0529 4.2800 4.2800 4.4837 4.4837 4.8931 4.8931 5.0995 5.0995 5.7383 5.7383 5.8777 5.8777 k = 0.4510 0.3736 0.3828 ( 9140 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4638 -9.4638 -9.4637 -9.4637 -8.8800 -8.8800 -8.8799 -8.8799 -8.8678 -8.8678 -8.8648 -8.8648 -7.3096 -7.3096 -7.3078 -7.3078 -7.2967 -7.2967 -7.2896 -7.2896 -7.2676 -7.2676 -7.2622 -7.2622 -7.0208 -7.0208 -6.9881 -6.9881 -6.6857 -6.6857 -6.6849 -6.6849 -6.6804 -6.6804 -6.6763 -6.6763 -6.6360 -6.6360 -6.6003 -6.6003 -2.3651 -2.3651 -2.3644 -2.3644 -1.6129 -1.6129 -1.6098 -1.6098 2.1436 2.1436 2.1708 2.1708 2.7653 2.7653 2.7764 2.7764 3.0337 3.0337 3.0490 3.0490 4.2178 4.2178 4.4371 4.4371 4.9090 4.9090 5.1326 5.1326 5.7565 5.7565 5.9287 5.9287 k = 0.4412 0.3906 0.3828 ( 9132 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4638 -9.4638 -9.4637 -9.4637 -8.8799 -8.8799 -8.8798 -8.8798 -8.8681 -8.8681 -8.8646 -8.8646 -7.3097 -7.3097 -7.3076 -7.3076 -7.2974 -7.2974 -7.2890 -7.2890 -7.2682 -7.2682 -7.2617 -7.2617 -7.0232 -7.0232 -6.9846 -6.9846 -6.6857 -6.6857 -6.6847 -6.6847 -6.6807 -6.6807 -6.6758 -6.6758 -6.6393 -6.6393 -6.5971 -6.5971 -2.3565 -2.3565 -2.3556 -2.3556 -1.6294 -1.6294 -1.6256 -1.6256 2.1623 2.1623 2.1945 2.1945 2.7740 2.7740 2.7869 2.7869 3.0263 3.0263 3.0443 3.0443 4.1544 4.1544 4.3812 4.3812 4.9307 4.9307 5.1642 5.1642 5.7790 5.7790 5.9820 5.9820 k = 0.4314 0.4075 0.3828 ( 9136 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4638 -9.4638 -9.4637 -9.4637 -8.8799 -8.8799 -8.8798 -8.8798 -8.8684 -8.8684 -8.8643 -8.8643 -7.3098 -7.3098 -7.3073 -7.3073 -7.2981 -7.2981 -7.2884 -7.2884 -7.2688 -7.2688 -7.2614 -7.2614 -7.0254 -7.0254 -6.9813 -6.9813 -6.6858 -6.6858 -6.6845 -6.6845 -6.6810 -6.6810 -6.6753 -6.6753 -6.6426 -6.6426 -6.5940 -6.5940 -2.3467 -2.3467 -2.3456 -2.3456 -1.6478 -1.6478 -1.6435 -1.6435 2.1832 2.1832 2.2203 2.2203 2.7845 2.7845 2.7988 2.7988 3.0187 3.0187 3.0389 3.0389 4.0906 4.0906 4.3202 4.3202 4.9552 4.9552 5.1948 5.1948 5.8041 5.8041 6.0351 6.0351 k = 0.4216 0.4245 0.3828 ( 9144 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8799 -8.8799 -8.8797 -8.8797 -8.8687 -8.8687 -8.8641 -8.8641 -7.3099 -7.3099 -7.3071 -7.3071 -7.2988 -7.2988 -7.2879 -7.2879 -7.2693 -7.2693 -7.2611 -7.2611 -7.0273 -7.0273 -6.9781 -6.9781 -6.6858 -6.6858 -6.6844 -6.6844 -6.6813 -6.6813 -6.6748 -6.6748 -6.6457 -6.6457 -6.5912 -6.5912 -2.3358 -2.3358 -2.3344 -2.3344 -1.6678 -1.6678 -1.6629 -1.6629 2.2055 2.2055 2.2474 2.2474 2.7965 2.7965 2.8116 2.8116 3.0114 3.0114 3.0331 3.0331 4.0274 4.0274 4.2571 4.2571 4.9809 4.9809 5.2247 5.2247 5.8304 5.8304 6.0858 6.0858 k = 0.4118 0.4415 0.3828 ( 9148 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8799 -8.8799 -8.8797 -8.8797 -8.8689 -8.8689 -8.8639 -8.8639 -7.3100 -7.3100 -7.3069 -7.3069 -7.2995 -7.2995 -7.2875 -7.2875 -7.2698 -7.2698 -7.2608 -7.2608 -7.0290 -7.0290 -6.9751 -6.9751 -6.6859 -6.6859 -6.6842 -6.6842 -6.6816 -6.6816 -6.6742 -6.6742 -6.6486 -6.6486 -6.5886 -6.5886 -2.3239 -2.3239 -2.3222 -2.3222 -1.6888 -1.6888 -1.6834 -1.6834 2.2285 2.2285 2.2749 2.2749 2.8098 2.8098 2.8247 2.8247 3.0052 3.0052 3.0276 3.0276 3.9658 3.9658 4.1941 4.1941 5.0066 5.0066 5.2540 5.2540 5.8566 5.8566 6.1317 6.1317 k = 0.4020 0.4585 0.3828 ( 9152 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8798 -8.8798 -8.8796 -8.8796 -8.8691 -8.8691 -8.8638 -8.8638 -7.3101 -7.3101 -7.3066 -7.3066 -7.3001 -7.3001 -7.2871 -7.2871 -7.2702 -7.2702 -7.2605 -7.2605 -7.0304 -7.0304 -6.9723 -6.9723 -6.6860 -6.6860 -6.6840 -6.6840 -6.6818 -6.6818 -6.6735 -6.6735 -6.6514 -6.6514 -6.5862 -6.5862 -2.3114 -2.3114 -2.3095 -2.3095 -1.7104 -1.7104 -1.7045 -1.7045 2.2513 2.2513 2.3019 2.3019 2.8240 2.8240 2.8370 2.8370 3.0011 3.0011 3.0228 3.0228 3.9064 3.9064 4.1329 4.1329 5.0317 5.0317 5.2827 5.2827 5.8815 5.8815 6.1707 6.1707 k = 0.3922 0.4755 0.3828 ( 9150 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8798 -8.8798 -8.8796 -8.8796 -8.8694 -8.8694 -8.8636 -8.8636 -7.3101 -7.3101 -7.3064 -7.3064 -7.3007 -7.3007 -7.2867 -7.2867 -7.2706 -7.2706 -7.2603 -7.2603 -7.0317 -7.0317 -6.9699 -6.9699 -6.6860 -6.6860 -6.6838 -6.6838 -6.6820 -6.6820 -6.6728 -6.6728 -6.6539 -6.6539 -6.5841 -6.5841 -2.2986 -2.2986 -2.2964 -2.2964 -1.7318 -1.7318 -1.7254 -1.7254 2.2729 2.2729 2.3273 2.3273 2.8381 2.8381 2.8473 2.8473 3.0005 3.0005 3.0195 3.0195 3.8503 3.8503 4.0749 4.0749 5.0558 5.0558 5.3102 5.3102 5.9043 5.9043 6.2012 6.2012 k = 0.3824 0.4924 0.3828 ( 9154 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8798 -8.8798 -8.8795 -8.8795 -8.8695 -8.8695 -8.8635 -8.8635 -7.3102 -7.3102 -7.3061 -7.3061 -7.3013 -7.3013 -7.2865 -7.2865 -7.2710 -7.2710 -7.2601 -7.2601 -7.0327 -7.0327 -6.9677 -6.9677 -6.6861 -6.6861 -6.6836 -6.6836 -6.6821 -6.6821 -6.6720 -6.6720 -6.6563 -6.6563 -6.5823 -6.5823 -2.2861 -2.2861 -2.2834 -2.2834 -1.7524 -1.7524 -1.7454 -1.7454 2.2925 2.2925 2.3504 2.3504 2.8513 2.8513 2.8544 2.8544 3.0043 3.0043 3.0187 3.0187 3.7986 3.7986 4.0215 4.0215 5.0781 5.0781 5.3362 5.3362 5.9243 5.9243 6.2225 6.2225 k = 0.3725 0.5094 0.3828 ( 9154 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8798 -8.8798 -8.8795 -8.8795 -8.8697 -8.8697 -8.8634 -8.8634 -7.3103 -7.3103 -7.3059 -7.3059 -7.3018 -7.3018 -7.2862 -7.2862 -7.2713 -7.2713 -7.2600 -7.2600 -7.0334 -7.0334 -6.9659 -6.9659 -6.6862 -6.6862 -6.6835 -6.6835 -6.6822 -6.6822 -6.6711 -6.6711 -6.6585 -6.6585 -6.5808 -6.5808 -2.2742 -2.2742 -2.2712 -2.2712 -1.7713 -1.7713 -1.7639 -1.7639 2.3093 2.3093 2.3702 2.3702 2.8579 2.8579 2.8623 2.8623 3.0123 3.0123 3.0209 3.0209 3.7525 3.7525 3.9742 3.9742 5.0980 5.0980 5.3597 5.3597 5.9409 5.9409 6.2350 6.2350 k = 0.3627 0.5264 0.3828 ( 9150 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8798 -8.8798 -8.8795 -8.8795 -8.8698 -8.8698 -8.8633 -8.8633 -7.3103 -7.3103 -7.3056 -7.3056 -7.3022 -7.3022 -7.2861 -7.2861 -7.2715 -7.2715 -7.2599 -7.2599 -7.0340 -7.0340 -6.9645 -6.9645 -6.6862 -6.6862 -6.6833 -6.6833 -6.6823 -6.6823 -6.6702 -6.6702 -6.6605 -6.6605 -6.5796 -6.5796 -2.2637 -2.2637 -2.2604 -2.2604 -1.7877 -1.7877 -1.7798 -1.7798 2.3228 2.3228 2.3861 2.3861 2.8586 2.8586 2.8703 2.8703 3.0229 3.0229 3.0259 3.0259 3.7134 3.7134 3.9346 3.9346 5.1147 5.1147 5.3798 5.3798 5.9539 5.9539 6.2406 6.2406 k = 0.3529 0.5434 0.3828 ( 9158 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8798 -8.8798 -8.8794 -8.8794 -8.8699 -8.8699 -8.8633 -8.8633 -7.3103 -7.3103 -7.3054 -7.3054 -7.3026 -7.3026 -7.2859 -7.2859 -7.2717 -7.2717 -7.2598 -7.2598 -7.0344 -7.0344 -6.9634 -6.9634 -6.6863 -6.6863 -6.6832 -6.6832 -6.6824 -6.6824 -6.6692 -6.6692 -6.6622 -6.6622 -6.5788 -6.5788 -2.2554 -2.2554 -2.2518 -2.2518 -1.8004 -1.8004 -1.7922 -1.7922 2.3325 2.3325 2.3977 2.3977 2.8577 2.8577 2.8753 2.8753 3.0325 3.0325 3.0336 3.0336 3.6833 3.6833 3.9044 3.9044 5.1275 5.1275 5.3952 5.3952 5.9632 5.9632 6.2416 6.2416 k = 0.3431 0.5604 0.3828 ( 9166 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8798 -8.8798 -8.8794 -8.8794 -8.8700 -8.8700 -8.8632 -8.8632 -7.3103 -7.3103 -7.3053 -7.3053 -7.3028 -7.3028 -7.2859 -7.2859 -7.2718 -7.2718 -7.2598 -7.2598 -7.0346 -7.0346 -6.9628 -6.9628 -6.6863 -6.6863 -6.6832 -6.6832 -6.6824 -6.6824 -6.6683 -6.6683 -6.6635 -6.6635 -6.5782 -6.5782 -2.2500 -2.2500 -2.2462 -2.2462 -1.8087 -1.8087 -1.8002 -1.8002 2.3382 2.3382 2.4045 2.4045 2.8566 2.8566 2.8777 2.8777 3.0383 3.0383 3.0416 3.0416 3.6641 3.6641 3.8854 3.8854 5.1355 5.1355 5.4051 5.4051 5.9686 5.9686 6.2408 6.2408 k = 0.3333 0.5774 0.3828 ( 9162 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8797 -8.8797 -8.8794 -8.8794 -8.8700 -8.8700 -8.8632 -8.8632 -7.3103 -7.3103 -7.3053 -7.3053 -7.3029 -7.3029 -7.2859 -7.2859 -7.2718 -7.2718 -7.2598 -7.2598 -7.0347 -7.0347 -6.9626 -6.9626 -6.6863 -6.6863 -6.6832 -6.6832 -6.6824 -6.6824 -6.6679 -6.6679 -6.6641 -6.6641 -6.5781 -6.5781 -2.2481 -2.2481 -2.2442 -2.2442 -1.8116 -1.8116 -1.8030 -1.8030 2.3401 2.3401 2.4068 2.4068 2.8561 2.8561 2.8784 2.8784 3.0406 3.0406 3.0446 3.0446 3.6574 3.6574 3.8789 3.8789 5.1382 5.1382 5.4084 5.4084 5.9704 5.9704 6.2403 6.2403 k = 0.3333 0.5774 0.3828 ( 9162 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8797 -8.8797 -8.8794 -8.8794 -8.8700 -8.8700 -8.8632 -8.8632 -7.3103 -7.3103 -7.3053 -7.3053 -7.3029 -7.3029 -7.2859 -7.2859 -7.2718 -7.2718 -7.2598 -7.2598 -7.0347 -7.0347 -6.9626 -6.9626 -6.6863 -6.6863 -6.6832 -6.6832 -6.6824 -6.6824 -6.6679 -6.6679 -6.6641 -6.6641 -6.5781 -6.5781 -2.2481 -2.2481 -2.2442 -2.2442 -1.8116 -1.8116 -1.8030 -1.8030 2.3401 2.3401 2.4068 2.4068 2.8561 2.8561 2.8784 2.8784 3.0406 3.0406 3.0446 3.0446 3.6574 3.6574 3.8789 3.8789 5.1382 5.1382 5.4084 5.4084 5.9704 5.9704 6.2403 6.2403 k = 0.3235 0.5604 0.3828 ( 9162 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8797 -8.8797 -8.8794 -8.8794 -8.8700 -8.8700 -8.8632 -8.8632 -7.3103 -7.3103 -7.3053 -7.3053 -7.3028 -7.3028 -7.2859 -7.2859 -7.2718 -7.2718 -7.2598 -7.2598 -7.0346 -7.0346 -6.9628 -6.9628 -6.6863 -6.6863 -6.6832 -6.6832 -6.6824 -6.6824 -6.6683 -6.6683 -6.6636 -6.6636 -6.5782 -6.5782 -2.2500 -2.2500 -2.2462 -2.2462 -1.8086 -1.8086 -1.8001 -1.8001 2.3384 2.3384 2.4047 2.4047 2.8566 2.8566 2.8779 2.8779 3.0379 3.0379 3.0413 3.0413 3.6642 3.6642 3.8855 3.8855 5.1355 5.1355 5.4050 5.4050 5.9687 5.9687 6.2410 6.2410 k = 0.3137 0.5434 0.3828 ( 9166 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8798 -8.8798 -8.8794 -8.8794 -8.8699 -8.8699 -8.8633 -8.8633 -7.3103 -7.3103 -7.3054 -7.3054 -7.3026 -7.3026 -7.2859 -7.2859 -7.2717 -7.2717 -7.2598 -7.2598 -7.0345 -7.0345 -6.9634 -6.9634 -6.6863 -6.6863 -6.6832 -6.6832 -6.6824 -6.6824 -6.6691 -6.6691 -6.6624 -6.6624 -6.5788 -6.5788 -2.2559 -2.2559 -2.2523 -2.2523 -1.7996 -1.7996 -1.7914 -1.7914 2.3334 2.3334 2.3987 2.3987 2.8584 2.8584 2.8761 2.8761 3.0297 3.0297 3.0311 3.0311 3.6843 3.6843 3.9050 3.9050 5.1272 5.1272 5.3950 5.3950 5.9638 5.9638 6.2430 6.2430 k = 0.3039 0.5264 0.3828 ( 9172 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8798 -8.8798 -8.8795 -8.8795 -8.8698 -8.8698 -8.8633 -8.8633 -7.3103 -7.3103 -7.3056 -7.3056 -7.3023 -7.3023 -7.2860 -7.2860 -7.2715 -7.2715 -7.2599 -7.2599 -7.0342 -7.0342 -6.9645 -6.9645 -6.6862 -6.6862 -6.6834 -6.6834 -6.6824 -6.6824 -6.6700 -6.6700 -6.6609 -6.6609 -6.5796 -6.5796 -2.2654 -2.2654 -2.2621 -2.2621 -1.7850 -1.7850 -1.7771 -1.7771 2.3258 2.3258 2.3897 2.3897 2.8610 2.8610 2.8727 2.8727 3.0147 3.0147 3.0172 3.0172 3.7163 3.7163 3.9364 3.9364 5.1140 5.1140 5.3790 5.3790 5.9559 5.9559 6.2454 6.2454 k = 0.2941 0.5094 0.3828 ( 9158 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8798 -8.8798 -8.8795 -8.8795 -8.8697 -8.8697 -8.8634 -8.8634 -7.3103 -7.3103 -7.3058 -7.3058 -7.3019 -7.3019 -7.2861 -7.2861 -7.2714 -7.2714 -7.2599 -7.2599 -7.0339 -7.0339 -6.9659 -6.9659 -6.6861 -6.6861 -6.6835 -6.6835 -6.6823 -6.6823 -6.6707 -6.6707 -6.6593 -6.6593 -6.5808 -6.5808 -2.2779 -2.2779 -2.2750 -2.2750 -1.7653 -1.7653 -1.7579 -1.7579 2.3161 2.3161 2.3783 2.3783 2.8640 2.8640 2.8667 2.8667 2.9934 2.9934 3.0027 3.0027 3.7583 3.7583 3.9780 3.9780 5.0965 5.0965 5.3581 5.3581 5.9453 5.9453 6.2466 6.2466 k = 0.2843 0.4924 0.3828 ( 9158 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8798 -8.8798 -8.8796 -8.8796 -8.8695 -8.8695 -8.8634 -8.8634 -7.3102 -7.3102 -7.3059 -7.3059 -7.3014 -7.3014 -7.2862 -7.2862 -7.2711 -7.2711 -7.2600 -7.2600 -7.0336 -7.0336 -6.9678 -6.9678 -6.6860 -6.6860 -6.6836 -6.6836 -6.6822 -6.6822 -6.6714 -6.6714 -6.6576 -6.6576 -6.5823 -6.5823 -2.2927 -2.2927 -2.2901 -2.2901 -1.7413 -1.7413 -1.7344 -1.7344 2.3051 2.3051 2.3652 2.3652 2.8569 2.8569 2.8664 2.8664 2.9690 2.9690 2.9885 2.9885 3.8082 3.8082 4.0279 4.0279 5.0757 5.0757 5.3334 5.3334 5.9322 5.9322 6.2449 6.2449 k = 0.2745 0.4755 0.3828 ( 9158 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8799 -8.8799 -8.8797 -8.8797 -8.8694 -8.8694 -8.8635 -8.8635 -7.3101 -7.3101 -7.3061 -7.3061 -7.3009 -7.3009 -7.2863 -7.2863 -7.2709 -7.2709 -7.2601 -7.2601 -7.0332 -7.0332 -6.9700 -6.9700 -6.6859 -6.6859 -6.6838 -6.6838 -6.6821 -6.6821 -6.6720 -6.6720 -6.6559 -6.6559 -6.5841 -6.5841 -2.3091 -2.3091 -2.3070 -2.3070 -1.7136 -1.7136 -1.7072 -1.7072 2.2933 2.2933 2.3513 2.3513 2.8422 2.8422 2.8664 2.8664 2.9444 2.9444 2.9770 2.9770 3.8642 3.8642 4.0845 4.0845 5.0525 5.0525 5.3063 5.3063 5.9166 5.9166 6.2388 6.2388 k = 0.2647 0.4585 0.3828 ( 9154 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8799 -8.8799 -8.8798 -8.8798 -8.8692 -8.8692 -8.8636 -8.8636 -7.3101 -7.3101 -7.3062 -7.3062 -7.3004 -7.3004 -7.2864 -7.2864 -7.2706 -7.2706 -7.2602 -7.2602 -7.0329 -7.0329 -6.9726 -6.9726 -6.6857 -6.6857 -6.6840 -6.6840 -6.6819 -6.6819 -6.6725 -6.6725 -6.6542 -6.6542 -6.5861 -6.5861 -2.3266 -2.3266 -2.3248 -2.3248 -1.6829 -1.6829 -1.6770 -1.6770 2.2814 2.2814 2.3371 2.3371 2.8226 2.8226 2.8601 2.8601 2.9243 2.9243 2.9690 2.9690 3.9244 3.9244 4.1460 4.1460 5.0278 5.0278 5.2779 5.2779 5.8988 5.8988 6.2274 6.2274 k = 0.2549 0.4415 0.3828 ( 9138 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8800 -8.8800 -8.8798 -8.8798 -8.8689 -8.8689 -8.8637 -8.8637 -7.3100 -7.3100 -7.3063 -7.3063 -7.2997 -7.2997 -7.2865 -7.2865 -7.2703 -7.2703 -7.2603 -7.2603 -7.0326 -7.0326 -6.9755 -6.9755 -6.6855 -6.6855 -6.6842 -6.6842 -6.6817 -6.6817 -6.6728 -6.6728 -6.6525 -6.6525 -6.5884 -6.5884 -2.3447 -2.3447 -2.3432 -2.3432 -1.6498 -1.6498 -1.6443 -1.6443 2.2698 2.2698 2.3233 2.3233 2.7991 2.7991 2.8430 2.8430 2.9136 2.9136 2.9641 2.9641 3.9876 3.9876 4.2108 4.2108 5.0028 5.0028 5.2492 5.2492 5.8788 5.8788 6.2100 6.2100 k = 0.2451 0.4245 0.3828 ( 9132 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8800 -8.8800 -8.8799 -8.8799 -8.8687 -8.8687 -8.8638 -8.8638 -7.3099 -7.3099 -7.3065 -7.3065 -7.2991 -7.2991 -7.2865 -7.2865 -7.2699 -7.2699 -7.2604 -7.2604 -7.0324 -7.0324 -6.9787 -6.9787 -6.6854 -6.6854 -6.6844 -6.6844 -6.6815 -6.6815 -6.6731 -6.6731 -6.6508 -6.6508 -6.5910 -6.5910 -2.3630 -2.3630 -2.3618 -2.3618 -1.6148 -1.6148 -1.6097 -1.6097 2.2592 2.2592 2.3104 2.3104 2.7732 2.7732 2.8176 2.8176 2.9105 2.9105 2.9613 2.9613 4.0524 4.0524 4.2775 4.2775 4.9786 4.9786 5.2214 5.2214 5.8569 5.8569 6.1866 6.1866 k = 0.2353 0.4075 0.3828 ( 9148 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4637 -9.4637 -8.8801 -8.8801 -8.8801 -8.8801 -8.8684 -8.8684 -8.8639 -8.8639 -7.3097 -7.3097 -7.3066 -7.3066 -7.2984 -7.2984 -7.2866 -7.2866 -7.2695 -7.2695 -7.2606 -7.2606 -7.0322 -7.0322 -6.9821 -6.9821 -6.6852 -6.6852 -6.6845 -6.6845 -6.6812 -6.6812 -6.6733 -6.6733 -6.6493 -6.6493 -6.5937 -6.5937 -2.3812 -2.3812 -2.3802 -2.3802 -1.5783 -1.5783 -1.5736 -1.5736 2.2499 2.2499 2.2987 2.2987 2.7459 2.7459 2.7886 2.7886 2.9105 2.9105 2.9596 2.9596 4.1174 4.1174 4.3442 4.3442 4.9564 4.9564 5.1953 5.1953 5.8332 5.8332 6.1576 6.1576 k = 0.2255 0.3906 0.3828 ( 9144 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4637 -9.4637 -8.8802 -8.8802 -8.8802 -8.8802 -8.8682 -8.8682 -8.8640 -8.8640 -7.3096 -7.3096 -7.3066 -7.3066 -7.2977 -7.2977 -7.2867 -7.2867 -7.2691 -7.2691 -7.2607 -7.2607 -7.0322 -7.0322 -6.9858 -6.9858 -6.6850 -6.6850 -6.6847 -6.6847 -6.6809 -6.6809 -6.6735 -6.6735 -6.6478 -6.6478 -6.5966 -6.5966 -2.3990 -2.3990 -2.3982 -2.3982 -1.5406 -1.5406 -1.5363 -1.5363 2.2423 2.2423 2.2886 2.2886 2.7184 2.7184 2.7588 2.7588 2.9113 2.9113 2.9584 2.9584 4.1815 4.1815 4.4090 4.4090 4.9379 4.9379 5.1720 5.1720 5.8080 5.8080 6.1236 6.1236 k = 0.2157 0.3736 0.3828 ( 9142 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4639 -9.4639 -9.4637 -9.4637 -8.8803 -8.8803 -8.8803 -8.8803 -8.8679 -8.8679 -8.8641 -8.8641 -7.3095 -7.3095 -7.3067 -7.3067 -7.2969 -7.2969 -7.2867 -7.2867 -7.2687 -7.2687 -7.2608 -7.2608 -7.0322 -7.0322 -6.9897 -6.9897 -6.6849 -6.6849 -6.6848 -6.6848 -6.6806 -6.6806 -6.6736 -6.6736 -6.6465 -6.6465 -6.5996 -6.5996 -2.4163 -2.4163 -2.4157 -2.4157 -1.5021 -1.5021 -1.4982 -1.4982 2.2366 2.2366 2.2805 2.2805 2.6912 2.6912 2.7294 2.7294 2.9117 2.9117 2.9572 2.9572 4.2430 4.2430 4.4686 4.4686 4.9257 4.9257 5.1525 5.1525 5.7815 5.7815 6.0854 6.0854 k = 0.2059 0.3566 0.3828 ( 9146 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4639 -9.4639 -9.4637 -9.4637 -8.8804 -8.8804 -8.8804 -8.8804 -8.8676 -8.8676 -8.8642 -8.8642 -7.3093 -7.3093 -7.3067 -7.3067 -7.2961 -7.2961 -7.2867 -7.2867 -7.2683 -7.2683 -7.2609 -7.2609 -7.0325 -7.0325 -6.9938 -6.9938 -6.6849 -6.6849 -6.6847 -6.6847 -6.6801 -6.6801 -6.6736 -6.6736 -6.6453 -6.6453 -6.6027 -6.6027 -2.4329 -2.4329 -2.4324 -2.4324 -1.4631 -1.4631 -1.4595 -1.4595 2.2333 2.2333 2.2745 2.2745 2.6649 2.6649 2.7010 2.7010 2.9115 2.9115 2.9555 2.9555 4.3002 4.3002 4.5191 4.5191 4.9235 4.9235 5.1380 5.1380 5.7540 5.7540 6.0440 6.0440 k = 0.1961 0.3396 0.3828 ( 9132 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4639 -9.4639 -9.4637 -9.4637 -8.8805 -8.8805 -8.8805 -8.8805 -8.8673 -8.8673 -8.8643 -8.8643 -7.3091 -7.3091 -7.3068 -7.3068 -7.2953 -7.2953 -7.2867 -7.2867 -7.2678 -7.2678 -7.2610 -7.2610 -7.0328 -7.0328 -6.9980 -6.9980 -6.6849 -6.6849 -6.6846 -6.6846 -6.6797 -6.6797 -6.6736 -6.6736 -6.6441 -6.6441 -6.6059 -6.6059 -2.4488 -2.4488 -2.4484 -2.4484 -1.4239 -1.4239 -1.4207 -1.4207 2.2324 2.2324 2.2708 2.2708 2.6396 2.6396 2.6741 2.6741 2.9103 2.9103 2.9531 2.9531 4.3514 4.3514 4.5554 4.5554 4.9354 4.9354 5.1297 5.1297 5.7261 5.7261 6.0007 6.0007 k = 0.1863 0.3226 0.3828 ( 9132 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4637 -9.4637 -8.8807 -8.8807 -8.8806 -8.8806 -8.8671 -8.8671 -8.8644 -8.8644 -7.3090 -7.3090 -7.3068 -7.3068 -7.2945 -7.2945 -7.2866 -7.2866 -7.2673 -7.2673 -7.2611 -7.2611 -7.0334 -7.0334 -7.0022 -7.0022 -6.6849 -6.6849 -6.6845 -6.6845 -6.6792 -6.6792 -6.6735 -6.6735 -6.6432 -6.6432 -6.6091 -6.6091 -2.4639 -2.4639 -2.4636 -2.4636 -1.3847 -1.3847 -1.3818 -1.3818 2.2341 2.2341 2.2696 2.2696 2.6158 2.6158 2.6489 2.6489 2.9083 2.9083 2.9500 2.9500 4.3944 4.3944 4.5747 4.5747 4.9637 4.9637 5.1289 5.1289 5.6984 5.6984 5.9567 5.9567 k = 0.1765 0.3057 0.3828 ( 9134 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4637 -9.4637 -8.8808 -8.8808 -8.8807 -8.8807 -8.8668 -8.8668 -8.8644 -8.8644 -7.3088 -7.3088 -7.3068 -7.3068 -7.2936 -7.2936 -7.2866 -7.2866 -7.2669 -7.2669 -7.2612 -7.2612 -7.0341 -7.0341 -7.0066 -7.0066 -6.6849 -6.6849 -6.6844 -6.6844 -6.6786 -6.6786 -6.6734 -6.6734 -6.6424 -6.6424 -6.6123 -6.6123 -2.4781 -2.4781 -2.4779 -2.4779 -1.3458 -1.3458 -1.3432 -1.3432 2.2386 2.2386 2.2709 2.2709 2.5936 2.5936 2.6255 2.6255 2.9052 2.9052 2.9460 2.9460 4.4275 4.4275 4.5776 4.5776 5.0065 5.0065 5.1362 5.1362 5.6716 5.6716 5.9137 5.9137 k = 0.1667 0.2887 0.3828 ( 9134 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4637 -9.4637 -8.8809 -8.8809 -8.8808 -8.8808 -8.8666 -8.8666 -8.8645 -8.8645 -7.3086 -7.3086 -7.3068 -7.3068 -7.2928 -7.2928 -7.2865 -7.2865 -7.2664 -7.2664 -7.2613 -7.2613 -7.0349 -7.0349 -7.0109 -7.0109 -6.6848 -6.6848 -6.6843 -6.6843 -6.6780 -6.6780 -6.6733 -6.6733 -6.6417 -6.6417 -6.6154 -6.6154 -2.4914 -2.4914 -2.4913 -2.4913 -1.3074 -1.3074 -1.3051 -1.3051 2.2457 2.2457 2.2747 2.2747 2.5731 2.5731 2.6043 2.6043 2.9013 2.9013 2.9412 2.9412 4.4495 4.4495 4.5681 4.5681 5.0585 5.0585 5.1515 5.1515 5.6469 5.6469 5.8732 5.8732 k = 0.1569 0.2717 0.3828 ( 9134 PWs) bands (ev): -9.4924 -9.4924 -9.4923 -9.4923 -9.4638 -9.4638 -9.4637 -9.4637 -8.8810 -8.8810 -8.8810 -8.8810 -8.8663 -8.8663 -8.8645 -8.8645 -7.3084 -7.3084 -7.3069 -7.3069 -7.2919 -7.2919 -7.2864 -7.2864 -7.2659 -7.2659 -7.2614 -7.2614 -7.0360 -7.0360 -7.0153 -7.0153 -6.6847 -6.6847 -6.6842 -6.6842 -6.6773 -6.6773 -6.6730 -6.6730 -6.6412 -6.6412 -6.6185 -6.6185 -2.5039 -2.5039 -2.5038 -2.5038 -1.2698 -1.2698 -1.2677 -1.2677 2.2556 2.2556 2.2810 2.2810 2.5545 2.5545 2.5851 2.5851 2.8966 2.8966 2.9355 2.9355 4.4602 4.4602 4.5500 4.5500 5.1139 5.1139 5.1732 5.1732 5.6259 5.6259 5.8373 5.8373 k = 0.1471 0.2547 0.3828 ( 9144 PWs) bands (ev): -9.4924 -9.4924 -9.4923 -9.4923 -9.4638 -9.4638 -9.4638 -9.4638 -8.8812 -8.8812 -8.8811 -8.8811 -8.8661 -8.8661 -8.8646 -8.8646 -7.3082 -7.3082 -7.3068 -7.3068 -7.2910 -7.2910 -7.2862 -7.2862 -7.2654 -7.2654 -7.2614 -7.2614 -7.0371 -7.0371 -7.0196 -7.0196 -6.6846 -6.6846 -6.6841 -6.6841 -6.6766 -6.6766 -6.6728 -6.6728 -6.6409 -6.6409 -6.6215 -6.6215 -2.5155 -2.5155 -2.5154 -2.5154 -1.2331 -1.2331 -1.2314 -1.2314 2.2681 2.2681 2.2897 2.2897 2.5378 2.5378 2.5682 2.5682 2.8912 2.8912 2.9289 2.9289 4.4603 4.4603 4.5262 4.5262 5.1672 5.1672 5.1986 5.1986 5.6109 5.6109 5.8082 5.8082 k = 0.1373 0.2377 0.3828 ( 9154 PWs) bands (ev): -9.4924 -9.4924 -9.4923 -9.4923 -9.4638 -9.4638 -9.4638 -9.4638 -8.8813 -8.8813 -8.8812 -8.8812 -8.8659 -8.8659 -8.8646 -8.8646 -7.3080 -7.3080 -7.3068 -7.3068 -7.2902 -7.2902 -7.2861 -7.2861 -7.2649 -7.2649 -7.2615 -7.2615 -7.0385 -7.0385 -7.0238 -7.0238 -6.6845 -6.6845 -6.6840 -6.6840 -6.6759 -6.6759 -6.6725 -6.6725 -6.6407 -6.6407 -6.6244 -6.6244 -2.5262 -2.5262 -2.5261 -2.5261 -1.1977 -1.1977 -1.1962 -1.1962 2.2830 2.2830 2.3005 2.3005 2.5232 2.5232 2.5536 2.5536 2.8854 2.8854 2.9216 2.9216 4.4512 4.4512 4.4983 4.4983 5.2129 5.2129 5.2236 5.2236 5.6052 5.6052 5.7884 5.7884 k = 0.1275 0.2208 0.3828 ( 9154 PWs) bands (ev): -9.4924 -9.4924 -9.4923 -9.4923 -9.4638 -9.4638 -9.4638 -9.4638 -8.8814 -8.8814 -8.8813 -8.8813 -8.8657 -8.8657 -8.8647 -8.8647 -7.3078 -7.3078 -7.3068 -7.3068 -7.2894 -7.2894 -7.2859 -7.2859 -7.2644 -7.2644 -7.2615 -7.2615 -7.0399 -7.0399 -7.0278 -7.0278 -6.6844 -6.6844 -6.6839 -6.6839 -6.6752 -6.6752 -6.6722 -6.6722 -6.6407 -6.6407 -6.6271 -6.6271 -2.5360 -2.5360 -2.5360 -2.5360 -1.1637 -1.1637 -1.1625 -1.1625 2.3002 2.3002 2.3132 2.3132 2.5106 2.5106 2.5412 2.5412 2.8792 2.8792 2.9137 2.9137 4.4345 4.4345 4.4675 4.4675 5.2440 5.2440 5.2459 5.2459 5.6119 5.6119 5.7803 5.7803 k = 0.1176 0.2038 0.3828 ( 9170 PWs) bands (ev): -9.4924 -9.4924 -9.4923 -9.4923 -9.4639 -9.4639 -9.4638 -9.4638 -8.8815 -8.8815 -8.8814 -8.8814 -8.8655 -8.8655 -8.8647 -8.8647 -7.3076 -7.3076 -7.3068 -7.3068 -7.2886 -7.2886 -7.2857 -7.2857 -7.2640 -7.2640 -7.2615 -7.2615 -7.0415 -7.0415 -7.0317 -7.0317 -6.6842 -6.6842 -6.6838 -6.6838 -6.6744 -6.6744 -6.6718 -6.6718 -6.6407 -6.6407 -6.6297 -6.6297 -2.5450 -2.5450 -2.5450 -2.5450 -1.1314 -1.1314 -1.1303 -1.1303 2.3191 2.3191 2.3274 2.3274 2.5002 2.5002 2.5312 2.5312 2.8729 2.8729 2.9053 2.9053 4.4118 4.4118 4.4345 4.4345 5.2564 5.2564 5.2633 5.2633 5.6322 5.6322 5.7846 5.7846 k = 0.1078 0.1868 0.3828 ( 9160 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4638 -9.4638 -8.8816 -8.8816 -8.8815 -8.8815 -8.8653 -8.8653 -8.8647 -8.8647 -7.3074 -7.3074 -7.3067 -7.3067 -7.2878 -7.2878 -7.2855 -7.2855 -7.2635 -7.2635 -7.2615 -7.2615 -7.0431 -7.0431 -7.0354 -7.0354 -6.6841 -6.6841 -6.6837 -6.6837 -6.6736 -6.6736 -6.6714 -6.6714 -6.6410 -6.6410 -6.6322 -6.6322 -2.5532 -2.5532 -2.5532 -2.5532 -1.1008 -1.1008 -1.1000 -1.1000 2.3393 2.3393 2.3429 2.3429 2.4920 2.4920 2.5235 2.5235 2.8668 2.8668 2.8966 2.8966 4.3847 4.3847 4.4000 4.4000 5.2593 5.2593 5.2663 5.2663 5.6624 5.6624 5.7992 5.7992 k = 0.0980 0.1698 0.3828 ( 9144 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4638 -9.4638 -9.4638 -9.4638 -8.8817 -8.8817 -8.8816 -8.8816 -8.8652 -8.8652 -8.8647 -8.8647 -7.3072 -7.3072 -7.3067 -7.3067 -7.2871 -7.2871 -7.2853 -7.2853 -7.2631 -7.2631 -7.2615 -7.2615 -7.0448 -7.0448 -7.0389 -7.0389 -6.6839 -6.6839 -6.6837 -6.6837 -6.6728 -6.6728 -6.6710 -6.6710 -6.6413 -6.6413 -6.6344 -6.6344 -2.5605 -2.5605 -2.5605 -2.5605 -1.0723 -1.0723 -1.0716 -1.0716 2.3589 2.3589 2.3602 2.3602 2.4863 2.4863 2.5181 2.5181 2.8610 2.8610 2.8878 2.8878 4.3544 4.3544 4.3645 4.3645 5.2536 5.2536 5.2586 5.2586 5.6952 5.6952 5.8158 5.8158 k = 0.0882 0.1528 0.3828 ( 9152 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4638 -9.4638 -8.8818 -8.8818 -8.8817 -8.8817 -8.8650 -8.8650 -8.8647 -8.8647 -7.3070 -7.3070 -7.3067 -7.3067 -7.2864 -7.2864 -7.2851 -7.2851 -7.2627 -7.2627 -7.2615 -7.2615 -7.0465 -7.0465 -7.0421 -7.0421 -6.6838 -6.6838 -6.6836 -6.6836 -6.6719 -6.6719 -6.6705 -6.6705 -6.6417 -6.6417 -6.6365 -6.6365 -2.5671 -2.5671 -2.5671 -2.5671 -1.0460 -1.0460 -1.0455 -1.0455 2.3749 2.3749 2.3807 2.3807 2.4834 2.4834 2.5149 2.5149 2.8558 2.8558 2.8791 2.8791 4.3222 4.3222 4.3287 4.3287 5.2412 5.2412 5.2442 5.2442 5.7217 5.7217 5.8175 5.8175 k = 0.0784 0.1358 0.3828 ( 9144 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4638 -9.4638 -8.8818 -8.8818 -8.8818 -8.8818 -8.8649 -8.8649 -8.8647 -8.8647 -7.3069 -7.3069 -7.3066 -7.3066 -7.2858 -7.2858 -7.2848 -7.2848 -7.2623 -7.2623 -7.2614 -7.2614 -7.0482 -7.0482 -7.0451 -7.0451 -6.6836 -6.6836 -6.6835 -6.6835 -6.6711 -6.6711 -6.6700 -6.6700 -6.6422 -6.6422 -6.6384 -6.6384 -2.5729 -2.5729 -2.5729 -2.5729 -1.0220 -1.0220 -1.0216 -1.0216 2.3903 2.3903 2.3994 2.3994 2.4839 2.4839 2.5140 2.5140 2.8512 2.8512 2.8708 2.8708 4.2892 4.2892 4.2934 4.2934 5.2244 5.2244 5.2260 5.2260 5.7338 5.7338 5.7959 5.7959 k = 0.0686 0.1189 0.3828 ( 9146 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8819 -8.8819 -8.8819 -8.8819 -8.8648 -8.8648 -8.8646 -8.8646 -7.3067 -7.3067 -7.3066 -7.3066 -7.2853 -7.2853 -7.2846 -7.2846 -7.2620 -7.2620 -7.2614 -7.2614 -7.0498 -7.0498 -7.0477 -7.0477 -6.6835 -6.6835 -6.6834 -6.6834 -6.6703 -6.6703 -6.6695 -6.6695 -6.6428 -6.6428 -6.6401 -6.6401 -2.5780 -2.5780 -2.5780 -2.5780 -1.0004 -1.0004 -1.0002 -1.0002 2.4044 2.4044 2.4149 2.4149 2.4884 2.4884 2.5152 2.5152 2.8476 2.8476 2.8630 2.8630 4.2565 4.2565 4.2591 4.2591 5.2053 5.2053 5.2060 5.2060 5.7298 5.7298 5.7643 5.7643 k = 0.0588 0.1019 0.3828 ( 9142 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8820 -8.8820 -8.8820 -8.8820 -8.8647 -8.8647 -8.8646 -8.8646 -7.3066 -7.3066 -7.3065 -7.3065 -7.2848 -7.2848 -7.2843 -7.2843 -7.2617 -7.2617 -7.2613 -7.2613 -7.0514 -7.0514 -7.0500 -7.0500 -6.6834 -6.6834 -6.6833 -6.6833 -6.6696 -6.6696 -6.6690 -6.6690 -6.6433 -6.6433 -6.6416 -6.6416 -2.5824 -2.5824 -2.5824 -2.5824 -0.9815 -0.9815 -0.9814 -0.9814 2.4165 2.4165 2.4260 2.4260 2.4971 2.4971 2.5184 2.5184 2.8448 2.8448 2.8562 2.8562 4.2253 4.2253 4.2268 4.2268 5.1854 5.1854 5.1857 5.1857 5.7151 5.7151 5.7327 5.7327 k = 0.0490 0.0849 0.3828 ( 9144 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8820 -8.8820 -8.8820 -8.8820 -8.8647 -8.8647 -8.8646 -8.8646 -7.3065 -7.3065 -7.3065 -7.3065 -7.2844 -7.2844 -7.2841 -7.2841 -7.2614 -7.2614 -7.2612 -7.2612 -7.0527 -7.0527 -7.0519 -7.0519 -6.6833 -6.6833 -6.6833 -6.6833 -6.6689 -6.6689 -6.6685 -6.6685 -6.6439 -6.6439 -6.6429 -6.6429 -2.5861 -2.5861 -2.5861 -2.5861 -0.9653 -0.9653 -0.9652 -0.9652 2.4264 2.4264 2.4332 2.4332 2.5084 2.5084 2.5230 2.5230 2.8430 2.8430 2.8505 2.8505 4.1965 4.1965 4.1973 4.1973 5.1662 5.1662 5.1664 5.1664 5.6963 5.6963 5.7048 5.7048 k = 0.0392 0.0679 0.3828 ( 9140 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8821 -8.8821 -8.8821 -8.8821 -8.8646 -8.8646 -8.8646 -8.8646 -7.3065 -7.3065 -7.3064 -7.3064 -7.2841 -7.2841 -7.2839 -7.2839 -7.2612 -7.2612 -7.2611 -7.2611 -7.0539 -7.0539 -7.0535 -7.0535 -6.6833 -6.6833 -6.6832 -6.6832 -6.6683 -6.6683 -6.6681 -6.6681 -6.6445 -6.6445 -6.6440 -6.6440 -2.5891 -2.5891 -2.5891 -2.5891 -0.9519 -0.9519 -0.9519 -0.9519 2.4339 2.4339 2.4378 2.4378 2.5202 2.5202 2.5286 2.5286 2.8418 2.8418 2.8462 2.8462 4.1712 4.1712 4.1716 4.1716 5.1489 5.1489 5.1489 5.1489 5.6779 5.6779 5.6817 5.6817 k = 0.0294 0.0509 0.3828 ( 9136 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8821 -8.8821 -8.8821 -8.8821 -8.8646 -8.8646 -8.8646 -8.8646 -7.3064 -7.3064 -7.3064 -7.3064 -7.2838 -7.2838 -7.2838 -7.2838 -7.2611 -7.2611 -7.2610 -7.2610 -7.0549 -7.0549 -7.0548 -7.0548 -6.6832 -6.6832 -6.6832 -6.6832 -6.6678 -6.6678 -6.6677 -6.6677 -6.6450 -6.6450 -6.6448 -6.6448 -2.5914 -2.5914 -2.5914 -2.5914 -0.9415 -0.9415 -0.9414 -0.9414 2.4392 2.4392 2.4410 2.4410 2.5304 2.5304 2.5342 2.5342 2.8412 2.8412 2.8433 2.8433 4.1503 4.1503 4.1505 4.1505 5.1343 5.1343 5.1343 5.1343 5.6624 5.6624 5.6638 5.6638 k = 0.0196 0.0340 0.3828 ( 9148 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8821 -8.8821 -8.8821 -8.8821 -8.8645 -8.8645 -8.8645 -8.8645 -7.3064 -7.3064 -7.3064 -7.3064 -7.2837 -7.2837 -7.2836 -7.2836 -7.2610 -7.2610 -7.2609 -7.2609 -7.0557 -7.0557 -7.0556 -7.0556 -6.6832 -6.6832 -6.6832 -6.6832 -6.6674 -6.6674 -6.6674 -6.6674 -6.6454 -6.6454 -6.6454 -6.6454 -2.5930 -2.5930 -2.5930 -2.5930 -0.9339 -0.9339 -0.9339 -0.9339 2.4426 2.4426 2.4432 2.4432 2.5380 2.5380 2.5392 2.5392 2.8409 2.8409 2.8415 2.8415 4.1347 4.1347 4.1347 4.1347 5.1233 5.1233 5.1233 5.1233 5.6508 5.6508 5.6512 5.6512 k = 0.0098 0.0170 0.3828 ( 9164 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8822 -8.8822 -8.8822 -8.8822 -8.8645 -8.8645 -8.8645 -8.8645 -7.3063 -7.3063 -7.3063 -7.3063 -7.2836 -7.2836 -7.2836 -7.2836 -7.2609 -7.2609 -7.2609 -7.2609 -7.0562 -7.0562 -7.0562 -7.0562 -6.6832 -6.6832 -6.6832 -6.6832 -6.6672 -6.6672 -6.6672 -6.6672 -6.6457 -6.6457 -6.6457 -6.6457 -2.5940 -2.5940 -2.5940 -2.5940 -0.9294 -0.9294 -0.9294 -0.9294 2.4445 2.4445 2.4445 2.4445 2.5425 2.5425 2.5426 2.5426 2.8407 2.8407 2.8408 2.8408 4.1250 4.1250 4.1250 4.1250 5.1165 5.1165 5.1165 5.1165 5.6437 5.6437 5.6438 5.6438 k = 0.0000 0.0000 0.3828 ( 9152 PWs) bands (ev): -9.4923 -9.4923 -9.4923 -9.4923 -9.4639 -9.4639 -9.4639 -9.4639 -8.8822 -8.8822 -8.8822 -8.8822 -8.8645 -8.8645 -8.8645 -8.8645 -7.3063 -7.3063 -7.3063 -7.3063 -7.2835 -7.2835 -7.2835 -7.2835 -7.2609 -7.2609 -7.2609 -7.2609 -7.0563 -7.0563 -7.0563 -7.0563 -6.6831 -6.6831 -6.6831 -6.6831 -6.6671 -6.6671 -6.6671 -6.6671 -6.6458 -6.6458 -6.6458 -6.6458 -2.5943 -2.5943 -2.5943 -2.5943 -0.9279 -0.9279 -0.9279 -0.9279 2.4450 2.4450 2.4450 2.4450 2.5439 2.5439 2.5439 2.5439 2.8406 2.8406 2.8406 2.8406 4.1218 4.1218 4.1218 4.1218 5.1141 5.1141 5.1141 5.1141 5.6413 5.6413 5.6413 5.6413 k = 0.5000 0.2887 0.3828 ( 9136 PWs) bands (ev): -9.4924 -9.4924 -9.4924 -9.4924 -9.4638 -9.4638 -9.4638 -9.4638 -8.8800 -8.8800 -8.8800 -8.8800 -8.8663 -8.8663 -8.8663 -8.8663 -7.3088 -7.3088 -7.3088 -7.3088 -7.2929 -7.2929 -7.2929 -7.2929 -7.2647 -7.2647 -7.2647 -7.2647 -7.0058 -7.0058 -7.0058 -7.0058 -6.6854 -6.6854 -6.6854 -6.6854 -6.6785 -6.6785 -6.6785 -6.6785 -6.6180 -6.6180 -6.6180 -6.6180 -2.3851 -2.3851 -2.3851 -2.3851 -1.5720 -1.5720 -1.5720 -1.5720 2.1041 2.1041 2.1041 2.1041 2.7485 2.7485 2.7485 2.7485 3.0567 3.0567 3.0567 3.0567 4.4866 4.4866 4.4866 4.4866 4.9523 4.9523 4.9523 4.9523 5.7371 5.7371 5.7371 5.7371 k = 0.5000 0.2887 0.3636 ( 9140 PWs) bands (ev): -9.4933 -9.4933 -9.4916 -9.4916 -9.4639 -9.4639 -9.4636 -9.4636 -8.8801 -8.8801 -8.8799 -8.8799 -8.8663 -8.8663 -8.8662 -8.8662 -7.3109 -7.3109 -7.3070 -7.3070 -7.2942 -7.2942 -7.2913 -7.2913 -7.2652 -7.2652 -7.2641 -7.2641 -7.0075 -7.0075 -7.0042 -7.0042 -6.6856 -6.6856 -6.6852 -6.6852 -6.6792 -6.6792 -6.6777 -6.6777 -6.6187 -6.6187 -6.6172 -6.6172 -2.4176 -2.4176 -2.3516 -2.3516 -1.5768 -1.5768 -1.5668 -1.5668 2.0772 2.0772 2.1314 2.1314 2.7322 2.7322 2.7553 2.7553 3.0541 3.0541 3.0607 3.0607 4.4630 4.4630 4.5117 4.5117 4.8994 4.8994 5.0090 5.0090 5.7184 5.7184 5.7623 5.7623 k = 0.5000 0.2887 0.3445 ( 9136 PWs) bands (ev): -9.4941 -9.4941 -9.4907 -9.4907 -9.4640 -9.4640 -9.4635 -9.4635 -8.8801 -8.8801 -8.8798 -8.8798 -8.8663 -8.8663 -8.8662 -8.8662 -7.3131 -7.3131 -7.3058 -7.3058 -7.2950 -7.2950 -7.2896 -7.2896 -7.2658 -7.2658 -7.2635 -7.2635 -7.0093 -7.0093 -7.0028 -7.0028 -6.6857 -6.6857 -6.6849 -6.6849 -6.6798 -6.6798 -6.6770 -6.6770 -6.6193 -6.6193 -6.6163 -6.6163 -2.4490 -2.4490 -2.3173 -2.3173 -1.5814 -1.5814 -1.5612 -1.5612 2.0507 2.0507 2.1587 2.1587 2.7069 2.7069 2.7530 2.7530 3.0528 3.0528 3.0659 3.0659 4.4394 4.4394 4.5385 4.5385 4.8550 4.8550 5.0656 5.0656 5.7056 5.7056 5.7944 5.7944 k = 0.5000 0.2887 0.3253 ( 9150 PWs) bands (ev): -9.4950 -9.4950 -9.4899 -9.4899 -9.4642 -9.4642 -9.4633 -9.4633 -8.8802 -8.8802 -8.8798 -8.8798 -8.8664 -8.8664 -8.8662 -8.8662 -7.3153 -7.3153 -7.3053 -7.3053 -7.2949 -7.2949 -7.2878 -7.2878 -7.2663 -7.2663 -7.2629 -7.2629 -7.0112 -7.0112 -7.0015 -7.0015 -6.6859 -6.6859 -6.6847 -6.6847 -6.6805 -6.6805 -6.6763 -6.6763 -6.6198 -6.6198 -6.6154 -6.6154 -2.4792 -2.4792 -2.2823 -2.2823 -1.5856 -1.5856 -1.5552 -1.5552 2.0248 2.0248 2.1859 2.1859 2.6739 2.6739 2.7426 2.7426 3.0515 3.0515 3.0716 3.0716 4.4136 4.4136 4.5662 4.5662 4.8245 4.8245 5.1195 5.1195 5.6980 5.6980 5.8332 5.8332 k = 0.5000 0.2887 0.3062 ( 9138 PWs) bands (ev): -9.4959 -9.4959 -9.4891 -9.4891 -9.4643 -9.4643 -9.4632 -9.4632 -8.8803 -8.8803 -8.8797 -8.8797 -8.8664 -8.8664 -8.8662 -8.8662 -7.3176 -7.3176 -7.3058 -7.3058 -7.2940 -7.2940 -7.2859 -7.2859 -7.2668 -7.2668 -7.2623 -7.2623 -7.0133 -7.0133 -7.0003 -7.0003 -6.6860 -6.6860 -6.6844 -6.6844 -6.6811 -6.6811 -6.6756 -6.6756 -6.6203 -6.6203 -6.6144 -6.6144 -2.5081 -2.5081 -2.2467 -2.2467 -1.5896 -1.5896 -1.5489 -1.5489 1.9997 1.9997 2.2129 2.2129 2.6351 2.6351 2.7259 2.7259 3.0482 3.0482 3.0777 3.0777 4.3832 4.3832 4.5942 4.5942 4.8119 4.8119 5.1687 5.1687 5.6948 5.6948 5.8779 5.8779 k = 0.5000 0.2887 0.2871 ( 9138 PWs) bands (ev): -9.4967 -9.4967 -9.4884 -9.4884 -9.4645 -9.4645 -9.4631 -9.4631 -8.8804 -8.8804 -8.8797 -8.8797 -8.8664 -8.8664 -8.8661 -8.8661 -7.3198 -7.3198 -7.3068 -7.3068 -7.2925 -7.2925 -7.2841 -7.2841 -7.2673 -7.2673 -7.2618 -7.2618 -7.0153 -7.0153 -6.9992 -6.9992 -6.6862 -6.6862 -6.6842 -6.6842 -6.6817 -6.6817 -6.6749 -6.6749 -6.6207 -6.6207 -6.6133 -6.6133 -2.5356 -2.5356 -2.2107 -2.2107 -1.5934 -1.5934 -1.5424 -1.5424 1.9754 1.9754 2.2394 2.2394 2.5921 2.5921 2.7041 2.7041 3.0413 3.0413 3.0841 3.0841 4.3475 4.3475 4.6225 4.6225 4.8179 4.8179 5.2128 5.2128 5.6954 5.6954 5.9262 5.9262 k = 0.5000 0.2887 0.2679 ( 9130 PWs) bands (ev): -9.4975 -9.4975 -9.4877 -9.4877 -9.4646 -9.4646 -9.4629 -9.4629 -8.8805 -8.8805 -8.8797 -8.8797 -8.8664 -8.8664 -8.8661 -8.8661 -7.3219 -7.3219 -7.3080 -7.3080 -7.2907 -7.2907 -7.2824 -7.2824 -7.2676 -7.2676 -7.2612 -7.2612 -7.0175 -7.0175 -6.9983 -6.9983 -6.6863 -6.6863 -6.6839 -6.6839 -6.6822 -6.6822 -6.6742 -6.6742 -6.6210 -6.6210 -6.6122 -6.6122 -2.5617 -2.5617 -2.1746 -2.1746 -1.5972 -1.5972 -1.5355 -1.5355 1.9521 1.9521 2.2650 2.2650 2.5466 2.5466 2.6787 2.6787 3.0301 3.0301 3.0908 3.0908 4.3076 4.3076 4.6523 4.6523 4.8394 4.8394 5.2519 5.2519 5.6995 5.6995 5.9751 5.9751 k = 0.5000 0.2887 0.2488 ( 9126 PWs) bands (ev): -9.4983 -9.4983 -9.4870 -9.4870 -9.4647 -9.4647 -9.4628 -9.4628 -8.8806 -8.8806 -8.8796 -8.8796 -8.8664 -8.8664 -8.8661 -8.8661 -7.3240 -7.3240 -7.3094 -7.3094 -7.2888 -7.2888 -7.2807 -7.2807 -7.2679 -7.2679 -7.2607 -7.2607 -7.0196 -7.0196 -6.9976 -6.9976 -6.6863 -6.6863 -6.6838 -6.6838 -6.6825 -6.6825 -6.6736 -6.6736 -6.6212 -6.6212 -6.6111 -6.6111 -2.5862 -2.5862 -2.1385 -2.1385 -1.6009 -1.6009 -1.5285 -1.5285 1.9299 1.9299 2.2896 2.2896 2.5000 2.5000 2.6508 2.6508 3.0146 3.0146 3.0974 3.0974 4.2659 4.2659 4.6847 4.6847 4.8715 4.8715 5.2869 5.2869 5.7065 5.7065 6.0208 6.0208 k = 0.5000 0.2887 0.2297 ( 9112 PWs) bands (ev): -9.4990 -9.4990 -9.4863 -9.4863 -9.4648 -9.4648 -9.4627 -9.4627 -8.8807 -8.8807 -8.8796 -8.8796 -8.8664 -8.8664 -8.8661 -8.8661 -7.3260 -7.3260 -7.3108 -7.3108 -7.2869 -7.2869 -7.2792 -7.2792 -7.2681 -7.2681 -7.2602 -7.2602 -7.0217 -7.0217 -6.9969 -6.9969 -6.6864 -6.6864 -6.6839 -6.6839 -6.6826 -6.6826 -6.6729 -6.6729 -6.6214 -6.6214 -6.6099 -6.6099 -2.6090 -2.6090 -2.1026 -2.1026 -1.6048 -1.6048 -1.5214 -1.5214 1.9089 1.9089 2.3125 2.3125 2.4538 2.4538 2.6213 2.6213 2.9955 2.9955 3.1037 3.1037 4.2244 4.2244 4.7200 4.7200 4.9098 4.9098 5.3192 5.3192 5.7161 5.7161 6.0595 6.0595 k = 0.5000 0.2887 0.2105 ( 9120 PWs) bands (ev): -9.4998 -9.4998 -9.4857 -9.4857 -9.4650 -9.4650 -9.4626 -9.4626 -8.8808 -8.8808 -8.8796 -8.8796 -8.8665 -8.8665 -8.8660 -8.8660 -7.3279 -7.3279 -7.3121 -7.3121 -7.2851 -7.2851 -7.2779 -7.2779 -7.2681 -7.2681 -7.2597 -7.2597 -7.0238 -7.0238 -6.9964 -6.9964 -6.6865 -6.6865 -6.6841 -6.6841 -6.6825 -6.6825 -6.6724 -6.6724 -6.6215 -6.6215 -6.6087 -6.6087 -2.6303 -2.6303 -2.0671 -2.0671 -1.6090 -1.6090 -1.5143 -1.5143 1.8892 1.8892 2.3322 2.3322 2.4103 2.4103 2.5912 2.5912 2.9734 2.9734 3.1096 3.1096 4.1848 4.1848 4.7574 4.7574 4.9510 4.9510 5.3501 5.3501 5.7278 5.7278 6.0882 6.0882 k = 0.5000 0.2887 0.1914 ( 9112 PWs) bands (ev): -9.5004 -9.5004 -9.4851 -9.4851 -9.4651 -9.4651 -9.4624 -9.4624 -8.8809 -8.8809 -8.8796 -8.8796 -8.8665 -8.8665 -8.8660 -8.8660 -7.3296 -7.3296 -7.3134 -7.3134 -7.2833 -7.2833 -7.2768 -7.2768 -7.2680 -7.2680 -7.2592 -7.2592 -7.0259 -7.0259 -6.9959 -6.9959 -6.6865 -6.6865 -6.6844 -6.6844 -6.6822 -6.6822 -6.6719 -6.6719 -6.6216 -6.6216 -6.6076 -6.6076 -2.6498 -2.6498 -2.0324 -2.0324 -1.6135 -1.6135 -1.5073 -1.5073 1.8709 1.8709 2.3385 2.3385 2.3800 2.3800 2.5612 2.5612 2.9494 2.9494 3.1149 3.1149 4.1482 4.1482 4.7960 4.7960 4.9924 4.9924 5.3811 5.3811 5.7411 5.7411 6.1052 6.1052 k = 0.5000 0.2887 0.1722 ( 9132 PWs) bands (ev): -9.5011 -9.5011 -9.4846 -9.4846 -9.4652 -9.4652 -9.4624 -9.4624 -8.8810 -8.8810 -8.8796 -8.8796 -8.8665 -8.8665 -8.8660 -8.8660 -7.3313 -7.3313 -7.3146 -7.3146 -7.2817 -7.2817 -7.2760 -7.2760 -7.2677 -7.2677 -7.2588 -7.2588 -7.0278 -7.0278 -6.9956 -6.9956 -6.6865 -6.6865 -6.6848 -6.6848 -6.6820 -6.6820 -6.6714 -6.6714 -6.6217 -6.6217 -6.6065 -6.6065 -2.6676 -2.6676 -1.9985 -1.9985 -1.6185 -1.6185 -1.5005 -1.5005 1.8540 1.8540 2.3107 2.3107 2.3838 2.3838 2.5325 2.5325 2.9246 2.9246 3.1197 3.1197 4.1151 4.1151 4.8344 4.8344 5.0322 5.0322 5.4134 5.4134 5.7557 5.7557 6.1106 6.1106 k = 0.5000 0.2887 0.1531 ( 9138 PWs) bands (ev): -9.5017 -9.5017 -9.4842 -9.4842 -9.4653 -9.4653 -9.4623 -9.4623 -8.8811 -8.8811 -8.8796 -8.8796 -8.8665 -8.8665 -8.8660 -8.8660 -7.3328 -7.3328 -7.3157 -7.3157 -7.2803 -7.2803 -7.2754 -7.2754 -7.2671 -7.2671 -7.2584 -7.2584 -7.0297 -7.0297 -6.9953 -6.9953 -6.6866 -6.6866 -6.6850 -6.6850 -6.6818 -6.6818 -6.6709 -6.6709 -6.6217 -6.6217 -6.6054 -6.6054 -2.6836 -2.6836 -1.9659 -1.9659 -1.6240 -1.6240 -1.4940 -1.4940 1.8387 1.8387 2.2742 2.2742 2.3963 2.3963 2.5063 2.5063 2.8999 2.8999 3.1239 3.1239 4.0857 4.0857 4.8716 4.8716 5.0689 5.0689 5.4482 5.4482 5.7709 5.7709 6.1054 6.1054 k = 0.5000 0.2887 0.1340 ( 9124 PWs) bands (ev): -9.5022 -9.5022 -9.4837 -9.4837 -9.4653 -9.4653 -9.4622 -9.4622 -8.8811 -8.8811 -8.8796 -8.8796 -8.8665 -8.8665 -8.8660 -8.8660 -7.3341 -7.3341 -7.3167 -7.3167 -7.2790 -7.2790 -7.2751 -7.2751 -7.2665 -7.2665 -7.2580 -7.2580 -7.0314 -7.0314 -6.9951 -6.9951 -6.6866 -6.6866 -6.6853 -6.6853 -6.6815 -6.6815 -6.6705 -6.6705 -6.6217 -6.6217 -6.6044 -6.6044 -2.6977 -2.6977 -1.9347 -1.9347 -1.6303 -1.6303 -1.4879 -1.4879 1.8250 1.8250 2.2393 2.2393 2.4056 2.4056 2.4849 2.4849 2.8762 2.8762 3.1275 3.1275 4.0602 4.0602 4.9063 4.9063 5.1014 5.1014 5.4859 5.4859 5.7862 5.7862 6.0913 6.0913 k = 0.5000 0.2887 0.1148 ( 9120 PWs) bands (ev): -9.5027 -9.5027 -9.4834 -9.4834 -9.4654 -9.4654 -9.4621 -9.4621 -8.8812 -8.8812 -8.8796 -8.8796 -8.8665 -8.8665 -8.8660 -8.8660 -7.3353 -7.3353 -7.3176 -7.3176 -7.2779 -7.2779 -7.2748 -7.2748 -7.2658 -7.2658 -7.2577 -7.2577 -7.0329 -7.0329 -6.9949 -6.9949 -6.6866 -6.6866 -6.6855 -6.6855 -6.6813 -6.6813 -6.6702 -6.6702 -6.6217 -6.6217 -6.6035 -6.6035 -2.7101 -2.7101 -1.9052 -1.9052 -1.6372 -1.6372 -1.4824 -1.4824 1.8130 1.8130 2.2079 2.2079 2.4070 2.4070 2.4722 2.4722 2.8543 2.8543 3.1306 3.1306 4.0385 4.0385 4.9377 4.9377 5.1291 5.1291 5.5268 5.5268 5.8007 5.8007 6.0701 6.0701 k = 0.5000 0.2887 0.0957 ( 9116 PWs) bands (ev): -9.5031 -9.5031 -9.4831 -9.4831 -9.4655 -9.4655 -9.4620 -9.4620 -8.8813 -8.8813 -8.8796 -8.8796 -8.8665 -8.8665 -8.8660 -8.8660 -7.3363 -7.3363 -7.3183 -7.3183 -7.2771 -7.2771 -7.2745 -7.2745 -7.2651 -7.2651 -7.2574 -7.2574 -7.0342 -7.0342 -6.9948 -6.9948 -6.6867 -6.6867 -6.6856 -6.6856 -6.6811 -6.6811 -6.6699 -6.6699 -6.6216 -6.6216 -6.6028 -6.6028 -2.7205 -2.7205 -1.8779 -1.8779 -1.6449 -1.6449 -1.4775 -1.4775 1.8027 1.8027 2.1805 2.1805 2.3992 2.3992 2.4696 2.4696 2.8349 2.8349 3.1331 3.1331 4.0204 4.0204 4.9651 4.9651 5.1519 5.1519 5.5702 5.5702 5.8138 5.8138 6.0437 6.0437 k = 0.5000 0.2887 0.0766 ( 9136 PWs) bands (ev): -9.5034 -9.5034 -9.4828 -9.4828 -9.4655 -9.4655 -9.4620 -9.4620 -8.8813 -8.8813 -8.8796 -8.8796 -8.8666 -8.8666 -8.8660 -8.8660 -7.3371 -7.3371 -7.3190 -7.3190 -7.2765 -7.2765 -7.2742 -7.2742 -7.2645 -7.2645 -7.2572 -7.2572 -7.0353 -7.0353 -6.9947 -6.9947 -6.6867 -6.6867 -6.6858 -6.6858 -6.6810 -6.6810 -6.6697 -6.6697 -6.6216 -6.6216 -6.6021 -6.6021 -2.7291 -2.7291 -1.8532 -1.8532 -1.6530 -1.6530 -1.4733 -1.4733 1.7942 1.7942 2.1577 2.1577 2.3869 2.3869 2.4728 2.4728 2.8185 2.8185 3.1351 3.1351 4.0059 4.0059 4.9881 4.9881 5.1701 5.1701 5.6155 5.6155 5.8244 5.8244 6.0137 6.0137 k = 0.5000 0.2887 0.0574 ( 9128 PWs) bands (ev): -9.5037 -9.5037 -9.4826 -9.4826 -9.4656 -9.4656 -9.4620 -9.4620 -8.8814 -8.8814 -8.8796 -8.8796 -8.8666 -8.8666 -8.8659 -8.8659 -7.3377 -7.3377 -7.3194 -7.3194 -7.2762 -7.2762 -7.2738 -7.2738 -7.2640 -7.2640 -7.2570 -7.2570 -7.0362 -7.0362 -6.9946 -6.9946 -6.6868 -6.6868 -6.6859 -6.6859 -6.6808 -6.6808 -6.6695 -6.6695 -6.6216 -6.6216 -6.6016 -6.6016 -2.7358 -2.7358 -1.8318 -1.8318 -1.6612 -1.6612 -1.4700 -1.4700 1.7876 1.7876 2.1396 2.1396 2.3749 2.3749 2.4772 2.4772 2.8054 2.8054 3.1367 3.1367 3.9947 3.9947 5.0061 5.0061 5.1839 5.1839 5.6613 5.6613 5.8308 5.8308 5.9825 5.9825 k = 0.5000 0.2887 0.0383 ( 9108 PWs) bands (ev): -9.5038 -9.5038 -9.4825 -9.4825 -9.4656 -9.4656 -9.4619 -9.4619 -8.8814 -8.8814 -8.8796 -8.8796 -8.8666 -8.8666 -8.8659 -8.8659 -7.3382 -7.3382 -7.3198 -7.3198 -7.2761 -7.2761 -7.2735 -7.2735 -7.2637 -7.2637 -7.2568 -7.2568 -7.0369 -7.0369 -6.9946 -6.9946 -6.6868 -6.6868 -6.6859 -6.6859 -6.6807 -6.6807 -6.6694 -6.6694 -6.6216 -6.6216 -6.6012 -6.6012 -2.7406 -2.7406 -1.8147 -1.8147 -1.6688 -1.6688 -1.4676 -1.4676 1.7828 1.7828 2.1266 2.1266 2.3654 2.3654 2.4809 2.4809 2.7959 2.7959 3.1378 3.1378 3.9869 3.9869 5.0191 5.0191 5.1935 5.1935 5.7060 5.7060 5.8304 5.8304 5.9537 5.9537 k = 0.5000 0.2887 0.0191 ( 9118 PWs) bands (ev): -9.5040 -9.5040 -9.4824 -9.4824 -9.4656 -9.4656 -9.4619 -9.4619 -8.8814 -8.8814 -8.8796 -8.8796 -8.8666 -8.8666 -8.8659 -8.8659 -7.3385 -7.3385 -7.3200 -7.3200 -7.2760 -7.2760 -7.2733 -7.2733 -7.2634 -7.2634 -7.2567 -7.2567 -7.0373 -7.0373 -6.9945 -6.9945 -6.6868 -6.6868 -6.6859 -6.6859 -6.6807 -6.6807 -6.6693 -6.6693 -6.6215 -6.6215 -6.6010 -6.6010 -2.7435 -2.7435 -1.8033 -1.8033 -1.6744 -1.6744 -1.4661 -1.4661 1.7799 1.7799 2.1187 2.1187 2.3594 2.3594 2.4833 2.4833 2.7902 2.7902 3.1384 3.1384 3.9822 3.9822 5.0269 5.0269 5.1993 5.1993 5.7467 5.7467 5.8200 5.8200 5.9331 5.9331 k = 0.5000 0.2887-0.0000 ( 9114 PWs) bands (ev): -9.5040 -9.5040 -9.4823 -9.4823 -9.4656 -9.4656 -9.4619 -9.4619 -8.8814 -8.8814 -8.8796 -8.8796 -8.8666 -8.8666 -8.8659 -8.8659 -7.3386 -7.3386 -7.3201 -7.3201 -7.2760 -7.2760 -7.2732 -7.2732 -7.2634 -7.2634 -7.2567 -7.2567 -7.0374 -7.0374 -6.9945 -6.9945 -6.6868 -6.6868 -6.6860 -6.6860 -6.6807 -6.6807 -6.6693 -6.6693 -6.6215 -6.6215 -6.6009 -6.6009 -2.7444 -2.7444 -1.7992 -1.7992 -1.6765 -1.6765 -1.4656 -1.4656 1.7789 1.7789 2.1161 2.1161 2.3574 2.3574 2.4842 2.4842 2.7883 2.7883 3.1386 3.1386 3.9806 3.9806 5.0295 5.0295 5.2012 5.2012 5.7703 5.7703 5.8068 5.8068 5.9258 5.9258 k = 0.3333 0.5774-0.0000 ( 9108 PWs) bands (ev): -9.5039 -9.5039 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8803 -8.8803 -8.8799 -8.8799 -8.8698 -8.8698 -8.8633 -8.8633 -7.3387 -7.3387 -7.3191 -7.3191 -7.2785 -7.2785 -7.2728 -7.2728 -7.2677 -7.2677 -7.2567 -7.2567 -7.0433 -7.0433 -6.9713 -6.9713 -6.6882 -6.6882 -6.6842 -6.6842 -6.6795 -6.6795 -6.6675 -6.6675 -6.6503 -6.6503 -6.5740 -6.5740 -2.6507 -2.6507 -1.7698 -1.7698 -1.7612 -1.7612 -1.6563 -1.6563 1.7986 1.7986 2.3407 2.3407 2.4055 2.4055 2.5340 2.5340 2.9844 2.9844 2.9872 2.9872 4.2752 4.2752 4.4630 4.4630 4.4941 4.4941 5.2737 5.2737 5.6885 5.6885 6.9899 6.9899 k = 0.3333 0.5774 0.0191 ( 9132 PWs) bands (ev): -9.5039 -9.5039 -9.4824 -9.4824 -9.4656 -9.4656 -9.4620 -9.4620 -8.8803 -8.8803 -8.8799 -8.8799 -8.8698 -8.8698 -8.8633 -8.8633 -7.3386 -7.3386 -7.3191 -7.3191 -7.2785 -7.2785 -7.2729 -7.2729 -7.2678 -7.2678 -7.2567 -7.2567 -7.0433 -7.0433 -6.9713 -6.9713 -6.6882 -6.6882 -6.6842 -6.6842 -6.6795 -6.6795 -6.6675 -6.6675 -6.6504 -6.6504 -6.5740 -6.5740 -2.6496 -2.6496 -1.7701 -1.7701 -1.7615 -1.7615 -1.6586 -1.6586 1.8015 1.8015 2.3429 2.3429 2.4077 2.4077 2.5339 2.5339 2.9847 2.9847 2.9875 2.9875 4.2749 4.2749 4.4607 4.4607 4.4906 4.4906 5.2768 5.2768 5.6906 5.6906 6.9874 6.9874 k = 0.3333 0.5774 0.0383 ( 9144 PWs) bands (ev): -9.5038 -9.5038 -9.4825 -9.4825 -9.4655 -9.4655 -9.4620 -9.4620 -8.8803 -8.8803 -8.8799 -8.8799 -8.8699 -8.8699 -8.8633 -8.8633 -7.3383 -7.3383 -7.3189 -7.3189 -7.2785 -7.2785 -7.2731 -7.2731 -7.2680 -7.2680 -7.2568 -7.2568 -7.0431 -7.0431 -6.9711 -6.9711 -6.6881 -6.6881 -6.6842 -6.6842 -6.6796 -6.6796 -6.6675 -6.6675 -6.6506 -6.6506 -6.5741 -6.5741 -2.6464 -2.6464 -1.7709 -1.7709 -1.7623 -1.7623 -1.6656 -1.6656 1.8100 1.8100 2.3495 2.3495 2.4144 2.4144 2.5335 2.5335 2.9856 2.9856 2.9883 2.9883 4.2734 4.2734 4.4547 4.4547 4.4802 4.4802 5.2861 5.2861 5.6967 5.6967 6.9800 6.9800 k = 0.3333 0.5774 0.0574 ( 9114 PWs) bands (ev): -9.5036 -9.5036 -9.4826 -9.4826 -9.4655 -9.4655 -9.4620 -9.4620 -8.8803 -8.8803 -8.8799 -8.8799 -8.8698 -8.8698 -8.8632 -8.8632 -7.3379 -7.3379 -7.3185 -7.3185 -7.2786 -7.2786 -7.2734 -7.2734 -7.2684 -7.2684 -7.2568 -7.2568 -7.0429 -7.0429 -6.9709 -6.9709 -6.6881 -6.6881 -6.6841 -6.6841 -6.6797 -6.6797 -6.6675 -6.6675 -6.6510 -6.6510 -6.5742 -6.5742 -2.6410 -2.6410 -1.7722 -1.7722 -1.7636 -1.7636 -1.6771 -1.6771 1.8241 1.8241 2.3605 2.3605 2.4253 2.4253 2.5328 2.5328 2.9870 2.9870 2.9897 2.9897 4.2691 4.2691 4.4475 4.4475 4.4633 4.4633 5.3008 5.3008 5.7065 5.7065 6.9675 6.9675 k = 0.3333 0.5774 0.0766 ( 9105 PWs) bands (ev): -9.5034 -9.5034 -9.4828 -9.4828 -9.4655 -9.4655 -9.4621 -9.4621 -8.8802 -8.8802 -8.8799 -8.8799 -8.8698 -8.8698 -8.8632 -8.8632 -7.3372 -7.3372 -7.3181 -7.3181 -7.2788 -7.2788 -7.2738 -7.2738 -7.2689 -7.2689 -7.2569 -7.2569 -7.0425 -7.0425 -6.9705 -6.9705 -6.6880 -6.6880 -6.6841 -6.6841 -6.6798 -6.6798 -6.6675 -6.6675 -6.6515 -6.6515 -6.5744 -6.5744 -2.6334 -2.6334 -1.7739 -1.7739 -1.7653 -1.7653 -1.6930 -1.6930 1.8432 1.8432 2.3756 2.3756 2.4404 2.4404 2.5319 2.5319 2.9891 2.9891 2.9915 2.9915 4.2591 4.2591 4.4402 4.4402 4.4428 4.4428 5.3201 5.3201 5.7196 5.7196 6.9496 6.9496 k = 0.3333 0.5774 0.0957 ( 9108 PWs) bands (ev): -9.5030 -9.5030 -9.4831 -9.4831 -9.4654 -9.4654 -9.4621 -9.4621 -8.8802 -8.8802 -8.8798 -8.8798 -8.8699 -8.8699 -8.8632 -8.8632 -7.3364 -7.3364 -7.3175 -7.3175 -7.2792 -7.2792 -7.2742 -7.2742 -7.2696 -7.2696 -7.2570 -7.2570 -7.0421 -7.0421 -6.9701 -6.9701 -6.6879 -6.6879 -6.6841 -6.6841 -6.6800 -6.6800 -6.6676 -6.6676 -6.6521 -6.6521 -6.5746 -6.5746 -2.6237 -2.6237 -1.7761 -1.7761 -1.7675 -1.7675 -1.7129 -1.7129 1.8671 1.8671 2.3947 2.3947 2.4596 2.4596 2.5307 2.5307 2.9916 2.9916 2.9939 2.9939 4.2408 4.2408 4.4117 4.4117 4.4443 4.4443 5.3430 5.3430 5.7356 5.7356 6.9264 6.9264 k = 0.3333 0.5774 0.1148 ( 9117 PWs) bands (ev): -9.5026 -9.5026 -9.4834 -9.4834 -9.4654 -9.4654 -9.4622 -9.4622 -8.8802 -8.8802 -8.8798 -8.8798 -8.8699 -8.8699 -8.8632 -8.8632 -7.3354 -7.3354 -7.3168 -7.3168 -7.2798 -7.2798 -7.2744 -7.2744 -7.2704 -7.2704 -7.2571 -7.2571 -7.0416 -7.0416 -6.9696 -6.9696 -6.6878 -6.6878 -6.6840 -6.6840 -6.6802 -6.6802 -6.6676 -6.6676 -6.6529 -6.6529 -6.5748 -6.5748 -2.6119 -2.6119 -1.7787 -1.7787 -1.7700 -1.7700 -1.7364 -1.7364 1.8951 1.8951 2.4174 2.4174 2.4825 2.4825 2.5294 2.5294 2.9947 2.9947 2.9966 2.9966 4.2133 4.2133 4.3784 4.3784 4.4543 4.4543 5.3685 5.3685 5.7537 5.7537 6.8975 6.8975 k = 0.3333 0.5774 0.1340 ( 9114 PWs) bands (ev): -9.5022 -9.5022 -9.4837 -9.4837 -9.4653 -9.4653 -9.4622 -9.4622 -8.8801 -8.8801 -8.8798 -8.8798 -8.8699 -8.8699 -8.8632 -8.8632 -7.3343 -7.3343 -7.3160 -7.3160 -7.2807 -7.2807 -7.2745 -7.2745 -7.2714 -7.2714 -7.2572 -7.2572 -7.0410 -7.0410 -6.9690 -6.9690 -6.6877 -6.6877 -6.6840 -6.6840 -6.6804 -6.6804 -6.6676 -6.6676 -6.6537 -6.6537 -6.5751 -6.5751 -2.5980 -2.5980 -1.7816 -1.7816 -1.7728 -1.7728 -1.7633 -1.7633 1.9266 1.9266 2.4429 2.4429 2.5089 2.5089 2.5284 2.5284 2.9981 2.9981 2.9997 2.9997 4.1778 4.1778 4.3410 4.3410 4.4728 4.4728 5.3956 5.3956 5.7734 5.7734 6.8629 6.8629 k = 0.3333 0.5774 0.1531 ( 9138 PWs) bands (ev): -9.5017 -9.5017 -9.4842 -9.4842 -9.4652 -9.4652 -9.4623 -9.4623 -8.8801 -8.8801 -8.8797 -8.8797 -8.8699 -8.8699 -8.8632 -8.8632 -7.3330 -7.3330 -7.3151 -7.3151 -7.2819 -7.2819 -7.2745 -7.2745 -7.2724 -7.2724 -7.2574 -7.2574 -7.0404 -7.0404 -6.9684 -6.9684 -6.6876 -6.6876 -6.6839 -6.6839 -6.6807 -6.6807 -6.6676 -6.6676 -6.6547 -6.6547 -6.5754 -6.5754 -2.5820 -2.5820 -1.7937 -1.7937 -1.7841 -1.7841 -1.7759 -1.7759 1.9610 1.9610 2.4696 2.4696 2.5290 2.5290 2.5385 2.5385 3.0018 3.0018 3.0031 3.0031 4.1360 4.1360 4.3003 4.3003 4.4991 4.4991 5.4235 5.4235 5.7942 5.7942 6.8228 6.8228 k = 0.3333 0.5774 0.1722 ( 9150 PWs) bands (ev): -9.5011 -9.5011 -9.4847 -9.4847 -9.4651 -9.4651 -9.4624 -9.4624 -8.8801 -8.8801 -8.8797 -8.8797 -8.8699 -8.8699 -8.8632 -8.8632 -7.3315 -7.3315 -7.3141 -7.3141 -7.2834 -7.2834 -7.2744 -7.2744 -7.2736 -7.2736 -7.2576 -7.2576 -7.0397 -7.0397 -6.9677 -6.9677 -6.6875 -6.6875 -6.6838 -6.6838 -6.6810 -6.6810 -6.6676 -6.6676 -6.6557 -6.6557 -6.5757 -6.5757 -2.5640 -2.5640 -1.8259 -1.8259 -1.7876 -1.7876 -1.7791 -1.7791 1.9974 1.9974 2.4915 2.4915 2.5367 2.5367 2.5708 2.5708 3.0059 3.0059 3.0067 3.0067 4.0898 4.0898 4.2569 4.2569 4.5322 4.5322 5.4512 5.4512 5.8156 5.8156 6.7776 6.7776 k = 0.3333 0.5774 0.1914 ( 9138 PWs) bands (ev): -9.5004 -9.5004 -9.4852 -9.4852 -9.4650 -9.4650 -9.4625 -9.4625 -8.8800 -8.8800 -8.8797 -8.8797 -8.8699 -8.8699 -8.8632 -8.8632 -7.3299 -7.3299 -7.3130 -7.3130 -7.2850 -7.2850 -7.2748 -7.2748 -7.2742 -7.2742 -7.2579 -7.2579 -7.0390 -7.0390 -6.9670 -6.9670 -6.6873 -6.6873 -6.6837 -6.6837 -6.6813 -6.6813 -6.6676 -6.6676 -6.6567 -6.6567 -6.5760 -6.5760 -2.5440 -2.5440 -1.8604 -1.8604 -1.7909 -1.7909 -1.7824 -1.7824 2.0353 2.0353 2.4993 2.4993 2.5601 2.5601 2.6054 2.6054 3.0101 3.0101 3.0105 3.0105 4.0406 4.0406 4.2118 4.2118 4.5719 4.5719 5.4779 5.4779 5.8370 5.8370 6.7276 6.7276 k = 0.3333 0.5774 0.2105 ( 9144 PWs) bands (ev): -9.4997 -9.4997 -9.4857 -9.4857 -9.4649 -9.4649 -9.4626 -9.4626 -8.8800 -8.8800 -8.8796 -8.8796 -8.8699 -8.8699 -8.8632 -8.8632 -7.3281 -7.3281 -7.3119 -7.3119 -7.2868 -7.2868 -7.2761 -7.2761 -7.2739 -7.2739 -7.2581 -7.2581 -7.0384 -7.0384 -6.9663 -6.9663 -6.6872 -6.6872 -6.6836 -6.6836 -6.6816 -6.6816 -6.6676 -6.6676 -6.6578 -6.6578 -6.5764 -6.5764 -2.5220 -2.5220 -1.8968 -1.8968 -1.7942 -1.7942 -1.7856 -1.7856 2.0739 2.0739 2.4978 2.4978 2.5940 2.5940 2.6415 2.6415 3.0144 3.0144 3.0144 3.0144 3.9896 3.9896 4.1656 4.1656 4.6176 4.6176 5.5025 5.5025 5.8580 5.8580 6.6730 6.6730 k = 0.3333 0.5774 0.2297 ( 9138 PWs) bands (ev): -9.4990 -9.4990 -9.4864 -9.4864 -9.4648 -9.4648 -9.4627 -9.4627 -8.8799 -8.8799 -8.8796 -8.8796 -8.8699 -8.8699 -8.8632 -8.8632 -7.3263 -7.3263 -7.3106 -7.3106 -7.2888 -7.2888 -7.2775 -7.2775 -7.2736 -7.2736 -7.2583 -7.2583 -7.0377 -7.0377 -6.9657 -6.9657 -6.6870 -6.6870 -6.6835 -6.6835 -6.6818 -6.6818 -6.6677 -6.6677 -6.6589 -6.6589 -6.5767 -6.5767 -2.4980 -2.4980 -1.9344 -1.9344 -1.7974 -1.7974 -1.7888 -1.7888 2.1124 2.1124 2.4926 2.4926 2.6318 2.6318 2.6786 2.6786 3.0183 3.0183 3.0188 3.0188 3.9379 3.9379 4.1192 4.1192 4.6691 4.6691 5.5236 5.5236 5.8783 5.8783 6.6113 6.6113 k = 0.3333 0.5774 0.2488 ( 9135 PWs) bands (ev): -9.4983 -9.4983 -9.4870 -9.4870 -9.4647 -9.4647 -9.4628 -9.4628 -8.8799 -8.8799 -8.8795 -8.8795 -8.8699 -8.8699 -8.8632 -8.8632 -7.3243 -7.3243 -7.3094 -7.3094 -7.2909 -7.2909 -7.2789 -7.2789 -7.2732 -7.2732 -7.2586 -7.2586 -7.0371 -7.0371 -6.9650 -6.9650 -6.6869 -6.6869 -6.6833 -6.6833 -6.6821 -6.6821 -6.6677 -6.6677 -6.6599 -6.6599 -6.5770 -6.5770 -2.4722 -2.4722 -1.9731 -1.9731 -1.8004 -1.8004 -1.7918 -1.7918 2.1504 2.1504 2.4854 2.4854 2.6711 2.6711 2.7157 2.7157 3.0222 3.0222 3.0231 3.0231 3.8865 3.8865 4.0736 4.0736 4.7262 4.7262 5.5396 5.5396 5.8975 5.8975 6.5356 6.5356 k = 0.3333 0.5774 0.2679 ( 9153 PWs) bands (ev): -9.4975 -9.4975 -9.4877 -9.4877 -9.4646 -9.4646 -9.4629 -9.4629 -8.8799 -8.8799 -8.8795 -8.8795 -8.8699 -8.8699 -8.8632 -8.8632 -7.3222 -7.3222 -7.3081 -7.3081 -7.2931 -7.2931 -7.2803 -7.2803 -7.2729 -7.2729 -7.2589 -7.2589 -7.0365 -7.0365 -6.9644 -6.9644 -6.6867 -6.6867 -6.6832 -6.6832 -6.6824 -6.6824 -6.6677 -6.6677 -6.6609 -6.6609 -6.5772 -6.5772 -2.4447 -2.4447 -2.0124 -2.0124 -1.8031 -1.8031 -1.7945 -1.7945 2.1871 2.1871 2.4764 2.4764 2.7104 2.7104 2.7519 2.7519 3.0260 3.0260 3.0273 3.0273 3.8366 3.8366 4.0297 4.0297 4.7882 4.7882 5.5480 5.5480 5.9151 5.9151 6.4519 6.4519 k = 0.3333 0.5774 0.2871 ( 9147 PWs) bands (ev): -9.4967 -9.4967 -9.4884 -9.4884 -9.4645 -9.4645 -9.4631 -9.4631 -8.8798 -8.8798 -8.8795 -8.8795 -8.8699 -8.8699 -8.8632 -8.8632 -7.3200 -7.3200 -7.3068 -7.3068 -7.2953 -7.2953 -7.2817 -7.2817 -7.2726 -7.2726 -7.2591 -7.2591 -7.0360 -7.0360 -6.9639 -6.9639 -6.6866 -6.6866 -6.6830 -6.6830 -6.6826 -6.6826 -6.6677 -6.6677 -6.6618 -6.6618 -6.5775 -6.5775 -2.4153 -2.4153 -2.0520 -2.0520 -1.8056 -1.8056 -1.7970 -1.7970 2.2222 2.2222 2.4658 2.4658 2.7483 2.7483 2.7860 2.7860 3.0296 3.0296 3.0314 3.0314 3.7895 3.7895 3.9889 3.9889 4.8546 4.8546 5.5461 5.5461 5.9309 5.9309 6.3752 6.3752 k = 0.3333 0.5774 0.3062 ( 9150 PWs) bands (ev): -9.4958 -9.4958 -9.4892 -9.4892 -9.4643 -9.4643 -9.4632 -9.4632 -8.8798 -8.8798 -8.8795 -8.8795 -8.8700 -8.8700 -8.8632 -8.8632 -7.3178 -7.3178 -7.3056 -7.3056 -7.2976 -7.2976 -7.2830 -7.2830 -7.2723 -7.2723 -7.2593 -7.2593 -7.0355 -7.0355 -6.9634 -6.9634 -6.6865 -6.6865 -6.6828 -6.6828 -6.6828 -6.6828 -6.6678 -6.6678 -6.6626 -6.6626 -6.5777 -6.5777 -2.3844 -2.3844 -2.0917 -2.0917 -1.8077 -1.8077 -1.7991 -1.7991 2.2550 2.2550 2.4537 2.4537 2.7831 2.7831 2.8166 2.8166 3.0330 3.0330 3.0353 3.0353 3.7467 3.7467 3.9525 3.9525 4.9240 4.9240 5.5314 5.5314 5.9445 5.9445 6.3136 6.3136 k = 0.3333 0.5774 0.3253 ( 9162 PWs) bands (ev): -9.4950 -9.4950 -9.4900 -9.4900 -9.4642 -9.4642 -9.4633 -9.4633 -8.8798 -8.8798 -8.8794 -8.8794 -8.8700 -8.8700 -8.8632 -8.8632 -7.3156 -7.3156 -7.3046 -7.3046 -7.3000 -7.3000 -7.2841 -7.2841 -7.2721 -7.2721 -7.2595 -7.2595 -7.0352 -7.0352 -6.9631 -6.9631 -6.6864 -6.6864 -6.6830 -6.6830 -6.6827 -6.6827 -6.6678 -6.6678 -6.6632 -6.6632 -6.5779 -6.5779 -2.3519 -2.3519 -2.1312 -2.1312 -1.8093 -1.8093 -1.8007 -1.8007 2.2850 2.2850 2.4402 2.4402 2.8130 2.8130 2.8424 2.8424 3.0360 3.0360 3.0388 3.0388 3.7101 3.7101 3.9218 3.9218 4.9944 4.9944 5.5031 5.5031 5.9555 5.9555 6.2710 6.2710 k = 0.3333 0.5774 0.3445 ( 9168 PWs) bands (ev): -9.4941 -9.4941 -9.4908 -9.4908 -9.4641 -9.4641 -9.4634 -9.4634 -8.8798 -8.8798 -8.8794 -8.8794 -8.8700 -8.8700 -8.8632 -8.8632 -7.3133 -7.3133 -7.3037 -7.3037 -7.3022 -7.3022 -7.2850 -7.2850 -7.2719 -7.2719 -7.2597 -7.2597 -7.0349 -7.0349 -6.9628 -6.9628 -6.6864 -6.6864 -6.6831 -6.6831 -6.6826 -6.6826 -6.6678 -6.6678 -6.6637 -6.6637 -6.5780 -6.5780 -2.3179 -2.3179 -2.1702 -2.1702 -1.8106 -1.8106 -1.8020 -1.8020 2.3112 2.3112 2.4259 2.4259 2.8362 2.8362 2.8620 2.8620 3.0384 3.0384 3.0418 3.0418 3.6817 3.6817 3.8985 3.8985 5.0613 5.0613 5.4645 5.4645 5.9637 5.9637 6.2479 6.2479 k = 0.3333 0.5774 0.3636 ( 9168 PWs) bands (ev): -9.4933 -9.4933 -9.4916 -9.4916 -9.4640 -9.4640 -9.4636 -9.4636 -8.8798 -8.8798 -8.8794 -8.8794 -8.8700 -8.8700 -8.8632 -8.8632 -7.3113 -7.3113 -7.3042 -7.3042 -7.3031 -7.3031 -7.2856 -7.2856 -7.2718 -7.2718 -7.2598 -7.2598 -7.0347 -7.0347 -6.9626 -6.9626 -6.6863 -6.6863 -6.6831 -6.6831 -6.6825 -6.6825 -6.6679 -6.6679 -6.6640 -6.6640 -6.5780 -6.5780 -2.2826 -2.2826 -2.2086 -2.2086 -1.8113 -1.8113 -1.8027 -1.8027 2.3316 2.3316 2.4129 2.4129 2.8510 2.8510 2.8743 2.8743 3.0400 3.0400 3.0439 3.0439 3.6637 3.6637 3.8839 3.8839 5.1155 5.1155 5.4262 5.4262 5.9687 5.9687 6.2404 6.2404 k = 0.3333 0.5774 0.3828 ( 9162 PWs) bands (ev): -9.4925 -9.4925 -9.4924 -9.4924 -9.4639 -9.4639 -9.4636 -9.4636 -8.8797 -8.8797 -8.8794 -8.8794 -8.8700 -8.8700 -8.8632 -8.8632 -7.3103 -7.3103 -7.3053 -7.3053 -7.3029 -7.3029 -7.2859 -7.2859 -7.2718 -7.2718 -7.2598 -7.2598 -7.0347 -7.0347 -6.9626 -6.9626 -6.6863 -6.6863 -6.6832 -6.6832 -6.6824 -6.6824 -6.6679 -6.6679 -6.6641 -6.6641 -6.5781 -6.5781 -2.2481 -2.2481 -2.2442 -2.2442 -1.8116 -1.8116 -1.8030 -1.8030 2.3401 2.3401 2.4068 2.4068 2.8561 2.8561 2.8784 2.8784 3.0406 3.0406 3.0446 3.0446 3.6574 3.6574 3.8789 3.8789 5.1382 5.1382 5.4084 5.4084 5.9704 5.9704 6.2403 6.2403 Writing output data file Tl2S.save init_run : 0.67s CPU 0.79s WALL ( 1 calls) electrons : 226.19s CPU 229.06s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 226.19s CPU 229.05s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.07s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.06s WALL ( 231 calls) cegterg : 205.42s CPU 207.64s WALL ( 293 calls) Called by sum_band: Called by *egterg: h_psi : 118.58s CPU 121.07s WALL ( 4976 calls) s_psi : 7.26s CPU 7.24s WALL ( 4976 calls) g_psi : 0.20s CPU 0.22s WALL ( 4452 calls) cdiaghg : 71.14s CPU 71.36s WALL ( 4683 calls) cegterg:over : 10.55s CPU 10.55s WALL ( 4452 calls) cegterg:upda : 6.72s CPU 6.59s WALL ( 4452 calls) cegterg:last : 4.47s CPU 4.42s WALL ( 755 calls) cdiaghg:chol : 2.93s CPU 3.08s WALL ( 4683 calls) cdiaghg:inve : 2.16s CPU 2.09s WALL ( 4683 calls) cdiaghg:para : 4.12s CPU 4.19s WALL ( 9366 calls) Called by h_psi: h_psi:vloc : 102.30s CPU 104.55s WALL ( 4976 calls) h_psi:vnl : 16.07s CPU 16.28s WALL ( 4976 calls) add_vuspsi : 8.58s CPU 8.65s WALL ( 4976 calls) General routines calbec : 7.46s CPU 7.61s WALL ( 4976 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 99.56s CPU 101.61s WALL ( 716468 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.17s CPU 0.24s WALL ( 462 calls) Parallel routines fft_scatter : 65.54s CPU 67.23s WALL ( 716491 calls) PWSCF : 4m24.04s CPU 4m42.58s WALL This run was terminated on: 9:32:51 1Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=