Program PWSCF v.5.3.0 (svn rev. 11974) starts on 27Jan2017 at 19:36:50 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./K3As.save/ file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 63 37 10 4335 1957 292 Max 64 38 11 4342 1978 301 Sum 2275 1345 379 156157 70747 10679 bravais-lattice index = 14 lattice parameter (alat) = 10.9264 a.u. unit-cell volume = 1997.1891 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 41.0000 Ry charge density cutoff = 278.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.926396 celldm(2)= 1.000000 celldm(3)= 1.767900 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 1.767900 ) 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 0.565643 ) PseudoPot. # 1 for As read from file: /users/gautes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1209 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for K read from file: /users/gautes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential As 5.00 74.92160 As( 1.00) K 9.00 39.09830 K( 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 ) ( -0.8839502 ) 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 ) ( 0.8839502 ) 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 ) ( -0.8839502 ) 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 ) ( -0.8839502 ) 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 ) ( 0.8839502 ) 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 ) ( 0.8839502 ) 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 ) ( 0.8839502 ) 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 ) ( -0.8839502 ) 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 ) ( 0.8839502 ) 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 ) ( 0.8839502 ) 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 ) ( -0.8839502 ) 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 ) ( -0.8839502 ) 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= 233 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042918 k( 2) = ( 0.0156250 0.0090211 -0.0000000), wk = 0.0042918 k( 3) = ( 0.0312500 0.0180422 -0.0000000), wk = 0.0042918 k( 4) = ( 0.0468750 0.0270633 -0.0000000), wk = 0.0042918 k( 5) = ( 0.0625000 0.0360844 -0.0000000), wk = 0.0042918 k( 6) = ( 0.0781250 0.0451055 -0.0000000), wk = 0.0042918 k( 7) = ( 0.0937500 0.0541266 -0.0000000), wk = 0.0042918 k( 8) = ( 0.1093750 0.0631477 -0.0000000), wk = 0.0042918 k( 9) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0042918 k( 10) = ( 0.1406250 0.0811899 -0.0000000), wk = 0.0042918 k( 11) = ( 0.1562500 0.0902110 -0.0000000), wk = 0.0042918 k( 12) = ( 0.1718750 0.0992321 -0.0000000), wk = 0.0042918 k( 13) = ( 0.1875000 0.1082532 -0.0000000), wk = 0.0042918 k( 14) = ( 0.2031250 0.1172743 -0.0000000), wk = 0.0042918 k( 15) = ( 0.2187500 0.1262954 -0.0000000), wk = 0.0042918 k( 16) = ( 0.2343750 0.1353165 -0.0000000), wk = 0.0042918 k( 17) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0042918 k( 18) = ( 0.2656250 0.1533587 -0.0000000), wk = 0.0042918 k( 19) = ( 0.2812500 0.1623798 -0.0000000), wk = 0.0042918 k( 20) = ( 0.2968750 0.1714009 -0.0000000), wk = 0.0042918 k( 21) = ( 0.3125000 0.1804220 -0.0000000), wk = 0.0042918 k( 22) = ( 0.3281250 0.1894431 -0.0000000), wk = 0.0042918 k( 23) = ( 0.3437500 0.1984642 -0.0000000), wk = 0.0042918 k( 24) = ( 0.3593750 0.2074853 -0.0000000), wk = 0.0042918 k( 25) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0042918 k( 26) = ( 0.3906250 0.2255274 -0.0000000), wk = 0.0042918 k( 27) = ( 0.4062500 0.2345485 -0.0000000), wk = 0.0042918 k( 28) = ( 0.4218750 0.2435696 -0.0000000), wk = 0.0042918 k( 29) = ( 0.4375000 0.2525907 -0.0000000), wk = 0.0042918 k( 30) = ( 0.4531250 0.2616118 -0.0000000), wk = 0.0042918 k( 31) = ( 0.4687500 0.2706329 -0.0000000), wk = 0.0042918 k( 32) = ( 0.4843750 0.2796540 -0.0000000), wk = 0.0042918 k( 33) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0042918 k( 34) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0042918 k( 35) = ( 0.4912281 0.3038686 -0.0000000), wk = 0.0042918 k( 36) = ( 0.4824561 0.3190620 -0.0000000), wk = 0.0042918 k( 37) = ( 0.4736842 0.3342554 -0.0000000), wk = 0.0042918 k( 38) = ( 0.4649123 0.3494488 -0.0000000), wk = 0.0042918 k( 39) = ( 0.4561404 0.3646423 -0.0000000), wk = 0.0042918 k( 40) = ( 0.4473684 0.3798357 -0.0000000), wk = 0.0042918 k( 41) = ( 0.4385965 0.3950291 -0.0000000), wk = 0.0042918 k( 42) = ( 0.4298246 0.4102226 -0.0000000), wk = 0.0042918 k( 43) = ( 0.4210526 0.4254160 -0.0000000), wk = 0.0042918 k( 44) = ( 0.4122807 0.4406094 -0.0000000), wk = 0.0042918 k( 45) = ( 0.4035088 0.4558028 -0.0000000), wk = 0.0042918 k( 46) = ( 0.3947368 0.4709963 -0.0000000), wk = 0.0042918 k( 47) = ( 0.3859649 0.4861897 -0.0000000), wk = 0.0042918 k( 48) = ( 0.3771930 0.5013831 -0.0000000), wk = 0.0042918 k( 49) = ( 0.3684211 0.5165765 -0.0000000), wk = 0.0042918 k( 50) = ( 0.3596491 0.5317700 -0.0000000), wk = 0.0042918 k( 51) = ( 0.3508772 0.5469634 -0.0000000), wk = 0.0042918 k( 52) = ( 0.3421053 0.5621568 -0.0000000), wk = 0.0042918 k( 53) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0042918 k( 54) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0042918 k( 55) = ( 0.3243243 0.5617462 -0.0000000), wk = 0.0042918 k( 56) = ( 0.3153153 0.5461422 -0.0000000), wk = 0.0042918 k( 57) = ( 0.3063063 0.5305381 -0.0000000), wk = 0.0042918 k( 58) = ( 0.2972973 0.5149340 -0.0000000), wk = 0.0042918 k( 59) = ( 0.2882883 0.4993300 -0.0000000), wk = 0.0042918 k( 60) = ( 0.2792793 0.4837259 -0.0000000), wk = 0.0042918 k( 61) = ( 0.2702703 0.4681218 -0.0000000), wk = 0.0042918 k( 62) = ( 0.2612613 0.4525178 -0.0000000), wk = 0.0042918 k( 63) = ( 0.2522523 0.4369137 -0.0000000), wk = 0.0042918 k( 64) = ( 0.2432432 0.4213097 -0.0000000), wk = 0.0042918 k( 65) = ( 0.2342342 0.4057056 -0.0000000), wk = 0.0042918 k( 66) = ( 0.2252252 0.3901015 -0.0000000), wk = 0.0042918 k( 67) = ( 0.2162162 0.3744975 -0.0000000), wk = 0.0042918 k( 68) = ( 0.2072072 0.3588934 -0.0000000), wk = 0.0042918 k( 69) = ( 0.1981982 0.3432894 -0.0000000), wk = 0.0042918 k( 70) = ( 0.1891892 0.3276853 -0.0000000), wk = 0.0042918 k( 71) = ( 0.1801802 0.3120812 -0.0000000), wk = 0.0042918 k( 72) = ( 0.1711712 0.2964772 -0.0000000), wk = 0.0042918 k( 73) = ( 0.1621622 0.2808731 -0.0000000), wk = 0.0042918 k( 74) = ( 0.1531531 0.2652690 -0.0000000), wk = 0.0042918 k( 75) = ( 0.1441441 0.2496650 -0.0000000), wk = 0.0042918 k( 76) = ( 0.1351351 0.2340609 -0.0000000), wk = 0.0042918 k( 77) = ( 0.1261261 0.2184569 -0.0000000), wk = 0.0042918 k( 78) = ( 0.1171171 0.2028528 -0.0000000), wk = 0.0042918 k( 79) = ( 0.1081081 0.1872487 -0.0000000), wk = 0.0042918 k( 80) = ( 0.0990991 0.1716447 -0.0000000), wk = 0.0042918 k( 81) = ( 0.0900901 0.1560406 -0.0000000), wk = 0.0042918 k( 82) = ( 0.0810811 0.1404366 -0.0000000), wk = 0.0042918 k( 83) = ( 0.0720721 0.1248325 -0.0000000), wk = 0.0042918 k( 84) = ( 0.0630631 0.1092284 -0.0000000), wk = 0.0042918 k( 85) = ( 0.0540540 0.0936244 -0.0000000), wk = 0.0042918 k( 86) = ( 0.0450451 0.0780203 -0.0000000), wk = 0.0042918 k( 87) = ( 0.0360360 0.0624163 -0.0000000), wk = 0.0042918 k( 88) = ( 0.0270270 0.0468122 -0.0000000), wk = 0.0042918 k( 89) = ( 0.0180180 0.0312081 -0.0000000), wk = 0.0042918 k( 90) = ( 0.0090090 0.0156041 -0.0000000), wk = 0.0042918 k( 91) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042918 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042918 k( 93) = ( 0.0000000 0.0000000 0.0176763), wk = 0.0042918 k( 94) = ( 0.0000000 0.0000000 0.0353527), wk = 0.0042918 k( 95) = ( 0.0000000 0.0000000 0.0530290), wk = 0.0042918 k( 96) = ( 0.0000000 0.0000000 0.0707053), wk = 0.0042918 k( 97) = ( 0.0000000 0.0000000 0.0883817), wk = 0.0042918 k( 98) = ( 0.0000000 0.0000000 0.1060580), wk = 0.0042918 k( 99) = ( 0.0000000 0.0000000 0.1237343), wk = 0.0042918 k( 100) = ( 0.0000000 0.0000000 0.1414107), wk = 0.0042918 k( 101) = ( 0.0000000 0.0000000 0.1590870), wk = 0.0042918 k( 102) = ( 0.0000000 0.0000000 0.1767634), wk = 0.0042918 k( 103) = ( 0.0000000 0.0000000 0.1944397), wk = 0.0042918 k( 104) = ( 0.0000000 0.0000000 0.2121160), wk = 0.0042918 k( 105) = ( 0.0000000 0.0000000 0.2297924), wk = 0.0042918 k( 106) = ( 0.0000000 0.0000000 0.2474687), wk = 0.0042918 k( 107) = ( 0.0000000 0.0000000 0.2651450), wk = 0.0042918 k( 108) = ( 0.0000000 0.0000000 0.2828214), wk = 0.0042918 k( 109) = ( 0.0000000 0.0000000 0.2828214), wk = 0.0042918 k( 110) = ( 0.0156250 0.0090211 0.2828214), wk = 0.0042918 k( 111) = ( 0.0312500 0.0180422 0.2828214), wk = 0.0042918 k( 112) = ( 0.0468750 0.0270633 0.2828214), wk = 0.0042918 k( 113) = ( 0.0625000 0.0360844 0.2828214), wk = 0.0042918 k( 114) = ( 0.0781250 0.0451055 0.2828214), wk = 0.0042918 k( 115) = ( 0.0937500 0.0541266 0.2828214), wk = 0.0042918 k( 116) = ( 0.1093750 0.0631477 0.2828214), wk = 0.0042918 k( 117) = ( 0.1250000 0.0721688 0.2828214), wk = 0.0042918 k( 118) = ( 0.1406250 0.0811899 0.2828214), wk = 0.0042918 k( 119) = ( 0.1562500 0.0902110 0.2828214), wk = 0.0042918 k( 120) = ( 0.1718750 0.0992321 0.2828214), wk = 0.0042918 k( 121) = ( 0.1875000 0.1082532 0.2828214), wk = 0.0042918 k( 122) = ( 0.2031250 0.1172743 0.2828214), wk = 0.0042918 k( 123) = ( 0.2187500 0.1262954 0.2828214), wk = 0.0042918 k( 124) = ( 0.2343750 0.1353165 0.2828214), wk = 0.0042918 k( 125) = ( 0.2500000 0.1443376 0.2828214), wk = 0.0042918 k( 126) = ( 0.2656250 0.1533587 0.2828214), wk = 0.0042918 k( 127) = ( 0.2812500 0.1623798 0.2828214), wk = 0.0042918 k( 128) = ( 0.2968750 0.1714009 0.2828214), wk = 0.0042918 k( 129) = ( 0.3125000 0.1804220 0.2828214), wk = 0.0042918 k( 130) = ( 0.3281250 0.1894431 0.2828214), wk = 0.0042918 k( 131) = ( 0.3437500 0.1984642 0.2828214), wk = 0.0042918 k( 132) = ( 0.3593750 0.2074853 0.2828214), wk = 0.0042918 k( 133) = ( 0.3750000 0.2165064 0.2828214), wk = 0.0042918 k( 134) = ( 0.3906250 0.2255274 0.2828214), wk = 0.0042918 k( 135) = ( 0.4062500 0.2345485 0.2828214), wk = 0.0042918 k( 136) = ( 0.4218750 0.2435696 0.2828214), wk = 0.0042918 k( 137) = ( 0.4375000 0.2525907 0.2828214), wk = 0.0042918 k( 138) = ( 0.4531250 0.2616118 0.2828214), wk = 0.0042918 k( 139) = ( 0.4687500 0.2706329 0.2828214), wk = 0.0042918 k( 140) = ( 0.4843750 0.2796540 0.2828214), wk = 0.0042918 k( 141) = ( 0.5000000 0.2886751 0.2828214), wk = 0.0042918 k( 142) = ( 0.5000000 0.2886751 0.2828214), wk = 0.0042918 k( 143) = ( 0.4912281 0.3038686 0.2828214), wk = 0.0042918 k( 144) = ( 0.4824561 0.3190620 0.2828214), wk = 0.0042918 k( 145) = ( 0.4736842 0.3342554 0.2828214), wk = 0.0042918 k( 146) = ( 0.4649123 0.3494488 0.2828214), wk = 0.0042918 k( 147) = ( 0.4561404 0.3646423 0.2828214), wk = 0.0042918 k( 148) = ( 0.4473684 0.3798357 0.2828214), wk = 0.0042918 k( 149) = ( 0.4385965 0.3950291 0.2828214), wk = 0.0042918 k( 150) = ( 0.4298246 0.4102226 0.2828214), wk = 0.0042918 k( 151) = ( 0.4210526 0.4254160 0.2828214), wk = 0.0042918 k( 152) = ( 0.4122807 0.4406094 0.2828214), wk = 0.0042918 k( 153) = ( 0.4035088 0.4558028 0.2828214), wk = 0.0042918 k( 154) = ( 0.3947368 0.4709963 0.2828214), wk = 0.0042918 k( 155) = ( 0.3859649 0.4861897 0.2828214), wk = 0.0042918 k( 156) = ( 0.3771930 0.5013831 0.2828214), wk = 0.0042918 k( 157) = ( 0.3684211 0.5165765 0.2828214), wk = 0.0042918 k( 158) = ( 0.3596491 0.5317700 0.2828214), wk = 0.0042918 k( 159) = ( 0.3508772 0.5469634 0.2828214), wk = 0.0042918 k( 160) = ( 0.3421053 0.5621568 0.2828214), wk = 0.0042918 k( 161) = ( 0.3333333 0.5773503 0.2828214), wk = 0.0042918 k( 162) = ( 0.3333333 0.5773503 0.2828214), wk = 0.0042918 k( 163) = ( 0.3243243 0.5617462 0.2828214), wk = 0.0042918 k( 164) = ( 0.3153153 0.5461422 0.2828214), wk = 0.0042918 k( 165) = ( 0.3063063 0.5305381 0.2828214), wk = 0.0042918 k( 166) = ( 0.2972973 0.5149340 0.2828214), wk = 0.0042918 k( 167) = ( 0.2882883 0.4993300 0.2828214), wk = 0.0042918 k( 168) = ( 0.2792793 0.4837259 0.2828214), wk = 0.0042918 k( 169) = ( 0.2702703 0.4681218 0.2828214), wk = 0.0042918 k( 170) = ( 0.2612613 0.4525178 0.2828214), wk = 0.0042918 k( 171) = ( 0.2522523 0.4369137 0.2828214), wk = 0.0042918 k( 172) = ( 0.2432432 0.4213097 0.2828214), wk = 0.0042918 k( 173) = ( 0.2342342 0.4057056 0.2828214), wk = 0.0042918 k( 174) = ( 0.2252252 0.3901015 0.2828214), wk = 0.0042918 k( 175) = ( 0.2162162 0.3744975 0.2828214), wk = 0.0042918 k( 176) = ( 0.2072072 0.3588934 0.2828214), wk = 0.0042918 k( 177) = ( 0.1981982 0.3432894 0.2828214), wk = 0.0042918 k( 178) = ( 0.1891892 0.3276853 0.2828214), wk = 0.0042918 k( 179) = ( 0.1801802 0.3120812 0.2828214), wk = 0.0042918 k( 180) = ( 0.1711712 0.2964772 0.2828214), wk = 0.0042918 k( 181) = ( 0.1621622 0.2808731 0.2828214), wk = 0.0042918 k( 182) = ( 0.1531531 0.2652690 0.2828214), wk = 0.0042918 k( 183) = ( 0.1441441 0.2496650 0.2828214), wk = 0.0042918 k( 184) = ( 0.1351351 0.2340609 0.2828214), wk = 0.0042918 k( 185) = ( 0.1261261 0.2184569 0.2828214), wk = 0.0042918 k( 186) = ( 0.1171171 0.2028528 0.2828214), wk = 0.0042918 k( 187) = ( 0.1081081 0.1872487 0.2828214), wk = 0.0042918 k( 188) = ( 0.0990991 0.1716447 0.2828214), wk = 0.0042918 k( 189) = ( 0.0900901 0.1560406 0.2828214), wk = 0.0042918 k( 190) = ( 0.0810811 0.1404366 0.2828214), wk = 0.0042918 k( 191) = ( 0.0720721 0.1248325 0.2828214), wk = 0.0042918 k( 192) = ( 0.0630631 0.1092284 0.2828214), wk = 0.0042918 k( 193) = ( 0.0540540 0.0936244 0.2828214), wk = 0.0042918 k( 194) = ( 0.0450451 0.0780203 0.2828214), wk = 0.0042918 k( 195) = ( 0.0360360 0.0624163 0.2828214), wk = 0.0042918 k( 196) = ( 0.0270270 0.0468122 0.2828214), wk = 0.0042918 k( 197) = ( 0.0180180 0.0312081 0.2828214), wk = 0.0042918 k( 198) = ( 0.0090090 0.0156041 0.2828214), wk = 0.0042918 k( 199) = ( 0.0000000 0.0000000 0.2828214), wk = 0.0042918 k( 200) = ( 0.5000000 0.2886751 0.2828214), wk = 0.0042918 k( 201) = ( 0.5000000 0.2886751 0.2651450), wk = 0.0042918 k( 202) = ( 0.5000000 0.2886751 0.2474687), wk = 0.0042918 k( 203) = ( 0.5000000 0.2886751 0.2297924), wk = 0.0042918 k( 204) = ( 0.5000000 0.2886751 0.2121160), wk = 0.0042918 k( 205) = ( 0.5000000 0.2886751 0.1944397), wk = 0.0042918 k( 206) = ( 0.5000000 0.2886751 0.1767634), wk = 0.0042918 k( 207) = ( 0.5000000 0.2886751 0.1590870), wk = 0.0042918 k( 208) = ( 0.5000000 0.2886751 0.1414107), wk = 0.0042918 k( 209) = ( 0.5000000 0.2886751 0.1237343), wk = 0.0042918 k( 210) = ( 0.5000000 0.2886751 0.1060580), wk = 0.0042918 k( 211) = ( 0.5000000 0.2886751 0.0883817), wk = 0.0042918 k( 212) = ( 0.5000000 0.2886751 0.0707053), wk = 0.0042918 k( 213) = ( 0.5000000 0.2886751 0.0530290), wk = 0.0042918 k( 214) = ( 0.5000000 0.2886751 0.0353527), wk = 0.0042918 k( 215) = ( 0.5000000 0.2886751 0.0176763), wk = 0.0042918 k( 216) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0042918 k( 217) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0042918 k( 218) = ( 0.3333333 0.5773503 0.0176763), wk = 0.0042918 k( 219) = ( 0.3333333 0.5773503 0.0353527), wk = 0.0042918 k( 220) = ( 0.3333333 0.5773503 0.0530290), wk = 0.0042918 k( 221) = ( 0.3333333 0.5773503 0.0707053), wk = 0.0042918 k( 222) = ( 0.3333333 0.5773503 0.0883817), wk = 0.0042918 k( 223) = ( 0.3333333 0.5773503 0.1060580), wk = 0.0042918 k( 224) = ( 0.3333333 0.5773503 0.1237343), wk = 0.0042918 k( 225) = ( 0.3333333 0.5773503 0.1414107), wk = 0.0042918 k( 226) = ( 0.3333333 0.5773503 0.1590870), wk = 0.0042918 k( 227) = ( 0.3333333 0.5773503 0.1767634), wk = 0.0042918 k( 228) = ( 0.3333333 0.5773503 0.1944397), wk = 0.0042918 k( 229) = ( 0.3333333 0.5773503 0.2121160), wk = 0.0042918 k( 230) = ( 0.3333333 0.5773503 0.2297924), wk = 0.0042918 k( 231) = ( 0.3333333 0.5773503 0.2474687), wk = 0.0042918 k( 232) = ( 0.3333333 0.5773503 0.2651450), wk = 0.0042918 k( 233) = ( 0.3333333 0.5773503 0.2828214), wk = 0.0042918 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042918 k( 2) = ( 0.0156250 -0.0000000 0.0000000), wk = 0.0042918 k( 3) = ( 0.0312500 -0.0000000 0.0000000), wk = 0.0042918 k( 4) = ( 0.0468750 0.0000000 0.0000000), wk = 0.0042918 k( 5) = ( 0.0625000 -0.0000000 0.0000000), wk = 0.0042918 k( 6) = ( 0.0781250 -0.0000000 0.0000000), wk = 0.0042918 k( 7) = ( 0.0937500 0.0000000 0.0000000), wk = 0.0042918 k( 8) = ( 0.1093750 -0.0000000 0.0000000), wk = 0.0042918 k( 9) = ( 0.1250000 -0.0000000 0.0000000), wk = 0.0042918 k( 10) = ( 0.1406250 -0.0000000 0.0000000), wk = 0.0042918 k( 11) = ( 0.1562500 -0.0000000 0.0000000), wk = 0.0042918 k( 12) = ( 0.1718750 -0.0000000 -0.0000000), wk = 0.0042918 k( 13) = ( 0.1875000 0.0000000 0.0000000), wk = 0.0042918 k( 14) = ( 0.2031250 -0.0000000 -0.0000000), wk = 0.0042918 k( 15) = ( 0.2187500 -0.0000000 0.0000000), wk = 0.0042918 k( 16) = ( 0.2343750 -0.0000000 -0.0000000), wk = 0.0042918 k( 17) = ( 0.2500000 -0.0000000 0.0000000), wk = 0.0042918 k( 18) = ( 0.2656250 0.0000000 0.0000000), wk = 0.0042918 k( 19) = ( 0.2812500 -0.0000000 0.0000000), wk = 0.0042918 k( 20) = ( 0.2968750 -0.0000000 0.0000000), wk = 0.0042918 k( 21) = ( 0.3125000 -0.0000000 0.0000000), wk = 0.0042918 k( 22) = ( 0.3281250 -0.0000000 0.0000000), wk = 0.0042918 k( 23) = ( 0.3437500 -0.0000000 -0.0000000), wk = 0.0042918 k( 24) = ( 0.3593750 -0.0000000 -0.0000000), wk = 0.0042918 k( 25) = ( 0.3750000 0.0000000 0.0000000), wk = 0.0042918 k( 26) = ( 0.3906250 -0.0000000 0.0000000), wk = 0.0042918 k( 27) = ( 0.4062500 -0.0000000 -0.0000000), wk = 0.0042918 k( 28) = ( 0.4218750 -0.0000000 -0.0000000), wk = 0.0042918 k( 29) = ( 0.4375000 -0.0000000 0.0000000), wk = 0.0042918 k( 30) = ( 0.4531250 -0.0000000 0.0000000), wk = 0.0042918 k( 31) = ( 0.4687500 -0.0000000 -0.0000000), wk = 0.0042918 k( 32) = ( 0.4843750 -0.0000000 0.0000000), wk = 0.0042918 k( 33) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0042918 k( 34) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0042918 k( 35) = ( 0.4912281 0.0175439 0.0000000), wk = 0.0042918 k( 36) = ( 0.4824561 0.0350877 0.0000000), wk = 0.0042918 k( 37) = ( 0.4736842 0.0526316 0.0000000), wk = 0.0042918 k( 38) = ( 0.4649123 0.0701754 0.0000000), wk = 0.0042918 k( 39) = ( 0.4561404 0.0877193 -0.0000000), wk = 0.0042918 k( 40) = ( 0.4473684 0.1052632 0.0000000), wk = 0.0042918 k( 41) = ( 0.4385965 0.1228070 0.0000000), wk = 0.0042918 k( 42) = ( 0.4298246 0.1403509 0.0000000), wk = 0.0042918 k( 43) = ( 0.4210526 0.1578947 0.0000000), wk = 0.0042918 k( 44) = ( 0.4122807 0.1754386 0.0000000), wk = 0.0042918 k( 45) = ( 0.4035088 0.1929825 0.0000000), wk = 0.0042918 k( 46) = ( 0.3947368 0.2105263 0.0000000), wk = 0.0042918 k( 47) = ( 0.3859649 0.2280702 0.0000000), wk = 0.0042918 k( 48) = ( 0.3771930 0.2456140 0.0000000), wk = 0.0042918 k( 49) = ( 0.3684211 0.2631579 0.0000000), wk = 0.0042918 k( 50) = ( 0.3596491 0.2807018 -0.0000000), wk = 0.0042918 k( 51) = ( 0.3508772 0.2982456 0.0000000), wk = 0.0042918 k( 52) = ( 0.3421053 0.3157895 0.0000000), wk = 0.0042918 k( 53) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0042918 k( 54) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0042918 k( 55) = ( 0.3243243 0.3243243 -0.0000000), wk = 0.0042918 k( 56) = ( 0.3153153 0.3153153 0.0000000), wk = 0.0042918 k( 57) = ( 0.3063063 0.3063063 0.0000000), wk = 0.0042918 k( 58) = ( 0.2972973 0.2972973 0.0000000), wk = 0.0042918 k( 59) = ( 0.2882883 0.2882883 0.0000000), wk = 0.0042918 k( 60) = ( 0.2792793 0.2792793 0.0000000), wk = 0.0042918 k( 61) = ( 0.2702703 0.2702703 0.0000000), wk = 0.0042918 k( 62) = ( 0.2612613 0.2612613 -0.0000000), wk = 0.0042918 k( 63) = ( 0.2522523 0.2522523 -0.0000000), wk = 0.0042918 k( 64) = ( 0.2432432 0.2432432 0.0000000), wk = 0.0042918 k( 65) = ( 0.2342342 0.2342342 -0.0000000), wk = 0.0042918 k( 66) = ( 0.2252252 0.2252252 0.0000000), wk = 0.0042918 k( 67) = ( 0.2162162 0.2162162 0.0000000), wk = 0.0042918 k( 68) = ( 0.2072072 0.2072072 0.0000000), wk = 0.0042918 k( 69) = ( 0.1981982 0.1981982 -0.0000000), wk = 0.0042918 k( 70) = ( 0.1891892 0.1891892 0.0000000), wk = 0.0042918 k( 71) = ( 0.1801802 0.1801802 0.0000000), wk = 0.0042918 k( 72) = ( 0.1711712 0.1711712 0.0000000), wk = 0.0042918 k( 73) = ( 0.1621622 0.1621622 -0.0000000), wk = 0.0042918 k( 74) = ( 0.1531531 0.1531532 -0.0000000), wk = 0.0042918 k( 75) = ( 0.1441441 0.1441441 0.0000000), wk = 0.0042918 k( 76) = ( 0.1351351 0.1351351 -0.0000000), wk = 0.0042918 k( 77) = ( 0.1261261 0.1261261 0.0000000), wk = 0.0042918 k( 78) = ( 0.1171171 0.1171171 0.0000000), wk = 0.0042918 k( 79) = ( 0.1081081 0.1081081 0.0000000), wk = 0.0042918 k( 80) = ( 0.0990991 0.0990991 -0.0000000), wk = 0.0042918 k( 81) = ( 0.0900901 0.0900901 0.0000000), wk = 0.0042918 k( 82) = ( 0.0810811 0.0810811 -0.0000000), wk = 0.0042918 k( 83) = ( 0.0720721 0.0720721 0.0000000), wk = 0.0042918 k( 84) = ( 0.0630631 0.0630631 0.0000000), wk = 0.0042918 k( 85) = ( 0.0540540 0.0540540 0.0000000), wk = 0.0042918 k( 86) = ( 0.0450451 0.0450450 0.0000000), wk = 0.0042918 k( 87) = ( 0.0360360 0.0360360 -0.0000000), wk = 0.0042918 k( 88) = ( 0.0270270 0.0270270 0.0000000), wk = 0.0042918 k( 89) = ( 0.0180180 0.0180180 -0.0000000), wk = 0.0042918 k( 90) = ( 0.0090090 0.0090090 -0.0000000), wk = 0.0042918 k( 91) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042918 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042918 k( 93) = ( 0.0000000 0.0000000 0.0312500), wk = 0.0042918 k( 94) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0042918 k( 95) = ( 0.0000000 0.0000000 0.0937500), wk = 0.0042918 k( 96) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0042918 k( 97) = ( 0.0000000 0.0000000 0.1562500), wk = 0.0042918 k( 98) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0042918 k( 99) = ( 0.0000000 0.0000000 0.2187500), wk = 0.0042918 k( 100) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0042918 k( 101) = ( 0.0000000 0.0000000 0.2812500), wk = 0.0042918 k( 102) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0042918 k( 103) = ( 0.0000000 0.0000000 0.3437500), wk = 0.0042918 k( 104) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0042918 k( 105) = ( 0.0000000 0.0000000 0.4062500), wk = 0.0042918 k( 106) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0042918 k( 107) = ( 0.0000000 0.0000000 0.4687500), wk = 0.0042918 k( 108) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0042918 k( 109) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0042918 k( 110) = ( 0.0156250 -0.0000000 0.5000000), wk = 0.0042918 k( 111) = ( 0.0312500 -0.0000000 0.5000000), wk = 0.0042918 k( 112) = ( 0.0468750 0.0000000 0.5000000), wk = 0.0042918 k( 113) = ( 0.0625000 -0.0000000 0.5000000), wk = 0.0042918 k( 114) = ( 0.0781250 -0.0000000 0.5000000), wk = 0.0042918 k( 115) = ( 0.0937500 0.0000000 0.5000000), wk = 0.0042918 k( 116) = ( 0.1093750 -0.0000000 0.5000000), wk = 0.0042918 k( 117) = ( 0.1250000 -0.0000000 0.5000000), wk = 0.0042918 k( 118) = ( 0.1406250 -0.0000000 0.5000000), wk = 0.0042918 k( 119) = ( 0.1562500 -0.0000000 0.5000000), wk = 0.0042918 k( 120) = ( 0.1718750 -0.0000000 0.5000000), wk = 0.0042918 k( 121) = ( 0.1875000 0.0000000 0.5000000), wk = 0.0042918 k( 122) = ( 0.2031250 -0.0000000 0.5000000), wk = 0.0042918 k( 123) = ( 0.2187500 -0.0000000 0.5000000), wk = 0.0042918 k( 124) = ( 0.2343750 -0.0000000 0.5000000), wk = 0.0042918 k( 125) = ( 0.2500000 -0.0000000 0.5000000), wk = 0.0042918 k( 126) = ( 0.2656250 0.0000000 0.5000000), wk = 0.0042918 k( 127) = ( 0.2812500 -0.0000000 0.5000000), wk = 0.0042918 k( 128) = ( 0.2968750 -0.0000000 0.5000000), wk = 0.0042918 k( 129) = ( 0.3125000 -0.0000000 0.5000000), wk = 0.0042918 k( 130) = ( 0.3281250 -0.0000000 0.5000000), wk = 0.0042918 k( 131) = ( 0.3437500 -0.0000000 0.5000000), wk = 0.0042918 k( 132) = ( 0.3593750 -0.0000000 0.5000000), wk = 0.0042918 k( 133) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0042918 k( 134) = ( 0.3906250 -0.0000000 0.5000000), wk = 0.0042918 k( 135) = ( 0.4062500 -0.0000000 0.5000000), wk = 0.0042918 k( 136) = ( 0.4218750 -0.0000000 0.5000000), wk = 0.0042918 k( 137) = ( 0.4375000 -0.0000000 0.5000000), wk = 0.0042918 k( 138) = ( 0.4531250 -0.0000000 0.5000000), wk = 0.0042918 k( 139) = ( 0.4687500 -0.0000000 0.5000000), wk = 0.0042918 k( 140) = ( 0.4843750 -0.0000000 0.5000000), wk = 0.0042918 k( 141) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0042918 k( 142) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0042918 k( 143) = ( 0.4912281 0.0175439 0.5000000), wk = 0.0042918 k( 144) = ( 0.4824561 0.0350877 0.5000000), wk = 0.0042918 k( 145) = ( 0.4736842 0.0526316 0.5000000), wk = 0.0042918 k( 146) = ( 0.4649123 0.0701754 0.5000000), wk = 0.0042918 k( 147) = ( 0.4561404 0.0877193 0.5000000), wk = 0.0042918 k( 148) = ( 0.4473684 0.1052632 0.5000000), wk = 0.0042918 k( 149) = ( 0.4385965 0.1228070 0.5000000), wk = 0.0042918 k( 150) = ( 0.4298246 0.1403509 0.5000000), wk = 0.0042918 k( 151) = ( 0.4210526 0.1578947 0.5000000), wk = 0.0042918 k( 152) = ( 0.4122807 0.1754386 0.5000000), wk = 0.0042918 k( 153) = ( 0.4035088 0.1929825 0.5000000), wk = 0.0042918 k( 154) = ( 0.3947368 0.2105263 0.5000000), wk = 0.0042918 k( 155) = ( 0.3859649 0.2280702 0.5000000), wk = 0.0042918 k( 156) = ( 0.3771930 0.2456140 0.5000000), wk = 0.0042918 k( 157) = ( 0.3684211 0.2631579 0.5000000), wk = 0.0042918 k( 158) = ( 0.3596491 0.2807018 0.5000000), wk = 0.0042918 k( 159) = ( 0.3508772 0.2982456 0.5000000), wk = 0.0042918 k( 160) = ( 0.3421053 0.3157895 0.5000000), wk = 0.0042918 k( 161) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0042918 k( 162) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0042918 k( 163) = ( 0.3243243 0.3243243 0.5000000), wk = 0.0042918 k( 164) = ( 0.3153153 0.3153153 0.5000000), wk = 0.0042918 k( 165) = ( 0.3063063 0.3063063 0.5000000), wk = 0.0042918 k( 166) = ( 0.2972973 0.2972973 0.5000000), wk = 0.0042918 k( 167) = ( 0.2882883 0.2882883 0.5000000), wk = 0.0042918 k( 168) = ( 0.2792793 0.2792793 0.5000000), wk = 0.0042918 k( 169) = ( 0.2702703 0.2702703 0.5000000), wk = 0.0042918 k( 170) = ( 0.2612613 0.2612613 0.5000000), wk = 0.0042918 k( 171) = ( 0.2522523 0.2522523 0.5000000), wk = 0.0042918 k( 172) = ( 0.2432432 0.2432432 0.5000000), wk = 0.0042918 k( 173) = ( 0.2342342 0.2342342 0.5000000), wk = 0.0042918 k( 174) = ( 0.2252252 0.2252252 0.5000000), wk = 0.0042918 k( 175) = ( 0.2162162 0.2162162 0.5000000), wk = 0.0042918 k( 176) = ( 0.2072072 0.2072072 0.5000000), wk = 0.0042918 k( 177) = ( 0.1981982 0.1981982 0.5000000), wk = 0.0042918 k( 178) = ( 0.1891892 0.1891892 0.5000000), wk = 0.0042918 k( 179) = ( 0.1801802 0.1801802 0.5000000), wk = 0.0042918 k( 180) = ( 0.1711712 0.1711712 0.5000000), wk = 0.0042918 k( 181) = ( 0.1621622 0.1621622 0.5000000), wk = 0.0042918 k( 182) = ( 0.1531531 0.1531532 0.5000000), wk = 0.0042918 k( 183) = ( 0.1441441 0.1441441 0.5000000), wk = 0.0042918 k( 184) = ( 0.1351351 0.1351351 0.5000000), wk = 0.0042918 k( 185) = ( 0.1261261 0.1261261 0.5000000), wk = 0.0042918 k( 186) = ( 0.1171171 0.1171171 0.5000000), wk = 0.0042918 k( 187) = ( 0.1081081 0.1081081 0.5000000), wk = 0.0042918 k( 188) = ( 0.0990991 0.0990991 0.5000000), wk = 0.0042918 k( 189) = ( 0.0900901 0.0900901 0.5000000), wk = 0.0042918 k( 190) = ( 0.0810811 0.0810811 0.5000000), wk = 0.0042918 k( 191) = ( 0.0720721 0.0720721 0.5000000), wk = 0.0042918 k( 192) = ( 0.0630631 0.0630631 0.5000000), wk = 0.0042918 k( 193) = ( 0.0540540 0.0540540 0.5000000), wk = 0.0042918 k( 194) = ( 0.0450451 0.0450450 0.5000000), wk = 0.0042918 k( 195) = ( 0.0360360 0.0360360 0.5000000), wk = 0.0042918 k( 196) = ( 0.0270270 0.0270270 0.5000000), wk = 0.0042918 k( 197) = ( 0.0180180 0.0180180 0.5000000), wk = 0.0042918 k( 198) = ( 0.0090090 0.0090090 0.5000000), wk = 0.0042918 k( 199) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0042918 k( 200) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0042918 k( 201) = ( 0.5000000 -0.0000000 0.4687500), wk = 0.0042918 k( 202) = ( 0.5000000 -0.0000000 0.4375000), wk = 0.0042918 k( 203) = ( 0.5000000 -0.0000000 0.4062500), wk = 0.0042918 k( 204) = ( 0.5000000 -0.0000000 0.3750000), wk = 0.0042918 k( 205) = ( 0.5000000 -0.0000000 0.3437500), wk = 0.0042918 k( 206) = ( 0.5000000 -0.0000000 0.3125000), wk = 0.0042918 k( 207) = ( 0.5000000 -0.0000000 0.2812500), wk = 0.0042918 k( 208) = ( 0.5000000 -0.0000000 0.2500000), wk = 0.0042918 k( 209) = ( 0.5000000 -0.0000000 0.2187500), wk = 0.0042918 k( 210) = ( 0.5000000 -0.0000000 0.1875000), wk = 0.0042918 k( 211) = ( 0.5000000 -0.0000000 0.1562500), wk = 0.0042918 k( 212) = ( 0.5000000 -0.0000000 0.1250000), wk = 0.0042918 k( 213) = ( 0.5000000 -0.0000000 0.0937500), wk = 0.0042918 k( 214) = ( 0.5000000 -0.0000000 0.0625000), wk = 0.0042918 k( 215) = ( 0.5000000 -0.0000000 0.0312500), wk = 0.0042918 k( 216) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0042918 k( 217) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0042918 k( 218) = ( 0.3333333 0.3333333 0.0312500), wk = 0.0042918 k( 219) = ( 0.3333333 0.3333333 0.0625000), wk = 0.0042918 k( 220) = ( 0.3333333 0.3333333 0.0937500), wk = 0.0042918 k( 221) = ( 0.3333333 0.3333333 0.1250000), wk = 0.0042918 k( 222) = ( 0.3333333 0.3333333 0.1562500), wk = 0.0042918 k( 223) = ( 0.3333333 0.3333333 0.1875000), wk = 0.0042918 k( 224) = ( 0.3333333 0.3333333 0.2187500), wk = 0.0042918 k( 225) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0042918 k( 226) = ( 0.3333333 0.3333333 0.2812500), wk = 0.0042918 k( 227) = ( 0.3333333 0.3333333 0.3125000), wk = 0.0042918 k( 228) = ( 0.3333333 0.3333333 0.3437500), wk = 0.0042918 k( 229) = ( 0.3333333 0.3333333 0.3750000), wk = 0.0042918 k( 230) = ( 0.3333333 0.3333333 0.4062500), wk = 0.0042918 k( 231) = ( 0.3333333 0.3333333 0.4375000), wk = 0.0042918 k( 232) = ( 0.3333333 0.3333333 0.4687500), wk = 0.0042918 k( 233) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0042918 Dense grid: 156157 G-vectors FFT dimensions: ( 60, 60, 108) Smooth grid: 70747 G-vectors FFT dimensions: ( 45, 45, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.59 Mb ( 512, 76) NL pseudopotentials 0.91 Mb ( 256, 232) Each V/rho on FFT grid 0.16 Mb ( 10800) Each G-vector array 0.03 Mb ( 4339) G-vector shells 0.02 Mb ( 2019) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.38 Mb ( 512, 304) Each subspace H/S matrix 0.09 Mb ( 76, 76) Each matrix 0.54 Mb ( 232, 2, 76) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./K3As.save/charge-density.dat Starting wfc are 112 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.7 secs Computing kpt #: 2 total cpu time spent up to now is 5.3 secs Computing kpt #: 3 total cpu time spent up to now is 6.9 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 9.8 secs Computing kpt #: 6 total cpu time spent up to now is 11.3 secs Computing kpt #: 7 total cpu time spent up to now is 12.8 secs Computing kpt #: 8 total cpu time spent up to now is 14.3 secs Computing kpt #: 9 total cpu time spent up to now is 15.8 secs Computing kpt #: 10 total cpu time spent up to now is 17.3 secs Computing kpt #: 11 total cpu time spent up to now is 18.8 secs Computing kpt #: 12 total cpu time spent up to now is 20.3 secs Computing kpt #: 13 total cpu time spent up to now is 21.8 secs Computing kpt #: 14 total cpu time spent up to now is 23.2 secs Computing kpt #: 15 total cpu time spent up to now is 24.8 secs Computing kpt #: 16 total cpu time spent up to now is 26.2 secs Computing kpt #: 17 total cpu time spent up to now is 27.7 secs Computing kpt #: 18 total cpu time spent up to now is 29.3 secs Computing kpt #: 19 total cpu time spent up to now is 30.7 secs Computing kpt #: 20 total cpu time spent up to now is 32.3 secs Computing kpt #: 21 total cpu time spent up to now is 33.8 secs Computing kpt #: 22 total cpu time spent up to now is 35.3 secs Computing kpt #: 23 total cpu time spent up to now is 36.7 secs Computing kpt #: 24 total cpu time spent up to now is 38.2 secs Computing kpt #: 25 total cpu time spent up to now is 39.7 secs Computing kpt #: 26 total cpu time spent up to now is 41.1 secs Computing kpt #: 27 total cpu time spent up to now is 42.6 secs Computing kpt #: 28 total cpu time spent up to now is 44.1 secs Computing kpt #: 29 total cpu time spent up to now is 45.5 secs Computing kpt #: 30 total cpu time spent up to now is 47.0 secs Computing kpt #: 31 total cpu time spent up to now is 48.4 secs Computing kpt #: 32 total cpu time spent up to now is 49.8 secs Computing kpt #: 33 total cpu time spent up to now is 51.2 secs Computing kpt #: 34 total cpu time spent up to now is 52.7 secs Computing kpt #: 35 total cpu time spent up to now is 54.1 secs Computing kpt #: 36 total cpu time spent up to now is 55.6 secs Computing kpt #: 37 total cpu time spent up to now is 57.0 secs Computing kpt #: 38 total cpu time spent up to now is 58.4 secs Computing kpt #: 39 total cpu time spent up to now is 59.8 secs Computing kpt #: 40 total cpu time spent up to now is 61.2 secs Computing kpt #: 41 total cpu time spent up to now is 62.7 secs Computing kpt #: 42 total cpu time spent up to now is 64.1 secs Computing kpt #: 43 total cpu time spent up to now is 65.5 secs Computing kpt #: 44 total cpu time spent up to now is 66.8 secs Computing kpt #: 45 total cpu time spent up to now is 68.2 secs Computing kpt #: 46 total cpu time spent up to now is 69.4 secs Computing kpt #: 47 total cpu time spent up to now is 70.5 secs Computing kpt #: 48 total cpu time spent up to now is 71.6 secs Computing kpt #: 49 total cpu time spent up to now is 72.7 secs Computing kpt #: 50 total cpu time spent up to now is 73.8 secs Computing kpt #: 51 total cpu time spent up to now is 74.9 secs Computing kpt #: 52 total cpu time spent up to now is 76.0 secs Computing kpt #: 53 total cpu time spent up to now is 77.1 secs Computing kpt #: 54 total cpu time spent up to now is 78.2 secs Computing kpt #: 55 total cpu time spent up to now is 79.3 secs Computing kpt #: 56 total cpu time spent up to now is 80.4 secs Computing kpt #: 57 total cpu time spent up to now is 81.6 secs Computing kpt #: 58 total cpu time spent up to now is 82.7 secs Computing kpt #: 59 total cpu time spent up to now is 83.8 secs Computing kpt #: 60 total cpu time spent up to now is 84.9 secs Computing kpt #: 61 total cpu time spent up to now is 86.3 secs Computing kpt #: 62 total cpu time spent up to now is 87.6 secs Computing kpt #: 63 total cpu time spent up to now is 89.0 secs Computing kpt #: 64 total cpu time spent up to now is 90.4 secs Computing kpt #: 65 total cpu time spent up to now is 91.8 secs Computing kpt #: 66 total cpu time spent up to now is 93.2 secs Computing kpt #: 67 total cpu time spent up to now is 94.6 secs Computing kpt #: 68 total cpu time spent up to now is 96.0 secs Computing kpt #: 69 total cpu time spent up to now is 97.4 secs Computing kpt #: 70 total cpu time spent up to now is 98.8 secs Computing kpt #: 71 total cpu time spent up to now is 100.3 secs Computing kpt #: 72 total cpu time spent up to now is 101.7 secs Computing kpt #: 73 total cpu time spent up to now is 103.2 secs Computing kpt #: 74 total cpu time spent up to now is 104.6 secs Computing kpt #: 75 total cpu time spent up to now is 106.1 secs Computing kpt #: 76 total cpu time spent up to now is 107.6 secs Computing kpt #: 77 total cpu time spent up to now is 109.0 secs Computing kpt #: 78 total cpu time spent up to now is 110.5 secs Computing kpt #: 79 total cpu time spent up to now is 111.9 secs Computing kpt #: 80 total cpu time spent up to now is 113.4 secs Computing kpt #: 81 total cpu time spent up to now is 114.9 secs Computing kpt #: 82 total cpu time spent up to now is 116.4 secs Computing kpt #: 83 total cpu time spent up to now is 117.9 secs Computing kpt #: 84 total cpu time spent up to now is 119.4 secs Computing kpt #: 85 total cpu time spent up to now is 120.9 secs Computing kpt #: 86 total cpu time spent up to now is 122.4 secs Computing kpt #: 87 total cpu time spent up to now is 123.8 secs Computing kpt #: 88 total cpu time spent up to now is 125.4 secs Computing kpt #: 89 total cpu time spent up to now is 126.9 secs Computing kpt #: 90 total cpu time spent up to now is 128.5 secs Computing kpt #: 91 total cpu time spent up to now is 130.1 secs Computing kpt #: 92 total cpu time spent up to now is 131.6 secs Computing kpt #: 93 total cpu time spent up to now is 133.0 secs Computing kpt #: 94 total cpu time spent up to now is 134.5 secs Computing kpt #: 95 total cpu time spent up to now is 136.0 secs Computing kpt #: 96 total cpu time spent up to now is 137.5 secs Computing kpt #: 97 total cpu time spent up to now is 139.0 secs Computing kpt #: 98 total cpu time spent up to now is 140.5 secs Computing kpt #: 99 total cpu time spent up to now is 141.9 secs Computing kpt #: 100 total cpu time spent up to now is 143.4 secs Computing kpt #: 101 total cpu time spent up to now is 144.9 secs Computing kpt #: 102 total cpu time spent up to now is 146.3 secs Computing kpt #: 103 total cpu time spent up to now is 147.8 secs Computing kpt #: 104 total cpu time spent up to now is 149.3 secs Computing kpt #: 105 total cpu time spent up to now is 150.8 secs Computing kpt #: 106 total cpu time spent up to now is 152.3 secs Computing kpt #: 107 total cpu time spent up to now is 154.2 secs Computing kpt #: 108 total cpu time spent up to now is 156.1 secs Computing kpt #: 109 total cpu time spent up to now is 157.9 secs Computing kpt #: 110 total cpu time spent up to now is 159.4 secs Computing kpt #: 111 total cpu time spent up to now is 161.3 secs Computing kpt #: 112 total cpu time spent up to now is 163.2 secs Computing kpt #: 113 total cpu time spent up to now is 164.8 secs Computing kpt #: 114 total cpu time spent up to now is 166.3 secs Computing kpt #: 115 total cpu time spent up to now is 167.9 secs Computing kpt #: 116 total cpu time spent up to now is 169.5 secs Computing kpt #: 117 total cpu time spent up to now is 171.0 secs Computing kpt #: 118 total cpu time spent up to now is 172.6 secs Computing kpt #: 119 total cpu time spent up to now is 174.4 secs Computing kpt #: 120 total cpu time spent up to now is 176.4 secs Computing kpt #: 121 total cpu time spent up to now is 178.4 secs Computing kpt #: 122 total cpu time spent up to now is 180.0 secs Computing kpt #: 123 total cpu time spent up to now is 181.6 secs Computing kpt #: 124 total cpu time spent up to now is 183.0 secs Computing kpt #: 125 total cpu time spent up to now is 184.4 secs Computing kpt #: 126 total cpu time spent up to now is 185.8 secs Computing kpt #: 127 total cpu time spent up to now is 187.2 secs Computing kpt #: 128 total cpu time spent up to now is 188.5 secs Computing kpt #: 129 total cpu time spent up to now is 189.9 secs Computing kpt #: 130 total cpu time spent up to now is 191.2 secs Computing kpt #: 131 total cpu time spent up to now is 192.6 secs Computing kpt #: 132 total cpu time spent up to now is 193.9 secs Computing kpt #: 133 total cpu time spent up to now is 195.3 secs Computing kpt #: 134 total cpu time spent up to now is 196.5 secs Computing kpt #: 135 total cpu time spent up to now is 197.7 secs Computing kpt #: 136 total cpu time spent up to now is 198.9 secs Computing kpt #: 137 total cpu time spent up to now is 200.0 secs Computing kpt #: 138 total cpu time spent up to now is 201.2 secs Computing kpt #: 139 total cpu time spent up to now is 202.3 secs Computing kpt #: 140 total cpu time spent up to now is 203.5 secs Computing kpt #: 141 total cpu time spent up to now is 204.7 secs Computing kpt #: 142 total cpu time spent up to now is 205.8 secs Computing kpt #: 143 total cpu time spent up to now is 207.0 secs Computing kpt #: 144 total cpu time spent up to now is 208.4 secs Computing kpt #: 145 total cpu time spent up to now is 209.7 secs Computing kpt #: 146 total cpu time spent up to now is 211.1 secs Computing kpt #: 147 total cpu time spent up to now is 212.5 secs Computing kpt #: 148 total cpu time spent up to now is 213.8 secs Computing kpt #: 149 total cpu time spent up to now is 215.2 secs Computing kpt #: 150 total cpu time spent up to now is 216.5 secs Computing kpt #: 151 total cpu time spent up to now is 217.9 secs Computing kpt #: 152 total cpu time spent up to now is 219.2 secs Computing kpt #: 153 total cpu time spent up to now is 220.5 secs Computing kpt #: 154 total cpu time spent up to now is 221.9 secs Computing kpt #: 155 total cpu time spent up to now is 223.5 secs Computing kpt #: 156 total cpu time spent up to now is 225.0 secs Computing kpt #: 157 total cpu time spent up to now is 226.3 secs Computing kpt #: 158 total cpu time spent up to now is 227.7 secs Computing kpt #: 159 total cpu time spent up to now is 229.0 secs Computing kpt #: 160 total cpu time spent up to now is 230.4 secs Computing kpt #: 161 total cpu time spent up to now is 231.7 secs Computing kpt #: 162 total cpu time spent up to now is 233.0 secs Computing kpt #: 163 total cpu time spent up to now is 234.4 secs Computing kpt #: 164 total cpu time spent up to now is 235.7 secs Computing kpt #: 165 total cpu time spent up to now is 237.1 secs Computing kpt #: 166 total cpu time spent up to now is 238.4 secs Computing kpt #: 167 total cpu time spent up to now is 239.7 secs Computing kpt #: 168 total cpu time spent up to now is 241.1 secs Computing kpt #: 169 total cpu time spent up to now is 242.4 secs Computing kpt #: 170 total cpu time spent up to now is 243.8 secs Computing kpt #: 171 total cpu time spent up to now is 245.2 secs Computing kpt #: 172 total cpu time spent up to now is 246.5 secs Computing kpt #: 173 total cpu time spent up to now is 247.9 secs Computing kpt #: 174 total cpu time spent up to now is 249.3 secs Computing kpt #: 175 total cpu time spent up to now is 250.7 secs Computing kpt #: 176 total cpu time spent up to now is 252.1 secs Computing kpt #: 177 total cpu time spent up to now is 253.5 secs Computing kpt #: 178 total cpu time spent up to now is 254.9 secs Computing kpt #: 179 total cpu time spent up to now is 256.2 secs Computing kpt #: 180 total cpu time spent up to now is 257.6 secs Computing kpt #: 181 total cpu time spent up to now is 259.0 secs Computing kpt #: 182 total cpu time spent up to now is 260.3 secs Computing kpt #: 183 total cpu time spent up to now is 261.7 secs Computing kpt #: 184 total cpu time spent up to now is 263.1 secs Computing kpt #: 185 total cpu time spent up to now is 264.4 secs Computing kpt #: 186 total cpu time spent up to now is 265.8 secs Computing kpt #: 187 total cpu time spent up to now is 267.2 secs Computing kpt #: 188 total cpu time spent up to now is 268.6 secs Computing kpt #: 189 total cpu time spent up to now is 270.0 secs Computing kpt #: 190 total cpu time spent up to now is 271.5 secs Computing kpt #: 191 total cpu time spent up to now is 273.0 secs Computing kpt #: 192 total cpu time spent up to now is 274.5 secs Computing kpt #: 193 total cpu time spent up to now is 276.0 secs Computing kpt #: 194 total cpu time spent up to now is 277.5 secs Computing kpt #: 195 total cpu time spent up to now is 279.0 secs Computing kpt #: 196 total cpu time spent up to now is 280.6 secs Computing kpt #: 197 total cpu time spent up to now is 282.1 secs Computing kpt #: 198 total cpu time spent up to now is 283.8 secs Computing kpt #: 199 total cpu time spent up to now is 285.6 secs Computing kpt #: 200 total cpu time spent up to now is 286.7 secs Computing kpt #: 201 total cpu time spent up to now is 287.9 secs Computing kpt #: 202 total cpu time spent up to now is 289.0 secs Computing kpt #: 203 total cpu time spent up to now is 290.2 secs Computing kpt #: 204 total cpu time spent up to now is 291.6 secs Computing kpt #: 205 total cpu time spent up to now is 292.9 secs Computing kpt #: 206 total cpu time spent up to now is 294.3 secs Computing kpt #: 207 total cpu time spent up to now is 295.7 secs Computing kpt #: 208 total cpu time spent up to now is 297.2 secs Computing kpt #: 209 total cpu time spent up to now is 298.7 secs Computing kpt #: 210 total cpu time spent up to now is 300.1 secs Computing kpt #: 211 total cpu time spent up to now is 301.6 secs Computing kpt #: 212 total cpu time spent up to now is 303.1 secs Computing kpt #: 213 total cpu time spent up to now is 304.5 secs Computing kpt #: 214 total cpu time spent up to now is 306.0 secs Computing kpt #: 215 total cpu time spent up to now is 307.4 secs Computing kpt #: 216 total cpu time spent up to now is 308.8 secs Computing kpt #: 217 total cpu time spent up to now is 310.0 secs Computing kpt #: 218 total cpu time spent up to now is 311.1 secs Computing kpt #: 219 total cpu time spent up to now is 312.2 secs Computing kpt #: 220 total cpu time spent up to now is 313.3 secs Computing kpt #: 221 total cpu time spent up to now is 314.4 secs Computing kpt #: 222 total cpu time spent up to now is 315.5 secs Computing kpt #: 223 total cpu time spent up to now is 316.7 secs Computing kpt #: 224 total cpu time spent up to now is 317.8 secs Computing kpt #: 225 total cpu time spent up to now is 318.9 secs Computing kpt #: 226 total cpu time spent up to now is 320.1 secs Computing kpt #: 227 total cpu time spent up to now is 321.3 secs Computing kpt #: 228 total cpu time spent up to now is 322.4 secs Computing kpt #: 229 total cpu time spent up to now is 323.6 secs Computing kpt #: 230 total cpu time spent up to now is 324.8 secs Computing kpt #: 231 total cpu time spent up to now is 326.0 secs Computing kpt #: 232 total cpu time spent up to now is 327.3 secs Computing kpt #: 233 total cpu time spent up to now is 328.7 secs ethr = 1.56E-08, avg # of iterations = 26.1 total cpu time spent up to now is 328.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8847 PWs) bands (ev): -27.0882 -27.0882 -27.0536 -27.0536 -27.0530 -27.0530 -27.0185 -27.0185 -26.7117 -26.7117 -26.7114 -26.7114 -10.8424 -10.8424 -10.8151 -10.8151 -10.7729 -10.7729 -10.7034 -10.7034 -10.6028 -10.6028 -10.5973 -10.5973 -10.5432 -10.5432 -10.5009 -10.5009 -10.4758 -10.4758 -10.4450 -10.4450 -10.4245 -10.4245 -10.4018 -10.4018 -10.3837 -10.3837 -10.3400 -10.3400 -10.1803 -10.1803 -10.1542 -10.1542 -10.0905 -10.0905 -10.0768 -10.0768 -4.5199 -4.5199 -4.4129 -4.4129 2.7022 2.7022 3.4969 3.4969 3.6487 3.6487 3.6516 3.6516 3.7614 3.7614 3.7783 3.7783 3.9821 3.9821 6.2985 6.2985 6.7321 6.7321 7.0409 7.0409 7.0435 7.0435 7.6246 7.6246 k = 0.0156 0.0090-0.0000 ( 8889 PWs) bands (ev): -27.0882 -27.0882 -27.0536 -27.0536 -27.0530 -27.0530 -27.0185 -27.0185 -26.7117 -26.7117 -26.7115 -26.7115 -10.8425 -10.8425 -10.8151 -10.8151 -10.7730 -10.7730 -10.7036 -10.7036 -10.6027 -10.6027 -10.5973 -10.5973 -10.5434 -10.5434 -10.5011 -10.5011 -10.4761 -10.4761 -10.4448 -10.4448 -10.4244 -10.4244 -10.4018 -10.4018 -10.3835 -10.3835 -10.3399 -10.3399 -10.1803 -10.1803 -10.1543 -10.1543 -10.0905 -10.0905 -10.0769 -10.0769 -4.5196 -4.5196 -4.4127 -4.4127 2.7031 2.7031 3.4929 3.4929 3.6450 3.6450 3.6477 3.6477 3.7603 3.7603 3.7770 3.7770 3.9962 3.9962 6.3033 6.3033 6.7190 6.7190 7.0426 7.0426 7.0553 7.0553 7.5955 7.5955 k = 0.0312 0.0180-0.0000 ( 8881 PWs) bands (ev): -27.0881 -27.0881 -27.0536 -27.0536 -27.0531 -27.0531 -27.0186 -27.0186 -26.7117 -26.7117 -26.7115 -26.7115 -10.8425 -10.8425 -10.8151 -10.8151 -10.7732 -10.7732 -10.7043 -10.7043 -10.6022 -10.6022 -10.5972 -10.5972 -10.5438 -10.5438 -10.5018 -10.5018 -10.4767 -10.4767 -10.4439 -10.4439 -10.4243 -10.4243 -10.4017 -10.4017 -10.3829 -10.3829 -10.3398 -10.3398 -10.1800 -10.1800 -10.1544 -10.1544 -10.0904 -10.0904 -10.0771 -10.0771 -4.5186 -4.5186 -4.4122 -4.4122 2.7060 2.7060 3.4800 3.4800 3.6297 3.6297 3.6441 3.6441 3.7581 3.7581 3.7735 3.7735 4.0341 4.0341 6.3175 6.3175 6.6847 6.6847 7.0444 7.0444 7.0887 7.0887 7.5487 7.5487 k = 0.0469 0.0271-0.0000 ( 8873 PWs) bands (ev): -27.0880 -27.0880 -27.0535 -27.0535 -27.0532 -27.0532 -27.0187 -27.0187 -26.7117 -26.7117 -26.7115 -26.7115 -10.8425 -10.8425 -10.8151 -10.8151 -10.7736 -10.7736 -10.7054 -10.7054 -10.6017 -10.6017 -10.5969 -10.5969 -10.5446 -10.5446 -10.5029 -10.5029 -10.4777 -10.4777 -10.4428 -10.4428 -10.4240 -10.4240 -10.4015 -10.4015 -10.3818 -10.3818 -10.3395 -10.3395 -10.1797 -10.1797 -10.1548 -10.1548 -10.0902 -10.0902 -10.0775 -10.0775 -4.5169 -4.5169 -4.4113 -4.4113 2.7109 2.7109 3.4567 3.4567 3.6137 3.6137 3.6376 3.6376 3.7565 3.7565 3.7683 3.7683 4.0874 4.0874 6.3409 6.3409 6.6384 6.6384 7.0471 7.0471 7.1335 7.1335 7.4966 7.4966 k = 0.0625 0.0361-0.0000 ( 8857 PWs) bands (ev): -27.0878 -27.0878 -27.0533 -27.0533 -27.0533 -27.0533 -27.0188 -27.0188 -26.7117 -26.7117 -26.7115 -26.7115 -10.8426 -10.8426 -10.8151 -10.8151 -10.7742 -10.7742 -10.7068 -10.7068 -10.6011 -10.6011 -10.5964 -10.5964 -10.5458 -10.5458 -10.5044 -10.5044 -10.4786 -10.4786 -10.4415 -10.4415 -10.4236 -10.4236 -10.4011 -10.4011 -10.3804 -10.3804 -10.3391 -10.3391 -10.1791 -10.1791 -10.1552 -10.1552 -10.0900 -10.0900 -10.0779 -10.0779 -4.5147 -4.5147 -4.4100 -4.4100 2.7176 2.7176 3.4235 3.4235 3.6023 3.6023 3.6277 3.6277 3.7556 3.7556 3.7624 3.7624 4.1502 4.1502 6.3729 6.3729 6.5860 6.5860 7.0509 7.0509 7.1828 7.1828 7.4402 7.4402 k = 0.0781 0.0451-0.0000 ( 8853 PWs) bands (ev): -27.0876 -27.0876 -27.0534 -27.0534 -27.0531 -27.0531 -27.0190 -27.0190 -26.7117 -26.7117 -26.7115 -26.7115 -10.8427 -10.8427 -10.8151 -10.8151 -10.7749 -10.7749 -10.7086 -10.7086 -10.6008 -10.6008 -10.5954 -10.5954 -10.5472 -10.5472 -10.5063 -10.5063 -10.4795 -10.4795 -10.4404 -10.4404 -10.4232 -10.4232 -10.4004 -10.4004 -10.3787 -10.3787 -10.3386 -10.3386 -10.1784 -10.1784 -10.1557 -10.1557 -10.0897 -10.0897 -10.0785 -10.0785 -4.5118 -4.5118 -4.4084 -4.4084 2.7262 2.7262 3.3834 3.3834 3.5959 3.5959 3.6139 3.6139 3.7552 3.7552 3.7568 3.7568 4.2191 4.2191 6.4128 6.4128 6.5310 6.5310 7.0557 7.0557 7.2327 7.2327 7.3802 7.3802 k = 0.0938 0.0541-0.0000 ( 8841 PWs) bands (ev): -27.0874 -27.0874 -27.0535 -27.0535 -27.0529 -27.0529 -27.0192 -27.0192 -26.7118 -26.7118 -26.7115 -26.7115 -10.8429 -10.8429 -10.8152 -10.8152 -10.7757 -10.7757 -10.7106 -10.7106 -10.6008 -10.6008 -10.5940 -10.5940 -10.5490 -10.5490 -10.5084 -10.5084 -10.4802 -10.4802 -10.4395 -10.4395 -10.4226 -10.4226 -10.3995 -10.3995 -10.3767 -10.3767 -10.3380 -10.3380 -10.1777 -10.1777 -10.1563 -10.1563 -10.0894 -10.0894 -10.0791 -10.0791 -4.5083 -4.5083 -4.4065 -4.4065 2.7367 2.7367 3.3397 3.3397 3.5921 3.5921 3.5967 3.5967 3.7523 3.7523 3.7551 3.7551 4.2922 4.2922 6.4562 6.4562 6.4789 6.4789 7.0615 7.0615 7.2801 7.2801 7.3173 7.3173 k = 0.1094 0.0631-0.0000 ( 8833 PWs) bands (ev): -27.0870 -27.0870 -27.0537 -27.0537 -27.0527 -27.0527 -27.0194 -27.0194 -26.7118 -26.7118 -26.7116 -26.7116 -10.8430 -10.8430 -10.8153 -10.8153 -10.7767 -10.7767 -10.7128 -10.7128 -10.6010 -10.6010 -10.5924 -10.5924 -10.5512 -10.5512 -10.5106 -10.5106 -10.4808 -10.4808 -10.4389 -10.4389 -10.4219 -10.4219 -10.3983 -10.3983 -10.3745 -10.3745 -10.3373 -10.3373 -10.1768 -10.1768 -10.1570 -10.1570 -10.0891 -10.0891 -10.0799 -10.0799 -4.5043 -4.5043 -4.4043 -4.4043 2.7490 2.7490 3.2947 3.2947 3.5727 3.5727 3.5935 3.5935 3.7492 3.7492 3.7552 3.7552 4.3682 4.3682 6.4164 6.4164 6.5162 6.5162 7.0682 7.0682 7.2522 7.2522 7.3226 7.3226 k = 0.1250 0.0722-0.0000 ( 8833 PWs) bands (ev): -27.0867 -27.0867 -27.0540 -27.0540 -27.0524 -27.0524 -27.0196 -27.0196 -26.7118 -26.7118 -26.7116 -26.7116 -10.8431 -10.8431 -10.8154 -10.8154 -10.7778 -10.7778 -10.7152 -10.7152 -10.6013 -10.6013 -10.5905 -10.5905 -10.5536 -10.5536 -10.5128 -10.5128 -10.4813 -10.4813 -10.4386 -10.4386 -10.4212 -10.4212 -10.3968 -10.3968 -10.3722 -10.3722 -10.3366 -10.3366 -10.1758 -10.1758 -10.1578 -10.1578 -10.0887 -10.0887 -10.0807 -10.0807 -4.4997 -4.4997 -4.4018 -4.4018 2.7630 2.7630 3.2500 3.2500 3.5467 3.5467 3.5948 3.5948 3.7476 3.7476 3.7555 3.7555 4.4463 4.4463 6.3608 6.3608 6.5753 6.5753 7.0757 7.0757 7.1859 7.1859 7.3579 7.3579 k = 0.1406 0.0812-0.0000 ( 8827 PWs) bands (ev): -27.0864 -27.0864 -27.0542 -27.0542 -27.0521 -27.0521 -27.0199 -27.0199 -26.7119 -26.7119 -26.7117 -26.7117 -10.8433 -10.8433 -10.8156 -10.8156 -10.7790 -10.7790 -10.7176 -10.7176 -10.6018 -10.6018 -10.5887 -10.5887 -10.5563 -10.5563 -10.5149 -10.5149 -10.4818 -10.4818 -10.4385 -10.4385 -10.4203 -10.4203 -10.3952 -10.3952 -10.3697 -10.3697 -10.3358 -10.3358 -10.1748 -10.1748 -10.1586 -10.1586 -10.0884 -10.0884 -10.0815 -10.0815 -4.4947 -4.4947 -4.3991 -4.3991 2.7788 2.7788 3.2064 3.2064 3.5176 3.5176 3.5973 3.5973 3.7473 3.7473 3.7558 3.7558 4.5258 4.5258 6.3057 6.3057 6.6386 6.6386 7.0840 7.0840 7.1198 7.1198 7.3842 7.3842 k = 0.1562 0.0902-0.0000 ( 8839 PWs) bands (ev): -27.0860 -27.0860 -27.0545 -27.0545 -27.0517 -27.0517 -27.0203 -27.0203 -26.7119 -26.7119 -26.7117 -26.7117 -10.8435 -10.8435 -10.8158 -10.8158 -10.7802 -10.7802 -10.7201 -10.7201 -10.6023 -10.6023 -10.5869 -10.5869 -10.5592 -10.5592 -10.5169 -10.5169 -10.4823 -10.4823 -10.4385 -10.4385 -10.4193 -10.4193 -10.3934 -10.3934 -10.3671 -10.3671 -10.3349 -10.3349 -10.1738 -10.1738 -10.1595 -10.1595 -10.0881 -10.0881 -10.0822 -10.0822 -4.4893 -4.4893 -4.3962 -4.3962 2.7961 2.7961 3.1645 3.1645 3.4862 3.4862 3.6006 3.6006 3.7481 3.7481 3.7562 3.7562 4.6063 4.6063 6.2516 6.2516 6.7033 6.7033 7.0561 7.0561 7.0931 7.0931 7.4002 7.4002 k = 0.1719 0.0992-0.0000 ( 8831 PWs) bands (ev): -27.0855 -27.0855 -27.0548 -27.0548 -27.0514 -27.0514 -27.0206 -27.0206 -26.7120 -26.7120 -26.7118 -26.7118 -10.8436 -10.8436 -10.8162 -10.8162 -10.7815 -10.7815 -10.7226 -10.7226 -10.6030 -10.6030 -10.5853 -10.5853 -10.5622 -10.5622 -10.5186 -10.5186 -10.4828 -10.4828 -10.4387 -10.4387 -10.4182 -10.4182 -10.3916 -10.3916 -10.3644 -10.3644 -10.3340 -10.3340 -10.1727 -10.1727 -10.1603 -10.1603 -10.0880 -10.0880 -10.0829 -10.0829 -4.4835 -4.4835 -4.3931 -4.3931 2.8150 2.8150 3.1246 3.1246 3.4533 3.4533 3.6045 3.6045 3.7497 3.7497 3.7566 3.7566 4.6873 4.6873 6.1988 6.1988 6.7631 6.7631 7.0011 7.0011 7.1028 7.1028 7.4057 7.4057 k = 0.1875 0.1083-0.0000 ( 8827 PWs) bands (ev): -27.0850 -27.0850 -27.0551 -27.0551 -27.0509 -27.0509 -27.0210 -27.0210 -26.7121 -26.7121 -26.7118 -26.7118 -10.8438 -10.8438 -10.8166 -10.8166 -10.7829 -10.7829 -10.7251 -10.7251 -10.6037 -10.6037 -10.5841 -10.5841 -10.5649 -10.5649 -10.5202 -10.5202 -10.4834 -10.4834 -10.4389 -10.4389 -10.4169 -10.4169 -10.3898 -10.3898 -10.3617 -10.3617 -10.3330 -10.3330 -10.1718 -10.1718 -10.1610 -10.1610 -10.0880 -10.0880 -10.0834 -10.0834 -4.4773 -4.4773 -4.3899 -4.3899 2.8354 2.8354 3.0870 3.0870 3.4193 3.4193 3.6087 3.6087 3.7519 3.7519 3.7571 3.7571 4.7684 4.7684 6.1473 6.1473 6.7981 6.7981 6.9741 6.9741 7.1129 7.1129 7.4016 7.4016 k = 0.2031 0.1173-0.0000 ( 8837 PWs) bands (ev): -27.0845 -27.0845 -27.0555 -27.0555 -27.0505 -27.0505 -27.0215 -27.0215 -26.7122 -26.7122 -26.7119 -26.7119 -10.8439 -10.8439 -10.8172 -10.8172 -10.7842 -10.7842 -10.7274 -10.7274 -10.6044 -10.6044 -10.5837 -10.5837 -10.5671 -10.5671 -10.5217 -10.5217 -10.4841 -10.4841 -10.4392 -10.4392 -10.4155 -10.4155 -10.3881 -10.3881 -10.3590 -10.3590 -10.3321 -10.3321 -10.1709 -10.1709 -10.1617 -10.1617 -10.0882 -10.0882 -10.0837 -10.0837 -4.4709 -4.4709 -4.3865 -4.3865 2.8571 2.8571 3.0519 3.0519 3.3848 3.3848 3.6131 3.6131 3.7544 3.7544 3.7578 3.7578 4.8489 4.8489 6.0974 6.0974 6.7810 6.7810 7.0019 7.0019 7.1235 7.1235 7.3890 7.3890 k = 0.2188 0.1263-0.0000 ( 8843 PWs) bands (ev): -27.0840 -27.0840 -27.0559 -27.0559 -27.0500 -27.0500 -27.0219 -27.0219 -26.7122 -26.7122 -26.7120 -26.7120 -10.8441 -10.8441 -10.8179 -10.8179 -10.7856 -10.7856 -10.7297 -10.7297 -10.6052 -10.6052 -10.5842 -10.5842 -10.5684 -10.5684 -10.5230 -10.5230 -10.4850 -10.4850 -10.4393 -10.4393 -10.4139 -10.4139 -10.3864 -10.3864 -10.3563 -10.3563 -10.3311 -10.3311 -10.1702 -10.1702 -10.1621 -10.1621 -10.0886 -10.0886 -10.0838 -10.0838 -4.4643 -4.4643 -4.3831 -4.3831 2.8799 2.8799 3.0192 3.0192 3.3503 3.3503 3.6176 3.6176 3.7565 3.7565 3.7592 3.7592 4.9285 4.9285 6.0490 6.0490 6.7327 6.7327 7.0633 7.0633 7.1345 7.1345 7.3698 7.3698 k = 0.2344 0.1353-0.0000 ( 8837 PWs) bands (ev): -27.0834 -27.0834 -27.0563 -27.0563 -27.0496 -27.0496 -27.0224 -27.0224 -26.7123 -26.7123 -26.7120 -26.7120 -10.8442 -10.8442 -10.8187 -10.8187 -10.7869 -10.7869 -10.7318 -10.7318 -10.6061 -10.6061 -10.5859 -10.5859 -10.5687 -10.5687 -10.5242 -10.5242 -10.4860 -10.4860 -10.4395 -10.4395 -10.4121 -10.4121 -10.3847 -10.3847 -10.3537 -10.3537 -10.3302 -10.3302 -10.1698 -10.1698 -10.1624 -10.1624 -10.0892 -10.0892 -10.0838 -10.0838 -4.4575 -4.4575 -4.3797 -4.3797 2.9038 2.9038 2.9891 2.9891 3.3161 3.3161 3.6220 3.6220 3.7574 3.7574 3.7621 3.7621 5.0066 5.0066 6.0024 6.0024 6.6764 6.6764 7.1336 7.1336 7.1459 7.1459 7.3454 7.3454 k = 0.2500 0.1443-0.0000 ( 8847 PWs) bands (ev): -27.0828 -27.0828 -27.0567 -27.0567 -27.0491 -27.0491 -27.0229 -27.0229 -26.7124 -26.7124 -26.7121 -26.7121 -10.8443 -10.8443 -10.8196 -10.8196 -10.7882 -10.7882 -10.7338 -10.7338 -10.6069 -10.6069 -10.5884 -10.5884 -10.5683 -10.5683 -10.5254 -10.5254 -10.4872 -10.4872 -10.4395 -10.4395 -10.4102 -10.4102 -10.3831 -10.3831 -10.3512 -10.3512 -10.3293 -10.3293 -10.1696 -10.1696 -10.1623 -10.1623 -10.0898 -10.0898 -10.0837 -10.0837 -4.4506 -4.4506 -4.3763 -4.3763 2.9285 2.9285 2.9617 2.9617 3.2827 3.2827 3.6263 3.6263 3.7579 3.7579 3.7656 3.7656 5.0828 5.0828 5.9576 5.9576 6.6196 6.6196 7.1567 7.1567 7.2051 7.2051 7.3179 7.3179 k = 0.2656 0.1534-0.0000 ( 8855 PWs) bands (ev): -27.0823 -27.0823 -27.0572 -27.0572 -27.0486 -27.0486 -27.0234 -27.0234 -26.7125 -26.7125 -26.7122 -26.7122 -10.8444 -10.8444 -10.8207 -10.8207 -10.7894 -10.7894 -10.7357 -10.7357 -10.6079 -10.6079 -10.5912 -10.5912 -10.5674 -10.5674 -10.5264 -10.5264 -10.4884 -10.4884 -10.4395 -10.4395 -10.4081 -10.4081 -10.3816 -10.3816 -10.3488 -10.3488 -10.3285 -10.3285 -10.1696 -10.1696 -10.1621 -10.1621 -10.0904 -10.0904 -10.0835 -10.0835 -4.4437 -4.4437 -4.3730 -4.3730 2.9366 2.9366 2.9540 2.9540 3.2504 3.2504 3.6301 3.6301 3.7582 3.7582 3.7692 3.7692 5.1563 5.1563 5.9145 5.9145 6.5647 6.5647 7.1680 7.1680 7.2622 7.2622 7.2984 7.2984 k = 0.2812 0.1624-0.0000 ( 8851 PWs) bands (ev): -27.0816 -27.0816 -27.0577 -27.0577 -27.0480 -27.0480 -27.0240 -27.0240 -26.7126 -26.7126 -26.7122 -26.7122 -10.8445 -10.8445 -10.8219 -10.8219 -10.7906 -10.7906 -10.7374 -10.7374 -10.6088 -10.6088 -10.5942 -10.5942 -10.5663 -10.5663 -10.5275 -10.5275 -10.4898 -10.4898 -10.4395 -10.4395 -10.4059 -10.4059 -10.3802 -10.3802 -10.3466 -10.3466 -10.3278 -10.3278 -10.1697 -10.1697 -10.1617 -10.1617 -10.0910 -10.0910 -10.0833 -10.0833 -4.4368 -4.4368 -4.3698 -4.3698 2.9145 2.9145 2.9792 2.9792 3.2196 3.2196 3.6335 3.6335 3.7585 3.7585 3.7730 3.7730 5.2267 5.2267 5.8734 5.8734 6.5133 6.5133 7.1792 7.1792 7.2465 7.2465 7.3419 7.3419 k = 0.2969 0.1714-0.0000 ( 8853 PWs) bands (ev): -27.0810 -27.0810 -27.0581 -27.0581 -27.0474 -27.0474 -27.0245 -27.0245 -26.7126 -26.7126 -26.7123 -26.7123 -10.8445 -10.8445 -10.8232 -10.8232 -10.7916 -10.7916 -10.7389 -10.7389 -10.6097 -10.6097 -10.5972 -10.5972 -10.5652 -10.5652 -10.5284 -10.5284 -10.4913 -10.4913 -10.4393 -10.4393 -10.4036 -10.4036 -10.3789 -10.3789 -10.3446 -10.3446 -10.3272 -10.3272 -10.1699 -10.1699 -10.1612 -10.1612 -10.0915 -10.0915 -10.0832 -10.0832 -4.4300 -4.4300 -4.3667 -4.3667 2.8949 2.8949 3.0039 3.0039 3.1911 3.1911 3.6362 3.6362 3.7589 3.7589 3.7767 3.7767 5.2931 5.2931 5.8344 5.8344 6.4664 6.4664 7.1901 7.1901 7.2138 7.2138 7.3789 7.3789 k = 0.3125 0.1804-0.0000 ( 8851 PWs) bands (ev): -27.0804 -27.0804 -27.0586 -27.0586 -27.0469 -27.0469 -27.0251 -27.0251 -26.7127 -26.7127 -26.7124 -26.7124 -10.8445 -10.8445 -10.8246 -10.8246 -10.7926 -10.7926 -10.7403 -10.7403 -10.6107 -10.6107 -10.6000 -10.6000 -10.5641 -10.5641 -10.5294 -10.5294 -10.4928 -10.4928 -10.4392 -10.4392 -10.4011 -10.4011 -10.3777 -10.3777 -10.3427 -10.3427 -10.3267 -10.3267 -10.1700 -10.1700 -10.1608 -10.1608 -10.0919 -10.0919 -10.0831 -10.0831 -4.4233 -4.4233 -4.3638 -4.3638 2.8777 2.8777 3.0265 3.0265 3.1663 3.1663 3.6381 3.6381 3.7593 3.7593 3.7803 3.7803 5.3548 5.3548 5.7974 5.7974 6.4247 6.4247 7.1799 7.1799 7.2009 7.2009 7.3736 7.3736 k = 0.3281 0.1894-0.0000 ( 8853 PWs) bands (ev): -27.0797 -27.0797 -27.0591 -27.0591 -27.0463 -27.0463 -27.0257 -27.0257 -26.7128 -26.7128 -26.7124 -26.7124 -10.8445 -10.8445 -10.8261 -10.8261 -10.7935 -10.7935 -10.7415 -10.7415 -10.6118 -10.6118 -10.6025 -10.6025 -10.5630 -10.5630 -10.5302 -10.5302 -10.4944 -10.4944 -10.4390 -10.4390 -10.3986 -10.3986 -10.3765 -10.3765 -10.3410 -10.3410 -10.3263 -10.3263 -10.1701 -10.1701 -10.1605 -10.1605 -10.0922 -10.0922 -10.0831 -10.0831 -4.4168 -4.4168 -4.3610 -4.3610 2.8631 2.8631 3.0436 3.0436 3.1485 3.1485 3.6390 3.6390 3.7599 3.7599 3.7838 3.7838 5.4112 5.4112 5.7626 5.7626 6.3891 6.3891 7.1465 7.1465 7.2110 7.2110 7.3419 7.3419 k = 0.3438 0.1985-0.0000 ( 8861 PWs) bands (ev): -27.0791 -27.0791 -27.0596 -27.0596 -27.0457 -27.0457 -27.0262 -27.0262 -26.7128 -26.7128 -26.7125 -26.7125 -10.8444 -10.8444 -10.8275 -10.8275 -10.7944 -10.7944 -10.7426 -10.7426 -10.6129 -10.6129 -10.6048 -10.6048 -10.5621 -10.5621 -10.5310 -10.5310 -10.4960 -10.4960 -10.4388 -10.4388 -10.3961 -10.3961 -10.3755 -10.3755 -10.3395 -10.3395 -10.3260 -10.3260 -10.1700 -10.1700 -10.1602 -10.1602 -10.0924 -10.0924 -10.0831 -10.0831 -4.4105 -4.4105 -4.3586 -4.3586 2.8508 2.8508 3.0489 3.0489 3.1438 3.1438 3.6389 3.6389 3.7606 3.7606 3.7871 3.7871 5.4614 5.4614 5.7301 5.7301 6.3602 6.3602 7.1141 7.1141 7.2207 7.2207 7.3017 7.3017 k = 0.3594 0.2075-0.0000 ( 8852 PWs) bands (ev): -27.0785 -27.0785 -27.0602 -27.0602 -27.0451 -27.0451 -27.0268 -27.0268 -26.7129 -26.7129 -26.7126 -26.7126 -10.8442 -10.8442 -10.8290 -10.8290 -10.7951 -10.7951 -10.7436 -10.7436 -10.6140 -10.6140 -10.6067 -10.6067 -10.5612 -10.5612 -10.5316 -10.5316 -10.4976 -10.4976 -10.4385 -10.4385 -10.3936 -10.3936 -10.3746 -10.3746 -10.3382 -10.3382 -10.3258 -10.3258 -10.1699 -10.1699 -10.1601 -10.1601 -10.0925 -10.0925 -10.0832 -10.0832 -4.4046 -4.4046 -4.3564 -4.3564 2.8408 2.8408 3.0404 3.0404 3.1540 3.1540 3.6376 3.6376 3.7615 3.7615 3.7901 3.7901 5.5047 5.5047 5.7001 5.7001 6.3386 6.3386 7.0834 7.0834 7.2297 7.2297 7.2585 7.2585 k = 0.3750 0.2165-0.0000 ( 8854 PWs) bands (ev): -27.0779 -27.0779 -27.0606 -27.0606 -27.0446 -27.0446 -27.0274 -27.0274 -26.7129 -26.7129 -26.7126 -26.7126 -10.8441 -10.8441 -10.8305 -10.8305 -10.7958 -10.7958 -10.7444 -10.7444 -10.6152 -10.6152 -10.6083 -10.6083 -10.5605 -10.5605 -10.5322 -10.5322 -10.4992 -10.4992 -10.4383 -10.4383 -10.3911 -10.3911 -10.3739 -10.3739 -10.3370 -10.3370 -10.3257 -10.3257 -10.1696 -10.1696 -10.1601 -10.1601 -10.0926 -10.0926 -10.0832 -10.0832 -4.3990 -4.3990 -4.3544 -4.3544 2.8330 2.8330 3.0243 3.0243 3.1727 3.1727 3.6353 3.6353 3.7625 3.7625 3.7930 3.7930 5.5409 5.5409 5.6728 5.6728 6.3246 6.3246 7.0549 7.0549 7.2137 7.2137 7.2385 7.2385 k = 0.3906 0.2255-0.0000 ( 8864 PWs) bands (ev): -27.0773 -27.0773 -27.0611 -27.0611 -27.0440 -27.0440 -27.0279 -27.0279 -26.7130 -26.7130 -26.7127 -26.7127 -10.8439 -10.8439 -10.8319 -10.8319 -10.7964 -10.7964 -10.7451 -10.7451 -10.6164 -10.6164 -10.6096 -10.6096 -10.5599 -10.5599 -10.5326 -10.5326 -10.5007 -10.5007 -10.4381 -10.4381 -10.3886 -10.3886 -10.3733 -10.3733 -10.3360 -10.3360 -10.3258 -10.3258 -10.1692 -10.1692 -10.1602 -10.1602 -10.0925 -10.0925 -10.0834 -10.0834 -4.3938 -4.3938 -4.3528 -4.3528 2.8273 2.8273 3.0062 3.0062 3.1942 3.1942 3.6320 3.6320 3.7637 3.7637 3.7955 3.7955 5.5697 5.5697 5.6482 5.6482 6.3179 6.3179 7.0290 7.0290 7.1700 7.1700 7.2460 7.2460 k = 0.4062 0.2345-0.0000 ( 8864 PWs) bands (ev): -27.0767 -27.0767 -27.0616 -27.0616 -27.0435 -27.0435 -27.0284 -27.0284 -26.7131 -26.7131 -26.7127 -26.7127 -10.8436 -10.8436 -10.8333 -10.8333 -10.7970 -10.7970 -10.7457 -10.7457 -10.6176 -10.6176 -10.6106 -10.6106 -10.5594 -10.5594 -10.5329 -10.5329 -10.5021 -10.5021 -10.4378 -10.4378 -10.3863 -10.3863 -10.3728 -10.3728 -10.3352 -10.3352 -10.3259 -10.3259 -10.1687 -10.1687 -10.1605 -10.1605 -10.0925 -10.0925 -10.0835 -10.0835 -4.3892 -4.3892 -4.3515 -4.3515 2.8234 2.8234 2.9882 2.9882 3.2158 3.2158 3.6278 3.6278 3.7649 3.7649 3.7977 3.7977 5.5914 5.5914 5.6267 5.6267 6.3177 6.3177 7.0059 7.0059 7.1276 7.1276 7.2527 7.2527 k = 0.4219 0.2436-0.0000 ( 8866 PWs) bands (ev): -27.0762 -27.0762 -27.0620 -27.0620 -27.0431 -27.0431 -27.0289 -27.0289 -26.7131 -26.7131 -26.7127 -26.7127 -10.8432 -10.8432 -10.8346 -10.8346 -10.7974 -10.7974 -10.7462 -10.7462 -10.6186 -10.6186 -10.6114 -10.6114 -10.5590 -10.5590 -10.5331 -10.5331 -10.5034 -10.5034 -10.4377 -10.4377 -10.3841 -10.3841 -10.3725 -10.3725 -10.3345 -10.3345 -10.3261 -10.3261 -10.1681 -10.1681 -10.1608 -10.1608 -10.0923 -10.0923 -10.0837 -10.0837 -4.3850 -4.3850 -4.3505 -4.3505 2.8212 2.8212 2.9714 2.9714 3.2363 3.2363 3.6230 3.6230 3.7661 3.7661 3.7996 3.7996 5.6028 5.6028 5.6126 5.6126 6.3228 6.3228 6.9860 6.9860 7.0880 7.0880 7.2585 7.2585 k = 0.4375 0.2526-0.0000 ( 8872 PWs) bands (ev): -27.0758 -27.0758 -27.0624 -27.0624 -27.0426 -27.0426 -27.0293 -27.0293 -26.7131 -26.7131 -26.7128 -26.7128 -10.8428 -10.8428 -10.8358 -10.8358 -10.7978 -10.7978 -10.7466 -10.7466 -10.6195 -10.6195 -10.6120 -10.6120 -10.5588 -10.5588 -10.5332 -10.5332 -10.5045 -10.5045 -10.4375 -10.4375 -10.3821 -10.3821 -10.3724 -10.3724 -10.3339 -10.3339 -10.3263 -10.3263 -10.1675 -10.1675 -10.1613 -10.1613 -10.0922 -10.0922 -10.0839 -10.0839 -4.3814 -4.3814 -4.3497 -4.3497 2.8204 2.8204 2.9566 2.9566 3.2545 3.2545 3.6181 3.6181 3.7672 3.7672 3.8012 3.8012 5.5908 5.5908 5.6198 5.6198 6.3314 6.3314 6.9694 6.9694 7.0525 7.0525 7.2634 7.2634 k = 0.4531 0.2616-0.0000 ( 8866 PWs) bands (ev): -27.0754 -27.0754 -27.0627 -27.0627 -27.0423 -27.0423 -27.0296 -27.0296 -26.7131 -26.7131 -26.7128 -26.7128 -10.8424 -10.8424 -10.8369 -10.8369 -10.7981 -10.7981 -10.7469 -10.7469 -10.6202 -10.6202 -10.6125 -10.6125 -10.5586 -10.5586 -10.5332 -10.5332 -10.5054 -10.5054 -10.4374 -10.4374 -10.3803 -10.3803 -10.3725 -10.3725 -10.3334 -10.3334 -10.3265 -10.3265 -10.1668 -10.1668 -10.1618 -10.1618 -10.0920 -10.0920 -10.0841 -10.0841 -4.3785 -4.3785 -4.3492 -4.3492 2.8205 2.8205 2.9441 2.9441 3.2699 3.2699 3.6135 3.6135 3.7682 3.7682 3.8024 3.8024 5.5789 5.5789 5.6265 5.6265 6.3414 6.3414 6.9565 6.9565 7.0225 7.0225 7.2672 7.2672 k = 0.4688 0.2706-0.0000 ( 8862 PWs) bands (ev): -27.0751 -27.0751 -27.0630 -27.0630 -27.0420 -27.0420 -27.0299 -27.0299 -26.7132 -26.7132 -26.7128 -26.7128 -10.8419 -10.8419 -10.8379 -10.8379 -10.7983 -10.7983 -10.7471 -10.7471 -10.6207 -10.6207 -10.6128 -10.6128 -10.5585 -10.5585 -10.5331 -10.5331 -10.5061 -10.5061 -10.4373 -10.4373 -10.3789 -10.3789 -10.3728 -10.3728 -10.3331 -10.3331 -10.3267 -10.3267 -10.1661 -10.1661 -10.1624 -10.1624 -10.0919 -10.0919 -10.0842 -10.0842 -4.3764 -4.3764 -4.3489 -4.3489 2.8212 2.8212 2.9347 2.9347 3.2815 3.2815 3.6097 3.6097 3.7690 3.7690 3.8033 3.8033 5.5702 5.5702 5.6306 5.6306 6.3506 6.3506 6.9472 6.9472 6.9995 6.9995 7.2700 7.2700 k = 0.4844 0.2797-0.0000 ( 8850 PWs) bands (ev): -27.0749 -27.0749 -27.0631 -27.0631 -27.0418 -27.0418 -27.0300 -27.0300 -26.7132 -26.7132 -26.7128 -26.7128 -10.8414 -10.8414 -10.8386 -10.8386 -10.7984 -10.7984 -10.7472 -10.7472 -10.6210 -10.6210 -10.6129 -10.6129 -10.5584 -10.5584 -10.5331 -10.5331 -10.5066 -10.5066 -10.4372 -10.4372 -10.3778 -10.3778 -10.3730 -10.3730 -10.3329 -10.3329 -10.3268 -10.3268 -10.1654 -10.1654 -10.1630 -10.1630 -10.0918 -10.0918 -10.0843 -10.0843 -4.3751 -4.3751 -4.3488 -4.3488 2.8219 2.8219 2.9287 2.9287 3.2887 3.2887 3.6071 3.6071 3.7694 3.7694 3.8038 3.8038 5.5649 5.5649 5.6327 5.6327 6.3570 6.3570 6.9416 6.9416 6.9850 6.9850 7.2716 7.2716 k = 0.5000 0.2887-0.0000 ( 8844 PWs) bands (ev): -27.0748 -27.0748 -27.0632 -27.0632 -27.0418 -27.0418 -27.0301 -27.0301 -26.7132 -26.7132 -26.7128 -26.7128 -10.8412 -10.8412 -10.8389 -10.8389 -10.7985 -10.7985 -10.7473 -10.7473 -10.6211 -10.6211 -10.6130 -10.6130 -10.5584 -10.5584 -10.5331 -10.5331 -10.5067 -10.5067 -10.4372 -10.4372 -10.3774 -10.3774 -10.3732 -10.3732 -10.3328 -10.3328 -10.3268 -10.3268 -10.1651 -10.1651 -10.1632 -10.1632 -10.0918 -10.0918 -10.0843 -10.0843 -4.3746 -4.3746 -4.3487 -4.3487 2.8222 2.8222 2.9266 2.9266 3.2912 3.2912 3.6062 3.6062 3.7696 3.7696 3.8040 3.8040 5.5631 5.5631 5.6334 5.6334 6.3593 6.3593 6.9398 6.9398 6.9800 6.9800 7.2722 7.2722 k = 0.5000 0.2887-0.0000 ( 8844 PWs) bands (ev): -27.0748 -27.0748 -27.0632 -27.0632 -27.0418 -27.0418 -27.0301 -27.0301 -26.7132 -26.7132 -26.7128 -26.7128 -10.8412 -10.8412 -10.8389 -10.8389 -10.7985 -10.7985 -10.7473 -10.7473 -10.6211 -10.6211 -10.6130 -10.6130 -10.5584 -10.5584 -10.5331 -10.5331 -10.5067 -10.5067 -10.4372 -10.4372 -10.3774 -10.3774 -10.3732 -10.3732 -10.3328 -10.3328 -10.3268 -10.3268 -10.1651 -10.1651 -10.1632 -10.1632 -10.0918 -10.0918 -10.0843 -10.0843 -4.3746 -4.3746 -4.3487 -4.3487 2.8222 2.8222 2.9266 2.9266 3.2912 3.2912 3.6062 3.6062 3.7696 3.7696 3.8040 3.8040 5.5631 5.5631 5.6334 5.6334 6.3593 6.3593 6.9398 6.9398 6.9800 6.9800 7.2722 7.2722 k = 0.4912 0.3039-0.0000 ( 8846 PWs) bands (ev): -27.0748 -27.0748 -27.0632 -27.0632 -27.0418 -27.0418 -27.0301 -27.0301 -26.7132 -26.7132 -26.7128 -26.7128 -10.8413 -10.8413 -10.8389 -10.8389 -10.7983 -10.7983 -10.7473 -10.7473 -10.6239 -10.6239 -10.6103 -10.6103 -10.5585 -10.5585 -10.5330 -10.5330 -10.5066 -10.5066 -10.4376 -10.4376 -10.3779 -10.3779 -10.3725 -10.3725 -10.3329 -10.3329 -10.3267 -10.3267 -10.1656 -10.1656 -10.1628 -10.1628 -10.0918 -10.0918 -10.0844 -10.0844 -4.3745 -4.3745 -4.3487 -4.3487 2.8232 2.8232 2.9277 2.9277 3.2919 3.2919 3.6057 3.6057 3.7676 3.7676 3.8015 3.8015 5.5640 5.5640 5.6342 5.6342 6.3628 6.3628 6.9379 6.9379 6.9816 6.9816 7.2654 7.2654 k = 0.4825 0.3191-0.0000 ( 8850 PWs) bands (ev): -27.0748 -27.0748 -27.0633 -27.0633 -27.0417 -27.0417 -27.0302 -27.0302 -26.7132 -26.7132 -26.7128 -26.7128 -10.8415 -10.8415 -10.8390 -10.8390 -10.7980 -10.7980 -10.7475 -10.7475 -10.6286 -10.6286 -10.6055 -10.6055 -10.5587 -10.5587 -10.5328 -10.5328 -10.5063 -10.5063 -10.4388 -10.4388 -10.3788 -10.3788 -10.3710 -10.3710 -10.3331 -10.3331 -10.3264 -10.3264 -10.1664 -10.1664 -10.1619 -10.1619 -10.0917 -10.0917 -10.0845 -10.0845 -4.3742 -4.3742 -4.3486 -4.3486 2.8264 2.8264 2.9310 2.9310 3.2941 3.2941 3.6040 3.6040 3.7617 3.7617 3.7942 3.7942 5.5665 5.5665 5.6365 5.6365 6.3734 6.3734 6.9324 6.9324 6.9865 6.9865 7.2456 7.2456 k = 0.4737 0.3343-0.0000 ( 8854 PWs) bands (ev): -27.0747 -27.0747 -27.0633 -27.0633 -27.0416 -27.0416 -27.0303 -27.0303 -26.7132 -26.7132 -26.7128 -26.7128 -10.8418 -10.8418 -10.8391 -10.8391 -10.7973 -10.7973 -10.7478 -10.7478 -10.6337 -10.6337 -10.6003 -10.6003 -10.5591 -10.5591 -10.5325 -10.5325 -10.5058 -10.5058 -10.4406 -10.4406 -10.3798 -10.3798 -10.3690 -10.3690 -10.3334 -10.3334 -10.3258 -10.3258 -10.1674 -10.1674 -10.1608 -10.1608 -10.0918 -10.0918 -10.0846 -10.0846 -4.3737 -4.3737 -4.3485 -4.3485 2.8316 2.8316 2.9365 2.9365 3.2977 3.2977 3.6011 3.6011 3.7522 3.7522 3.7821 3.7821 5.5708 5.5708 5.6403 5.6403 6.3909 6.3909 6.9234 6.9234 6.9945 6.9945 7.2148 7.2148 k = 0.4649 0.3494-0.0000 ( 8854 PWs) bands (ev): -27.0745 -27.0745 -27.0635 -27.0635 -27.0415 -27.0415 -27.0304 -27.0304 -26.7132 -26.7132 -26.7128 -26.7128 -10.8422 -10.8422 -10.8392 -10.8392 -10.7965 -10.7965 -10.7481 -10.7481 -10.6387 -10.6387 -10.5952 -10.5952 -10.5596 -10.5596 -10.5321 -10.5321 -10.5052 -10.5052 -10.4430 -10.4430 -10.3808 -10.3808 -10.3667 -10.3667 -10.3337 -10.3337 -10.3251 -10.3251 -10.1683 -10.1683 -10.1598 -10.1598 -10.0918 -10.0918 -10.0848 -10.0848 -4.3730 -4.3730 -4.3483 -4.3483 2.8388 2.8388 2.9441 2.9441 3.3027 3.3027 3.5968 3.5968 3.7395 3.7395 3.7655 3.7655 5.5766 5.5766 5.6453 5.6453 6.4147 6.4147 6.9113 6.9113 7.0054 7.0054 7.1753 7.1753 k = 0.4561 0.3646-0.0000 ( 8848 PWs) bands (ev): -27.0744 -27.0744 -27.0636 -27.0636 -27.0413 -27.0413 -27.0305 -27.0305 -26.7132 -26.7132 -26.7128 -26.7128 -10.8426 -10.8426 -10.8394 -10.8394 -10.7954 -10.7954 -10.7486 -10.7486 -10.6436 -10.6436 -10.5902 -10.5902 -10.5603 -10.5603 -10.5315 -10.5315 -10.5043 -10.5043 -10.4460 -10.4460 -10.3819 -10.3819 -10.3643 -10.3643 -10.3341 -10.3341 -10.3243 -10.3243 -10.1692 -10.1692 -10.1587 -10.1587 -10.0918 -10.0918 -10.0850 -10.0850 -4.3721 -4.3721 -4.3480 -4.3480 2.8480 2.8480 2.9539 2.9539 3.3090 3.3090 3.5908 3.5908 3.7242 3.7242 3.7450 3.7450 5.5840 5.5840 5.6513 5.6513 6.4445 6.4445 6.8964 6.8964 7.0189 7.0189 7.1296 7.1296 k = 0.4474 0.3798-0.0000 ( 8860 PWs) bands (ev): -27.0742 -27.0742 -27.0638 -27.0638 -27.0412 -27.0412 -27.0307 -27.0307 -26.7132 -26.7132 -26.7128 -26.7128 -10.8431 -10.8431 -10.8397 -10.8397 -10.7941 -10.7941 -10.7492 -10.7492 -10.6483 -10.6483 -10.5854 -10.5854 -10.5611 -10.5611 -10.5309 -10.5309 -10.5033 -10.5033 -10.4492 -10.4492 -10.3829 -10.3829 -10.3618 -10.3618 -10.3345 -10.3345 -10.3234 -10.3234 -10.1701 -10.1701 -10.1576 -10.1576 -10.0918 -10.0918 -10.0852 -10.0852 -4.3711 -4.3711 -4.3478 -4.3478 2.8592 2.8592 2.9657 2.9657 3.3167 3.3167 3.5827 3.5827 3.7073 3.7073 3.7208 3.7208 5.5927 5.5927 5.6578 5.6578 6.4796 6.4796 6.8793 6.8793 7.0347 7.0347 7.0799 7.0799 k = 0.4386 0.3950-0.0000 ( 8856 PWs) bands (ev): -27.0739 -27.0739 -27.0640 -27.0640 -27.0409 -27.0409 -27.0310 -27.0310 -26.7132 -26.7132 -26.7128 -26.7128 -10.8436 -10.8436 -10.8400 -10.8400 -10.7927 -10.7927 -10.7500 -10.7500 -10.6527 -10.6527 -10.5808 -10.5808 -10.5619 -10.5619 -10.5301 -10.5301 -10.5021 -10.5021 -10.4527 -10.4527 -10.3840 -10.3840 -10.3593 -10.3593 -10.3348 -10.3348 -10.3225 -10.3225 -10.1710 -10.1710 -10.1565 -10.1565 -10.0920 -10.0920 -10.0854 -10.0854 -4.3699 -4.3699 -4.3475 -4.3475 2.8722 2.8722 2.9794 2.9794 3.3255 3.3255 3.5718 3.5718 3.6895 3.6895 3.6937 3.6937 5.6026 5.6026 5.6647 5.6647 6.5193 6.5193 6.8605 6.8605 7.0276 7.0276 7.0529 7.0529 k = 0.4298 0.4102-0.0000 ( 8847 PWs) bands (ev): -27.0737 -27.0737 -27.0642 -27.0642 -27.0407 -27.0407 -27.0312 -27.0312 -26.7132 -26.7132 -26.7128 -26.7128 -10.8441 -10.8441 -10.8403 -10.8403 -10.7911 -10.7911 -10.7508 -10.7508 -10.6569 -10.6569 -10.5764 -10.5764 -10.5628 -10.5628 -10.5293 -10.5293 -10.5008 -10.5008 -10.4564 -10.4564 -10.3851 -10.3851 -10.3568 -10.3568 -10.3351 -10.3351 -10.3215 -10.3215 -10.1718 -10.1718 -10.1554 -10.1554 -10.0921 -10.0921 -10.0856 -10.0856 -4.3685 -4.3685 -4.3472 -4.3472 2.8869 2.8869 2.9950 2.9950 3.3354 3.3354 3.5576 3.5576 3.6640 3.6640 3.6720 3.6720 5.6135 5.6135 5.6716 5.6716 6.5628 6.5628 6.8404 6.8404 6.9755 6.9755 7.0716 7.0716 k = 0.4211 0.4254-0.0000 ( 8853 PWs) bands (ev): -27.0734 -27.0734 -27.0645 -27.0645 -27.0404 -27.0404 -27.0315 -27.0315 -26.7133 -26.7133 -26.7128 -26.7128 -10.8445 -10.8445 -10.8407 -10.8407 -10.7895 -10.7895 -10.7518 -10.7518 -10.6608 -10.6608 -10.5724 -10.5724 -10.5637 -10.5637 -10.5284 -10.5284 -10.4994 -10.4994 -10.4601 -10.4601 -10.3863 -10.3863 -10.3545 -10.3545 -10.3354 -10.3354 -10.3205 -10.3205 -10.1726 -10.1726 -10.1544 -10.1544 -10.0923 -10.0923 -10.0858 -10.0858 -4.3670 -4.3670 -4.3470 -4.3470 2.9033 2.9033 3.0124 3.0124 3.3463 3.3463 3.5398 3.5398 3.6325 3.6325 3.6556 3.6556 5.6251 5.6251 5.6783 5.6783 6.6093 6.6093 6.8196 6.8196 6.9241 6.9241 7.0909 7.0909 k = 0.4123 0.4406-0.0000 ( 8867 PWs) bands (ev): -27.0730 -27.0730 -27.0648 -27.0648 -27.0401 -27.0401 -27.0318 -27.0318 -26.7133 -26.7133 -26.7129 -26.7129 -10.8450 -10.8450 -10.8410 -10.8410 -10.7877 -10.7877 -10.7529 -10.7529 -10.6644 -10.6644 -10.5689 -10.5689 -10.5646 -10.5646 -10.5274 -10.5274 -10.4979 -10.4979 -10.4638 -10.4638 -10.3875 -10.3875 -10.3523 -10.3523 -10.3356 -10.3356 -10.3196 -10.3196 -10.1733 -10.1733 -10.1534 -10.1534 -10.0926 -10.0926 -10.0859 -10.0859 -4.3654 -4.3654 -4.3467 -4.3467 2.9210 2.9210 3.0314 3.0314 3.3578 3.3578 3.5183 3.5183 3.6000 3.6000 3.6407 3.6407 5.6372 5.6372 5.6845 5.6845 6.6578 6.6578 6.7987 6.7987 6.8746 6.8746 7.1099 7.1099 k = 0.4035 0.4558-0.0000 ( 8863 PWs) bands (ev): -27.0727 -27.0727 -27.0652 -27.0652 -27.0397 -27.0397 -27.0322 -27.0322 -26.7133 -26.7133 -26.7129 -26.7129 -10.8455 -10.8455 -10.8414 -10.8414 -10.7859 -10.7859 -10.7541 -10.7541 -10.6676 -10.6676 -10.5666 -10.5666 -10.5644 -10.5644 -10.5264 -10.5264 -10.4964 -10.4964 -10.4672 -10.4672 -10.3887 -10.3887 -10.3503 -10.3503 -10.3356 -10.3356 -10.3186 -10.3186 -10.1740 -10.1740 -10.1525 -10.1525 -10.0929 -10.0929 -10.0860 -10.0860 -4.3638 -4.3638 -4.3466 -4.3466 2.9401 2.9401 3.0518 3.0518 3.3697 3.3697 3.4939 3.4939 3.5671 3.5671 3.6270 3.6270 5.6494 5.6494 5.6901 5.6901 6.7068 6.7068 6.7787 6.7787 6.8283 6.8283 7.1274 7.1274 k = 0.3947 0.4710-0.0000 ( 8859 PWs) bands (ev): -27.0723 -27.0723 -27.0655 -27.0655 -27.0393 -27.0393 -27.0326 -27.0326 -26.7133 -26.7133 -26.7129 -26.7129 -10.8459 -10.8459 -10.8418 -10.8418 -10.7841 -10.7841 -10.7553 -10.7553 -10.6705 -10.6705 -10.5669 -10.5669 -10.5620 -10.5620 -10.5253 -10.5253 -10.4952 -10.4952 -10.4703 -10.4703 -10.3898 -10.3898 -10.3487 -10.3487 -10.3356 -10.3356 -10.3177 -10.3177 -10.1746 -10.1746 -10.1516 -10.1516 -10.0933 -10.0933 -10.0860 -10.0860 -4.3620 -4.3620 -4.3465 -4.3465 2.9600 2.9600 3.0736 3.0736 3.3810 3.3810 3.4676 3.4676 3.5351 3.5351 3.6142 3.6142 5.6613 5.6613 5.6951 5.6951 6.7446 6.7446 6.7700 6.7700 6.7868 6.7868 7.1423 7.1423 k = 0.3860 0.4862-0.0000 ( 8855 PWs) bands (ev): -27.0718 -27.0718 -27.0659 -27.0659 -27.0389 -27.0389 -27.0330 -27.0330 -26.7133 -26.7133 -26.7129 -26.7129 -10.8463 -10.8463 -10.8421 -10.8421 -10.7823 -10.7823 -10.7566 -10.7566 -10.6730 -10.6730 -10.5677 -10.5677 -10.5595 -10.5595 -10.5243 -10.5243 -10.4942 -10.4942 -10.4730 -10.4730 -10.3909 -10.3909 -10.3473 -10.3473 -10.3354 -10.3354 -10.3170 -10.3170 -10.1751 -10.1751 -10.1508 -10.1508 -10.0937 -10.0937 -10.0860 -10.0860 -4.3603 -4.3603 -4.3465 -4.3465 2.9805 2.9805 3.0966 3.0966 3.3892 3.3892 3.4417 3.4417 3.5057 3.5057 3.6018 3.6018 5.6725 5.6725 5.6992 5.6992 6.7338 6.7338 6.7476 6.7476 6.8132 6.8132 7.1532 7.1532 k = 0.3772 0.5014-0.0000 ( 8863 PWs) bands (ev): -27.0714 -27.0714 -27.0664 -27.0664 -27.0385 -27.0385 -27.0334 -27.0334 -26.7134 -26.7134 -26.7129 -26.7129 -10.8466 -10.8466 -10.8424 -10.8424 -10.7805 -10.7805 -10.7580 -10.7580 -10.6751 -10.6751 -10.5684 -10.5684 -10.5574 -10.5574 -10.5232 -10.5232 -10.4937 -10.4937 -10.4750 -10.4750 -10.3920 -10.3920 -10.3463 -10.3463 -10.3352 -10.3352 -10.3163 -10.3163 -10.1756 -10.1756 -10.1501 -10.1501 -10.0940 -10.0940 -10.0860 -10.0860 -4.3585 -4.3585 -4.3467 -4.3467 3.0010 3.0010 3.1204 3.1204 3.3854 3.3854 3.4232 3.4232 3.4822 3.4822 3.5893 3.5893 5.6826 5.6826 5.7026 5.7026 6.7137 6.7137 6.7184 6.7184 6.8613 6.8613 7.1590 7.1590 k = 0.3684 0.5166-0.0000 ( 8859 PWs) bands (ev): -27.0709 -27.0709 -27.0668 -27.0668 -27.0380 -27.0380 -27.0338 -27.0338 -26.7134 -26.7134 -26.7129 -26.7129 -10.8469 -10.8469 -10.8427 -10.8427 -10.7788 -10.7788 -10.7594 -10.7594 -10.6768 -10.6768 -10.5691 -10.5691 -10.5556 -10.5556 -10.5222 -10.5222 -10.4938 -10.4938 -10.4762 -10.4762 -10.3929 -10.3929 -10.3455 -10.3455 -10.3348 -10.3348 -10.3157 -10.3157 -10.1760 -10.1760 -10.1495 -10.1495 -10.0943 -10.0943 -10.0859 -10.0859 -4.3568 -4.3568 -4.3470 -4.3470 3.0207 3.0207 3.1450 3.1450 3.3634 3.3634 3.4130 3.4130 3.4714 3.4714 3.5764 3.5764 5.6912 5.6912 5.7052 5.7052 6.6889 6.6889 6.7010 6.7010 6.9084 6.9084 7.1585 7.1585 k = 0.3596 0.5318-0.0000 ( 8859 PWs) bands (ev): -27.0704 -27.0704 -27.0673 -27.0673 -27.0375 -27.0375 -27.0343 -27.0343 -26.7134 -26.7134 -26.7129 -26.7129 -10.8472 -10.8472 -10.8428 -10.8428 -10.7773 -10.7773 -10.7606 -10.7606 -10.6781 -10.6781 -10.5696 -10.5696 -10.5543 -10.5543 -10.5213 -10.5213 -10.4944 -10.4944 -10.4767 -10.4767 -10.3936 -10.3936 -10.3450 -10.3450 -10.3344 -10.3344 -10.3152 -10.3152 -10.1763 -10.1763 -10.1491 -10.1491 -10.0946 -10.0946 -10.0859 -10.0859 -4.3551 -4.3551 -4.3475 -4.3475 3.0387 3.0387 3.1700 3.1700 3.3348 3.3348 3.3992 3.3992 3.4754 3.4754 3.5630 3.5630 5.6981 5.6981 5.7071 5.7071 6.6699 6.6699 6.6864 6.6864 6.9531 6.9531 7.1510 7.1510 k = 0.3509 0.5470-0.0000 ( 8861 PWs) bands (ev): -27.0699 -27.0699 -27.0678 -27.0678 -27.0370 -27.0370 -27.0348 -27.0348 -26.7134 -26.7134 -26.7129 -26.7129 -10.8474 -10.8474 -10.8430 -10.8430 -10.7761 -10.7761 -10.7617 -10.7617 -10.6790 -10.6790 -10.5700 -10.5700 -10.5533 -10.5533 -10.5206 -10.5206 -10.4951 -10.4951 -10.4768 -10.4768 -10.3942 -10.3942 -10.3447 -10.3447 -10.3341 -10.3341 -10.3149 -10.3149 -10.1765 -10.1765 -10.1488 -10.1488 -10.0948 -10.0948 -10.0859 -10.0859 -4.3535 -4.3535 -4.3482 -4.3482 3.0534 3.0534 3.1952 3.1952 3.3055 3.3055 3.3849 3.3849 3.4870 3.4870 3.5488 3.5488 5.7030 5.7030 5.7082 5.7082 6.6579 6.6579 6.6740 6.6740 6.9944 6.9944 7.1363 7.1363 k = 0.3421 0.5622-0.0000 ( 8861 PWs) bands (ev): -27.0694 -27.0694 -27.0683 -27.0683 -27.0365 -27.0365 -27.0354 -27.0354 -26.7134 -26.7134 -26.7130 -26.7130 -10.8475 -10.8475 -10.8431 -10.8431 -10.7753 -10.7753 -10.7624 -10.7624 -10.6796 -10.6796 -10.5703 -10.5703 -10.5528 -10.5528 -10.5202 -10.5202 -10.4957 -10.4957 -10.4767 -10.4767 -10.3945 -10.3945 -10.3445 -10.3445 -10.3339 -10.3339 -10.3147 -10.3147 -10.1766 -10.1766 -10.1485 -10.1485 -10.0949 -10.0949 -10.0858 -10.0858 -4.3521 -4.3521 -4.3490 -4.3490 3.0633 3.0633 3.2198 3.2198 3.2778 3.2778 3.3748 3.3748 3.5016 3.5016 3.5337 3.5337 5.7060 5.7060 5.7087 5.7087 6.6531 6.6531 6.6640 6.6640 7.0302 7.0302 7.1162 7.1162 k = 0.3333 0.5774-0.0000 ( 8865 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7134 -26.7134 -26.7130 -26.7130 -10.8476 -10.8476 -10.8431 -10.8431 -10.7750 -10.7750 -10.7627 -10.7627 -10.6798 -10.6798 -10.5703 -10.5703 -10.5526 -10.5526 -10.5201 -10.5201 -10.4959 -10.4959 -10.4766 -10.4766 -10.3946 -10.3946 -10.3445 -10.3445 -10.3338 -10.3338 -10.3146 -10.3146 -10.1766 -10.1766 -10.1485 -10.1485 -10.0949 -10.0949 -10.0858 -10.0858 -4.3514 -4.3514 -4.3495 -4.3495 3.0668 3.0668 3.2365 3.2365 3.2600 3.2600 3.3712 3.3712 3.5158 3.5158 3.5196 3.5196 5.7071 5.7071 5.7087 5.7087 6.6542 6.6542 6.6580 6.6580 7.0494 7.0494 7.1020 7.1020 k = 0.3333 0.5774-0.0000 ( 8865 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7134 -26.7134 -26.7130 -26.7130 -10.8476 -10.8476 -10.8431 -10.8431 -10.7750 -10.7750 -10.7627 -10.7627 -10.6798 -10.6798 -10.5703 -10.5703 -10.5526 -10.5526 -10.5201 -10.5201 -10.4959 -10.4959 -10.4766 -10.4766 -10.3946 -10.3946 -10.3445 -10.3445 -10.3338 -10.3338 -10.3146 -10.3146 -10.1766 -10.1766 -10.1485 -10.1485 -10.0949 -10.0949 -10.0858 -10.0858 -4.3514 -4.3514 -4.3495 -4.3495 3.0668 3.0668 3.2365 3.2365 3.2600 3.2600 3.3712 3.3712 3.5158 3.5158 3.5196 3.5196 5.7071 5.7071 5.7087 5.7087 6.6542 6.6542 6.6580 6.6580 7.0494 7.0494 7.1020 7.1020 k = 0.3243 0.5617-0.0000 ( 8861 PWs) bands (ev): -27.0694 -27.0694 -27.0683 -27.0683 -27.0365 -27.0365 -27.0353 -27.0353 -26.7134 -26.7134 -26.7130 -26.7130 -10.8475 -10.8475 -10.8431 -10.8431 -10.7753 -10.7753 -10.7624 -10.7624 -10.6796 -10.6796 -10.5703 -10.5703 -10.5528 -10.5528 -10.5202 -10.5202 -10.4956 -10.4956 -10.4767 -10.4767 -10.3945 -10.3945 -10.3445 -10.3445 -10.3339 -10.3339 -10.3147 -10.3147 -10.1766 -10.1766 -10.1486 -10.1486 -10.0949 -10.0949 -10.0858 -10.0858 -4.3522 -4.3522 -4.3489 -4.3489 3.0631 3.0631 3.2203 3.2203 3.2776 3.2776 3.3749 3.3749 3.5005 3.5005 3.5348 3.5348 5.7061 5.7061 5.7087 5.7087 6.6509 6.6509 6.6664 6.6664 7.0281 7.0281 7.1184 7.1184 k = 0.3153 0.5461-0.0000 ( 8869 PWs) bands (ev): -27.0700 -27.0700 -27.0677 -27.0677 -27.0371 -27.0371 -27.0348 -27.0348 -26.7134 -26.7134 -26.7130 -26.7130 -10.8474 -10.8474 -10.8430 -10.8430 -10.7761 -10.7761 -10.7617 -10.7617 -10.6790 -10.6790 -10.5700 -10.5700 -10.5533 -10.5533 -10.5206 -10.5206 -10.4949 -10.4949 -10.4770 -10.4770 -10.3942 -10.3942 -10.3447 -10.3447 -10.3342 -10.3342 -10.3149 -10.3149 -10.1765 -10.1765 -10.1488 -10.1488 -10.0948 -10.0948 -10.0859 -10.0859 -4.3539 -4.3539 -4.3479 -4.3479 3.0528 3.0528 3.1987 3.1987 3.3031 3.3031 3.3851 3.3851 3.4830 3.4830 3.5519 3.5519 5.7038 5.7038 5.7084 5.7084 6.6491 6.6491 6.6832 6.6832 6.9870 6.9870 7.1454 7.1454 k = 0.3063 0.5305-0.0000 ( 8863 PWs) bands (ev): -27.0707 -27.0707 -27.0671 -27.0671 -27.0377 -27.0377 -27.0341 -27.0341 -26.7134 -26.7134 -26.7129 -26.7129 -10.8472 -10.8472 -10.8428 -10.8428 -10.7772 -10.7772 -10.7607 -10.7607 -10.6781 -10.6781 -10.5696 -10.5696 -10.5541 -10.5541 -10.5210 -10.5210 -10.4939 -10.4939 -10.4776 -10.4776 -10.3936 -10.3936 -10.3449 -10.3449 -10.3347 -10.3347 -10.3152 -10.3152 -10.1763 -10.1763 -10.1491 -10.1491 -10.0946 -10.0946 -10.0859 -10.0859 -4.3560 -4.3560 -4.3471 -4.3471 3.0376 3.0376 3.1791 3.1791 3.3288 3.3288 3.3997 3.3997 3.4662 3.4662 3.5690 3.5690 5.7009 5.7010 5.7076 5.7076 6.6502 6.6502 6.7063 6.7063 6.9390 6.9390 7.1719 7.1719 k = 0.2973 0.5149-0.0000 ( 8857 PWs) bands (ev): -27.0713 -27.0713 -27.0665 -27.0665 -27.0383 -27.0383 -27.0335 -27.0335 -26.7134 -26.7134 -26.7129 -26.7129 -10.8469 -10.8469 -10.8425 -10.8425 -10.7784 -10.7784 -10.7595 -10.7595 -10.6768 -10.6768 -10.5690 -10.5690 -10.5552 -10.5552 -10.5215 -10.5215 -10.4926 -10.4926 -10.4782 -10.4782 -10.3930 -10.3930 -10.3452 -10.3452 -10.3353 -10.3353 -10.3156 -10.3156 -10.1760 -10.1760 -10.1495 -10.1495 -10.0943 -10.0943 -10.0859 -10.0859 -4.3585 -4.3585 -4.3465 -4.3465 3.0195 3.0195 3.1619 3.1619 3.3519 3.3519 3.4150 3.4150 3.4539 3.4539 3.5859 3.5859 5.6981 5.6981 5.7063 5.7063 6.6544 6.6544 6.7349 6.7349 6.8871 6.8871 7.1965 7.1965 k = 0.2883 0.4993-0.0000 ( 8875 PWs) bands (ev): -27.0720 -27.0720 -27.0658 -27.0658 -27.0390 -27.0390 -27.0329 -27.0329 -26.7134 -26.7134 -26.7129 -26.7129 -10.8466 -10.8466 -10.8421 -10.8421 -10.7798 -10.7798 -10.7582 -10.7582 -10.6752 -10.6752 -10.5683 -10.5683 -10.5566 -10.5566 -10.5219 -10.5219 -10.4914 -10.4914 -10.4789 -10.4789 -10.3922 -10.3922 -10.3457 -10.3457 -10.3361 -10.3361 -10.3161 -10.3161 -10.1757 -10.1757 -10.1501 -10.1501 -10.0941 -10.0941 -10.0860 -10.0860 -4.3614 -4.3614 -4.3461 -4.3461 3.0002 3.0002 3.1472 3.1472 3.3659 3.3659 3.4255 3.4255 3.4564 3.4564 3.6024 3.6024 5.6957 5.6957 5.7044 5.7044 6.6617 6.6617 6.7674 6.7674 6.8340 6.8340 7.2191 7.2191 k = 0.2793 0.4837-0.0000 ( 8879 PWs) bands (ev): -27.0727 -27.0727 -27.0652 -27.0652 -27.0397 -27.0397 -27.0322 -27.0322 -26.7133 -26.7133 -26.7129 -26.7129 -10.8462 -10.8462 -10.8416 -10.8416 -10.7811 -10.7811 -10.7570 -10.7570 -10.6733 -10.6733 -10.5675 -10.5675 -10.5580 -10.5580 -10.5223 -10.5223 -10.4904 -10.4904 -10.4793 -10.4793 -10.3915 -10.3915 -10.3464 -10.3464 -10.3370 -10.3370 -10.3168 -10.3168 -10.1754 -10.1754 -10.1507 -10.1507 -10.0937 -10.0937 -10.0860 -10.0860 -4.3646 -4.3646 -4.3460 -4.3460 2.9810 2.9810 3.1349 3.1349 3.3617 3.3617 3.4390 3.4390 3.4734 3.4734 3.6184 3.6184 5.6940 5.6940 5.7019 5.7019 6.6719 6.6719 6.7725 6.7725 6.8116 6.8116 7.2400 7.2400 k = 0.2703 0.4681-0.0000 ( 8895 PWs) bands (ev): -27.0734 -27.0734 -27.0646 -27.0646 -27.0403 -27.0403 -27.0316 -27.0316 -26.7133 -26.7133 -26.7129 -26.7129 -10.8459 -10.8459 -10.8409 -10.8409 -10.7824 -10.7824 -10.7557 -10.7557 -10.6711 -10.6711 -10.5667 -10.5667 -10.5596 -10.5596 -10.5224 -10.5224 -10.4901 -10.4901 -10.4792 -10.4792 -10.3907 -10.3907 -10.3474 -10.3474 -10.3380 -10.3380 -10.3174 -10.3174 -10.1750 -10.1750 -10.1514 -10.1514 -10.0934 -10.0934 -10.0860 -10.0860 -4.3682 -4.3682 -4.3461 -4.3461 2.9627 2.9627 3.1251 3.1251 3.3446 3.3446 3.4594 3.4594 3.4950 3.4950 3.6337 3.6337 5.6921 5.6921 5.6998 5.6998 6.6846 6.6846 6.7214 6.7214 6.8499 6.8499 7.2597 7.2597 k = 0.2613 0.4525-0.0000 ( 8871 PWs) bands (ev): -27.0740 -27.0740 -27.0640 -27.0640 -27.0410 -27.0410 -27.0309 -27.0309 -26.7133 -26.7133 -26.7128 -26.7128 -10.8456 -10.8456 -10.8400 -10.8400 -10.7836 -10.7836 -10.7543 -10.7543 -10.6685 -10.6685 -10.5658 -10.5658 -10.5612 -10.5612 -10.5224 -10.5224 -10.4905 -10.4905 -10.4784 -10.4784 -10.3900 -10.3900 -10.3487 -10.3487 -10.3388 -10.3388 -10.3181 -10.3181 -10.1747 -10.1747 -10.1521 -10.1521 -10.0931 -10.0931 -10.0860 -10.0860 -4.3721 -4.3721 -4.3466 -4.3466 2.9460 2.9460 3.1177 3.1177 3.3224 3.3224 3.4812 3.4812 3.5182 3.5182 3.6484 3.6484 5.6872 5.6872 5.7006 5.7006 6.6672 6.6672 6.7028 6.7028 6.8933 6.8933 7.2783 7.2783 k = 0.2523 0.4369-0.0000 ( 8869 PWs) bands (ev): -27.0747 -27.0747 -27.0634 -27.0634 -27.0416 -27.0416 -27.0303 -27.0303 -26.7132 -26.7132 -26.7128 -26.7128 -10.8454 -10.8454 -10.8389 -10.8389 -10.7847 -10.7847 -10.7530 -10.7530 -10.6657 -10.6657 -10.5651 -10.5651 -10.5628 -10.5628 -10.5222 -10.5222 -10.4915 -10.4915 -10.4769 -10.4769 -10.3895 -10.3895 -10.3503 -10.3503 -10.3396 -10.3396 -10.3188 -10.3188 -10.1743 -10.1743 -10.1529 -10.1529 -10.0927 -10.0927 -10.0860 -10.0860 -4.3765 -4.3765 -4.3473 -4.3473 2.9314 2.9314 3.1127 3.1127 3.2980 3.2980 3.5019 3.5019 3.5419 3.5419 3.6622 3.6622 5.6781 5.6781 5.7048 5.7048 6.6189 6.6189 6.7209 6.7209 6.9391 6.9391 7.2963 7.2963 k = 0.2432 0.4213-0.0000 ( 8871 PWs) bands (ev): -27.0754 -27.0754 -27.0628 -27.0628 -27.0423 -27.0423 -27.0296 -27.0296 -26.7132 -26.7132 -26.7128 -26.7128 -10.8452 -10.8452 -10.8377 -10.8377 -10.7857 -10.7857 -10.7517 -10.7517 -10.6626 -10.6626 -10.5647 -10.5647 -10.5641 -10.5641 -10.5219 -10.5219 -10.4928 -10.4928 -10.4750 -10.4750 -10.3891 -10.3891 -10.3523 -10.3523 -10.3404 -10.3404 -10.3196 -10.3196 -10.1739 -10.1739 -10.1537 -10.1537 -10.0924 -10.0924 -10.0859 -10.0859 -4.3812 -4.3812 -4.3483 -4.3483 2.9190 2.9190 3.1096 3.1096 3.2729 3.2729 3.5208 3.5208 3.5657 3.5657 3.6752 3.6752 5.6647 5.6647 5.7119 5.7119 6.5753 6.5753 6.7420 6.7420 6.9863 6.9863 7.3140 7.3140 k = 0.2342 0.4057-0.0000 ( 8861 PWs) bands (ev): -27.0761 -27.0761 -27.0621 -27.0621 -27.0429 -27.0429 -27.0289 -27.0289 -26.7131 -26.7131 -26.7127 -26.7127 -10.8451 -10.8451 -10.8363 -10.8363 -10.7866 -10.7866 -10.7504 -10.7504 -10.6593 -10.6593 -10.5660 -10.5660 -10.5638 -10.5638 -10.5213 -10.5213 -10.4943 -10.4943 -10.4730 -10.4730 -10.3889 -10.3889 -10.3546 -10.3546 -10.3411 -10.3411 -10.3204 -10.3204 -10.1735 -10.1735 -10.1545 -10.1545 -10.0921 -10.0921 -10.0858 -10.0858 -4.3863 -4.3863 -4.3497 -4.3497 2.9092 2.9092 3.1081 3.1081 3.2481 3.2481 3.5376 3.5376 3.5888 3.5888 3.6873 3.6873 5.6459 5.6459 5.7219 5.7219 6.5383 6.5383 6.7653 6.7653 7.0343 7.0343 7.3316 7.3316 k = 0.2252 0.3901-0.0000 ( 8857 PWs) bands (ev): -27.0768 -27.0768 -27.0615 -27.0615 -27.0436 -27.0436 -27.0283 -27.0283 -26.7130 -26.7130 -26.7127 -26.7127 -10.8450 -10.8450 -10.8347 -10.8347 -10.7873 -10.7873 -10.7491 -10.7491 -10.6557 -10.6557 -10.5675 -10.5675 -10.5635 -10.5635 -10.5207 -10.5207 -10.4957 -10.4957 -10.4708 -10.4708 -10.3890 -10.3890 -10.3571 -10.3571 -10.3418 -10.3418 -10.3211 -10.3211 -10.1731 -10.1731 -10.1553 -10.1553 -10.0918 -10.0918 -10.0857 -10.0857 -4.3917 -4.3917 -4.3513 -4.3513 2.9021 2.9021 3.1069 3.1069 3.2251 3.2251 3.5522 3.5522 3.6109 3.6109 3.6983 3.6983 5.6207 5.6207 5.7347 5.7347 6.5097 6.5097 6.7904 6.7904 7.0825 7.0825 7.3491 7.3491 k = 0.2162 0.3745-0.0000 ( 8865 PWs) bands (ev): -27.0775 -27.0775 -27.0609 -27.0609 -27.0443 -27.0443 -27.0277 -27.0277 -26.7130 -26.7130 -26.7126 -26.7126 -10.8449 -10.8449 -10.8331 -10.8331 -10.7879 -10.7879 -10.7477 -10.7477 -10.6520 -10.6520 -10.5687 -10.5687 -10.5634 -10.5634 -10.5199 -10.5199 -10.4970 -10.4970 -10.4685 -10.4685 -10.3893 -10.3893 -10.3598 -10.3598 -10.3426 -10.3426 -10.3219 -10.3219 -10.1727 -10.1727 -10.1561 -10.1561 -10.0916 -10.0916 -10.0856 -10.0856 -4.3974 -4.3974 -4.3532 -4.3532 2.8979 2.8979 3.1038 3.1038 3.2064 3.2064 3.5649 3.5649 3.6316 3.6316 3.7083 3.7083 5.5883 5.5883 5.7504 5.7504 6.4907 6.4907 6.8169 6.8169 7.1302 7.1302 7.3665 7.3665 k = 0.2072 0.3589-0.0000 ( 8865 PWs) bands (ev): -27.0783 -27.0783 -27.0603 -27.0603 -27.0449 -27.0449 -27.0270 -27.0270 -26.7129 -26.7129 -26.7126 -26.7126 -10.8449 -10.8449 -10.8313 -10.8313 -10.7884 -10.7884 -10.7463 -10.7463 -10.6480 -10.6480 -10.5699 -10.5699 -10.5637 -10.5637 -10.5190 -10.5190 -10.4980 -10.4980 -10.4663 -10.4663 -10.3898 -10.3898 -10.3626 -10.3626 -10.3434 -10.3434 -10.3227 -10.3227 -10.1723 -10.1723 -10.1570 -10.1570 -10.0913 -10.0913 -10.0855 -10.0855 -4.4035 -4.4035 -4.3554 -4.3554 2.8967 2.8967 3.0954 3.0954 3.1956 3.1956 3.5757 3.5757 3.6505 3.6505 3.7172 3.7172 5.5482 5.5482 5.7690 5.7690 6.4820 6.4820 6.8444 6.8444 7.1767 7.1767 7.3837 7.3837 k = 0.1982 0.3433-0.0000 ( 8865 PWs) bands (ev): -27.0790 -27.0790 -27.0598 -27.0598 -27.0456 -27.0456 -27.0264 -27.0264 -26.7128 -26.7128 -26.7125 -26.7125 -10.8448 -10.8448 -10.8296 -10.8296 -10.7887 -10.7887 -10.7449 -10.7449 -10.6440 -10.6440 -10.5709 -10.5709 -10.5641 -10.5641 -10.5183 -10.5183 -10.4986 -10.4986 -10.4640 -10.4640 -10.3907 -10.3907 -10.3655 -10.3655 -10.3444 -10.3444 -10.3235 -10.3235 -10.1718 -10.1718 -10.1578 -10.1578 -10.0909 -10.0909 -10.0854 -10.0854 -4.4097 -4.4097 -4.3578 -4.3578 2.8987 2.8987 3.0798 3.0798 3.1947 3.1947 3.5847 3.5847 3.6675 3.6675 3.7250 3.7250 5.5005 5.5005 5.7906 5.7906 6.4838 6.4838 6.8723 6.8723 7.2216 7.2216 7.3995 7.3995 k = 0.1892 0.3277-0.0000 ( 8855 PWs) bands (ev): -27.0796 -27.0796 -27.0592 -27.0592 -27.0462 -27.0462 -27.0258 -27.0258 -26.7128 -26.7128 -26.7125 -26.7125 -10.8448 -10.8448 -10.8278 -10.8278 -10.7888 -10.7888 -10.7433 -10.7433 -10.6398 -10.6398 -10.5716 -10.5716 -10.5649 -10.5649 -10.5177 -10.5177 -10.4988 -10.4988 -10.4617 -10.4617 -10.3918 -10.3918 -10.3684 -10.3684 -10.3455 -10.3455 -10.3244 -10.3244 -10.1714 -10.1714 -10.1587 -10.1587 -10.0906 -10.0906 -10.0853 -10.0853 -4.4162 -4.4162 -4.3605 -4.3605 2.9037 2.9037 3.0584 3.0584 3.2024 3.2024 3.5920 3.5920 3.6826 3.6826 3.7317 3.7317 5.4456 5.4456 5.8150 5.8150 6.4958 6.4958 6.9002 6.9002 7.2640 7.2640 7.4112 7.4112 k = 0.1802 0.3121-0.0000 ( 8845 PWs) bands (ev): -27.0803 -27.0803 -27.0587 -27.0587 -27.0468 -27.0468 -27.0252 -27.0252 -26.7127 -26.7127 -26.7124 -26.7124 -10.8447 -10.8447 -10.8261 -10.8261 -10.7888 -10.7888 -10.7417 -10.7417 -10.6356 -10.6356 -10.5722 -10.5722 -10.5659 -10.5659 -10.5173 -10.5173 -10.4985 -10.4985 -10.4594 -10.4594 -10.3932 -10.3932 -10.3712 -10.3712 -10.3467 -10.3467 -10.3252 -10.3252 -10.1709 -10.1709 -10.1596 -10.1596 -10.0902 -10.0902 -10.0853 -10.0853 -4.4229 -4.4229 -4.3633 -4.3633 2.9120 2.9120 3.0339 3.0339 3.2162 3.2162 3.5977 3.5977 3.6956 3.6956 3.7374 3.7374 5.3844 5.3844 5.8424 5.8424 6.5171 6.5171 6.9275 6.9275 7.3029 7.3029 7.4093 7.4093 k = 0.1712 0.2965-0.0000 ( 8845 PWs) bands (ev): -27.0809 -27.0809 -27.0582 -27.0582 -27.0474 -27.0474 -27.0246 -27.0246 -26.7126 -26.7126 -26.7123 -26.7123 -10.8446 -10.8446 -10.8244 -10.8244 -10.7886 -10.7886 -10.7400 -10.7400 -10.6313 -10.6313 -10.5725 -10.5725 -10.5672 -10.5672 -10.5171 -10.5171 -10.4978 -10.4978 -10.4572 -10.4572 -10.3949 -10.3949 -10.3740 -10.3740 -10.3481 -10.3481 -10.3261 -10.3261 -10.1704 -10.1704 -10.1604 -10.1604 -10.0897 -10.0897 -10.0853 -10.0853 -4.4298 -4.4298 -4.3664 -4.3664 2.9234 2.9234 3.0078 3.0078 3.2344 3.2344 3.6020 3.6020 3.7067 3.7067 3.7421 3.7421 5.3179 5.3179 5.8725 5.8725 6.5469 6.5469 6.9536 6.9536 7.3341 7.3341 7.3807 7.3807 k = 0.1622 0.2809-0.0000 ( 8859 PWs) bands (ev): -27.0816 -27.0816 -27.0577 -27.0577 -27.0480 -27.0480 -27.0240 -27.0240 -26.7126 -26.7126 -26.7123 -26.7123 -10.8446 -10.8446 -10.8229 -10.8229 -10.7882 -10.7882 -10.7382 -10.7382 -10.6272 -10.6272 -10.5725 -10.5725 -10.5687 -10.5687 -10.5171 -10.5171 -10.4966 -10.4966 -10.4549 -10.4549 -10.3970 -10.3970 -10.3766 -10.3766 -10.3497 -10.3497 -10.3270 -10.3270 -10.1700 -10.1700 -10.1612 -10.1612 -10.0892 -10.0892 -10.0853 -10.0853 -4.4367 -4.4367 -4.3696 -4.3696 2.9381 2.9381 2.9814 2.9814 3.2559 3.2559 3.6050 3.6050 3.7159 3.7159 3.7459 3.7459 5.2469 5.2469 5.9054 5.9054 6.5842 6.5842 6.9779 6.9779 7.3085 7.3085 7.3800 7.3800 k = 0.1532 0.2653-0.0000 ( 8875 PWs) bands (ev): -27.0823 -27.0823 -27.0572 -27.0572 -27.0485 -27.0485 -27.0235 -27.0235 -26.7125 -26.7125 -26.7122 -26.7122 -10.8445 -10.8445 -10.8215 -10.8215 -10.7876 -10.7876 -10.7362 -10.7362 -10.6231 -10.6231 -10.5721 -10.5721 -10.5704 -10.5704 -10.5173 -10.5173 -10.4951 -10.4951 -10.4528 -10.4528 -10.3992 -10.3992 -10.3791 -10.3791 -10.3514 -10.3514 -10.3280 -10.3280 -10.1697 -10.1697 -10.1618 -10.1618 -10.0887 -10.0887 -10.0854 -10.0854 -4.4437 -4.4437 -4.3729 -4.3729 2.9541 2.9541 2.9571 2.9571 3.2801 3.2801 3.6067 3.6067 3.7234 3.7234 3.7489 3.7489 5.1724 5.1724 5.9409 5.9409 6.6281 6.6281 7.0000 7.0000 7.2421 7.2421 7.4054 7.4054 k = 0.1441 0.2497-0.0000 ( 8855 PWs) bands (ev): -27.0829 -27.0829 -27.0567 -27.0567 -27.0491 -27.0491 -27.0229 -27.0229 -26.7124 -26.7124 -26.7121 -26.7121 -10.8444 -10.8444 -10.8202 -10.8202 -10.7869 -10.7869 -10.7342 -10.7342 -10.6193 -10.6193 -10.5724 -10.5724 -10.5713 -10.5713 -10.5174 -10.5174 -10.4935 -10.4935 -10.4507 -10.4507 -10.4017 -10.4017 -10.3815 -10.3815 -10.3534 -10.3534 -10.3290 -10.3290 -10.1695 -10.1695 -10.1623 -10.1623 -10.0881 -10.0881 -10.0854 -10.0854 -4.4506 -4.4506 -4.3763 -4.3763 2.9291 2.9291 2.9773 2.9773 3.3067 3.3067 3.6074 3.6074 3.7292 3.7292 3.7512 3.7512 5.0952 5.0952 5.9790 5.9790 6.6776 6.6776 7.0194 7.0194 7.1688 7.1688 7.4279 7.4279 k = 0.1351 0.2341-0.0000 ( 8855 PWs) bands (ev): -27.0834 -27.0834 -27.0563 -27.0563 -27.0496 -27.0496 -27.0224 -27.0224 -26.7123 -26.7123 -26.7121 -26.7121 -10.8442 -10.8442 -10.8191 -10.8191 -10.7860 -10.7860 -10.7321 -10.7321 -10.6157 -10.6157 -10.5743 -10.5743 -10.5702 -10.5702 -10.5175 -10.5175 -10.4917 -10.4917 -10.4486 -10.4486 -10.4043 -10.4043 -10.3837 -10.3837 -10.3554 -10.3554 -10.3300 -10.3300 -10.1696 -10.1696 -10.1624 -10.1624 -10.0876 -10.0876 -10.0854 -10.0854 -4.4576 -4.4576 -4.3797 -4.3797 2.9041 2.9041 3.0016 3.0016 3.3350 3.3350 3.6072 3.6072 3.7337 3.7337 3.7529 3.7529 5.0159 5.0159 6.0196 6.0196 6.7320 6.7320 7.0357 7.0357 7.0926 7.0926 7.4452 7.4452 k = 0.1261 0.2185-0.0000 ( 8845 PWs) bands (ev): -27.0840 -27.0840 -27.0559 -27.0559 -27.0500 -27.0500 -27.0219 -27.0219 -26.7122 -26.7122 -26.7120 -26.7120 -10.8441 -10.8441 -10.8181 -10.8181 -10.7849 -10.7849 -10.7298 -10.7298 -10.6126 -10.6126 -10.5764 -10.5764 -10.5686 -10.5686 -10.5174 -10.5174 -10.4900 -10.4900 -10.4467 -10.4467 -10.4069 -10.4069 -10.3858 -10.3858 -10.3577 -10.3577 -10.3310 -10.3310 -10.1701 -10.1701 -10.1622 -10.1622 -10.0873 -10.0873 -10.0852 -10.0852 -4.4644 -4.4644 -4.3831 -4.3831 2.8800 2.8800 3.0290 3.0290 3.3649 3.3649 3.6062 3.6062 3.7369 3.7369 3.7541 3.7541 4.9352 4.9352 6.0626 6.0626 6.7904 6.7904 7.0147 7.0147 7.0491 7.0491 7.4565 7.4565 k = 0.1171 0.2029-0.0000 ( 8843 PWs) bands (ev): -27.0845 -27.0845 -27.0555 -27.0555 -27.0505 -27.0505 -27.0215 -27.0215 -26.7122 -26.7122 -26.7119 -26.7119 -10.8439 -10.8439 -10.8173 -10.8173 -10.7838 -10.7838 -10.7275 -10.7275 -10.6098 -10.6098 -10.5786 -10.5786 -10.5666 -10.5666 -10.5172 -10.5172 -10.4884 -10.4884 -10.4449 -10.4449 -10.4096 -10.4096 -10.3879 -10.3879 -10.3600 -10.3600 -10.3320 -10.3320 -10.1708 -10.1708 -10.1617 -10.1617 -10.0872 -10.0872 -10.0847 -10.0847 -4.4710 -4.4710 -4.3865 -4.3865 2.8570 2.8570 3.0594 3.0594 3.3958 3.3958 3.6046 3.6046 3.7392 3.7392 3.7548 3.7548 4.8535 4.8535 6.1079 6.1079 6.8520 6.8520 6.9370 6.9370 7.0587 7.0587 7.4612 7.4612 k = 0.1081 0.1872-0.0000 ( 8841 PWs) bands (ev): -27.0851 -27.0851 -27.0552 -27.0552 -27.0509 -27.0509 -27.0210 -27.0210 -26.7121 -26.7121 -26.7118 -26.7118 -10.8438 -10.8438 -10.8167 -10.8167 -10.7826 -10.7826 -10.7251 -10.7251 -10.6075 -10.6075 -10.5809 -10.5809 -10.5643 -10.5643 -10.5167 -10.5167 -10.4868 -10.4868 -10.4433 -10.4433 -10.4121 -10.4121 -10.3898 -10.3898 -10.3624 -10.3624 -10.3330 -10.3330 -10.1717 -10.1717 -10.1611 -10.1611 -10.0874 -10.0874 -10.0841 -10.0841 -4.4774 -4.4774 -4.3899 -4.3899 2.8352 2.8352 3.0928 3.0928 3.4272 3.4272 3.6026 3.6026 3.7408 3.7408 3.7553 3.7553 4.7713 4.7713 6.1553 6.1553 6.8593 6.8593 6.9168 6.9168 7.0652 7.0652 7.4586 7.4586 k = 0.0991 0.1716-0.0000 ( 8841 PWs) bands (ev): -27.0855 -27.0855 -27.0548 -27.0548 -27.0514 -27.0514 -27.0206 -27.0206 -26.7120 -26.7120 -26.7118 -26.7118 -10.8436 -10.8436 -10.8162 -10.8162 -10.7814 -10.7814 -10.7226 -10.7226 -10.6056 -10.6056 -10.5832 -10.5832 -10.5617 -10.5617 -10.5160 -10.5160 -10.4855 -10.4855 -10.4418 -10.4418 -10.4145 -10.4145 -10.3917 -10.3917 -10.3649 -10.3649 -10.3339 -10.3339 -10.1727 -10.1727 -10.1603 -10.1603 -10.0877 -10.0877 -10.0832 -10.0832 -4.4836 -4.4836 -4.3931 -4.3931 2.8149 2.8149 3.1290 3.1290 3.4588 3.4588 3.6003 3.6003 3.7419 3.7419 3.7554 3.7554 4.6891 4.6891 6.2047 6.2047 6.7840 6.7840 6.9828 6.9828 7.0688 7.0688 7.4482 7.4482 k = 0.0901 0.1560-0.0000 ( 8841 PWs) bands (ev): -27.0860 -27.0860 -27.0545 -27.0545 -27.0517 -27.0517 -27.0203 -27.0203 -26.7120 -26.7120 -26.7117 -26.7117 -10.8435 -10.8435 -10.8159 -10.8159 -10.7801 -10.7801 -10.7201 -10.7201 -10.6041 -10.6041 -10.5855 -10.5855 -10.5589 -10.5589 -10.5150 -10.5150 -10.4842 -10.4842 -10.4406 -10.4406 -10.4167 -10.4167 -10.3936 -10.3936 -10.3674 -10.3674 -10.3349 -10.3349 -10.1738 -10.1738 -10.1595 -10.1595 -10.0880 -10.0880 -10.0824 -10.0824 -4.4894 -4.4894 -4.3962 -4.3962 2.7959 2.7959 3.1677 3.1677 3.4899 3.4899 3.5979 3.5979 3.7429 3.7429 3.7554 3.7554 4.6072 4.6072 6.2559 6.2559 6.7110 6.7110 7.0502 7.0502 7.0699 7.0699 7.4296 7.4296 k = 0.0811 0.1404-0.0000 ( 8837 PWs) bands (ev): -27.0864 -27.0864 -27.0542 -27.0542 -27.0521 -27.0521 -27.0199 -27.0199 -26.7119 -26.7119 -26.7117 -26.7117 -10.8433 -10.8433 -10.8156 -10.8156 -10.7789 -10.7789 -10.7176 -10.7176 -10.6029 -10.6029 -10.5878 -10.5878 -10.5562 -10.5562 -10.5136 -10.5136 -10.4831 -10.4831 -10.4398 -10.4398 -10.4186 -10.4186 -10.3953 -10.3953 -10.3699 -10.3699 -10.3358 -10.3358 -10.1748 -10.1748 -10.1586 -10.1586 -10.0883 -10.0883 -10.0815 -10.0815 -4.4948 -4.4948 -4.3991 -4.3991 2.7786 2.7786 3.2087 3.2087 3.5197 3.5197 3.5958 3.5958 3.7440 3.7440 3.7553 3.7553 4.5261 4.5261 6.3087 6.3087 6.6414 6.6414 7.0687 7.0687 7.1183 7.1183 7.4031 7.4031 k = 0.0721 0.1248-0.0000 ( 8843 PWs) bands (ev): -27.0867 -27.0867 -27.0540 -27.0540 -27.0524 -27.0524 -27.0196 -27.0196 -26.7119 -26.7119 -26.7116 -26.7116 -10.8431 -10.8431 -10.8154 -10.8154 -10.7777 -10.7777 -10.7152 -10.7152 -10.6020 -10.6020 -10.5900 -10.5900 -10.5535 -10.5535 -10.5120 -10.5120 -10.4822 -10.4822 -10.4393 -10.4393 -10.4202 -10.4202 -10.3969 -10.3969 -10.3723 -10.3723 -10.3366 -10.3366 -10.1758 -10.1758 -10.1578 -10.1578 -10.0887 -10.0887 -10.0807 -10.0807 -4.4998 -4.4998 -4.4018 -4.4018 2.7629 2.7629 3.2516 3.2516 3.5477 3.5477 3.5942 3.5942 3.7457 3.7457 3.7552 3.7552 4.4461 4.4461 6.3629 6.3629 6.5762 6.5762 7.0662 7.0662 7.1860 7.1860 7.3691 7.3691 k = 0.0631 0.1092-0.0000 ( 8845 PWs) bands (ev): -27.0871 -27.0871 -27.0537 -27.0537 -27.0527 -27.0527 -27.0194 -27.0194 -26.7118 -26.7118 -26.7116 -26.7116 -10.8430 -10.8430 -10.8153 -10.8153 -10.7767 -10.7767 -10.7128 -10.7128 -10.6013 -10.6013 -10.5921 -10.5921 -10.5511 -10.5511 -10.5101 -10.5101 -10.4813 -10.4813 -10.4393 -10.4393 -10.4214 -10.4214 -10.3983 -10.3983 -10.3746 -10.3746 -10.3373 -10.3373 -10.1768 -10.1768 -10.1570 -10.1570 -10.0891 -10.0891 -10.0799 -10.0799 -4.5043 -4.5043 -4.4043 -4.4043 2.7489 2.7489 3.2958 3.2958 3.5726 3.5726 3.5938 3.5938 3.7482 3.7482 3.7551 3.7551 4.3678 4.3678 6.4178 6.4178 6.5163 6.5163 7.0626 7.0626 7.2528 7.2528 7.3286 7.3286 k = 0.0541 0.0936-0.0000 ( 8855 PWs) bands (ev): -27.0874 -27.0874 -27.0536 -27.0536 -27.0529 -27.0529 -27.0191 -27.0191 -26.7118 -26.7118 -26.7115 -26.7115 -10.8429 -10.8429 -10.8152 -10.8152 -10.7757 -10.7757 -10.7106 -10.7106 -10.6010 -10.6010 -10.5939 -10.5939 -10.5490 -10.5490 -10.5082 -10.5082 -10.4805 -10.4805 -10.4396 -10.4396 -10.4224 -10.4224 -10.3995 -10.3995 -10.3768 -10.3768 -10.3380 -10.3380 -10.1777 -10.1777 -10.1563 -10.1563 -10.0894 -10.0894 -10.0791 -10.0791 -4.5083 -4.5083 -4.4065 -4.4065 2.7366 2.7366 3.3404 3.3404 3.5902 3.5902 3.5987 3.5987 3.7518 3.7518 3.7550 3.7550 4.2918 4.2918 6.4562 6.4562 6.4796 6.4796 7.0585 7.0585 7.2829 7.2829 7.3180 7.3180 k = 0.0450 0.0780-0.0000 ( 8853 PWs) bands (ev): -27.0876 -27.0876 -27.0534 -27.0534 -27.0531 -27.0531 -27.0189 -27.0189 -26.7117 -26.7117 -26.7115 -26.7115 -10.8427 -10.8427 -10.8151 -10.8151 -10.7749 -10.7749 -10.7086 -10.7086 -10.6009 -10.6009 -10.5953 -10.5953 -10.5472 -10.5472 -10.5062 -10.5062 -10.4796 -10.4796 -10.4404 -10.4404 -10.4231 -10.4231 -10.4005 -10.4005 -10.3787 -10.3787 -10.3386 -10.3386 -10.1785 -10.1785 -10.1557 -10.1557 -10.0897 -10.0897 -10.0785 -10.0785 -4.5118 -4.5118 -4.4084 -4.4084 2.7262 2.7262 3.3839 3.3839 3.5954 3.5954 3.6144 3.6144 3.7551 3.7551 3.7567 3.7567 4.2188 4.2188 6.4126 6.4126 6.5316 6.5316 7.0543 7.0543 7.2338 7.2338 7.3808 7.3808 k = 0.0360 0.0624-0.0000 ( 8861 PWs) bands (ev): -27.0878 -27.0878 -27.0533 -27.0533 -27.0533 -27.0533 -27.0188 -27.0188 -26.7117 -26.7117 -26.7115 -26.7115 -10.8426 -10.8426 -10.8151 -10.8151 -10.7742 -10.7742 -10.7068 -10.7068 -10.6012 -10.6012 -10.5964 -10.5964 -10.5458 -10.5458 -10.5044 -10.5044 -10.4787 -10.4787 -10.4415 -10.4415 -10.4236 -10.4236 -10.4011 -10.4011 -10.3804 -10.3804 -10.3391 -10.3391 -10.1791 -10.1791 -10.1552 -10.1552 -10.0900 -10.0900 -10.0779 -10.0779 -4.5147 -4.5147 -4.4100 -4.4100 2.7176 2.7176 3.4238 3.4238 3.6022 3.6022 3.6279 3.6279 3.7556 3.7556 3.7624 3.7624 4.1499 4.1499 6.3727 6.3727 6.5864 6.5864 7.0503 7.0503 7.1831 7.1831 7.4407 7.4407 k = 0.0270 0.0468-0.0000 ( 8873 PWs) bands (ev): -27.0880 -27.0880 -27.0535 -27.0535 -27.0532 -27.0532 -27.0187 -27.0187 -26.7117 -26.7117 -26.7115 -26.7115 -10.8425 -10.8425 -10.8151 -10.8151 -10.7736 -10.7736 -10.7054 -10.7054 -10.6017 -10.6017 -10.5969 -10.5969 -10.5446 -10.5446 -10.5029 -10.5029 -10.4777 -10.4777 -10.4428 -10.4428 -10.4240 -10.4240 -10.4015 -10.4015 -10.3818 -10.3818 -10.3395 -10.3395 -10.1797 -10.1797 -10.1547 -10.1547 -10.0902 -10.0902 -10.0775 -10.0775 -4.5169 -4.5169 -4.4113 -4.4113 2.7108 2.7108 3.4569 3.4569 3.6137 3.6137 3.6377 3.6377 3.7565 3.7565 3.7683 3.7683 4.0872 4.0872 6.3408 6.3408 6.6386 6.6386 7.0469 7.0469 7.1335 7.1335 7.4969 7.4969 k = 0.0180 0.0312-0.0000 ( 8885 PWs) bands (ev): -27.0881 -27.0881 -27.0536 -27.0536 -27.0531 -27.0531 -27.0186 -27.0186 -26.7117 -26.7117 -26.7115 -26.7115 -10.8425 -10.8425 -10.8151 -10.8151 -10.7732 -10.7732 -10.7043 -10.7043 -10.6022 -10.6022 -10.5972 -10.5972 -10.5438 -10.5438 -10.5018 -10.5018 -10.4767 -10.4767 -10.4439 -10.4439 -10.4243 -10.4243 -10.4017 -10.4017 -10.3829 -10.3829 -10.3398 -10.3398 -10.1800 -10.1800 -10.1544 -10.1544 -10.0904 -10.0904 -10.0771 -10.0771 -4.5186 -4.5186 -4.4122 -4.4122 2.7060 2.7060 3.4801 3.4801 3.6297 3.6297 3.6441 3.6441 3.7582 3.7582 3.7735 3.7735 4.0340 4.0340 6.3175 6.3175 6.6848 6.6848 7.0443 7.0443 7.0886 7.0886 7.5488 7.5488 k = 0.0090 0.0156-0.0000 ( 8881 PWs) bands (ev): -27.0882 -27.0882 -27.0536 -27.0536 -27.0530 -27.0530 -27.0185 -27.0185 -26.7117 -26.7117 -26.7114 -26.7114 -10.8425 -10.8425 -10.8151 -10.8151 -10.7730 -10.7730 -10.7036 -10.7036 -10.6027 -10.6027 -10.5973 -10.5973 -10.5434 -10.5434 -10.5011 -10.5011 -10.4761 -10.4761 -10.4448 -10.4448 -10.4244 -10.4244 -10.4018 -10.4018 -10.3835 -10.3835 -10.3399 -10.3399 -10.1803 -10.1803 -10.1543 -10.1543 -10.0905 -10.0905 -10.0769 -10.0769 -4.5196 -4.5196 -4.4127 -4.4127 2.7031 2.7031 3.4929 3.4929 3.6450 3.6450 3.6477 3.6477 3.7603 3.7603 3.7770 3.7770 3.9962 3.9962 6.3033 6.3033 6.7190 6.7190 7.0426 7.0426 7.0553 7.0553 7.5955 7.5955 k = 0.0000 0.0000 0.0000 ( 8847 PWs) bands (ev): -27.0882 -27.0882 -27.0536 -27.0536 -27.0530 -27.0530 -27.0185 -27.0185 -26.7117 -26.7117 -26.7114 -26.7114 -10.8424 -10.8424 -10.8151 -10.8151 -10.7729 -10.7729 -10.7034 -10.7034 -10.6028 -10.6028 -10.5973 -10.5973 -10.5432 -10.5432 -10.5009 -10.5009 -10.4758 -10.4758 -10.4450 -10.4450 -10.4245 -10.4245 -10.4018 -10.4018 -10.3837 -10.3837 -10.3400 -10.3400 -10.1803 -10.1803 -10.1542 -10.1542 -10.0905 -10.0905 -10.0768 -10.0768 -4.5199 -4.5199 -4.4129 -4.4129 2.7022 2.7022 3.4969 3.4969 3.6487 3.6487 3.6516 3.6516 3.7614 3.7614 3.7783 3.7783 3.9821 3.9821 6.2985 6.2985 6.7321 6.7321 7.0409 7.0409 7.0435 7.0435 7.6246 7.6246 k = 0.0000 0.0000 0.0000 ( 8847 PWs) bands (ev): -27.0882 -27.0882 -27.0536 -27.0536 -27.0530 -27.0530 -27.0185 -27.0185 -26.7117 -26.7117 -26.7114 -26.7114 -10.8424 -10.8424 -10.8151 -10.8151 -10.7729 -10.7729 -10.7034 -10.7034 -10.6028 -10.6028 -10.5973 -10.5973 -10.5432 -10.5432 -10.5009 -10.5009 -10.4758 -10.4758 -10.4450 -10.4450 -10.4245 -10.4245 -10.4018 -10.4018 -10.3837 -10.3837 -10.3400 -10.3400 -10.1803 -10.1803 -10.1542 -10.1542 -10.0905 -10.0905 -10.0768 -10.0768 -4.5199 -4.5199 -4.4129 -4.4129 2.7022 2.7022 3.4969 3.4969 3.6487 3.6487 3.6516 3.6516 3.7614 3.7614 3.7783 3.7783 3.9821 3.9821 6.2985 6.2985 6.7321 6.7321 7.0409 7.0409 7.0435 7.0435 7.6246 7.6246 k = 0.0000 0.0000 0.0177 ( 8865 PWs) bands (ev): -27.0881 -27.0881 -27.0551 -27.0551 -27.0516 -27.0516 -27.0186 -27.0186 -26.7117 -26.7117 -26.7114 -26.7114 -10.8424 -10.8424 -10.8152 -10.8152 -10.7727 -10.7727 -10.7036 -10.7036 -10.6027 -10.6027 -10.5970 -10.5970 -10.5435 -10.5435 -10.5011 -10.5011 -10.4755 -10.4755 -10.4450 -10.4450 -10.4245 -10.4245 -10.4019 -10.4019 -10.3836 -10.3836 -10.3401 -10.3401 -10.1803 -10.1803 -10.1543 -10.1543 -10.0905 -10.0905 -10.0769 -10.0769 -4.5196 -4.5196 -4.4131 -4.4131 2.7030 2.7030 3.4958 3.4958 3.6484 3.6484 3.6519 3.6519 3.7422 3.7422 3.7780 3.7780 4.0045 4.0045 6.2943 6.2943 6.7297 6.7297 7.0421 7.0421 7.0448 7.0448 7.6236 7.6236 k = 0.0000 0.0000 0.0354 ( 8865 PWs) bands (ev): -27.0880 -27.0880 -27.0568 -27.0568 -27.0499 -27.0499 -27.0187 -27.0187 -26.7117 -26.7117 -26.7114 -26.7114 -10.8422 -10.8422 -10.8155 -10.8155 -10.7722 -10.7722 -10.7044 -10.7044 -10.6024 -10.6024 -10.5961 -10.5961 -10.5444 -10.5444 -10.5018 -10.5018 -10.4745 -10.4745 -10.4448 -10.4448 -10.4246 -10.4246 -10.4023 -10.4023 -10.3833 -10.3833 -10.3404 -10.3404 -10.1801 -10.1801 -10.1545 -10.1545 -10.0904 -10.0904 -10.0770 -10.0770 -4.5188 -4.5188 -4.4138 -4.4138 2.7054 2.7054 3.4920 3.4920 3.6476 3.6476 3.6528 3.6528 3.6994 3.6994 3.7770 3.7770 4.0575 4.0575 6.2811 6.2811 6.7235 6.7235 7.0458 7.0458 7.0485 7.0485 7.6205 7.6205 k = 0.0000 0.0000 0.0530 ( 8853 PWs) bands (ev): -27.0878 -27.0878 -27.0585 -27.0585 -27.0482 -27.0482 -27.0189 -27.0189 -26.7116 -26.7116 -26.7114 -26.7114 -10.8420 -10.8420 -10.8160 -10.8160 -10.7714 -10.7714 -10.7056 -10.7056 -10.6020 -10.6020 -10.5946 -10.5946 -10.5457 -10.5457 -10.5029 -10.5029 -10.4730 -10.4730 -10.4445 -10.4445 -10.4248 -10.4248 -10.4030 -10.4030 -10.3827 -10.3827 -10.3409 -10.3409 -10.1798 -10.1798 -10.1548 -10.1548 -10.0902 -10.0902 -10.0771 -10.0771 -4.5174 -4.5174 -4.4150 -4.4150 2.7095 2.7095 3.4835 3.4835 3.6462 3.6462 3.6520 3.6520 3.6543 3.6543 3.7755 3.7755 4.1241 4.1241 6.2573 6.2573 6.7169 6.7169 7.0519 7.0519 7.0548 7.0548 7.6153 7.6153 k = 0.0000 0.0000 0.0707 ( 8865 PWs) bands (ev): -27.0875 -27.0875 -27.0602 -27.0602 -27.0465 -27.0465 -27.0192 -27.0192 -26.7116 -26.7116 -26.7115 -26.7115 -10.8416 -10.8416 -10.8167 -10.8167 -10.7702 -10.7702 -10.7072 -10.7072 -10.6013 -10.6013 -10.5925 -10.5925 -10.5475 -10.5475 -10.5044 -10.5044 -10.4710 -10.4710 -10.4441 -10.4441 -10.4251 -10.4251 -10.4039 -10.4039 -10.3819 -10.3819 -10.3416 -10.3416 -10.1795 -10.1795 -10.1553 -10.1553 -10.0900 -10.0900 -10.0773 -10.0773 -4.5154 -4.5154 -4.4166 -4.4166 2.7153 2.7153 3.4662 3.4662 3.6110 3.6110 3.6442 3.6442 3.6563 3.6563 3.7733 3.7733 4.1974 4.1974 6.2217 6.2217 6.7138 6.7138 7.0605 7.0605 7.0635 7.0635 7.6077 7.6077 k = 0.0000 0.0000 0.0884 ( 8853 PWs) bands (ev): -27.0871 -27.0871 -27.0618 -27.0618 -27.0448 -27.0448 -27.0195 -27.0195 -26.7116 -26.7116 -26.7114 -26.7114 -10.8411 -10.8411 -10.8175 -10.8175 -10.7688 -10.7688 -10.7091 -10.7091 -10.6005 -10.6005 -10.5900 -10.5900 -10.5496 -10.5496 -10.5063 -10.5063 -10.4686 -10.4686 -10.4435 -10.4435 -10.4254 -10.4254 -10.4051 -10.4051 -10.3809 -10.3809 -10.3425 -10.3425 -10.1790 -10.1790 -10.1559 -10.1559 -10.0896 -10.0896 -10.0776 -10.0776 -4.5130 -4.5130 -4.4186 -4.4186 2.7229 2.7229 3.4359 3.4359 3.5832 3.5832 3.6417 3.6417 3.6589 3.6589 3.7706 3.7706 4.2747 4.2747 6.1735 6.1735 6.7172 6.7172 7.0714 7.0714 7.0746 7.0746 7.5946 7.5946 k = 0.0000 0.0000 0.1061 ( 8847 PWs) bands (ev): -27.0867 -27.0867 -27.0634 -27.0634 -27.0432 -27.0432 -27.0200 -27.0200 -26.7116 -26.7116 -26.7114 -26.7114 -10.8405 -10.8405 -10.8184 -10.8184 -10.7671 -10.7671 -10.7114 -10.7114 -10.5994 -10.5994 -10.5871 -10.5871 -10.5521 -10.5521 -10.5086 -10.5086 -10.4658 -10.4658 -10.4429 -10.4429 -10.4258 -10.4258 -10.4065 -10.4065 -10.3797 -10.3797 -10.3435 -10.3435 -10.1784 -10.1784 -10.1567 -10.1567 -10.0893 -10.0893 -10.0779 -10.0779 -4.5101 -4.5101 -4.4211 -4.4211 2.7323 2.7323 3.3938 3.3938 3.5687 3.5687 3.6388 3.6388 3.6620 3.6620 3.7673 3.7673 4.3549 4.3549 6.1138 6.1138 6.7285 6.7285 7.0846 7.0846 7.0881 7.0881 7.5716 7.5716 k = 0.0000 0.0000 0.1237 ( 8847 PWs) bands (ev): -27.0861 -27.0861 -27.0650 -27.0650 -27.0415 -27.0415 -27.0205 -27.0205 -26.7116 -26.7116 -26.7115 -26.7115 -10.8398 -10.8398 -10.8195 -10.8195 -10.7652 -10.7652 -10.7139 -10.7139 -10.5983 -10.5983 -10.5837 -10.5837 -10.5547 -10.5547 -10.5113 -10.5113 -10.4628 -10.4628 -10.4422 -10.4422 -10.4263 -10.4263 -10.4081 -10.4081 -10.3783 -10.3783 -10.3448 -10.3448 -10.1777 -10.1777 -10.1575 -10.1575 -10.0888 -10.0888 -10.0782 -10.0782 -4.5067 -4.5067 -4.4240 -4.4240 2.7436 2.7436 3.3454 3.3454 3.5626 3.5626 3.6353 3.6353 3.6656 3.6656 3.7635 3.7635 4.4373 4.4373 6.0442 6.0442 6.7478 6.7478 7.1001 7.1001 7.1039 7.1039 7.5441 7.5441 k = 0.0000 0.0000 0.1414 ( 8835 PWs) bands (ev): -27.0855 -27.0855 -27.0666 -27.0666 -27.0400 -27.0400 -27.0212 -27.0212 -26.7116 -26.7116 -26.7115 -26.7115 -10.8391 -10.8391 -10.8206 -10.8206 -10.7631 -10.7631 -10.7167 -10.7167 -10.5969 -10.5969 -10.5801 -10.5801 -10.5575 -10.5575 -10.5142 -10.5142 -10.4595 -10.4595 -10.4414 -10.4414 -10.4269 -10.4269 -10.4100 -10.4100 -10.3768 -10.3768 -10.3462 -10.3462 -10.1769 -10.1769 -10.1584 -10.1584 -10.0883 -10.0883 -10.0787 -10.0787 -4.5029 -4.5029 -4.4272 -4.4272 2.7569 2.7569 3.2949 3.2949 3.5609 3.5609 3.6315 3.6315 3.6697 3.6697 3.7593 3.7593 4.5215 4.5215 5.9670 5.9670 6.7743 6.7743 7.1178 7.1178 7.1219 7.1219 7.5123 7.5123 k = 0.0000 0.0000 0.1591 ( 8805 PWs) bands (ev): -27.0847 -27.0847 -27.0682 -27.0682 -27.0384 -27.0384 -27.0218 -27.0218 -26.7115 -26.7115 -26.7114 -26.7114 -10.8382 -10.8382 -10.8218 -10.8218 -10.7608 -10.7608 -10.7195 -10.7195 -10.5953 -10.5953 -10.5762 -10.5762 -10.5604 -10.5604 -10.5175 -10.5175 -10.4561 -10.4561 -10.4405 -10.4405 -10.4275 -10.4275 -10.4121 -10.4121 -10.3751 -10.3751 -10.3477 -10.3477 -10.1760 -10.1760 -10.1595 -10.1595 -10.0878 -10.0878 -10.0791 -10.0791 -4.4988 -4.4988 -4.4309 -4.4309 2.7724 2.7724 3.2445 3.2445 3.5617 3.5617 3.6272 3.6272 3.6742 3.6742 3.7546 3.7546 4.6074 4.6074 5.8840 5.8840 6.8071 6.8071 7.1375 7.1375 7.1421 7.1421 7.4762 7.4762 k = 0.0000 0.0000 0.1768 ( 8817 PWs) bands (ev): -27.0839 -27.0839 -27.0697 -27.0697 -27.0368 -27.0368 -27.0226 -27.0226 -26.7115 -26.7115 -26.7115 -26.7115 -10.8373 -10.8373 -10.8230 -10.8230 -10.7584 -10.7584 -10.7226 -10.7226 -10.5936 -10.5936 -10.5722 -10.5722 -10.5633 -10.5633 -10.5210 -10.5210 -10.4527 -10.4527 -10.4395 -10.4395 -10.4282 -10.4282 -10.4144 -10.4144 -10.3733 -10.3733 -10.3493 -10.3493 -10.1751 -10.1751 -10.1606 -10.1606 -10.0872 -10.0872 -10.0796 -10.0796 -4.4943 -4.4943 -4.4348 -4.4348 2.7900 2.7900 3.1953 3.1953 3.5640 3.5640 3.6227 3.6227 3.6791 3.6791 3.7495 3.7495 4.6947 4.6947 5.7969 5.7969 6.8451 6.8451 7.1593 7.1593 7.1643 7.1643 7.4362 7.4362 k = 0.0000 0.0000 0.1944 ( 8812 PWs) bands (ev): -27.0831 -27.0831 -27.0712 -27.0712 -27.0354 -27.0354 -27.0235 -27.0235 -26.7115 -26.7115 -26.7115 -26.7115 -10.8363 -10.8363 -10.8243 -10.8243 -10.7558 -10.7558 -10.7256 -10.7256 -10.5918 -10.5918 -10.5679 -10.5679 -10.5663 -10.5663 -10.5247 -10.5247 -10.4492 -10.4492 -10.4386 -10.4386 -10.4289 -10.4289 -10.4169 -10.4169 -10.3714 -10.3714 -10.3511 -10.3511 -10.1740 -10.1740 -10.1618 -10.1618 -10.0866 -10.0866 -10.0802 -10.0802 -4.4896 -4.4896 -4.4391 -4.4391 2.8100 2.8100 3.1480 3.1480 3.5673 3.5673 3.6178 3.6178 3.6844 3.6844 3.7441 3.7441 4.7833 4.7833 5.7070 5.7070 6.8876 6.8876 7.1829 7.1829 7.1884 7.1884 7.3926 7.3926 k = 0.0000 0.0000 0.2121 ( 8812 PWs) bands (ev): -27.0822 -27.0822 -27.0726 -27.0726 -27.0339 -27.0339 -27.0244 -27.0244 -26.7115 -26.7115 -26.7115 -26.7115 -10.8353 -10.8353 -10.8255 -10.8255 -10.7531 -10.7531 -10.7288 -10.7288 -10.5898 -10.5898 -10.5692 -10.5692 -10.5636 -10.5636 -10.5286 -10.5286 -10.4456 -10.4456 -10.4375 -10.4375 -10.4297 -10.4297 -10.4196 -10.4196 -10.3695 -10.3695 -10.3530 -10.3530 -10.1729 -10.1729 -10.1630 -10.1630 -10.0860 -10.0860 -10.0808 -10.0808 -4.4846 -4.4846 -4.4437 -4.4437 2.8323 2.8323 3.1028 3.1028 3.5713 3.5713 3.6127 3.6127 3.6899 3.6899 3.7384 3.7384 4.8730 4.8730 5.6152 5.6152 6.9337 6.9337 7.2082 7.2082 7.2142 7.2142 7.3459 7.3459 k = 0.0000 0.0000 0.2298 ( 8812 PWs) bands (ev): -27.0812 -27.0812 -27.0740 -27.0740 -27.0325 -27.0325 -27.0254 -27.0254 -26.7115 -26.7115 -26.7115 -26.7115 -10.8342 -10.8342 -10.8268 -10.8268 -10.7503 -10.7503 -10.7319 -10.7319 -10.5876 -10.5876 -10.5721 -10.5721 -10.5592 -10.5592 -10.5327 -10.5327 -10.4421 -10.4421 -10.4365 -10.4365 -10.4306 -10.4306 -10.4224 -10.4224 -10.3675 -10.3675 -10.3550 -10.3550 -10.1718 -10.1718 -10.1642 -10.1642 -10.0853 -10.0853 -10.0814 -10.0814 -4.4795 -4.4795 -4.4484 -4.4484 2.8571 2.8571 3.0600 3.0600 3.5758 3.5758 3.6074 3.6074 3.6957 3.6957 3.7325 3.7325 4.9639 4.9639 5.5222 5.5222 6.9827 6.9827 7.2350 7.2350 7.2416 7.2416 7.2966 7.2966 k = 0.0000 0.0000 0.2475 ( 8782 PWs) bands (ev): -27.0801 -27.0801 -27.0753 -27.0753 -27.0312 -27.0312 -27.0264 -27.0264 -26.7115 -26.7115 -26.7115 -26.7115 -10.8330 -10.8330 -10.8281 -10.8281 -10.7474 -10.7474 -10.7351 -10.7351 -10.5853 -10.5853 -10.5749 -10.5749 -10.5547 -10.5547 -10.5369 -10.5369 -10.4386 -10.4386 -10.4355 -10.4355 -10.4315 -10.4315 -10.4254 -10.4254 -10.3654 -10.3654 -10.3570 -10.3570 -10.1706 -10.1706 -10.1655 -10.1655 -10.0847 -10.0847 -10.0820 -10.0820 -4.4743 -4.4743 -4.4534 -4.4534 2.8844 2.8844 3.0196 3.0196 3.5807 3.5807 3.6020 3.6020 3.7017 3.7017 3.7264 3.7264 5.0556 5.0556 5.4287 5.4287 7.0337 7.0337 7.2453 7.2453 7.2632 7.2632 7.2704 7.2705 k = 0.0000 0.0000 0.2651 ( 8812 PWs) bands (ev): -27.0790 -27.0790 -27.0766 -27.0766 -27.0299 -27.0299 -27.0275 -27.0275 -26.7115 -26.7115 -26.7115 -26.7115 -10.8318 -10.8318 -10.8294 -10.8294 -10.7444 -10.7444 -10.7383 -10.7383 -10.5829 -10.5829 -10.5777 -10.5777 -10.5502 -10.5502 -10.5413 -10.5413 -10.4352 -10.4352 -10.4345 -10.4345 -10.4325 -10.4325 -10.4285 -10.4285 -10.3633 -10.3633 -10.3591 -10.3591 -10.1693 -10.1693 -10.1668 -10.1668 -10.0840 -10.0840 -10.0827 -10.0827 -4.4690 -4.4690 -4.4586 -4.4586 2.9143 2.9143 2.9819 2.9819 3.5858 3.5858 3.5966 3.5966 3.7078 3.7078 3.7203 3.7203 5.1482 5.1482 5.3349 5.3349 7.0862 7.0862 7.1927 7.1927 7.2926 7.2926 7.3004 7.3004 k = 0.0000 0.0000 0.2828 ( 8812 PWs) bands (ev): -27.0778 -27.0778 -27.0778 -27.0778 -27.0287 -27.0287 -27.0287 -27.0287 -26.7115 -26.7115 -26.7115 -26.7115 -10.8306 -10.8306 -10.8306 -10.8306 -10.7414 -10.7414 -10.7414 -10.7414 -10.5803 -10.5803 -10.5803 -10.5803 -10.5457 -10.5457 -10.5457 -10.5457 -10.4335 -10.4335 -10.4335 -10.4335 -10.4318 -10.4318 -10.4318 -10.4318 -10.3612 -10.3612 -10.3612 -10.3612 -10.1681 -10.1681 -10.1681 -10.1681 -10.0833 -10.0833 -10.0833 -10.0833 -4.4638 -4.4638 -4.4638 -4.4638 2.9468 2.9468 2.9468 2.9468 3.5912 3.5912 3.5912 3.5912 3.7140 3.7140 3.7140 3.7140 5.2414 5.2414 5.2414 5.2414 7.1395 7.1395 7.1395 7.1395 7.3227 7.3227 7.3227 7.3227 k = 0.0000 0.0000 0.2828 ( 8812 PWs) bands (ev): -27.0778 -27.0778 -27.0778 -27.0778 -27.0287 -27.0287 -27.0287 -27.0287 -26.7115 -26.7115 -26.7115 -26.7115 -10.8306 -10.8306 -10.8306 -10.8306 -10.7414 -10.7414 -10.7414 -10.7414 -10.5803 -10.5803 -10.5803 -10.5803 -10.5457 -10.5457 -10.5457 -10.5457 -10.4335 -10.4335 -10.4335 -10.4335 -10.4318 -10.4318 -10.4318 -10.4318 -10.3612 -10.3612 -10.3612 -10.3612 -10.1681 -10.1681 -10.1681 -10.1681 -10.0833 -10.0833 -10.0833 -10.0833 -4.4638 -4.4638 -4.4638 -4.4638 2.9468 2.9468 2.9468 2.9468 3.5912 3.5912 3.5912 3.5912 3.7140 3.7140 3.7140 3.7140 5.2414 5.2414 5.2414 5.2414 7.1395 7.1395 7.1395 7.1395 7.3227 7.3227 7.3227 7.3228 k = 0.0156 0.0090 0.2828 ( 8820 PWs) bands (ev): -27.0778 -27.0778 -27.0778 -27.0778 -27.0287 -27.0287 -27.0287 -27.0287 -26.7115 -26.7115 -26.7115 -26.7115 -10.8306 -10.8306 -10.8306 -10.8306 -10.7415 -10.7415 -10.7415 -10.7415 -10.5805 -10.5805 -10.5805 -10.5805 -10.5456 -10.5456 -10.5456 -10.5456 -10.4357 -10.4357 -10.4357 -10.4357 -10.4295 -10.4295 -10.4295 -10.4295 -10.3611 -10.3611 -10.3611 -10.3611 -10.1681 -10.1681 -10.1681 -10.1681 -10.0833 -10.0833 -10.0833 -10.0833 -4.4635 -4.4635 -4.4635 -4.4635 2.9465 2.9465 2.9465 2.9465 3.5908 3.5908 3.5908 3.5908 3.7135 3.7135 3.7135 3.7135 5.2439 5.2439 5.2439 5.2439 7.1317 7.1317 7.1317 7.1317 7.3257 7.3257 7.3257 7.3257 k = 0.0312 0.0180 0.2828 ( 8806 PWs) bands (ev): -27.0778 -27.0778 -27.0778 -27.0778 -27.0287 -27.0287 -27.0287 -27.0287 -26.7115 -26.7115 -26.7115 -26.7115 -10.8306 -10.8306 -10.8306 -10.8306 -10.7418 -10.7418 -10.7418 -10.7418 -10.5809 -10.5809 -10.5809 -10.5809 -10.5453 -10.5453 -10.5453 -10.5453 -10.4386 -10.4386 -10.4386 -10.4386 -10.4266 -10.4266 -10.4266 -10.4266 -10.3609 -10.3609 -10.3609 -10.3609 -10.1680 -10.1680 -10.1680 -10.1680 -10.0834 -10.0834 -10.0834 -10.0834 -4.4627 -4.4627 -4.4627 -4.4627 2.9456 2.9456 2.9456 2.9456 3.5895 3.5895 3.5895 3.5895 3.7122 3.7122 3.7122 3.7122 5.2514 5.2514 5.2514 5.2514 7.1122 7.1122 7.1122 7.1122 7.3284 7.3284 7.3284 7.3284 k = 0.0469 0.0271 0.2828 ( 8810 PWs) bands (ev): -27.0777 -27.0777 -27.0777 -27.0777 -27.0288 -27.0288 -27.0288 -27.0288 -26.7115 -26.7115 -26.7115 -26.7115 -10.8307 -10.8307 -10.8307 -10.8307 -10.7423 -10.7423 -10.7423 -10.7423 -10.5816 -10.5816 -10.5816 -10.5816 -10.5449 -10.5449 -10.5449 -10.5449 -10.4414 -10.4414 -10.4414 -10.4414 -10.4236 -10.4236 -10.4236 -10.4236 -10.3606 -10.3606 -10.3606 -10.3606 -10.1680 -10.1680 -10.1680 -10.1680 -10.0835 -10.0835 -10.0835 -10.0835 -4.4615 -4.4615 -4.4615 -4.4615 2.9441 2.9441 2.9441 2.9441 3.5874 3.5874 3.5874 3.5874 3.7101 3.7101 3.7101 3.7101 5.2636 5.2636 5.2636 5.2636 7.0872 7.0872 7.0872 7.0872 7.3310 7.3310 7.3310 7.3310 k = 0.0625 0.0361 0.2828 ( 8820 PWs) bands (ev): -27.0776 -27.0776 -27.0776 -27.0776 -27.0289 -27.0289 -27.0289 -27.0289 -26.7116 -26.7116 -26.7116 -26.7116 -10.8307 -10.8307 -10.8307 -10.8307 -10.7430 -10.7430 -10.7430 -10.7430 -10.5825 -10.5825 -10.5825 -10.5825 -10.5443 -10.5443 -10.5443 -10.5443 -10.4442 -10.4442 -10.4442 -10.4442 -10.4207 -10.4207 -10.4207 -10.4207 -10.3601 -10.3601 -10.3601 -10.3601 -10.1679 -10.1679 -10.1679 -10.1679 -10.0836 -10.0836 -10.0836 -10.0836 -4.4597 -4.4597 -4.4597 -4.4597 2.9420 2.9420 2.9420 2.9420 3.5842 3.5842 3.5842 3.5842 3.7078 3.7078 3.7078 3.7078 5.2800 5.2800 5.2800 5.2800 7.0608 7.0608 7.0608 7.0608 7.3344 7.3344 7.3344 7.3344 k = 0.0781 0.0451 0.2828 ( 8812 PWs) bands (ev): -27.0775 -27.0775 -27.0775 -27.0775 -27.0290 -27.0290 -27.0290 -27.0290 -26.7116 -26.7116 -26.7116 -26.7116 -10.8308 -10.8308 -10.8308 -10.8308 -10.7439 -10.7439 -10.7439 -10.7439 -10.5837 -10.5837 -10.5837 -10.5837 -10.5437 -10.5437 -10.5437 -10.5437 -10.4468 -10.4468 -10.4468 -10.4468 -10.4178 -10.4178 -10.4178 -10.4178 -10.3595 -10.3595 -10.3595 -10.3595 -10.1678 -10.1678 -10.1678 -10.1678 -10.0837 -10.0837 -10.0837 -10.0837 -4.4575 -4.4575 -4.4575 -4.4575 2.9393 2.9393 2.9393 2.9393 3.5801 3.5801 3.5801 3.5801 3.7055 3.7055 3.7055 3.7055 5.2999 5.2999 5.2999 5.2999 7.0354 7.0354 7.0354 7.0354 7.3387 7.3387 7.3387 7.3387 k = 0.0938 0.0541 0.2828 ( 8814 PWs) bands (ev): -27.0773 -27.0773 -27.0773 -27.0773 -27.0291 -27.0291 -27.0291 -27.0291 -26.7116 -26.7116 -26.7116 -26.7116 -10.8308 -10.8308 -10.8308 -10.8308 -10.7449 -10.7449 -10.7449 -10.7449 -10.5849 -10.5849 -10.5849 -10.5849 -10.5431 -10.5431 -10.5431 -10.5431 -10.4493 -10.4493 -10.4493 -10.4493 -10.4150 -10.4150 -10.4150 -10.4150 -10.3587 -10.3587 -10.3587 -10.3587 -10.1677 -10.1677 -10.1677 -10.1677 -10.0838 -10.0838 -10.0838 -10.0838 -4.4548 -4.4548 -4.4548 -4.4548 2.9358 2.9358 2.9358 2.9358 3.5750 3.5750 3.5750 3.5750 3.7037 3.7037 3.7037 3.7037 5.3225 5.3225 5.3225 5.3225 7.0124 7.0124 7.0124 7.0124 7.3439 7.3439 7.3439 7.3439 k = 0.1094 0.0631 0.2828 ( 8824 PWs) bands (ev): -27.0771 -27.0771 -27.0771 -27.0771 -27.0293 -27.0293 -27.0293 -27.0293 -26.7117 -26.7117 -26.7117 -26.7117 -10.8309 -10.8309 -10.8309 -10.8309 -10.7461 -10.7461 -10.7461 -10.7461 -10.5863 -10.5863 -10.5863 -10.5863 -10.5425 -10.5425 -10.5425 -10.5425 -10.4516 -10.4516 -10.4516 -10.4516 -10.4123 -10.4123 -10.4123 -10.4123 -10.3579 -10.3579 -10.3579 -10.3579 -10.1676 -10.1676 -10.1676 -10.1676 -10.0840 -10.0840 -10.0840 -10.0840 -4.4516 -4.4516 -4.4516 -4.4516 2.9317 2.9317 2.9317 2.9317 3.5691 3.5691 3.5691 3.5691 3.7027 3.7027 3.7027 3.7027 5.3470 5.3470 5.3470 5.3470 6.9926 6.9926 6.9926 6.9926 7.3500 7.3500 7.3500 7.3500 k = 0.1250 0.0722 0.2828 ( 8820 PWs) bands (ev): -27.0769 -27.0769 -27.0769 -27.0769 -27.0294 -27.0294 -27.0294 -27.0294 -26.7117 -26.7117 -26.7117 -26.7117 -10.8310 -10.8310 -10.8310 -10.8310 -10.7475 -10.7475 -10.7475 -10.7475 -10.5878 -10.5878 -10.5878 -10.5878 -10.5420 -10.5420 -10.5420 -10.5420 -10.4538 -10.4538 -10.4538 -10.4538 -10.4097 -10.4097 -10.4097 -10.4097 -10.3569 -10.3569 -10.3569 -10.3569 -10.1674 -10.1674 -10.1674 -10.1674 -10.0842 -10.0842 -10.0842 -10.0842 -4.4481 -4.4481 -4.4481 -4.4481 2.9268 2.9268 2.9268 2.9268 3.5627 3.5627 3.5627 3.5627 3.7026 3.7026 3.7026 3.7026 5.3724 5.3724 5.3724 5.3724 6.9768 6.9768 6.9768 6.9768 7.3570 7.3570 7.3570 7.3570 k = 0.1406 0.0812 0.2828 ( 8816 PWs) bands (ev): -27.0766 -27.0766 -27.0766 -27.0766 -27.0296 -27.0296 -27.0296 -27.0296 -26.7118 -26.7118 -26.7118 -26.7118 -10.8312 -10.8312 -10.8312 -10.8312 -10.7489 -10.7489 -10.7489 -10.7489 -10.5894 -10.5894 -10.5894 -10.5894 -10.5417 -10.5417 -10.5417 -10.5417 -10.4556 -10.4556 -10.4556 -10.4556 -10.4072 -10.4072 -10.4072 -10.4072 -10.3558 -10.3558 -10.3558 -10.3558 -10.1672 -10.1672 -10.1672 -10.1672 -10.0844 -10.0844 -10.0844 -10.0844 -4.4442 -4.4442 -4.4442 -4.4442 2.9212 2.9212 2.9212 2.9212 3.5560 3.5560 3.5560 3.5560 3.7034 3.7034 3.7034 3.7034 5.3979 5.3979 5.3979 5.3979 6.9654 6.9654 6.9654 6.9654 7.3649 7.3649 7.3649 7.3649 k = 0.1562 0.0902 0.2828 ( 8820 PWs) bands (ev): -27.0763 -27.0763 -27.0763 -27.0763 -27.0299 -27.0299 -27.0299 -27.0299 -26.7118 -26.7118 -26.7118 -26.7118 -10.8313 -10.8313 -10.8313 -10.8313 -10.7505 -10.7505 -10.7505 -10.7505 -10.5910 -10.5910 -10.5910 -10.5910 -10.5416 -10.5416 -10.5416 -10.5416 -10.4573 -10.4573 -10.4573 -10.4573 -10.4047 -10.4047 -10.4047 -10.4047 -10.3546 -10.3546 -10.3546 -10.3546 -10.1670 -10.1670 -10.1670 -10.1670 -10.0846 -10.0846 -10.0846 -10.0846 -4.4401 -4.4401 -4.4401 -4.4401 2.9148 2.9148 2.9148 2.9148 3.5494 3.5494 3.5494 3.5494 3.7052 3.7052 3.7052 3.7052 5.4224 5.4224 5.4224 5.4224 6.9587 6.9587 6.9587 6.9587 7.3735 7.3735 7.3735 7.3735 k = 0.1719 0.0992 0.2828 ( 8846 PWs) bands (ev): -27.0761 -27.0761 -27.0761 -27.0761 -27.0301 -27.0301 -27.0301 -27.0301 -26.7119 -26.7119 -26.7119 -26.7119 -10.8315 -10.8315 -10.8315 -10.8315 -10.7521 -10.7521 -10.7521 -10.7521 -10.5926 -10.5926 -10.5926 -10.5926 -10.5416 -10.5416 -10.5416 -10.5416 -10.4587 -10.4587 -10.4587 -10.4587 -10.4024 -10.4024 -10.4024 -10.4024 -10.3533 -10.3533 -10.3533 -10.3533 -10.1669 -10.1669 -10.1669 -10.1669 -10.0849 -10.0849 -10.0849 -10.0849 -4.4356 -4.4356 -4.4356 -4.4356 2.9077 2.9077 2.9077 2.9077 3.5432 3.5432 3.5432 3.5432 3.7078 3.7078 3.7078 3.7078 5.4453 5.4453 5.4453 5.4453 6.9567 6.9567 6.9567 6.9567 7.3828 7.3828 7.3828 7.3828 k = 0.1875 0.1083 0.2828 ( 8848 PWs) bands (ev): -27.0757 -27.0757 -27.0757 -27.0757 -27.0304 -27.0304 -27.0304 -27.0304 -26.7120 -26.7120 -26.7120 -26.7120 -10.8316 -10.8316 -10.8316 -10.8316 -10.7538 -10.7538 -10.7538 -10.7538 -10.5942 -10.5942 -10.5942 -10.5942 -10.5419 -10.5419 -10.5419 -10.5419 -10.4598 -10.4598 -10.4598 -10.4598 -10.4002 -10.4002 -10.4002 -10.4002 -10.3519 -10.3519 -10.3519 -10.3519 -10.1667 -10.1667 -10.1667 -10.1667 -10.0851 -10.0851 -10.0851 -10.0851 -4.4309 -4.4309 -4.4309 -4.4309 2.9001 2.9001 2.9001 2.9001 3.5377 3.5377 3.5377 3.5377 3.7111 3.7111 3.7111 3.7111 5.4658 5.4658 5.4658 5.4658 6.9594 6.9594 6.9594 6.9594 7.3901 7.3901 7.3901 7.3901 k = 0.2031 0.1173 0.2828 ( 8872 PWs) bands (ev): -27.0754 -27.0754 -27.0754 -27.0754 -27.0307 -27.0307 -27.0307 -27.0307 -26.7121 -26.7121 -26.7121 -26.7121 -10.8318 -10.8318 -10.8318 -10.8318 -10.7555 -10.7555 -10.7555 -10.7555 -10.5958 -10.5958 -10.5958 -10.5958 -10.5424 -10.5424 -10.5424 -10.5424 -10.4607 -10.4607 -10.4607 -10.4607 -10.3980 -10.3980 -10.3980 -10.3980 -10.3505 -10.3505 -10.3505 -10.3505 -10.1665 -10.1665 -10.1665 -10.1665 -10.0854 -10.0854 -10.0854 -10.0854 -4.4260 -4.4260 -4.4260 -4.4260 2.8918 2.8918 2.8918 2.8918 3.5331 3.5331 3.5331 3.5331 3.7150 3.7150 3.7150 3.7150 5.4834 5.4834 5.4834 5.4834 6.9662 6.9662 6.9662 6.9662 7.3636 7.3636 7.3636 7.3636 k = 0.2188 0.1263 0.2828 ( 8868 PWs) bands (ev): -27.0750 -27.0750 -27.0750 -27.0750 -27.0309 -27.0309 -27.0309 -27.0309 -26.7121 -26.7121 -26.7121 -26.7121 -10.8321 -10.8321 -10.8321 -10.8321 -10.7573 -10.7573 -10.7573 -10.7573 -10.5975 -10.5975 -10.5975 -10.5975 -10.5431 -10.5431 -10.5431 -10.5431 -10.4614 -10.4614 -10.4614 -10.4614 -10.3960 -10.3960 -10.3960 -10.3960 -10.3491 -10.3491 -10.3491 -10.3491 -10.1663 -10.1663 -10.1663 -10.1663 -10.0856 -10.0856 -10.0856 -10.0856 -4.4210 -4.4210 -4.4210 -4.4210 2.8831 2.8831 2.8831 2.8831 3.5296 3.5296 3.5296 3.5296 3.7194 3.7194 3.7194 3.7194 5.4979 5.4979 5.4979 5.4979 6.9764 6.9764 6.9764 6.9764 7.3321 7.3321 7.3321 7.3321 k = 0.2344 0.1353 0.2828 ( 8856 PWs) bands (ev): -27.0747 -27.0747 -27.0747 -27.0747 -27.0312 -27.0312 -27.0312 -27.0312 -26.7122 -26.7122 -26.7122 -26.7122 -10.8323 -10.8323 -10.8323 -10.8323 -10.7590 -10.7590 -10.7590 -10.7590 -10.5991 -10.5991 -10.5991 -10.5991 -10.5440 -10.5440 -10.5440 -10.5440 -10.4618 -10.4618 -10.4618 -10.4618 -10.3939 -10.3939 -10.3939 -10.3939 -10.3476 -10.3476 -10.3476 -10.3476 -10.1660 -10.1660 -10.1660 -10.1660 -10.0858 -10.0858 -10.0858 -10.0858 -4.4159 -4.4159 -4.4159 -4.4159 2.8741 2.8741 2.8741 2.8741 3.5272 3.5272 3.5272 3.5272 3.7241 3.7241 3.7241 3.7241 5.5089 5.5089 5.5089 5.5089 6.9888 6.9888 6.9888 6.9888 7.3014 7.3014 7.3014 7.3014 k = 0.2500 0.1443 0.2828 ( 8856 PWs) bands (ev): -27.0743 -27.0743 -27.0743 -27.0743 -27.0315 -27.0315 -27.0315 -27.0315 -26.7123 -26.7123 -26.7123 -26.7123 -10.8325 -10.8325 -10.8325 -10.8325 -10.7607 -10.7607 -10.7607 -10.7607 -10.6006 -10.6006 -10.6006 -10.6006 -10.5451 -10.5451 -10.5451 -10.5451 -10.4620 -10.4620 -10.4620 -10.4620 -10.3920 -10.3920 -10.3920 -10.3920 -10.3462 -10.3462 -10.3462 -10.3462 -10.1658 -10.1658 -10.1658 -10.1658 -10.0861 -10.0861 -10.0861 -10.0861 -4.4107 -4.4107 -4.4107 -4.4107 2.8650 2.8650 2.8650 2.8650 3.5259 3.5259 3.5259 3.5259 3.7292 3.7292 3.7292 3.7292 5.5166 5.5166 5.5166 5.5166 7.0014 7.0014 7.0014 7.0014 7.2730 7.2730 7.2730 7.2730 k = 0.2656 0.1534 0.2828 ( 8864 PWs) bands (ev): -27.0739 -27.0739 -27.0739 -27.0739 -27.0318 -27.0318 -27.0318 -27.0318 -26.7123 -26.7123 -26.7123 -26.7123 -10.8328 -10.8328 -10.8328 -10.8328 -10.7624 -10.7624 -10.7624 -10.7624 -10.6022 -10.6022 -10.6022 -10.6022 -10.5463 -10.5463 -10.5463 -10.5463 -10.4620 -10.4620 -10.4620 -10.4620 -10.3901 -10.3901 -10.3901 -10.3901 -10.3448 -10.3448 -10.3448 -10.3448 -10.1657 -10.1657 -10.1657 -10.1657 -10.0863 -10.0863 -10.0863 -10.0863 -4.4056 -4.4056 -4.4056 -4.4056 2.8557 2.8557 2.8557 2.8557 3.5256 3.5256 3.5256 3.5256 3.7344 3.7344 3.7344 3.7344 5.5212 5.5212 5.5212 5.5212 7.0122 7.0122 7.0122 7.0122 7.2487 7.2487 7.2487 7.2487 k = 0.2812 0.1624 0.2828 ( 8860 PWs) bands (ev): -27.0735 -27.0735 -27.0735 -27.0735 -27.0321 -27.0321 -27.0321 -27.0321 -26.7124 -26.7124 -26.7124 -26.7124 -10.8330 -10.8330 -10.8330 -10.8330 -10.7640 -10.7640 -10.7640 -10.7640 -10.6037 -10.6037 -10.6037 -10.6037 -10.5476 -10.5476 -10.5476 -10.5476 -10.4619 -10.4619 -10.4619 -10.4619 -10.3882 -10.3882 -10.3882 -10.3882 -10.3434 -10.3434 -10.3434 -10.3434 -10.1655 -10.1655 -10.1655 -10.1655 -10.0865 -10.0865 -10.0865 -10.0865 -4.4005 -4.4005 -4.4005 -4.4005 2.8466 2.8466 2.8466 2.8466 3.5263 3.5263 3.5263 3.5263 3.7398 3.7398 3.7398 3.7398 5.5230 5.5230 5.5230 5.5230 7.0185 7.0185 7.0185 7.0185 7.2300 7.2300 7.2300 7.2300 k = 0.2969 0.1714 0.2828 ( 8854 PWs) bands (ev): -27.0731 -27.0731 -27.0731 -27.0731 -27.0324 -27.0324 -27.0324 -27.0324 -26.7125 -26.7125 -26.7125 -26.7125 -10.8333 -10.8333 -10.8333 -10.8333 -10.7655 -10.7655 -10.7655 -10.7655 -10.6052 -10.6052 -10.6052 -10.6052 -10.5490 -10.5490 -10.5490 -10.5490 -10.4617 -10.4617 -10.4617 -10.4617 -10.3864 -10.3864 -10.3864 -10.3864 -10.3421 -10.3421 -10.3421 -10.3421 -10.1653 -10.1653 -10.1653 -10.1653 -10.0867 -10.0867 -10.0867 -10.0867 -4.3955 -4.3955 -4.3955 -4.3955 2.8376 2.8376 2.8376 2.8376 3.5278 3.5278 3.5278 3.5278 3.7451 3.7451 3.7451 3.7451 5.5224 5.5224 5.5224 5.5224 7.0184 7.0184 7.0184 7.0184 7.2182 7.2182 7.2182 7.2182 k = 0.3125 0.1804 0.2828 ( 8864 PWs) bands (ev): -27.0727 -27.0727 -27.0727 -27.0727 -27.0328 -27.0328 -27.0328 -27.0328 -26.7125 -26.7125 -26.7125 -26.7125 -10.8336 -10.8336 -10.8336 -10.8336 -10.7670 -10.7670 -10.7670 -10.7670 -10.6066 -10.6066 -10.6066 -10.6066 -10.5504 -10.5504 -10.5504 -10.5504 -10.4614 -10.4614 -10.4614 -10.4614 -10.3847 -10.3847 -10.3847 -10.3847 -10.3409 -10.3409 -10.3409 -10.3409 -10.1652 -10.1652 -10.1652 -10.1652 -10.0868 -10.0868 -10.0868 -10.0868 -4.3907 -4.3907 -4.3907 -4.3907 2.8290 2.8290 2.8290 2.8290 3.5301 3.5301 3.5301 3.5301 3.7504 3.7504 3.7504 3.7504 5.5198 5.5198 5.5198 5.5198 7.0114 7.0114 7.0114 7.0114 7.2125 7.2125 7.2125 7.2125 k = 0.3281 0.1894 0.2828 ( 8874 PWs) bands (ev): -27.0724 -27.0724 -27.0724 -27.0724 -27.0331 -27.0331 -27.0331 -27.0331 -26.7126 -26.7126 -26.7126 -26.7126 -10.8338 -10.8338 -10.8338 -10.8338 -10.7684 -10.7684 -10.7684 -10.7684 -10.6079 -10.6079 -10.6079 -10.6079 -10.5518 -10.5518 -10.5518 -10.5518 -10.4611 -10.4611 -10.4611 -10.4611 -10.3830 -10.3830 -10.3830 -10.3830 -10.3399 -10.3399 -10.3399 -10.3399 -10.1650 -10.1650 -10.1650 -10.1650 -10.0870 -10.0870 -10.0870 -10.0870 -4.3861 -4.3861 -4.3861 -4.3861 2.8208 2.8208 2.8208 2.8208 3.5329 3.5329 3.5329 3.5329 3.7555 3.7555 3.7555 3.7555 5.5156 5.5156 5.5156 5.5156 6.9991 6.9991 6.9991 6.9991 7.2110 7.2110 7.2110 7.2110 k = 0.3438 0.1985 0.2828 ( 8878 PWs) bands (ev): -27.0720 -27.0720 -27.0720 -27.0720 -27.0334 -27.0334 -27.0334 -27.0334 -26.7127 -26.7127 -26.7127 -26.7127 -10.8341 -10.8341 -10.8341 -10.8341 -10.7697 -10.7697 -10.7697 -10.7697 -10.6092 -10.6092 -10.6092 -10.6092 -10.5532 -10.5532 -10.5532 -10.5532 -10.4607 -10.4607 -10.4607 -10.4607 -10.3814 -10.3814 -10.3814 -10.3814 -10.3389 -10.3389 -10.3389 -10.3389 -10.1649 -10.1649 -10.1649 -10.1649 -10.0871 -10.0871 -10.0871 -10.0871 -4.3817 -4.3817 -4.3817 -4.3817 2.8131 2.8131 2.8131 2.8131 3.5361 3.5361 3.5361 3.5361 3.7605 3.7605 3.7605 3.7605 5.5102 5.5102 5.5102 5.5102 6.9837 6.9837 6.9837 6.9837 7.2108 7.2108 7.2108 7.2108 k = 0.3594 0.2075 0.2828 ( 8882 PWs) bands (ev): -27.0717 -27.0717 -27.0717 -27.0717 -27.0336 -27.0336 -27.0336 -27.0336 -26.7127 -26.7127 -26.7127 -26.7127 -10.8344 -10.8344 -10.8344 -10.8344 -10.7709 -10.7709 -10.7709 -10.7709 -10.6104 -10.6104 -10.6104 -10.6104 -10.5546 -10.5546 -10.5546 -10.5546 -10.4603 -10.4603 -10.4603 -10.4603 -10.3798 -10.3798 -10.3798 -10.3798 -10.3380 -10.3380 -10.3380 -10.3380 -10.1648 -10.1648 -10.1648 -10.1648 -10.0872 -10.0872 -10.0872 -10.0872 -4.3776 -4.3776 -4.3776 -4.3776 2.8061 2.8061 2.8061 2.8061 3.5395 3.5395 3.5395 3.5395 3.7652 3.7652 3.7652 3.7652 5.5042 5.5042 5.5042 5.5042 6.9672 6.9672 6.9672 6.9672 7.2102 7.2102 7.2102 7.2102 k = 0.3750 0.2165 0.2828 ( 8876 PWs) bands (ev): -27.0714 -27.0714 -27.0714 -27.0714 -27.0339 -27.0339 -27.0339 -27.0339 -26.7128 -26.7128 -26.7128 -26.7128 -10.8346 -10.8346 -10.8346 -10.8346 -10.7719 -10.7719 -10.7719 -10.7719 -10.6115 -10.6115 -10.6115 -10.6115 -10.5558 -10.5558 -10.5558 -10.5558 -10.4599 -10.4599 -10.4599 -10.4599 -10.3784 -10.3784 -10.3784 -10.3784 -10.3372 -10.3372 -10.3372 -10.3372 -10.1647 -10.1647 -10.1647 -10.1647 -10.0873 -10.0873 -10.0873 -10.0873 -4.3738 -4.3738 -4.3738 -4.3738 2.7996 2.7996 2.7996 2.7996 3.5431 3.5431 3.5431 3.5431 3.7695 3.7695 3.7695 3.7695 5.4979 5.4979 5.4979 5.4979 6.9508 6.9508 6.9508 6.9508 7.2079 7.2079 7.2079 7.2079 k = 0.3906 0.2255 0.2828 ( 8868 PWs) bands (ev): -27.0711 -27.0711 -27.0711 -27.0711 -27.0341 -27.0341 -27.0341 -27.0341 -26.7128 -26.7128 -26.7128 -26.7128 -10.8349 -10.8349 -10.8349 -10.8349 -10.7729 -10.7729 -10.7729 -10.7729 -10.6124 -10.6124 -10.6124 -10.6124 -10.5570 -10.5570 -10.5570 -10.5570 -10.4595 -10.4595 -10.4595 -10.4595 -10.3770 -10.3770 -10.3770 -10.3770 -10.3366 -10.3366 -10.3366 -10.3366 -10.1647 -10.1647 -10.1647 -10.1647 -10.0874 -10.0874 -10.0874 -10.0874 -4.3704 -4.3704 -4.3704 -4.3704 2.7939 2.7939 2.7939 2.7939 3.5466 3.5466 3.5466 3.5466 3.7735 3.7735 3.7735 3.7735 5.4915 5.4915 5.4915 5.4915 6.9355 6.9355 6.9355 6.9355 7.2039 7.2039 7.2039 7.2039 k = 0.4062 0.2345 0.2828 ( 8876 PWs) bands (ev): -27.0708 -27.0708 -27.0708 -27.0708 -27.0343 -27.0343 -27.0343 -27.0343 -26.7129 -26.7129 -26.7129 -26.7129 -10.8351 -10.8351 -10.8351 -10.8351 -10.7737 -10.7737 -10.7737 -10.7737 -10.6133 -10.6133 -10.6133 -10.6133 -10.5580 -10.5580 -10.5580 -10.5580 -10.4592 -10.4592 -10.4592 -10.4592 -10.3758 -10.3758 -10.3758 -10.3758 -10.3360 -10.3360 -10.3360 -10.3360 -10.1646 -10.1646 -10.1646 -10.1646 -10.0875 -10.0875 -10.0875 -10.0875 -4.3674 -4.3674 -4.3674 -4.3674 2.7889 2.7889 2.7889 2.7889 3.5499 3.5499 3.5499 3.5499 3.7771 3.7771 3.7771 3.7771 5.4854 5.4854 5.4854 5.4854 6.9218 6.9218 6.9218 6.9218 7.1984 7.1984 7.1984 7.1984 k = 0.4219 0.2436 0.2828 ( 8866 PWs) bands (ev): -27.0706 -27.0706 -27.0706 -27.0706 -27.0345 -27.0345 -27.0345 -27.0345 -26.7129 -26.7129 -26.7129 -26.7129 -10.8352 -10.8352 -10.8352 -10.8352 -10.7744 -10.7744 -10.7744 -10.7744 -10.6141 -10.6141 -10.6141 -10.6141 -10.5589 -10.5589 -10.5589 -10.5589 -10.4589 -10.4589 -10.4589 -10.4589 -10.3747 -10.3747 -10.3747 -10.3747 -10.3356 -10.3356 -10.3356 -10.3356 -10.1646 -10.1646 -10.1646 -10.1646 -10.0875 -10.0875 -10.0875 -10.0875 -4.3648 -4.3648 -4.3648 -4.3648 2.7847 2.7847 2.7847 2.7847 3.5529 3.5529 3.5529 3.5529 3.7802 3.7802 3.7802 3.7802 5.4799 5.4799 5.4799 5.4799 6.9099 6.9099 6.9099 6.9099 7.1920 7.1920 7.1920 7.1920 k = 0.4375 0.2526 0.2828 ( 8872 PWs) bands (ev): -27.0704 -27.0704 -27.0704 -27.0704 -27.0347 -27.0347 -27.0347 -27.0347 -26.7129 -26.7129 -26.7129 -26.7129 -10.8354 -10.8354 -10.8354 -10.8354 -10.7750 -10.7750 -10.7750 -10.7750 -10.6147 -10.6147 -10.6147 -10.6147 -10.5597 -10.5597 -10.5597 -10.5597 -10.4586 -10.4586 -10.4586 -10.4586 -10.3738 -10.3738 -10.3738 -10.3738 -10.3353 -10.3353 -10.3353 -10.3353 -10.1646 -10.1646 -10.1646 -10.1646 -10.0875 -10.0875 -10.0875 -10.0875 -4.3627 -4.3627 -4.3627 -4.3627 2.7812 2.7812 2.7812 2.7812 3.5555 3.5555 3.5555 3.5555 3.7828 3.7828 3.7828 3.7828 5.4751 5.4751 5.4751 5.4751 6.9002 6.9002 6.9002 6.9002 7.1855 7.1855 7.1855 7.1855 k = 0.4531 0.2616 0.2828 ( 8872 PWs) bands (ev): -27.0702 -27.0702 -27.0702 -27.0702 -27.0348 -27.0348 -27.0348 -27.0348 -26.7130 -26.7130 -26.7130 -26.7130 -10.8355 -10.8355 -10.8355 -10.8355 -10.7755 -10.7755 -10.7755 -10.7755 -10.6152 -10.6152 -10.6152 -10.6152 -10.5603 -10.5603 -10.5603 -10.5603 -10.4584 -10.4584 -10.4584 -10.4584 -10.3730 -10.3730 -10.3730 -10.3730 -10.3350 -10.3350 -10.3350 -10.3350 -10.1645 -10.1645 -10.1645 -10.1645 -10.0875 -10.0875 -10.0875 -10.0875 -4.3610 -4.3610 -4.3610 -4.3610 2.7785 2.7785 2.7785 2.7785 3.5576 3.5576 3.5576 3.5576 3.7848 3.7848 3.7848 3.7848 5.4712 5.4712 5.4712 5.4712 6.8925 6.8925 6.8925 6.8925 7.1795 7.1795 7.1795 7.1795 k = 0.4688 0.2706 0.2828 ( 8868 PWs) bands (ev): -27.0701 -27.0701 -27.0701 -27.0701 -27.0349 -27.0349 -27.0349 -27.0349 -26.7130 -26.7130 -26.7130 -26.7130 -10.8356 -10.8356 -10.8356 -10.8356 -10.7758 -10.7758 -10.7758 -10.7758 -10.6156 -10.6156 -10.6156 -10.6156 -10.5607 -10.5607 -10.5607 -10.5607 -10.4582 -10.4582 -10.4582 -10.4582 -10.3725 -10.3725 -10.3725 -10.3725 -10.3348 -10.3348 -10.3348 -10.3348 -10.1645 -10.1645 -10.1645 -10.1645 -10.0876 -10.0876 -10.0876 -10.0876 -4.3597 -4.3597 -4.3597 -4.3597 2.7765 2.7765 2.7765 2.7765 3.5591 3.5591 3.5591 3.5591 3.7863 3.7863 3.7863 3.7863 5.4683 5.4683 5.4683 5.4683 6.8871 6.8871 6.8871 6.8871 7.1748 7.1748 7.1748 7.1748 k = 0.4844 0.2797 0.2828 ( 8870 PWs) bands (ev): -27.0700 -27.0700 -27.0700 -27.0700 -27.0350 -27.0350 -27.0350 -27.0350 -26.7130 -26.7130 -26.7130 -26.7130 -10.8357 -10.8357 -10.8357 -10.8357 -10.7760 -10.7760 -10.7760 -10.7760 -10.6158 -10.6158 -10.6158 -10.6158 -10.5610 -10.5610 -10.5610 -10.5610 -10.4582 -10.4582 -10.4582 -10.4582 -10.3722 -10.3722 -10.3722 -10.3722 -10.3347 -10.3347 -10.3347 -10.3347 -10.1645 -10.1645 -10.1645 -10.1645 -10.0876 -10.0876 -10.0876 -10.0876 -4.3590 -4.3590 -4.3590 -4.3590 2.7753 2.7753 2.7753 2.7753 3.5601 3.5601 3.5601 3.5601 3.7872 3.7872 3.7872 3.7872 5.4665 5.4665 5.4665 5.4665 6.8838 6.8838 6.8838 6.8838 7.1717 7.1717 7.1717 7.1717 k = 0.5000 0.2887 0.2828 ( 8852 PWs) bands (ev): -27.0700 -27.0700 -27.0700 -27.0700 -27.0349 -27.0349 -27.0349 -27.0349 -26.7130 -26.7130 -26.7130 -26.7130 -10.8357 -10.8357 -10.8357 -10.8357 -10.7760 -10.7760 -10.7760 -10.7760 -10.6159 -10.6159 -10.6159 -10.6159 -10.5610 -10.5610 -10.5610 -10.5610 -10.4581 -10.4581 -10.4581 -10.4581 -10.3721 -10.3721 -10.3721 -10.3721 -10.3347 -10.3347 -10.3347 -10.3347 -10.1645 -10.1645 -10.1645 -10.1645 -10.0876 -10.0876 -10.0876 -10.0876 -4.3587 -4.3587 -4.3587 -4.3587 2.7750 2.7750 2.7750 2.7750 3.5604 3.5604 3.5604 3.5604 3.7875 3.7875 3.7875 3.7875 5.4660 5.4660 5.4660 5.4660 6.8828 6.8828 6.8828 6.8828 7.1707 7.1707 7.1707 7.1707 k = 0.5000 0.2887 0.2828 ( 8852 PWs) bands (ev): -27.0700 -27.0700 -27.0700 -27.0700 -27.0349 -27.0349 -27.0349 -27.0349 -26.7130 -26.7130 -26.7130 -26.7130 -10.8357 -10.8357 -10.8357 -10.8357 -10.7760 -10.7760 -10.7760 -10.7760 -10.6159 -10.6159 -10.6159 -10.6159 -10.5610 -10.5610 -10.5610 -10.5610 -10.4581 -10.4581 -10.4581 -10.4581 -10.3721 -10.3721 -10.3721 -10.3721 -10.3347 -10.3347 -10.3347 -10.3347 -10.1645 -10.1645 -10.1645 -10.1645 -10.0876 -10.0876 -10.0876 -10.0876 -4.3587 -4.3587 -4.3587 -4.3587 2.7750 2.7750 2.7750 2.7750 3.5604 3.5604 3.5604 3.5604 3.7875 3.7875 3.7875 3.7875 5.4660 5.4660 5.4660 5.4660 6.8828 6.8828 6.8828 6.8828 7.1707 7.1707 7.1707 7.1707 k = 0.4912 0.3039 0.2828 ( 8872 PWs) bands (ev): -27.0700 -27.0700 -27.0700 -27.0700 -27.0350 -27.0350 -27.0350 -27.0350 -26.7130 -26.7130 -26.7130 -26.7130 -10.8361 -10.8361 -10.8352 -10.8352 -10.7764 -10.7764 -10.7757 -10.7757 -10.6181 -10.6181 -10.6141 -10.6141 -10.5636 -10.5636 -10.5579 -10.5579 -10.4610 -10.4610 -10.4554 -10.4554 -10.3727 -10.3727 -10.3715 -10.3715 -10.3362 -10.3362 -10.3331 -10.3331 -10.1656 -10.1656 -10.1634 -10.1634 -10.0879 -10.0879 -10.0873 -10.0873 -4.3588 -4.3588 -4.3586 -4.3586 2.7758 2.7758 2.7763 2.7763 3.5553 3.5553 3.5627 3.5627 3.7827 3.7827 3.7914 3.7914 5.4663 5.4663 5.4680 5.4680 6.8790 6.8790 6.8799 6.8799 7.1678 7.1678 7.1686 7.1686 k = 0.4825 0.3191 0.2828 ( 8868 PWs) bands (ev): -27.0700 -27.0700 -27.0700 -27.0700 -27.0350 -27.0350 -27.0350 -27.0350 -26.7130 -26.7130 -26.7130 -26.7130 -10.8365 -10.8365 -10.8348 -10.8348 -10.7769 -10.7769 -10.7754 -10.7754 -10.6207 -10.6207 -10.6130 -10.6130 -10.5654 -10.5654 -10.5543 -10.5543 -10.4639 -10.4639 -10.4530 -10.4530 -10.3734 -10.3734 -10.3711 -10.3711 -10.3375 -10.3375 -10.3314 -10.3314 -10.1666 -10.1666 -10.1623 -10.1623 -10.0883 -10.0883 -10.0870 -10.0870 -4.3586 -4.3586 -4.3583 -4.3583 2.7789 2.7789 2.7797 2.7797 3.5474 3.5474 3.5620 3.5620 3.7772 3.7772 3.7944 3.7944 5.4690 5.4690 5.4725 5.4725 6.8680 6.8680 6.8700 6.8700 7.1619 7.1619 7.1641 7.1641 k = 0.4737 0.3343 0.2828 ( 8870 PWs) bands (ev): -27.0700 -27.0700 -27.0700 -27.0700 -27.0350 -27.0350 -27.0350 -27.0350 -26.7130 -26.7130 -26.7130 -26.7130 -10.8368 -10.8368 -10.8342 -10.8342 -10.7774 -10.7774 -10.7752 -10.7752 -10.6235 -10.6235 -10.6125 -10.6125 -10.5665 -10.5665 -10.5503 -10.5503 -10.4670 -10.4670 -10.4508 -10.4508 -10.3740 -10.3740 -10.3708 -10.3708 -10.3388 -10.3388 -10.3296 -10.3296 -10.1675 -10.1675 -10.1612 -10.1612 -10.0887 -10.0887 -10.0868 -10.0868 -4.3584 -4.3584 -4.3579 -4.3579 2.7841 2.7841 2.7854 2.7854 3.5368 3.5368 3.5580 3.5580 3.7714 3.7714 3.7966 3.7966 5.4741 5.4741 5.4793 5.4793 6.8485 6.8485 6.8517 6.8517 7.1576 7.1576 7.1619 7.1619 k = 0.4649 0.3494 0.2828 ( 8870 PWs) bands (ev): -27.0699 -27.0699 -27.0699 -27.0699 -27.0350 -27.0350 -27.0350 -27.0350 -26.7130 -26.7130 -26.7130 -26.7130 -10.8371 -10.8371 -10.8337 -10.8337 -10.7780 -10.7780 -10.7750 -10.7750 -10.6264 -10.6264 -10.6127 -10.6127 -10.5667 -10.5667 -10.5460 -10.5460 -10.4700 -10.4700 -10.4489 -10.4489 -10.3747 -10.3747 -10.3707 -10.3707 -10.3399 -10.3399 -10.3278 -10.3278 -10.1685 -10.1685 -10.1601 -10.1601 -10.0891 -10.0891 -10.0866 -10.0866 -4.3580 -4.3580 -4.3574 -4.3574 2.7915 2.7915 2.7931 2.7931 3.5235 3.5235 3.5505 3.5505 3.7659 3.7659 3.7979 3.7979 5.4814 5.4814 5.4883 5.4883 6.8199 6.8199 6.8243 6.8243 7.1595 7.1595 7.1661 7.1661 k = 0.4561 0.3646 0.2828 ( 8858 PWs) bands (ev): -27.0699 -27.0699 -27.0699 -27.0699 -27.0351 -27.0351 -27.0351 -27.0351 -26.7130 -26.7130 -26.7130 -26.7130 -10.8374 -10.8374 -10.8332 -10.8332 -10.7786 -10.7786 -10.7749 -10.7749 -10.6293 -10.6293 -10.6137 -10.6137 -10.5661 -10.5661 -10.5416 -10.5416 -10.4730 -10.4730 -10.4475 -10.4475 -10.3752 -10.3752 -10.3706 -10.3706 -10.3409 -10.3409 -10.3259 -10.3259 -10.1693 -10.1693 -10.1590 -10.1590 -10.0896 -10.0896 -10.0864 -10.0864 -4.3575 -4.3575 -4.3568 -4.3568 2.8009 2.8009 2.8030 2.8030 3.5076 3.5076 3.5392 3.5392 3.7609 3.7609 3.7988 3.7988 5.4909 5.4909 5.4994 5.4994 6.7831 6.7831 6.7886 6.7886 7.1695 7.1695 7.1786 7.1786 k = 0.4474 0.3798 0.2828 ( 8846 PWs) bands (ev): -27.0698 -27.0698 -27.0698 -27.0698 -27.0351 -27.0351 -27.0351 -27.0351 -26.7130 -26.7130 -26.7130 -26.7130 -10.8376 -10.8376 -10.8326 -10.8326 -10.7792 -10.7792 -10.7748 -10.7748 -10.6323 -10.6323 -10.6151 -10.6151 -10.5649 -10.5649 -10.5369 -10.5369 -10.4760 -10.4760 -10.4465 -10.4465 -10.3756 -10.3756 -10.3707 -10.3707 -10.3418 -10.3418 -10.3239 -10.3239 -10.1701 -10.1701 -10.1579 -10.1579 -10.0901 -10.0901 -10.0863 -10.0863 -4.3569 -4.3569 -4.3560 -4.3560 2.8124 2.8124 2.8149 2.8149 3.4891 3.4891 3.5242 3.5242 3.7569 3.7569 3.7994 3.7994 5.5024 5.5024 5.5124 5.5124 6.7401 6.7401 6.7463 6.7463 7.1876 7.1876 7.1991 7.1991 k = 0.4386 0.3950 0.2828 ( 8854 PWs) bands (ev): -27.0697 -27.0697 -27.0697 -27.0697 -27.0352 -27.0352 -27.0352 -27.0352 -26.7130 -26.7130 -26.7130 -26.7130 -10.8377 -10.8377 -10.8321 -10.8321 -10.7799 -10.7799 -10.7748 -10.7748 -10.6352 -10.6352 -10.6170 -10.6170 -10.5633 -10.5633 -10.5322 -10.5322 -10.4789 -10.4789 -10.4461 -10.4461 -10.3758 -10.3758 -10.3708 -10.3708 -10.3427 -10.3427 -10.3220 -10.3220 -10.1709 -10.1709 -10.1568 -10.1568 -10.0906 -10.0906 -10.0862 -10.0862 -4.3562 -4.3562 -4.3552 -4.3552 2.8259 2.8259 2.8287 2.8287 3.4681 3.4681 3.5056 3.5056 3.7540 3.7540 3.7999 3.7999 5.5157 5.5157 5.5271 5.5271 6.6931 6.6931 6.6997 6.6997 7.2126 7.2126 7.2265 7.2265 k = 0.4298 0.4102 0.2828 ( 8850 PWs) bands (ev): -27.0696 -27.0696 -27.0696 -27.0696 -27.0353 -27.0353 -27.0353 -27.0353 -26.7130 -26.7130 -26.7130 -26.7130 -10.8378 -10.8378 -10.8316 -10.8316 -10.7806 -10.7806 -10.7748 -10.7748 -10.6380 -10.6380 -10.6191 -10.6191 -10.5613 -10.5613 -10.5273 -10.5273 -10.4817 -10.4817 -10.4462 -10.4462 -10.3758 -10.3758 -10.3711 -10.3711 -10.3434 -10.3434 -10.3201 -10.3201 -10.1716 -10.1716 -10.1557 -10.1557 -10.0911 -10.0911 -10.0861 -10.0861 -4.3555 -4.3555 -4.3543 -4.3543 2.8413 2.8413 2.8444 2.8444 3.4449 3.4449 3.4836 3.4836 3.7523 3.7523 3.8004 3.8004 5.5306 5.5306 5.5433 5.5433 6.6438 6.6438 6.6506 6.6506 7.2432 7.2432 7.2595 7.2595 k = 0.4211 0.4254 0.2828 ( 8854 PWs) bands (ev): -27.0695 -27.0695 -27.0695 -27.0695 -27.0353 -27.0353 -27.0353 -27.0353 -26.7131 -26.7131 -26.7131 -26.7131 -10.8379 -10.8379 -10.8311 -10.8311 -10.7814 -10.7814 -10.7748 -10.7748 -10.6406 -10.6406 -10.6213 -10.6213 -10.5591 -10.5591 -10.5224 -10.5224 -10.4844 -10.4844 -10.4469 -10.4469 -10.3756 -10.3756 -10.3714 -10.3714 -10.3441 -10.3441 -10.3183 -10.3183 -10.1723 -10.1723 -10.1547 -10.1547 -10.0916 -10.0916 -10.0861 -10.0861 -4.3547 -4.3547 -4.3534 -4.3534 2.8585 2.8585 2.8619 2.8619 3.4195 3.4195 3.4588 3.4588 3.7517 3.7517 3.8010 3.8010 5.5468 5.5468 5.5607 5.5607 6.5937 6.5937 6.6006 6.6006 7.2781 7.2781 7.2968 7.2968 k = 0.4123 0.4406 0.2828 ( 8856 PWs) bands (ev): -27.0694 -27.0694 -27.0694 -27.0694 -27.0354 -27.0354 -27.0354 -27.0354 -26.7131 -26.7131 -26.7131 -26.7131 -10.8380 -10.8380 -10.8306 -10.8306 -10.7821 -10.7821 -10.7749 -10.7749 -10.6431 -10.6431 -10.6235 -10.6235 -10.5569 -10.5569 -10.5175 -10.5175 -10.4869 -10.4869 -10.4481 -10.4481 -10.3752 -10.3752 -10.3718 -10.3718 -10.3447 -10.3447 -10.3165 -10.3165 -10.1729 -10.1729 -10.1538 -10.1538 -10.0921 -10.0921 -10.0860 -10.0860 -4.3538 -4.3538 -4.3525 -4.3525 2.8774 2.8774 2.8810 2.8810 3.3924 3.3924 3.4317 3.4317 3.7519 3.7519 3.8019 3.8019 5.5640 5.5640 5.5791 5.5791 6.5441 6.5441 6.5509 6.5509 7.3158 7.3158 7.3372 7.3372 k = 0.4035 0.4558 0.2828 ( 8860 PWs) bands (ev): -27.0693 -27.0693 -27.0693 -27.0693 -27.0355 -27.0355 -27.0355 -27.0355 -26.7131 -26.7131 -26.7131 -26.7131 -10.8380 -10.8380 -10.8302 -10.8302 -10.7828 -10.7828 -10.7750 -10.7750 -10.6454 -10.6454 -10.6256 -10.6256 -10.5547 -10.5547 -10.5127 -10.5127 -10.4892 -10.4892 -10.4498 -10.4498 -10.3746 -10.3746 -10.3721 -10.3721 -10.3453 -10.3453 -10.3149 -10.3149 -10.1734 -10.1734 -10.1529 -10.1529 -10.0926 -10.0926 -10.0860 -10.0860 -4.3530 -4.3530 -4.3515 -4.3515 2.8978 2.8978 2.9016 2.9016 3.3640 3.3640 3.4029 3.4029 3.7528 3.7528 3.8029 3.8029 5.5820 5.5820 5.5982 5.5982 6.4958 6.4958 6.5026 6.5026 7.3551 7.3551 7.3792 7.3792 k = 0.3947 0.4710 0.2828 ( 8856 PWs) bands (ev): -27.0692 -27.0692 -27.0692 -27.0692 -27.0356 -27.0356 -27.0356 -27.0356 -26.7131 -26.7131 -26.7131 -26.7131 -10.8379 -10.8379 -10.8298 -10.8298 -10.7836 -10.7836 -10.7751 -10.7751 -10.6474 -10.6474 -10.6277 -10.6277 -10.5526 -10.5526 -10.5078 -10.5078 -10.4913 -10.4913 -10.4519 -10.4519 -10.3739 -10.3739 -10.3725 -10.3725 -10.3458 -10.3458 -10.3133 -10.3133 -10.1738 -10.1738 -10.1521 -10.1521 -10.0930 -10.0930 -10.0860 -10.0860 -4.3521 -4.3521 -4.3505 -4.3505 2.9197 2.9197 2.9235 2.9235 3.3344 3.3344 3.3729 3.3729 3.7542 3.7542 3.8041 3.8041 5.6003 5.6003 5.6174 5.6174 6.4500 6.4500 6.4565 6.4565 7.3945 7.3945 7.4217 7.4217 k = 0.3860 0.4862 0.2828 ( 8848 PWs) bands (ev): -27.0691 -27.0691 -27.0691 -27.0691 -27.0356 -27.0356 -27.0356 -27.0356 -26.7131 -26.7131 -26.7131 -26.7131 -10.8379 -10.8379 -10.8294 -10.8294 -10.7842 -10.7842 -10.7752 -10.7752 -10.6492 -10.6492 -10.6295 -10.6295 -10.5507 -10.5507 -10.5031 -10.5031 -10.4932 -10.4932 -10.4544 -10.4544 -10.3731 -10.3731 -10.3729 -10.3729 -10.3463 -10.3463 -10.3120 -10.3120 -10.1742 -10.1742 -10.1514 -10.1514 -10.0934 -10.0934 -10.0859 -10.0859 -4.3513 -4.3513 -4.3496 -4.3496 2.9428 2.9428 2.9464 2.9464 3.3042 3.3042 3.3423 3.3423 3.7558 3.7558 3.8054 3.8054 5.6183 5.6183 5.6364 5.6364 6.4073 6.4073 6.4136 6.4136 7.4324 7.4324 7.4628 7.4628 k = 0.3772 0.5014 0.2828 ( 8860 PWs) bands (ev): -27.0691 -27.0691 -27.0691 -27.0691 -27.0357 -27.0357 -27.0357 -27.0357 -26.7131 -26.7131 -26.7131 -26.7131 -10.8378 -10.8378 -10.8291 -10.8291 -10.7848 -10.7848 -10.7753 -10.7753 -10.6507 -10.6507 -10.6311 -10.6311 -10.5490 -10.5490 -10.4984 -10.4984 -10.4948 -10.4948 -10.4573 -10.4573 -10.3733 -10.3733 -10.3723 -10.3723 -10.3468 -10.3468 -10.3108 -10.3108 -10.1746 -10.1746 -10.1508 -10.1508 -10.0938 -10.0938 -10.0859 -10.0859 -4.3505 -4.3505 -4.3488 -4.3488 2.9669 2.9669 2.9699 2.9699 3.2738 3.2738 3.3119 3.3119 3.7575 3.7575 3.8067 3.8067 5.6355 5.6355 5.6546 5.6546 6.3688 6.3688 6.3747 6.3747 7.4673 7.4673 7.5011 7.5011 k = 0.3684 0.5166 0.2828 ( 8860 PWs) bands (ev): -27.0690 -27.0690 -27.0690 -27.0690 -27.0358 -27.0358 -27.0358 -27.0358 -26.7131 -26.7131 -26.7131 -26.7131 -10.8378 -10.8378 -10.8289 -10.8289 -10.7854 -10.7854 -10.7754 -10.7754 -10.6520 -10.6520 -10.6324 -10.6324 -10.5476 -10.5476 -10.4961 -10.4961 -10.4939 -10.4939 -10.4604 -10.4604 -10.3736 -10.3736 -10.3715 -10.3715 -10.3471 -10.3471 -10.3097 -10.3097 -10.1748 -10.1748 -10.1503 -10.1503 -10.0941 -10.0941 -10.0859 -10.0859 -4.3498 -4.3498 -4.3481 -4.3481 2.9916 2.9916 2.9935 2.9935 3.2438 3.2438 3.2823 3.2823 3.7592 3.7592 3.8079 3.8079 5.6512 5.6512 5.6711 5.6711 6.3354 6.3354 6.3409 6.3409 7.4975 7.4975 7.5347 7.5347 k = 0.3596 0.5318 0.2828 ( 8848 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0358 -27.0358 -27.0358 -27.0358 -26.7131 -26.7131 -26.7131 -26.7131 -10.8377 -10.8377 -10.8287 -10.8287 -10.7858 -10.7858 -10.7755 -10.7755 -10.6530 -10.6530 -10.6335 -10.6335 -10.5465 -10.5465 -10.4971 -10.4971 -10.4897 -10.4897 -10.4636 -10.4636 -10.3738 -10.3738 -10.3709 -10.3709 -10.3475 -10.3475 -10.3089 -10.3089 -10.1750 -10.1750 -10.1499 -10.1499 -10.0944 -10.0944 -10.0859 -10.0859 -4.3492 -4.3492 -4.3475 -4.3475 3.0164 3.0164 3.0164 3.0164 3.2147 3.2147 3.2547 3.2547 3.7606 3.7606 3.8090 3.8090 5.6646 5.6646 5.6852 5.6852 6.3081 6.3081 6.3132 6.3132 7.5216 7.5216 7.5617 7.5617 k = 0.3509 0.5470 0.2828 ( 8868 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7132 -26.7132 -26.7132 -26.7132 -10.8377 -10.8377 -10.8286 -10.8286 -10.7862 -10.7862 -10.7755 -10.7755 -10.6537 -10.6537 -10.6343 -10.6343 -10.5457 -10.5457 -10.4979 -10.4979 -10.4857 -10.4857 -10.4668 -10.4668 -10.3740 -10.3740 -10.3703 -10.3703 -10.3477 -10.3477 -10.3083 -10.3083 -10.1752 -10.1752 -10.1497 -10.1497 -10.0945 -10.0945 -10.0859 -10.0859 -4.3488 -4.3488 -4.3470 -4.3470 3.0367 3.0367 3.0400 3.0400 3.1880 3.1880 3.2308 3.2308 3.7618 3.7618 3.8099 3.8099 5.6748 5.6748 5.6960 5.6960 6.2878 6.2878 6.2925 6.2925 7.5386 7.5386 7.5811 7.5811 k = 0.3421 0.5622 0.2828 ( 8874 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7132 -26.7132 -26.7132 -26.7132 -10.8376 -10.8376 -10.8285 -10.8285 -10.7864 -10.7864 -10.7756 -10.7756 -10.6541 -10.6541 -10.6348 -10.6348 -10.5452 -10.5452 -10.4983 -10.4983 -10.4824 -10.4824 -10.4697 -10.4697 -10.3741 -10.3741 -10.3700 -10.3700 -10.3479 -10.3479 -10.3080 -10.3080 -10.1753 -10.1753 -10.1495 -10.1495 -10.0946 -10.0946 -10.0859 -10.0859 -4.3485 -4.3485 -4.3467 -4.3467 3.0517 3.0517 3.0595 3.0595 3.1666 3.1666 3.2137 3.2137 3.7626 3.7626 3.8105 3.8105 5.6812 5.6812 5.7028 5.7028 6.2753 6.2753 6.2798 6.2798 7.5483 7.5483 7.5922 7.5922 k = 0.3333 0.5774 0.2828 ( 8874 PWs) bands (ev): -27.0688 -27.0688 -27.0688 -27.0688 -27.0359 -27.0359 -27.0359 -27.0359 -26.7132 -26.7132 -26.7132 -26.7132 -10.8376 -10.8376 -10.8285 -10.8285 -10.7865 -10.7865 -10.7756 -10.7756 -10.6543 -10.6543 -10.6349 -10.6349 -10.5451 -10.5451 -10.4984 -10.4984 -10.4810 -10.4810 -10.4710 -10.4710 -10.3742 -10.3742 -10.3698 -10.3698 -10.3480 -10.3480 -10.3078 -10.3078 -10.1753 -10.1753 -10.1494 -10.1494 -10.0947 -10.0947 -10.0859 -10.0859 -4.3484 -4.3484 -4.3466 -4.3466 3.0574 3.0574 3.0680 3.0680 3.1575 3.1575 3.2073 3.2073 3.7629 3.7629 3.8107 3.8107 5.6834 5.6834 5.7050 5.7050 6.2711 6.2711 6.2756 6.2756 7.5513 7.5513 7.5956 7.5956 k = 0.3333 0.5774 0.2828 ( 8874 PWs) bands (ev): -27.0688 -27.0688 -27.0688 -27.0688 -27.0359 -27.0359 -27.0359 -27.0359 -26.7132 -26.7132 -26.7132 -26.7132 -10.8376 -10.8376 -10.8285 -10.8285 -10.7865 -10.7865 -10.7756 -10.7756 -10.6543 -10.6543 -10.6349 -10.6349 -10.5451 -10.5451 -10.4984 -10.4984 -10.4810 -10.4810 -10.4710 -10.4710 -10.3742 -10.3742 -10.3698 -10.3698 -10.3480 -10.3480 -10.3078 -10.3078 -10.1753 -10.1753 -10.1494 -10.1494 -10.0947 -10.0947 -10.0859 -10.0859 -4.3484 -4.3484 -4.3466 -4.3466 3.0574 3.0574 3.0680 3.0680 3.1575 3.1575 3.2073 3.2073 3.7629 3.7629 3.8107 3.8107 5.6834 5.6834 5.7050 5.7050 6.2711 6.2711 6.2756 6.2756 7.5513 7.5513 7.5956 7.5956 k = 0.3243 0.5617 0.2828 ( 8870 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7132 -26.7132 -26.7132 -26.7132 -10.8376 -10.8376 -10.8285 -10.8285 -10.7864 -10.7864 -10.7756 -10.7756 -10.6541 -10.6541 -10.6348 -10.6348 -10.5452 -10.5452 -10.4983 -10.4983 -10.4825 -10.4825 -10.4697 -10.4697 -10.3741 -10.3741 -10.3700 -10.3700 -10.3479 -10.3479 -10.3080 -10.3080 -10.1753 -10.1753 -10.1495 -10.1495 -10.0946 -10.0946 -10.0859 -10.0859 -4.3485 -4.3485 -4.3467 -4.3467 3.0516 3.0516 3.0594 3.0594 3.1668 3.1668 3.2138 3.2138 3.7625 3.7625 3.8105 3.8105 5.6812 5.6812 5.7027 5.7027 6.2754 6.2754 6.2800 6.2800 7.5487 7.5487 7.5926 7.5926 k = 0.3153 0.5461 0.2828 ( 8866 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7132 -26.7132 -26.7132 -26.7132 -10.8377 -10.8377 -10.8286 -10.8286 -10.7862 -10.7862 -10.7755 -10.7755 -10.6537 -10.6537 -10.6343 -10.6343 -10.5456 -10.5456 -10.4979 -10.4979 -10.4857 -10.4857 -10.4668 -10.4668 -10.3740 -10.3740 -10.3704 -10.3704 -10.3477 -10.3477 -10.3084 -10.3084 -10.1752 -10.1752 -10.1497 -10.1497 -10.0945 -10.0945 -10.0859 -10.0859 -4.3489 -4.3489 -4.3471 -4.3471 3.0368 3.0368 3.0403 3.0403 3.1878 3.1878 3.2308 3.2308 3.7616 3.7616 3.8097 3.8097 5.6750 5.6750 5.6962 5.6962 6.2880 6.2880 6.2928 6.2928 7.5419 7.5419 7.5848 7.5848 k = 0.3063 0.5305 0.2828 ( 8866 PWs) bands (ev): -27.0690 -27.0690 -27.0690 -27.0690 -27.0358 -27.0358 -27.0358 -27.0358 -26.7132 -26.7132 -26.7132 -26.7132 -10.8377 -10.8377 -10.8287 -10.8287 -10.7857 -10.7857 -10.7754 -10.7754 -10.6530 -10.6530 -10.6335 -10.6335 -10.5462 -10.5462 -10.4974 -10.4974 -10.4894 -10.4894 -10.4637 -10.4637 -10.3738 -10.3738 -10.3712 -10.3712 -10.3473 -10.3473 -10.3090 -10.3090 -10.1751 -10.1751 -10.1499 -10.1499 -10.0944 -10.0944 -10.0859 -10.0859 -4.3495 -4.3495 -4.3477 -4.3477 3.0176 3.0176 3.0181 3.0181 3.2132 3.2132 3.2537 3.2537 3.7599 3.7599 3.8085 3.8085 5.6657 5.6657 5.6863 5.6863 6.3080 6.3080 6.3130 6.3130 7.5327 7.5327 7.5743 7.5743 k = 0.2973 0.5149 0.2828 ( 8872 PWs) bands (ev): -27.0691 -27.0691 -27.0691 -27.0691 -27.0358 -27.0358 -27.0358 -27.0358 -26.7132 -26.7132 -26.7132 -26.7132 -10.8378 -10.8378 -10.8288 -10.8288 -10.7851 -10.7851 -10.7753 -10.7753 -10.6520 -10.6520 -10.6323 -10.6323 -10.5469 -10.5469 -10.4968 -10.4968 -10.4933 -10.4933 -10.4605 -10.4605 -10.3736 -10.3736 -10.3724 -10.3724 -10.3469 -10.3469 -10.3100 -10.3100 -10.1749 -10.1749 -10.1503 -10.1503 -10.0941 -10.0941 -10.0859 -10.0859 -4.3504 -4.3504 -4.3487 -4.3487 2.9956 2.9956 2.9969 2.9969 3.2399 3.2399 3.2794 3.2794 3.7576 3.7576 3.8067 3.8067 5.6542 5.6542 5.6742 5.6742 6.3342 6.3342 6.3394 6.3394 7.5226 7.5226 7.5626 7.5626 k = 0.2883 0.4993 0.2828 ( 8886 PWs) bands (ev): -27.0692 -27.0692 -27.0692 -27.0692 -27.0357 -27.0357 -27.0357 -27.0357 -26.7131 -26.7131 -26.7131 -26.7131 -10.8379 -10.8379 -10.8289 -10.8289 -10.7844 -10.7844 -10.7751 -10.7751 -10.6507 -10.6507 -10.6309 -10.6309 -10.5476 -10.5476 -10.4973 -10.4973 -10.4961 -10.4961 -10.4575 -10.4575 -10.3738 -10.3738 -10.3732 -10.3732 -10.3463 -10.3463 -10.3112 -10.3112 -10.1747 -10.1747 -10.1507 -10.1507 -10.0939 -10.0939 -10.0859 -10.0859 -4.3516 -4.3516 -4.3499 -4.3499 2.9741 2.9741 2.9762 2.9762 3.2667 3.2667 3.3063 3.3063 3.7546 3.7546 3.8044 3.8044 5.6415 5.6415 5.6608 5.6608 6.3655 6.3655 6.3709 6.3709 7.5127 7.5127 7.5513 7.5513 k = 0.2793 0.4837 0.2828 ( 8878 PWs) bands (ev): -27.0693 -27.0693 -27.0693 -27.0693 -27.0356 -27.0356 -27.0356 -27.0356 -26.7131 -26.7131 -26.7131 -26.7131 -10.8380 -10.8380 -10.8291 -10.8291 -10.7834 -10.7834 -10.7749 -10.7749 -10.6492 -10.6492 -10.6292 -10.6292 -10.5484 -10.5484 -10.5012 -10.5012 -10.4954 -10.4954 -10.4547 -10.4547 -10.3755 -10.3755 -10.3729 -10.3729 -10.3456 -10.3456 -10.3126 -10.3126 -10.1744 -10.1744 -10.1512 -10.1512 -10.0936 -10.0936 -10.0859 -10.0859 -4.3531 -4.3531 -4.3515 -4.3515 2.9540 2.9540 2.9564 2.9564 3.2930 3.2930 3.3333 3.3333 3.7509 3.7509 3.8016 3.8016 5.6285 5.6285 5.6471 5.6471 6.4009 6.4009 6.4064 6.4064 7.5040 7.5040 7.5411 7.5411 k = 0.2703 0.4681 0.2828 ( 8878 PWs) bands (ev): -27.0695 -27.0695 -27.0695 -27.0695 -27.0354 -27.0354 -27.0354 -27.0354 -26.7131 -26.7131 -26.7131 -26.7131 -10.8381 -10.8381 -10.8292 -10.8292 -10.7823 -10.7823 -10.7746 -10.7746 -10.6475 -10.6475 -10.6273 -10.6273 -10.5491 -10.5491 -10.5050 -10.5050 -10.4947 -10.4947 -10.4520 -10.4520 -10.3775 -10.3775 -10.3725 -10.3725 -10.3449 -10.3449 -10.3143 -10.3143 -10.1741 -10.1741 -10.1517 -10.1517 -10.0932 -10.0932 -10.0859 -10.0859 -4.3550 -4.3550 -4.3534 -4.3534 2.9356 2.9356 2.9380 2.9380 3.3182 3.3182 3.3598 3.3598 3.7466 3.7466 3.7984 3.7984 5.6158 5.6158 5.6336 5.6336 6.4393 6.4393 6.4448 6.4448 7.4971 7.4971 7.5328 7.5328 k = 0.2613 0.4525 0.2828 ( 8878 PWs) bands (ev): -27.0697 -27.0697 -27.0697 -27.0697 -27.0352 -27.0352 -27.0352 -27.0352 -26.7131 -26.7131 -26.7131 -26.7131 -10.8381 -10.8381 -10.8294 -10.8294 -10.7811 -10.7811 -10.7743 -10.7743 -10.6455 -10.6455 -10.6252 -10.6252 -10.5498 -10.5498 -10.5088 -10.5088 -10.4940 -10.4940 -10.4496 -10.4496 -10.3797 -10.3797 -10.3722 -10.3722 -10.3443 -10.3443 -10.3162 -10.3162 -10.1738 -10.1738 -10.1523 -10.1523 -10.0928 -10.0928 -10.0859 -10.0859 -4.3572 -4.3572 -4.3557 -4.3557 2.9191 2.9191 2.9213 2.9213 3.3422 3.3422 3.3853 3.3853 3.7418 3.7418 3.7948 3.7948 5.6039 5.6039 5.6210 5.6210 6.4800 6.4800 6.4853 6.4853 7.4921 7.4921 7.5266 7.5266 k = 0.2523 0.4369 0.2828 ( 8872 PWs) bands (ev): -27.0700 -27.0700 -27.0700 -27.0700 -27.0350 -27.0350 -27.0350 -27.0350 -26.7130 -26.7130 -26.7130 -26.7130 -10.8381 -10.8381 -10.8295 -10.8295 -10.7798 -10.7798 -10.7739 -10.7739 -10.6434 -10.6434 -10.6229 -10.6229 -10.5503 -10.5503 -10.5124 -10.5124 -10.4933 -10.4933 -10.4473 -10.4473 -10.3821 -10.3821 -10.3718 -10.3718 -10.3436 -10.3436 -10.3183 -10.3183 -10.1734 -10.1734 -10.1530 -10.1530 -10.0924 -10.0924 -10.0859 -10.0859 -4.3597 -4.3597 -4.3583 -4.3583 2.9045 2.9045 2.9064 2.9064 3.3646 3.3646 3.4095 3.4095 3.7366 3.7366 3.7908 3.7908 5.5931 5.5931 5.6094 5.6094 6.5223 6.5223 6.5274 6.5274 7.4888 7.4888 7.5224 7.5224 k = 0.2432 0.4213 0.2828 ( 8876 PWs) bands (ev): -27.0702 -27.0702 -27.0702 -27.0702 -27.0348 -27.0348 -27.0348 -27.0348 -26.7130 -26.7130 -26.7130 -26.7130 -10.8381 -10.8381 -10.8296 -10.8296 -10.7784 -10.7784 -10.7734 -10.7734 -10.6410 -10.6410 -10.6206 -10.6206 -10.5506 -10.5506 -10.5158 -10.5158 -10.4926 -10.4926 -10.4452 -10.4452 -10.3847 -10.3847 -10.3715 -10.3715 -10.3431 -10.3431 -10.3205 -10.3205 -10.1731 -10.1731 -10.1537 -10.1537 -10.0920 -10.0920 -10.0859 -10.0859 -4.3625 -4.3625 -4.3612 -4.3612 2.8920 2.8920 2.8935 2.8935 3.3852 3.3852 3.4321 3.4321 3.7312 3.7312 3.7867 3.7867 5.5837 5.5837 5.5993 5.5993 6.5656 6.5656 6.5703 6.5703 7.4866 7.4866 7.5193 7.5193 k = 0.2342 0.4057 0.2828 ( 8864 PWs) bands (ev): -27.0705 -27.0705 -27.0705 -27.0705 -27.0345 -27.0345 -27.0345 -27.0345 -26.7129 -26.7129 -26.7129 -26.7129 -10.8380 -10.8380 -10.8297 -10.8297 -10.7769 -10.7769 -10.7729 -10.7729 -10.6385 -10.6385 -10.6181 -10.6181 -10.5507 -10.5507 -10.5191 -10.5191 -10.4920 -10.4920 -10.4432 -10.4432 -10.3874 -10.3874 -10.3713 -10.3713 -10.3426 -10.3426 -10.3229 -10.3229 -10.1727 -10.1727 -10.1545 -10.1545 -10.0915 -10.0915 -10.0859 -10.0859 -4.3657 -4.3657 -4.3644 -4.3644 2.8816 2.8816 2.8827 2.8827 3.4039 3.4039 3.4527 3.4527 3.7257 3.7257 3.7823 3.7823 5.5758 5.5758 5.5905 5.5905 6.6095 6.6095 6.6136 6.6136 7.4837 7.4837 7.5155 7.5155 k = 0.2252 0.3901 0.2828 ( 8868 PWs) bands (ev): -27.0709 -27.0709 -27.0709 -27.0709 -27.0343 -27.0343 -27.0343 -27.0343 -26.7129 -26.7129 -26.7129 -26.7129 -10.8379 -10.8379 -10.8298 -10.8298 -10.7753 -10.7753 -10.7722 -10.7722 -10.6358 -10.6358 -10.6157 -10.6157 -10.5506 -10.5506 -10.5222 -10.5222 -10.4914 -10.4914 -10.4415 -10.4415 -10.3902 -10.3902 -10.3712 -10.3712 -10.3422 -10.3422 -10.3254 -10.3254 -10.1723 -10.1723 -10.1552 -10.1552 -10.0911 -10.0911 -10.0859 -10.0859 -4.3692 -4.3692 -4.3680 -4.3680 2.8732 2.8732 2.8738 2.8738 3.4206 3.4206 3.4712 3.4712 3.7202 3.7202 3.7779 3.7779 5.5692 5.5692 5.5830 5.5830 6.6534 6.6534 6.6570 6.6570 7.4775 7.4775 7.5081 7.5081 k = 0.2162 0.3745 0.2828 ( 8868 PWs) bands (ev): -27.0712 -27.0712 -27.0712 -27.0712 -27.0340 -27.0340 -27.0340 -27.0340 -26.7128 -26.7128 -26.7128 -26.7128 -10.8377 -10.8377 -10.8299 -10.8299 -10.7737 -10.7737 -10.7715 -10.7715 -10.6329 -10.6329 -10.6133 -10.6133 -10.5502 -10.5502 -10.5251 -10.5251 -10.4909 -10.4909 -10.4400 -10.4400 -10.3930 -10.3930 -10.3713 -10.3713 -10.3420 -10.3420 -10.3280 -10.3280 -10.1718 -10.1718 -10.1561 -10.1561 -10.0906 -10.0906 -10.0859 -10.0859 -4.3730 -4.3730 -4.3719 -4.3719 2.8668 2.8668 2.8670 2.8670 3.4353 3.4353 3.4875 3.4875 3.7150 3.7150 3.7734 3.7734 5.5638 5.5638 5.5768 5.5768 6.6972 6.6972 6.7002 6.7002 7.4643 7.4643 7.4926 7.4926 k = 0.2072 0.3589 0.2828 ( 8848 PWs) bands (ev): -27.0715 -27.0715 -27.0715 -27.0715 -27.0337 -27.0337 -27.0337 -27.0337 -26.7127 -26.7127 -26.7127 -26.7127 -10.8374 -10.8374 -10.8299 -10.8299 -10.7720 -10.7720 -10.7706 -10.7706 -10.6300 -10.6300 -10.6109 -10.6109 -10.5496 -10.5496 -10.5277 -10.5277 -10.4903 -10.4903 -10.4386 -10.4386 -10.3959 -10.3959 -10.3715 -10.3715 -10.3419 -10.3419 -10.3306 -10.3306 -10.1714 -10.1714 -10.1569 -10.1569 -10.0901 -10.0901 -10.0859 -10.0859 -4.3770 -4.3770 -4.3760 -4.3760 2.8622 2.8622 2.8624 2.8624 3.4480 3.4480 3.5013 3.5013 3.7102 3.7102 3.7690 3.7690 5.5595 5.5595 5.5716 5.5716 6.7405 6.7405 6.7427 6.7427 7.4412 7.4412 7.4658 7.4658 k = 0.1982 0.3433 0.2828 ( 8848 PWs) bands (ev): -27.0719 -27.0719 -27.0719 -27.0719 -27.0334 -27.0334 -27.0334 -27.0334 -26.7127 -26.7127 -26.7127 -26.7127 -10.8371 -10.8371 -10.8300 -10.8300 -10.7703 -10.7703 -10.7696 -10.7696 -10.6269 -10.6269 -10.6087 -10.6087 -10.5487 -10.5487 -10.5302 -10.5302 -10.4897 -10.4897 -10.4374 -10.4374 -10.3987 -10.3987 -10.3719 -10.3719 -10.3420 -10.3420 -10.3332 -10.3332 -10.1710 -10.1710 -10.1577 -10.1577 -10.0896 -10.0896 -10.0859 -10.0859 -4.3814 -4.3814 -4.3805 -4.3805 2.8593 2.8593 2.8599 2.8599 3.4589 3.4589 3.5128 3.5128 3.7060 3.7060 3.7645 3.7645 5.5558 5.5558 5.5671 5.5671 6.7830 6.7830 6.7846 6.7846 7.4084 7.4084 7.4286 7.4286 k = 0.1892 0.3277 0.2828 ( 8844 PWs) bands (ev): -27.0723 -27.0723 -27.0723 -27.0723 -27.0331 -27.0331 -27.0331 -27.0331 -26.7126 -26.7126 -26.7126 -26.7126 -10.8368 -10.8368 -10.8300 -10.8300 -10.7686 -10.7686 -10.7685 -10.7685 -10.6238 -10.6238 -10.6066 -10.6066 -10.5476 -10.5476 -10.5324 -10.5324 -10.4891 -10.4891 -10.4365 -10.4365 -10.4014 -10.4014 -10.3725 -10.3725 -10.3423 -10.3423 -10.3358 -10.3358 -10.1705 -10.1705 -10.1586 -10.1586 -10.0892 -10.0892 -10.0858 -10.0858 -4.3859 -4.3859 -4.3851 -4.3851 2.8582 2.8582 2.8592 2.8592 3.4682 3.4682 3.5220 3.5220 3.7025 3.7025 3.7601 3.7601 5.5526 5.5526 5.5629 5.5629 6.8244 6.8244 6.8252 6.8252 7.3690 7.3690 7.3852 7.3852 k = 0.1802 0.3121 0.2828 ( 8848 PWs) bands (ev): -27.0727 -27.0727 -27.0727 -27.0727 -27.0328 -27.0328 -27.0328 -27.0328 -26.7125 -26.7125 -26.7125 -26.7125 -10.8364 -10.8364 -10.8301 -10.8301 -10.7673 -10.7673 -10.7669 -10.7669 -10.6207 -10.6207 -10.6046 -10.6046 -10.5464 -10.5464 -10.5344 -10.5344 -10.4884 -10.4884 -10.4359 -10.4359 -10.4040 -10.4040 -10.3734 -10.3734 -10.3427 -10.3427 -10.3382 -10.3382 -10.1701 -10.1701 -10.1594 -10.1594 -10.0887 -10.0887 -10.0858 -10.0858 -4.3907 -4.3907 -4.3899 -4.3899 2.8588 2.8588 2.8601 2.8601 3.4761 3.4761 3.5290 3.5290 3.6997 3.6997 3.7557 3.7557 5.5493 5.5493 5.5587 5.5587 6.8643 6.8643 6.8643 6.8643 7.3271 7.3271 7.3399 7.3399 k = 0.1712 0.2965 0.2828 ( 8852 PWs) bands (ev): -27.0731 -27.0731 -27.0731 -27.0731 -27.0325 -27.0325 -27.0325 -27.0325 -26.7125 -26.7125 -26.7125 -26.7125 -10.8359 -10.8359 -10.8302 -10.8302 -10.7660 -10.7660 -10.7651 -10.7651 -10.6175 -10.6175 -10.6028 -10.6028 -10.5450 -10.5450 -10.5361 -10.5361 -10.4876 -10.4876 -10.4356 -10.4356 -10.4064 -10.4064 -10.3746 -10.3746 -10.3434 -10.3434 -10.3406 -10.3406 -10.1698 -10.1698 -10.1603 -10.1603 -10.0882 -10.0882 -10.0857 -10.0857 -4.3956 -4.3956 -4.3949 -4.3949 2.8609 2.8609 2.8624 2.8624 3.4828 3.4828 3.5343 3.5343 3.6975 3.6975 3.7513 3.7513 5.5454 5.5454 5.5539 5.5539 6.9009 6.9009 6.9017 6.9017 7.2863 7.2863 7.2965 7.2965 k = 0.1622 0.2809 0.2828 ( 8848 PWs) bands (ev): -27.0735 -27.0735 -27.0735 -27.0735 -27.0322 -27.0322 -27.0322 -27.0322 -26.7124 -26.7124 -26.7124 -26.7124 -10.8355 -10.8355 -10.8302 -10.8302 -10.7645 -10.7645 -10.7634 -10.7634 -10.6144 -10.6144 -10.6011 -10.6011 -10.5435 -10.5435 -10.5376 -10.5376 -10.4866 -10.4866 -10.4356 -10.4356 -10.4084 -10.4084 -10.3761 -10.3761 -10.3441 -10.3441 -10.3428 -10.3428 -10.1694 -10.1694 -10.1611 -10.1611 -10.0878 -10.0878 -10.0857 -10.0857 -4.4006 -4.4006 -4.4000 -4.4000 2.8643 2.8643 2.8661 2.8661 3.4888 3.4888 3.5381 3.5381 3.6959 3.6959 3.7469 3.7469 5.5406 5.5406 5.5482 5.5482 6.9337 6.9337 6.9352 6.9352 7.2502 7.2502 7.2581 7.2581 k = 0.1532 0.2653 0.2828 ( 8840 PWs) bands (ev): -27.0739 -27.0739 -27.0739 -27.0739 -27.0318 -27.0318 -27.0318 -27.0318 -26.7123 -26.7123 -26.7123 -26.7123 -10.8350 -10.8350 -10.8303 -10.8303 -10.7630 -10.7630 -10.7616 -10.7616 -10.6113 -10.6113 -10.5995 -10.5995 -10.5422 -10.5422 -10.5389 -10.5389 -10.4853 -10.4853 -10.4359 -10.4359 -10.4101 -10.4101 -10.3779 -10.3779 -10.3451 -10.3451 -10.3449 -10.3449 -10.1691 -10.1691 -10.1619 -10.1619 -10.0874 -10.0874 -10.0856 -10.0856 -4.4057 -4.4057 -4.4052 -4.4052 2.8689 2.8689 2.8708 2.8708 3.4944 3.4944 3.5409 3.5409 3.6946 3.6946 3.7424 3.7424 5.5342 5.5342 5.5409 5.5409 6.9601 6.9601 6.9624 6.9624 7.2224 7.2224 7.2286 7.2286 k = 0.1441 0.2497 0.2828 ( 8834 PWs) bands (ev): -27.0743 -27.0743 -27.0743 -27.0743 -27.0315 -27.0315 -27.0315 -27.0315 -26.7122 -26.7122 -26.7122 -26.7122 -10.8345 -10.8345 -10.8303 -10.8303 -10.7614 -10.7614 -10.7599 -10.7599 -10.6082 -10.6082 -10.5981 -10.5981 -10.5409 -10.5409 -10.5399 -10.5399 -10.4838 -10.4838 -10.4367 -10.4367 -10.4115 -10.4115 -10.3799 -10.3799 -10.3468 -10.3468 -10.3461 -10.3461 -10.1688 -10.1688 -10.1627 -10.1627 -10.0869 -10.0869 -10.0854 -10.0854 -4.4109 -4.4109 -4.4105 -4.4105 2.8745 2.8745 2.8765 2.8765 3.4998 3.4998 3.5431 3.5431 3.6937 3.6937 3.7379 3.7379 5.5259 5.5259 5.5317 5.5317 6.9772 6.9772 6.9801 6.9801 7.2072 7.2072 7.2119 7.2119 k = 0.1351 0.2341 0.2828 ( 8834 PWs) bands (ev): -27.0746 -27.0746 -27.0746 -27.0746 -27.0312 -27.0312 -27.0312 -27.0312 -26.7122 -26.7122 -26.7122 -26.7122 -10.8340 -10.8340 -10.8304 -10.8304 -10.7597 -10.7597 -10.7582 -10.7582 -10.6053 -10.6053 -10.5967 -10.5967 -10.5408 -10.5408 -10.5399 -10.5399 -10.4819 -10.4819 -10.4377 -10.4377 -10.4125 -10.4125 -10.3823 -10.3823 -10.3486 -10.3486 -10.3473 -10.3473 -10.1685 -10.1685 -10.1634 -10.1634 -10.0865 -10.0865 -10.0853 -10.0853 -4.4161 -4.4161 -4.4157 -4.4157 2.8808 2.8808 2.8828 2.8828 3.5053 3.5053 3.5451 3.5451 3.6930 3.6930 3.7333 3.7333 5.5152 5.5152 5.5202 5.5202 6.9831 6.9831 6.9863 6.9863 7.2067 7.2067 7.2106 7.2106 k = 0.1261 0.2185 0.2828 ( 8834 PWs) bands (ev): -27.0750 -27.0750 -27.0750 -27.0750 -27.0309 -27.0309 -27.0309 -27.0309 -26.7121 -26.7121 -26.7121 -26.7121 -10.8336 -10.8336 -10.8304 -10.8304 -10.7579 -10.7579 -10.7564 -10.7564 -10.6024 -10.6024 -10.5953 -10.5953 -10.5414 -10.5414 -10.5392 -10.5392 -10.4798 -10.4798 -10.4390 -10.4390 -10.4133 -10.4133 -10.3849 -10.3849 -10.3502 -10.3502 -10.3486 -10.3486 -10.1683 -10.1683 -10.1641 -10.1641 -10.0861 -10.0861 -10.0852 -10.0852 -4.4212 -4.4212 -4.4209 -4.4209 2.8875 2.8875 2.8895 2.8895 3.5111 3.5111 3.5473 3.5473 3.6924 3.6924 3.7288 3.7288 5.5018 5.5018 5.5061 5.5061 6.9800 6.9800 6.9831 6.9831 7.2190 7.2190 7.2227 7.2227 k = 0.1171 0.2029 0.2828 ( 8832 PWs) bands (ev): -27.0754 -27.0754 -27.0754 -27.0754 -27.0306 -27.0306 -27.0306 -27.0306 -26.7120 -26.7120 -26.7120 -26.7120 -10.8331 -10.8331 -10.8305 -10.8305 -10.7561 -10.7561 -10.7548 -10.7548 -10.5997 -10.5997 -10.5940 -10.5940 -10.5419 -10.5419 -10.5387 -10.5387 -10.4772 -10.4772 -10.4403 -10.4403 -10.4138 -10.4138 -10.3878 -10.3878 -10.3517 -10.3517 -10.3499 -10.3499 -10.1681 -10.1681 -10.1647 -10.1647 -10.0858 -10.0858 -10.0850 -10.0850 -4.4262 -4.4262 -4.4259 -4.4259 2.8946 2.8946 2.8964 2.8964 3.5175 3.5175 3.5499 3.5499 3.6920 3.6920 3.7244 3.7244 5.4857 5.4857 5.4893 5.4893 6.9730 6.9730 6.9756 6.9756 7.2388 7.2388 7.2428 7.2428 k = 0.1081 0.1872 0.2828 ( 8828 PWs) bands (ev): -27.0757 -27.0757 -27.0757 -27.0757 -27.0304 -27.0304 -27.0304 -27.0304 -26.7120 -26.7120 -26.7120 -26.7120 -10.8327 -10.8327 -10.8305 -10.8305 -10.7544 -10.7544 -10.7531 -10.7531 -10.5971 -10.5971 -10.5927 -10.5927 -10.5422 -10.5422 -10.5386 -10.5386 -10.4744 -10.4744 -10.4417 -10.4417 -10.4143 -10.4143 -10.3908 -10.3908 -10.3531 -10.3531 -10.3512 -10.3512 -10.1680 -10.1680 -10.1653 -10.1653 -10.0854 -10.0854 -10.0848 -10.0848 -4.4310 -4.4310 -4.4308 -4.4308 2.9016 2.9016 2.9033 2.9033 3.5245 3.5245 3.5529 3.5529 3.6919 3.6919 3.7202 3.7202 5.4669 5.4669 5.4698 5.4698 6.9664 6.9664 6.9683 6.9683 7.2614 7.2614 7.2659 7.2659 k = 0.0991 0.1716 0.2828 ( 8832 PWs) bands (ev): -27.0760 -27.0760 -27.0760 -27.0760 -27.0301 -27.0301 -27.0301 -27.0301 -26.7119 -26.7119 -26.7119 -26.7119 -10.8323 -10.8323 -10.8306 -10.8306 -10.7526 -10.7526 -10.7515 -10.7515 -10.5947 -10.5947 -10.5913 -10.5913 -10.5425 -10.5425 -10.5387 -10.5387 -10.4713 -10.4713 -10.4429 -10.4429 -10.4148 -10.4148 -10.3941 -10.3941 -10.3543 -10.3543 -10.3526 -10.3526 -10.1679 -10.1679 -10.1658 -10.1658 -10.0851 -10.0851 -10.0847 -10.0847 -4.4357 -4.4357 -4.4356 -4.4356 2.9085 2.9085 2.9100 2.9100 3.5320 3.5320 3.5565 3.5565 3.6920 3.6920 3.7163 3.7163 5.4456 5.4456 5.4479 5.4479 6.9627 6.9627 6.9641 6.9641 7.2832 7.2832 7.2883 7.2883 k = 0.0901 0.1560 0.2828 ( 8826 PWs) bands (ev): -27.0763 -27.0763 -27.0763 -27.0763 -27.0299 -27.0299 -27.0299 -27.0299 -26.7118 -26.7118 -26.7118 -26.7118 -10.8320 -10.8320 -10.8306 -10.8306 -10.7509 -10.7509 -10.7500 -10.7500 -10.5925 -10.5925 -10.5900 -10.5900 -10.5427 -10.5427 -10.5391 -10.5391 -10.4680 -10.4680 -10.4439 -10.4439 -10.4153 -10.4153 -10.3974 -10.3974 -10.3554 -10.3554 -10.3540 -10.3540 -10.1678 -10.1678 -10.1663 -10.1663 -10.0848 -10.0848 -10.0845 -10.0845 -4.4402 -4.4402 -4.4400 -4.4400 2.9151 2.9151 2.9163 2.9163 3.5401 3.5401 3.5606 3.5606 3.6926 3.6926 3.7129 3.7129 5.4223 5.4223 5.4241 5.4241 6.9633 6.9633 6.9643 6.9643 7.3020 7.3020 7.3076 7.3076 k = 0.0811 0.1404 0.2828 ( 8822 PWs) bands (ev): -27.0766 -27.0766 -27.0766 -27.0766 -27.0296 -27.0296 -27.0296 -27.0296 -26.7118 -26.7118 -26.7118 -26.7118 -10.8317 -10.8317 -10.8306 -10.8306 -10.7493 -10.7493 -10.7486 -10.7486 -10.5904 -10.5904 -10.5887 -10.5887 -10.5429 -10.5429 -10.5398 -10.5398 -10.4645 -10.4645 -10.4446 -10.4446 -10.4159 -10.4159 -10.4009 -10.4009 -10.3565 -10.3565 -10.3553 -10.3553 -10.1678 -10.1678 -10.1667 -10.1667 -10.0845 -10.0845 -10.0843 -10.0843 -4.4443 -4.4443 -4.4442 -4.4442 2.9212 2.9212 2.9222 2.9222 3.5484 3.5484 3.5650 3.5650 3.6937 3.6937 3.7101 3.7101 5.3975 5.3975 5.3988 5.3988 6.9688 6.9688 6.9694 6.9694 7.3164 7.3164 7.3223 7.3223 k = 0.0721 0.1248 0.2828 ( 8814 PWs) bands (ev): -27.0769 -27.0769 -27.0769 -27.0769 -27.0294 -27.0294 -27.0294 -27.0294 -26.7117 -26.7117 -26.7117 -26.7117 -10.8314 -10.8314 -10.8307 -10.8307 -10.7477 -10.7477 -10.7472 -10.7472 -10.5885 -10.5885 -10.5873 -10.5873 -10.5431 -10.5431 -10.5405 -10.5405 -10.4608 -10.4608 -10.4450 -10.4450 -10.4168 -10.4168 -10.4045 -10.4045 -10.3574 -10.3574 -10.3565 -10.3565 -10.1678 -10.1678 -10.1670 -10.1670 -10.0843 -10.0843 -10.0841 -10.0841 -4.4482 -4.4482 -4.4481 -4.4481 2.9267 2.9267 2.9275 2.9275 3.5568 3.5568 3.5697 3.5697 3.6953 3.6953 3.7080 3.7080 5.3720 5.3720 5.3730 5.3730 6.9792 6.9792 6.9794 6.9794 7.3261 7.3261 7.3319 7.3319 k = 0.0631 0.1092 0.2828 ( 8818 PWs) bands (ev): -27.0771 -27.0771 -27.0771 -27.0771 -27.0293 -27.0293 -27.0293 -27.0293 -26.7117 -26.7117 -26.7117 -26.7117 -10.8312 -10.8312 -10.8307 -10.8307 -10.7463 -10.7463 -10.7459 -10.7459 -10.5867 -10.5867 -10.5860 -10.5860 -10.5434 -10.5434 -10.5414 -10.5414 -10.4571 -10.4571 -10.4449 -10.4449 -10.4178 -10.4178 -10.4081 -10.4081 -10.3583 -10.3583 -10.3576 -10.3576 -10.1678 -10.1678 -10.1673 -10.1673 -10.0841 -10.0841 -10.0840 -10.0840 -4.4517 -4.4517 -4.4516 -4.4516 2.9316 2.9316 2.9321 2.9321 3.5648 3.5648 3.5742 3.5742 3.6976 3.6976 3.7069 3.7069 5.3466 5.3466 5.3473 5.3473 6.9942 6.9942 6.9942 6.9942 7.3313 7.3313 7.3368 7.3368 k = 0.0541 0.0936 0.2828 ( 8818 PWs) bands (ev): -27.0773 -27.0773 -27.0773 -27.0773 -27.0291 -27.0291 -27.0291 -27.0291 -26.7116 -26.7116 -26.7116 -26.7116 -10.8310 -10.8310 -10.8307 -10.8307 -10.7451 -10.7451 -10.7448 -10.7448 -10.5851 -10.5851 -10.5848 -10.5848 -10.5437 -10.5437 -10.5423 -10.5423 -10.4534 -10.4534 -10.4444 -10.4444 -10.4192 -10.4192 -10.4118 -10.4118 -10.3590 -10.3590 -10.3585 -10.3585 -10.1679 -10.1679 -10.1675 -10.1675 -10.0839 -10.0839 -10.0838 -10.0838 -4.4548 -4.4548 -4.4548 -4.4548 2.9357 2.9357 2.9361 2.9361 3.5720 3.5720 3.5784 3.5784 3.7004 3.7004 3.7067 3.7067 5.3222 5.3222 5.3226 5.3226 7.0133 7.0133 7.0134 7.0134 7.3332 7.3332 7.3380 7.3380 k = 0.0450 0.0780 0.2828 ( 8816 PWs) bands (ev): -27.0775 -27.0775 -27.0775 -27.0775 -27.0290 -27.0290 -27.0290 -27.0290 -26.7116 -26.7116 -26.7116 -26.7116 -10.8309 -10.8309 -10.8307 -10.8307 -10.7439 -10.7439 -10.7438 -10.7438 -10.5838 -10.5838 -10.5836 -10.5836 -10.5441 -10.5441 -10.5432 -10.5432 -10.4497 -10.4497 -10.4435 -10.4435 -10.4207 -10.4207 -10.4155 -10.4155 -10.3596 -10.3596 -10.3594 -10.3594 -10.1679 -10.1679 -10.1677 -10.1677 -10.0837 -10.0837 -10.0837 -10.0837 -4.4575 -4.4575 -4.4575 -4.4575 2.9392 2.9392 2.9394 2.9394 3.5782 3.5782 3.5822 3.5822 3.7035 3.7035 3.7074 3.7074 5.2997 5.2997 5.2999 5.2999 7.0359 7.0359 7.0360 7.0360 7.3329 7.3329 7.3369 7.3369 k = 0.0360 0.0624 0.2828 ( 8818 PWs) bands (ev): -27.0776 -27.0776 -27.0776 -27.0776 -27.0289 -27.0289 -27.0289 -27.0289 -26.7116 -26.7116 -26.7116 -26.7116 -10.8308 -10.8308 -10.8307 -10.8307 -10.7430 -10.7430 -10.7429 -10.7429 -10.5826 -10.5826 -10.5825 -10.5825 -10.5446 -10.5446 -10.5441 -10.5441 -10.4460 -10.4460 -10.4421 -10.4421 -10.4226 -10.4226 -10.4191 -10.4191 -10.3602 -10.3602 -10.3600 -10.3600 -10.1680 -10.1680 -10.1679 -10.1679 -10.0836 -10.0836 -10.0836 -10.0836 -4.4597 -4.4597 -4.4597 -4.4597 2.9420 2.9420 2.9421 2.9421 3.5832 3.5832 3.5853 3.5853 3.7067 3.7067 3.7088 3.7088 5.2799 5.2799 5.2800 5.2800 7.0610 7.0610 7.0612 7.0612 7.3313 7.3313 7.3345 7.3345 k = 0.0270 0.0468 0.2828 ( 8814 PWs) bands (ev): -27.0777 -27.0777 -27.0777 -27.0777 -27.0288 -27.0288 -27.0288 -27.0288 -26.7115 -26.7115 -26.7115 -26.7115 -10.8307 -10.8307 -10.8306 -10.8306 -10.7423 -10.7423 -10.7423 -10.7423 -10.5816 -10.5816 -10.5816 -10.5816 -10.5450 -10.5450 -10.5448 -10.5448 -10.4425 -10.4425 -10.4403 -10.4403 -10.4247 -10.4247 -10.4227 -10.4227 -10.3606 -10.3606 -10.3605 -10.3605 -10.1680 -10.1680 -10.1680 -10.1680 -10.0835 -10.0835 -10.0835 -10.0835 -4.4615 -4.4615 -4.4615 -4.4615 2.9441 2.9441 2.9442 2.9442 3.5869 3.5869 3.5878 3.5878 3.7097 3.7097 3.7106 3.7106 5.2636 5.2636 5.2636 5.2636 7.0873 7.0873 7.0874 7.0874 7.3294 7.3294 7.3318 7.3318 k = 0.0180 0.0312 0.2828 ( 8804 PWs) bands (ev): -27.0778 -27.0778 -27.0778 -27.0778 -27.0287 -27.0287 -27.0287 -27.0287 -26.7115 -26.7115 -26.7115 -26.7115 -10.8306 -10.8306 -10.8306 -10.8306 -10.7418 -10.7418 -10.7418 -10.7418 -10.5809 -10.5809 -10.5809 -10.5809 -10.5454 -10.5454 -10.5453 -10.5453 -10.4390 -10.4390 -10.4381 -10.4381 -10.4270 -10.4270 -10.4262 -10.4262 -10.3609 -10.3609 -10.3609 -10.3609 -10.1680 -10.1680 -10.1680 -10.1680 -10.0834 -10.0834 -10.0834 -10.0834 -4.4627 -4.4627 -4.4627 -4.4627 2.9456 2.9456 2.9456 2.9456 3.5894 3.5894 3.5897 3.5897 3.7120 3.7120 3.7123 3.7123 5.2514 5.2514 5.2514 5.2514 7.1123 7.1123 7.1123 7.1123 7.3275 7.3275 7.3291 7.3291 k = 0.0090 0.0156 0.2828 ( 8824 PWs) bands (ev): -27.0778 -27.0778 -27.0778 -27.0778 -27.0287 -27.0287 -27.0287 -27.0287 -26.7115 -26.7115 -26.7115 -26.7115 -10.8306 -10.8306 -10.8306 -10.8306 -10.7415 -10.7415 -10.7415 -10.7415 -10.5805 -10.5805 -10.5805 -10.5805 -10.5456 -10.5456 -10.5456 -10.5456 -10.4358 -10.4358 -10.4356 -10.4356 -10.4296 -10.4296 -10.4294 -10.4294 -10.3611 -10.3611 -10.3611 -10.3611 -10.1681 -10.1681 -10.1681 -10.1681 -10.0833 -10.0833 -10.0833 -10.0833 -4.4635 -4.4635 -4.4635 -4.4635 2.9465 2.9465 2.9465 2.9465 3.5907 3.5907 3.5908 3.5908 3.7135 3.7135 3.7136 3.7136 5.2439 5.2439 5.2439 5.2439 7.1317 7.1317 7.1318 7.1318 7.3254 7.3254 7.3260 7.3260 k = 0.0000 0.0000 0.2828 ( 8812 PWs) bands (ev): -27.0778 -27.0778 -27.0778 -27.0778 -27.0287 -27.0287 -27.0287 -27.0287 -26.7115 -26.7115 -26.7115 -26.7115 -10.8306 -10.8306 -10.8306 -10.8306 -10.7414 -10.7414 -10.7414 -10.7414 -10.5803 -10.5803 -10.5803 -10.5803 -10.5457 -10.5457 -10.5457 -10.5457 -10.4335 -10.4335 -10.4335 -10.4335 -10.4318 -10.4318 -10.4318 -10.4318 -10.3612 -10.3612 -10.3612 -10.3612 -10.1681 -10.1681 -10.1681 -10.1681 -10.0833 -10.0833 -10.0833 -10.0833 -4.4638 -4.4638 -4.4638 -4.4638 2.9468 2.9468 2.9468 2.9468 3.5912 3.5912 3.5912 3.5912 3.7140 3.7140 3.7140 3.7140 5.2414 5.2414 5.2414 5.2414 7.1395 7.1395 7.1395 7.1395 7.3227 7.3227 7.3227 7.3228 k = 0.5000 0.2887 0.2828 ( 8852 PWs) bands (ev): -27.0700 -27.0700 -27.0700 -27.0700 -27.0349 -27.0349 -27.0349 -27.0349 -26.7130 -26.7130 -26.7130 -26.7130 -10.8357 -10.8357 -10.8357 -10.8357 -10.7760 -10.7760 -10.7760 -10.7760 -10.6159 -10.6159 -10.6159 -10.6159 -10.5610 -10.5610 -10.5610 -10.5610 -10.4581 -10.4581 -10.4581 -10.4581 -10.3721 -10.3721 -10.3721 -10.3721 -10.3347 -10.3347 -10.3347 -10.3347 -10.1645 -10.1645 -10.1645 -10.1645 -10.0876 -10.0876 -10.0876 -10.0876 -4.3587 -4.3587 -4.3587 -4.3587 2.7750 2.7750 2.7750 2.7750 3.5604 3.5604 3.5604 3.5604 3.7875 3.7875 3.7875 3.7875 5.4660 5.4660 5.4660 5.4660 6.8828 6.8828 6.8828 6.8828 7.1707 7.1707 7.1707 7.1707 k = 0.5000 0.2887 0.2651 ( 8872 PWs) bands (ev): -27.0705 -27.0705 -27.0695 -27.0695 -27.0355 -27.0355 -27.0344 -27.0344 -26.7130 -26.7130 -26.7130 -26.7130 -10.8361 -10.8361 -10.8354 -10.8354 -10.7786 -10.7786 -10.7734 -10.7734 -10.6182 -10.6182 -10.6134 -10.6134 -10.5635 -10.5635 -10.5586 -10.5586 -10.4609 -10.4609 -10.4556 -10.4556 -10.3731 -10.3731 -10.3711 -10.3711 -10.3354 -10.3354 -10.3340 -10.3340 -10.1646 -10.1646 -10.1644 -10.1644 -10.0879 -10.0879 -10.0872 -10.0872 -4.3600 -4.3600 -4.3575 -4.3575 2.7704 2.7704 2.7811 2.7811 3.5428 3.5428 3.5761 3.5761 3.7857 3.7857 3.7894 3.7894 5.4523 5.4523 5.4818 5.4818 6.8375 6.8375 6.9327 6.9327 7.1197 7.1197 7.2160 7.2160 k = 0.5000 0.2887 0.2475 ( 8864 PWs) bands (ev): -27.0710 -27.0710 -27.0689 -27.0689 -27.0361 -27.0361 -27.0339 -27.0339 -26.7130 -26.7130 -26.7129 -26.7129 -10.8365 -10.8365 -10.8351 -10.8351 -10.7812 -10.7812 -10.7707 -10.7707 -10.6204 -10.6204 -10.6107 -10.6107 -10.5660 -10.5660 -10.5561 -10.5561 -10.4638 -10.4638 -10.4532 -10.4532 -10.3740 -10.3740 -10.3703 -10.3703 -10.3359 -10.3359 -10.3332 -10.3332 -10.1647 -10.1647 -10.1643 -10.1643 -10.0883 -10.0883 -10.0869 -10.0869 -4.3614 -4.3614 -4.3563 -4.3563 2.7676 2.7676 2.7889 2.7889 3.5235 3.5235 3.5896 3.5896 3.7840 3.7840 3.7914 3.7914 5.4414 5.4414 5.4992 5.4992 6.7977 6.7977 6.9856 6.9856 7.0654 7.0654 7.2545 7.2545 k = 0.5000 0.2887 0.2298 ( 8870 PWs) bands (ev): -27.0715 -27.0715 -27.0684 -27.0684 -27.0367 -27.0367 -27.0334 -27.0334 -26.7130 -26.7130 -26.7130 -26.7130 -10.8370 -10.8370 -10.8350 -10.8350 -10.7836 -10.7836 -10.7680 -10.7680 -10.6223 -10.6223 -10.6081 -10.6081 -10.5683 -10.5683 -10.5537 -10.5537 -10.4669 -10.4669 -10.4510 -10.4510 -10.3750 -10.3750 -10.3695 -10.3695 -10.3364 -10.3364 -10.3324 -10.3324 -10.1648 -10.1648 -10.1642 -10.1642 -10.0887 -10.0887 -10.0866 -10.0866 -4.3628 -4.3628 -4.3552 -4.3552 2.7664 2.7664 2.7980 2.7980 3.5030 3.5030 3.6008 3.6008 3.7826 3.7826 3.7934 3.7934 5.4338 5.4338 5.5174 5.5174 6.7639 6.7639 6.9963 6.9963 7.0536 7.0536 7.2849 7.2849 k = 0.5000 0.2887 0.2121 ( 8858 PWs) bands (ev): -27.0720 -27.0720 -27.0678 -27.0678 -27.0372 -27.0372 -27.0330 -27.0330 -26.7131 -26.7131 -26.7129 -26.7129 -10.8375 -10.8375 -10.8350 -10.8350 -10.7858 -10.7858 -10.7654 -10.7654 -10.6238 -10.6238 -10.6055 -10.6055 -10.5703 -10.5703 -10.5514 -10.5514 -10.4701 -10.4701 -10.4489 -10.4489 -10.3759 -10.3759 -10.3690 -10.3690 -10.3366 -10.3366 -10.3316 -10.3316 -10.1648 -10.1648 -10.1641 -10.1641 -10.0890 -10.0890 -10.0862 -10.0862 -4.3641 -4.3641 -4.3542 -4.3542 2.7669 2.7669 2.8085 2.8085 3.4814 3.4814 3.6096 3.6096 3.7813 3.7813 3.7952 3.7952 5.4298 5.4298 5.5357 5.5357 6.7367 6.7367 6.9370 6.9370 7.1126 7.1126 7.3065 7.3065 k = 0.5000 0.2887 0.1944 ( 8856 PWs) bands (ev): -27.0724 -27.0724 -27.0672 -27.0672 -27.0378 -27.0378 -27.0325 -27.0325 -26.7131 -26.7131 -26.7129 -26.7129 -10.8381 -10.8381 -10.8351 -10.8351 -10.7879 -10.7879 -10.7628 -10.7628 -10.6251 -10.6251 -10.6033 -10.6033 -10.5719 -10.5719 -10.5492 -10.5492 -10.4735 -10.4735 -10.4470 -10.4470 -10.3766 -10.3766 -10.3686 -10.3686 -10.3367 -10.3367 -10.3308 -10.3308 -10.1649 -10.1649 -10.1640 -10.1640 -10.0894 -10.0894 -10.0860 -10.0860 -4.3655 -4.3655 -4.3533 -4.3533 2.7688 2.7688 2.8201 2.8201 3.4592 3.4592 3.6161 3.6161 3.7801 3.7801 3.7969 3.7969 5.4297 5.4297 5.5534 5.5534 6.7166 6.7166 6.8730 6.8730 7.1778 7.1778 7.3184 7.3184 k = 0.5000 0.2887 0.1768 ( 8856 PWs) bands (ev): -27.0728 -27.0728 -27.0667 -27.0667 -27.0384 -27.0384 -27.0321 -27.0321 -26.7131 -26.7131 -26.7129 -26.7129 -10.8386 -10.8386 -10.8353 -10.8353 -10.7898 -10.7898 -10.7604 -10.7604 -10.6261 -10.6261 -10.6016 -10.6016 -10.5729 -10.5729 -10.5471 -10.5471 -10.4771 -10.4771 -10.4453 -10.4453 -10.3773 -10.3773 -10.3685 -10.3685 -10.3366 -10.3366 -10.3301 -10.3301 -10.1649 -10.1649 -10.1639 -10.1639 -10.0898 -10.0898 -10.0857 -10.0857 -4.3669 -4.3669 -4.3524 -4.3524 2.7722 2.7722 2.8326 2.8326 3.4368 3.4368 3.6203 3.6203 3.7790 3.7790 3.7984 3.7984 5.4336 5.4336 5.5699 5.5699 6.7039 6.7039 6.8078 6.8078 7.2460 7.2460 7.3207 7.3207 k = 0.5000 0.2887 0.1591 ( 8860 PWs) bands (ev): -27.0732 -27.0732 -27.0661 -27.0661 -27.0389 -27.0389 -27.0317 -27.0317 -26.7131 -26.7131 -26.7129 -26.7129 -10.8391 -10.8391 -10.8356 -10.8356 -10.7915 -10.7915 -10.7581 -10.7581 -10.6267 -10.6267 -10.6006 -10.6006 -10.5731 -10.5731 -10.5451 -10.5451 -10.4807 -10.4807 -10.4438 -10.4438 -10.3778 -10.3778 -10.3685 -10.3685 -10.3364 -10.3364 -10.3295 -10.3295 -10.1650 -10.1650 -10.1638 -10.1638 -10.0901 -10.0901 -10.0854 -10.0854 -4.3681 -4.3681 -4.3517 -4.3517 2.7768 2.7768 2.8456 2.8456 3.4146 3.4146 3.6225 3.6225 3.7780 3.7780 3.7997 3.7997 5.4413 5.4413 5.5847 5.5847 6.6985 6.6985 6.7430 6.7430 7.3072 7.3072 7.3227 7.3227 k = 0.5000 0.2887 0.1414 ( 8864 PWs) bands (ev): -27.0735 -27.0735 -27.0656 -27.0656 -27.0394 -27.0394 -27.0314 -27.0314 -26.7131 -26.7131 -26.7128 -26.7128 -10.8396 -10.8396 -10.8360 -10.8360 -10.7931 -10.7931 -10.7559 -10.7559 -10.6270 -10.6270 -10.6006 -10.6006 -10.5724 -10.5724 -10.5432 -10.5432 -10.4844 -10.4844 -10.4424 -10.4424 -10.3782 -10.3782 -10.3688 -10.3688 -10.3360 -10.3360 -10.3289 -10.3289 -10.1650 -10.1650 -10.1637 -10.1637 -10.0904 -10.0904 -10.0852 -10.0852 -4.3694 -4.3694 -4.3510 -4.3510 2.7824 2.7824 2.8589 2.8589 3.3929 3.3929 3.6229 3.6229 3.7768 3.7768 3.8007 3.8007 5.4527 5.4527 5.5974 5.5974 6.6765 6.6765 6.7038 6.7038 7.2945 7.2945 7.3495 7.3495 k = 0.5000 0.2887 0.1237 ( 8856 PWs) bands (ev): -27.0738 -27.0738 -27.0651 -27.0651 -27.0399 -27.0399 -27.0311 -27.0311 -26.7131 -26.7131 -26.7128 -26.7128 -10.8400 -10.8400 -10.8364 -10.8364 -10.7944 -10.7944 -10.7540 -10.7540 -10.6269 -10.6269 -10.6015 -10.6015 -10.5708 -10.5708 -10.5414 -10.5414 -10.4882 -10.4882 -10.4412 -10.4412 -10.3784 -10.3784 -10.3693 -10.3693 -10.3355 -10.3355 -10.3284 -10.3284 -10.1651 -10.1651 -10.1636 -10.1636 -10.0907 -10.0907 -10.0850 -10.0850 -4.3705 -4.3705 -4.3505 -4.3505 2.7887 2.7887 2.8720 2.8720 3.3722 3.3722 3.6219 3.6219 3.7757 3.7757 3.8015 3.8015 5.4672 5.4672 5.6079 5.6079 6.6155 6.6155 6.7136 6.7136 7.2692 7.2692 7.3315 7.3315 k = 0.5000 0.2887 0.1061 ( 8856 PWs) bands (ev): -27.0741 -27.0741 -27.0646 -27.0646 -27.0404 -27.0404 -27.0308 -27.0308 -26.7132 -26.7132 -26.7128 -26.7128 -10.8404 -10.8404 -10.8369 -10.8369 -10.7955 -10.7955 -10.7523 -10.7523 -10.6265 -10.6265 -10.6029 -10.6029 -10.5686 -10.5686 -10.5397 -10.5397 -10.4919 -10.4919 -10.4401 -10.4401 -10.3785 -10.3785 -10.3698 -10.3698 -10.3350 -10.3350 -10.3279 -10.3279 -10.1651 -10.1651 -10.1635 -10.1635 -10.0910 -10.0910 -10.0848 -10.0848 -4.3715 -4.3715 -4.3500 -4.3500 2.7955 2.7955 2.8846 2.8846 3.3529 3.3529 3.6198 3.6198 3.7744 3.7744 3.8022 3.8022 5.4840 5.4840 5.6161 5.6161 6.5569 6.5569 6.7317 6.7317 7.2365 7.2365 7.3157 7.3157 k = 0.5000 0.2887 0.0884 ( 8858 PWs) bands (ev): -27.0743 -27.0743 -27.0642 -27.0642 -27.0408 -27.0408 -27.0306 -27.0306 -26.7131 -26.7131 -26.7128 -26.7128 -10.8407 -10.8407 -10.8374 -10.8374 -10.7964 -10.7964 -10.7508 -10.7508 -10.6259 -10.6259 -10.6048 -10.6048 -10.5662 -10.5662 -10.5381 -10.5381 -10.4955 -10.4955 -10.4392 -10.4392 -10.3785 -10.3785 -10.3705 -10.3705 -10.3345 -10.3345 -10.3276 -10.3276 -10.1651 -10.1651 -10.1634 -10.1634 -10.0912 -10.0912 -10.0847 -10.0847 -4.3725 -4.3725 -4.3496 -4.3496 2.8022 2.8022 2.8963 2.8963 3.3354 3.3354 3.6169 3.6169 3.7732 3.7732 3.8028 3.8028 5.5022 5.5022 5.6224 5.6224 6.5029 6.5029 6.7568 6.7568 7.1978 7.1978 7.3024 7.3024 k = 0.5000 0.2887 0.0707 ( 8846 PWs) bands (ev): -27.0745 -27.0745 -27.0639 -27.0639 -27.0411 -27.0411 -27.0304 -27.0304 -26.7132 -26.7132 -26.7128 -26.7128 -10.8409 -10.8409 -10.8378 -10.8378 -10.7972 -10.7972 -10.7495 -10.7495 -10.6249 -10.6249 -10.6069 -10.6069 -10.5638 -10.5638 -10.5367 -10.5367 -10.4989 -10.4989 -10.4385 -10.4385 -10.3783 -10.3783 -10.3712 -10.3712 -10.3339 -10.3339 -10.3273 -10.3273 -10.1651 -10.1651 -10.1634 -10.1634 -10.0914 -10.0914 -10.0845 -10.0845 -4.3732 -4.3732 -4.3493 -4.3493 2.8086 2.8086 2.9065 2.9065 3.3203 3.3203 3.6138 3.6138 3.7720 3.7720 3.8032 3.8032 5.5205 5.5205 5.6269 5.6269 6.4551 6.4551 6.7881 6.7881 7.1546 7.1546 7.2915 7.2915 k = 0.5000 0.2887 0.0530 ( 8866 PWs) bands (ev): -27.0747 -27.0747 -27.0636 -27.0636 -27.0414 -27.0414 -27.0303 -27.0303 -26.7132 -26.7132 -26.7128 -26.7128 -10.8411 -10.8411 -10.8383 -10.8383 -10.7978 -10.7978 -10.7485 -10.7485 -10.6238 -10.6238 -10.6090 -10.6090 -10.5616 -10.5616 -10.5353 -10.5353 -10.5020 -10.5020 -10.4379 -10.4379 -10.3781 -10.3781 -10.3719 -10.3719 -10.3335 -10.3335 -10.3271 -10.3271 -10.1651 -10.1651 -10.1633 -10.1633 -10.0916 -10.0916 -10.0844 -10.0844 -4.3738 -4.3738 -4.3490 -4.3490 2.8141 2.8141 2.9150 2.9150 3.3079 3.3079 3.6108 3.6108 3.7710 3.7710 3.8036 3.8036 5.5373 5.5373 5.6299 5.6299 6.4151 6.4151 6.8246 6.8246 7.1083 7.1083 7.2831 7.2831 k = 0.5000 0.2887 0.0354 ( 8858 PWs) bands (ev): -27.0748 -27.0748 -27.0634 -27.0634 -27.0416 -27.0416 -27.0302 -27.0302 -26.7132 -26.7132 -26.7128 -26.7128 -10.8412 -10.8412 -10.8386 -10.8386 -10.7982 -10.7982 -10.7478 -10.7478 -10.6226 -10.6226 -10.6109 -10.6109 -10.5599 -10.5599 -10.5342 -10.5342 -10.5044 -10.5044 -10.4375 -10.4375 -10.3778 -10.3778 -10.3726 -10.3726 -10.3331 -10.3331 -10.3269 -10.3269 -10.1651 -10.1651 -10.1633 -10.1633 -10.0917 -10.0917 -10.0844 -10.0844 -4.3743 -4.3743 -4.3489 -4.3489 2.8185 2.8185 2.9214 2.9214 3.2988 3.2988 3.6084 3.6084 3.7702 3.7702 3.8038 3.8038 5.5510 5.5510 5.6319 5.6319 6.3848 6.3848 6.8654 6.8654 7.0603 7.0603 7.2770 7.2770 k = 0.5000 0.2887 0.0177 ( 8850 PWs) bands (ev): -27.0748 -27.0748 -27.0632 -27.0632 -27.0417 -27.0417 -27.0301 -27.0301 -26.7132 -26.7132 -26.7128 -26.7128 -10.8412 -10.8412 -10.8388 -10.8388 -10.7984 -10.7984 -10.7474 -10.7474 -10.6216 -10.6216 -10.6124 -10.6124 -10.5588 -10.5588 -10.5334 -10.5334 -10.5061 -10.5061 -10.4373 -10.4373 -10.3775 -10.3775 -10.3730 -10.3730 -10.3329 -10.3329 -10.3269 -10.3269 -10.1651 -10.1651 -10.1633 -10.1633 -10.0917 -10.0917 -10.0843 -10.0843 -4.3745 -4.3745 -4.3488 -4.3488 2.8212 2.8212 2.9253 2.9253 3.2931 3.2931 3.6068 3.6068 3.7698 3.7698 3.8040 3.8040 5.5600 5.5600 5.6330 5.6330 6.3658 6.3658 6.9084 6.9084 7.0129 7.0129 7.2734 7.2734 k = 0.5000 0.2887-0.0000 ( 8844 PWs) bands (ev): -27.0748 -27.0748 -27.0632 -27.0632 -27.0418 -27.0418 -27.0301 -27.0301 -26.7132 -26.7132 -26.7128 -26.7128 -10.8412 -10.8412 -10.8389 -10.8389 -10.7985 -10.7985 -10.7473 -10.7473 -10.6211 -10.6211 -10.6130 -10.6130 -10.5584 -10.5584 -10.5331 -10.5331 -10.5067 -10.5067 -10.4372 -10.4372 -10.3774 -10.3774 -10.3732 -10.3732 -10.3328 -10.3328 -10.3268 -10.3268 -10.1651 -10.1651 -10.1632 -10.1632 -10.0918 -10.0918 -10.0843 -10.0843 -4.3746 -4.3746 -4.3487 -4.3487 2.8222 2.8222 2.9266 2.9266 3.2912 3.2912 3.6062 3.6062 3.7696 3.7696 3.8040 3.8040 5.5631 5.5631 5.6334 5.6334 6.3593 6.3593 6.9398 6.9398 6.9800 6.9800 7.2722 7.2722 k = 0.3333 0.5774-0.0000 ( 8865 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7134 -26.7134 -26.7130 -26.7130 -10.8476 -10.8476 -10.8431 -10.8431 -10.7750 -10.7750 -10.7627 -10.7627 -10.6798 -10.6798 -10.5703 -10.5703 -10.5526 -10.5526 -10.5201 -10.5201 -10.4959 -10.4959 -10.4766 -10.4766 -10.3946 -10.3946 -10.3445 -10.3445 -10.3338 -10.3338 -10.3146 -10.3146 -10.1766 -10.1766 -10.1485 -10.1485 -10.0949 -10.0949 -10.0858 -10.0858 -4.3514 -4.3514 -4.3495 -4.3495 3.0668 3.0668 3.2365 3.2365 3.2600 3.2600 3.3712 3.3712 3.5158 3.5158 3.5196 3.5196 5.7071 5.7071 5.7087 5.7087 6.6542 6.6542 6.6580 6.6580 7.0494 7.0494 7.1020 7.1020 k = 0.3333 0.5774 0.0177 ( 8853 PWs) bands (ev): -27.0688 -27.0688 -27.0688 -27.0688 -27.0359 -27.0359 -27.0359 -27.0359 -26.7134 -26.7134 -26.7130 -26.7130 -10.8474 -10.8474 -10.8431 -10.8431 -10.7750 -10.7750 -10.7629 -10.7629 -10.6797 -10.6797 -10.5712 -10.5712 -10.5525 -10.5525 -10.5193 -10.5193 -10.4959 -10.4959 -10.4766 -10.4766 -10.3945 -10.3945 -10.3445 -10.3445 -10.3341 -10.3341 -10.3145 -10.3145 -10.1766 -10.1766 -10.1485 -10.1485 -10.0949 -10.0949 -10.0858 -10.0858 -4.3513 -4.3513 -4.3495 -4.3495 3.0670 3.0670 3.2361 3.2361 3.2564 3.2564 3.3647 3.3647 3.5229 3.5229 3.5236 3.5236 5.7064 5.7064 5.7091 5.7091 6.6465 6.6465 6.6509 6.6509 7.0583 7.0583 7.1103 7.1103 k = 0.3333 0.5774 0.0354 ( 8859 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7134 -26.7134 -26.7130 -26.7130 -10.8470 -10.8470 -10.8429 -10.8429 -10.7750 -10.7750 -10.7634 -10.7634 -10.6793 -10.6793 -10.5735 -10.5735 -10.5523 -10.5523 -10.5173 -10.5173 -10.4958 -10.4958 -10.4766 -10.4766 -10.3943 -10.3943 -10.3446 -10.3446 -10.3349 -10.3349 -10.3141 -10.3141 -10.1766 -10.1766 -10.1485 -10.1485 -10.0949 -10.0949 -10.0858 -10.0858 -4.3513 -4.3513 -4.3494 -4.3494 3.0677 3.0677 3.2350 3.2350 3.2462 3.2462 3.3485 3.3485 3.5348 3.5348 3.5410 3.5410 5.7051 5.7051 5.7097 5.7097 6.6255 6.6255 6.6310 6.6310 7.0828 7.0828 7.1335 7.1335 k = 0.3333 0.5774 0.0530 ( 8877 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7134 -26.7134 -26.7130 -26.7130 -10.8464 -10.8464 -10.8427 -10.8427 -10.7750 -10.7750 -10.7643 -10.7643 -10.6787 -10.6787 -10.5770 -10.5770 -10.5519 -10.5519 -10.5144 -10.5144 -10.4958 -10.4958 -10.4766 -10.4766 -10.3939 -10.3939 -10.3448 -10.3448 -10.3362 -10.3362 -10.3136 -10.3136 -10.1765 -10.1765 -10.1486 -10.1486 -10.0949 -10.0949 -10.0859 -10.0859 -4.3511 -4.3511 -4.3493 -4.3493 3.0687 3.0687 3.2312 3.2312 3.2331 3.2331 3.3275 3.3275 3.5517 3.5517 3.5652 3.5652 5.7034 5.7034 5.7100 5.7100 6.5953 6.5953 6.6021 6.6021 7.1187 7.1187 7.1679 7.1679 k = 0.3333 0.5774 0.0707 ( 8880 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7134 -26.7134 -26.7130 -26.7130 -10.8454 -10.8454 -10.8423 -10.8423 -10.7751 -10.7751 -10.7656 -10.7656 -10.6778 -10.6778 -10.5814 -10.5814 -10.5515 -10.5515 -10.5109 -10.5109 -10.4956 -10.4956 -10.4766 -10.4766 -10.3933 -10.3933 -10.3450 -10.3450 -10.3379 -10.3379 -10.3129 -10.3129 -10.1765 -10.1765 -10.1486 -10.1486 -10.0949 -10.0949 -10.0859 -10.0859 -4.3509 -4.3509 -4.3491 -4.3491 3.0702 3.0702 3.2131 3.2131 3.2302 3.2302 3.3051 3.3051 3.5721 3.5721 3.5922 3.5922 5.7016 5.7016 5.7102 5.7102 6.5601 6.5601 6.5678 6.5678 7.1616 7.1616 7.2096 7.2096 k = 0.3333 0.5774 0.0884 ( 8889 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7134 -26.7134 -26.7130 -26.7130 -10.8443 -10.8443 -10.8419 -10.8419 -10.7751 -10.7751 -10.7671 -10.7671 -10.6767 -10.6767 -10.5863 -10.5863 -10.5509 -10.5509 -10.5073 -10.5073 -10.4953 -10.4953 -10.4766 -10.4766 -10.3926 -10.3926 -10.3453 -10.3453 -10.3400 -10.3400 -10.3122 -10.3122 -10.1764 -10.1764 -10.1487 -10.1487 -10.0949 -10.0949 -10.0859 -10.0859 -4.3507 -4.3507 -4.3489 -4.3489 3.0718 3.0718 3.1936 3.1936 3.2260 3.2260 3.2835 3.2835 3.5947 3.5947 3.6202 3.6202 5.6996 5.6996 5.7101 5.7101 6.5227 6.5227 6.5309 6.5309 7.2083 7.2083 7.2555 7.2555 k = 0.3333 0.5774 0.1061 ( 8880 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7134 -26.7134 -26.7130 -26.7130 -10.8429 -10.8429 -10.8414 -10.8414 -10.7752 -10.7752 -10.7688 -10.7688 -10.6754 -10.6754 -10.5915 -10.5915 -10.5502 -10.5502 -10.5039 -10.5039 -10.4946 -10.4946 -10.4766 -10.4766 -10.3917 -10.3917 -10.3456 -10.3456 -10.3423 -10.3423 -10.3115 -10.3115 -10.1762 -10.1762 -10.1488 -10.1488 -10.0949 -10.0949 -10.0859 -10.0859 -4.3505 -4.3505 -4.3486 -4.3486 3.0736 3.0736 3.1736 3.1736 3.2199 3.2199 3.2645 3.2645 3.6181 3.6181 3.6482 3.6482 5.6975 5.6975 5.7098 5.7098 6.4852 6.4852 6.4934 6.4934 7.2566 7.2566 7.3032 7.3032 k = 0.3333 0.5774 0.1237 ( 8883 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7133 -26.7133 -26.7131 -26.7131 -10.8414 -10.8414 -10.8409 -10.8409 -10.7752 -10.7752 -10.7708 -10.7708 -10.6738 -10.6738 -10.5968 -10.5968 -10.5495 -10.5495 -10.5014 -10.5014 -10.4932 -10.4932 -10.4765 -10.4765 -10.3907 -10.3907 -10.3459 -10.3459 -10.3449 -10.3449 -10.3109 -10.3109 -10.1761 -10.1761 -10.1489 -10.1489 -10.0948 -10.0948 -10.0859 -10.0859 -4.3502 -4.3502 -4.3483 -4.3483 3.0752 3.0752 3.1540 3.1540 3.2110 3.2110 3.2494 3.2494 3.6414 3.6414 3.6752 3.6752 5.6954 5.6954 5.7094 5.7094 6.4488 6.4488 6.4568 6.4568 7.3047 7.3047 7.3509 7.3509 k = 0.3333 0.5774 0.1414 ( 8868 PWs) bands (ev): -27.0689 -27.0689 -27.0689 -27.0689 -27.0359 -27.0359 -27.0359 -27.0359 -26.7133 -26.7133 -26.7130 -26.7130 -10.8404 -10.8404 -10.8397 -10.8397 -10.7753 -10.7753 -10.7730 -10.7730 -10.6719 -10.6719 -10.6023 -10.6023 -10.5488 -10.5488 -10.4998 -10.4998 -10.4910 -10.4910 -10.4763 -10.4763 -10.3894 -10.3894 -10.3476 -10.3476 -10.3462 -10.3462 -10.3102 -10.3102 -10.1760 -10.1760 -10.1490 -10.1490 -10.0948 -10.0948 -10.0859 -10.0859 -4.3499 -4.3499 -4.3481 -4.3481 3.0766 3.0766 3.1354 3.1354 3.1997 3.1997 3.2389 3.2389 3.6640 3.6640 3.7009 3.7009 5.6933 5.6933 5.7088 5.7088 6.4144 6.4144 6.4221 6.4221 7.3511 7.3511 7.3970 7.3970 k = 0.3333 0.5774 0.1591 ( 8844 PWs) bands (ev): -27.0688 -27.0688 -27.0688 -27.0688 -27.0359 -27.0359 -27.0359 -27.0359 -26.7133 -26.7133 -26.7130 -26.7130 -10.8398 -10.8398 -10.8378 -10.8378 -10.7753 -10.7753 -10.7753 -10.7753 -10.6698 -10.6698 -10.6076 -10.6076 -10.5480 -10.5480 -10.4991 -10.4991 -10.4885 -10.4885 -10.4760 -10.4760 -10.3879 -10.3879 -10.3505 -10.3505 -10.3465 -10.3465 -10.3097 -10.3097 -10.1758 -10.1758 -10.1490 -10.1490 -10.0948 -10.0948 -10.0859 -10.0859 -4.3496 -4.3496 -4.3478 -4.3478 3.0774 3.0774 3.1182 3.1182 3.1878 3.1878 3.2314 3.2314 3.6852 3.6852 3.7248 3.7248 5.6912 5.6912 5.7082 5.7082 6.3827 6.3827 6.3899 6.3899 7.3946 7.3946 7.4404 7.4404 k = 0.3333 0.5774 0.1768 ( 8856 PWs) bands (ev): -27.0688 -27.0688 -27.0688 -27.0688 -27.0359 -27.0359 -27.0359 -27.0359 -26.7133 -26.7133 -26.7130 -26.7130 -10.8393 -10.8393 -10.8360 -10.8360 -10.7776 -10.7776 -10.7754 -10.7754 -10.6675 -10.6675 -10.6129 -10.6129 -10.5473 -10.5473 -10.4987 -10.4987 -10.4860 -10.4860 -10.4755 -10.4755 -10.3863 -10.3863 -10.3535 -10.3535 -10.3469 -10.3469 -10.3092 -10.3092 -10.1757 -10.1757 -10.1491 -10.1491 -10.0948 -10.0948 -10.0859 -10.0859 -4.3493 -4.3493 -4.3475 -4.3475 3.0773 3.0773 3.1027 3.1027 3.1772 3.1772 3.2255 3.2255 3.7045 3.7045 3.7463 3.7463 5.6893 5.6893 5.7075 5.7075 6.3543 6.3543 6.3610 6.3610 7.4342 7.4342 7.4797 7.4797 k = 0.3333 0.5774 0.1944 ( 8868 PWs) bands (ev): -27.0688 -27.0688 -27.0688 -27.0688 -27.0359 -27.0359 -27.0359 -27.0359 -26.7133 -26.7133 -26.7131 -26.7131 -10.8389 -10.8389 -10.8341 -10.8341 -10.7798 -10.7798 -10.7754 -10.7754 -10.6650 -10.6650 -10.6181 -10.6181 -10.5467 -10.5467 -10.4985 -10.4985 -10.4841 -10.4841 -10.4748 -10.4748 -10.3845 -10.3845 -10.3565 -10.3565 -10.3472 -10.3472 -10.3088 -10.3088 -10.1756 -10.1756 -10.1492 -10.1492 -10.0947 -10.0947 -10.0859 -10.0859 -4.3491 -4.3491 -4.3472 -4.3472 3.0763 3.0763 3.0893 3.0893 3.1690 3.1690 3.2205 3.2205 3.7216 3.7216 3.7653 3.7653 5.6876 5.6876 5.7069 5.7069 6.3296 6.3296 6.3357 6.3357 7.4690 7.4690 7.5143 7.5143 k = 0.3333 0.5774 0.2121 ( 8871 PWs) bands (ev): -27.0688 -27.0688 -27.0688 -27.0688 -27.0359 -27.0359 -27.0359 -27.0359 -26.7133 -26.7133 -26.7131 -26.7131 -10.8384 -10.8384 -10.8323 -10.8323 -10.7819 -10.7819 -10.7755 -10.7755 -10.6623 -10.6623 -10.6229 -10.6229 -10.5461 -10.5461 -10.4985 -10.4985 -10.4827 -10.4827 -10.4738 -10.4738 -10.3824 -10.3824 -10.3596 -10.3596 -10.3475 -10.3475 -10.3084 -10.3084 -10.1755 -10.1755 -10.1493 -10.1493 -10.0947 -10.0947 -10.0859 -10.0859 -4.3488 -4.3488 -4.3470 -4.3470 3.0744 3.0744 3.0780 3.0780 3.1634 3.1634 3.2162 3.2162 3.7360 3.7360 3.7812 3.7812 5.6862 5.6862 5.7063 5.7063 6.3089 6.3089 6.3145 6.3145 7.4982 7.4982 7.5432 7.5432 k = 0.3333 0.5774 0.2298 ( 8865 PWs) bands (ev): -27.0688 -27.0688 -27.0688 -27.0688 -27.0359 -27.0359 -27.0359 -27.0359 -26.7132 -26.7132 -26.7131 -26.7131 -10.8381 -10.8381 -10.8308 -10.8308 -10.7838 -10.7838 -10.7755 -10.7755 -10.6596 -10.6596 -10.6273 -10.6273 -10.5457 -10.5457 -10.4984 -10.4984 -10.4818 -10.4818 -10.4728 -10.4728 -10.3802 -10.3802 -10.3626 -10.3626 -10.3477 -10.3477 -10.3082 -10.3082 -10.1754 -10.1754 -10.1494 -10.1494 -10.0947 -10.0947 -10.0859 -10.0859 -4.3487 -4.3487 -4.3468 -4.3468 3.0691 3.0691 3.0721 3.0721 3.1600 3.1600 3.2126 3.2126 3.7476 3.7476 3.7939 3.7939 5.6850 5.6850 5.7058 5.7058 6.2925 6.2925 6.2976 6.2976 7.5212 7.5212 7.5660 7.5660 k = 0.3333 0.5774 0.2475 ( 8859 PWs) bands (ev): -27.0688 -27.0688 -27.0688 -27.0688 -27.0359 -27.0359 -27.0359 -27.0359 -26.7132 -26.7132 -26.7131 -26.7131 -10.8378 -10.8378 -10.8295 -10.8295 -10.7852 -10.7852 -10.7756 -10.7756 -10.6571 -10.6571 -10.6311 -10.6311 -10.5453 -10.5453 -10.4984 -10.4984 -10.4813 -10.4813 -10.4719 -10.4719 -10.3778 -10.3778 -10.3656 -10.3656 -10.3478 -10.3478 -10.3080 -10.3080 -10.1754 -10.1754 -10.1494 -10.1494 -10.0947 -10.0947 -10.0859 -10.0859 -4.3485 -4.3485 -4.3467 -4.3467 3.0626 3.0626 3.0700 3.0700 3.1584 3.1584 3.2097 3.2097 3.7560 3.7560 3.8032 3.8032 5.6841 5.6841 5.7054 5.7054 6.2806 6.2806 6.2854 6.2854 7.5379 7.5379 7.5825 7.5825 k = 0.3333 0.5774 0.2651 ( 8874 PWs) bands (ev): -27.0688 -27.0688 -27.0688 -27.0688 -27.0360 -27.0360 -27.0360 -27.0360 -26.7132 -26.7132 -26.7132 -26.7132 -10.8377 -10.8377 -10.8287 -10.8287 -10.7862 -10.7862 -10.7756 -10.7756 -10.6551 -10.6551 -10.6339 -10.6339 -10.5451 -10.5451 -10.4984 -10.4984 -10.4810 -10.4810 -10.4713 -10.4713 -10.3755 -10.3755 -10.3683 -10.3683 -10.3479 -10.3479 -10.3079 -10.3079 -10.1753 -10.1753 -10.1494 -10.1494 -10.0947 -10.0947 -10.0859 -10.0859 -4.3484 -4.3484 -4.3466 -4.3466 3.0588 3.0588 3.0685 3.0685 3.1577 3.1577 3.2079 3.2079 3.7611 3.7611 3.8088 3.8088 5.6836 5.6836 5.7051 5.7051 6.2735 6.2735 6.2780 6.2780 7.5479 7.5479 7.5923 7.5923 k = 0.3333 0.5774 0.2828 ( 8874 PWs) bands (ev): -27.0688 -27.0688 -27.0688 -27.0688 -27.0359 -27.0359 -27.0359 -27.0359 -26.7132 -26.7132 -26.7132 -26.7132 -10.8376 -10.8376 -10.8285 -10.8285 -10.7865 -10.7865 -10.7756 -10.7756 -10.6543 -10.6543 -10.6349 -10.6349 -10.5451 -10.5451 -10.4984 -10.4984 -10.4810 -10.4810 -10.4710 -10.4710 -10.3742 -10.3742 -10.3698 -10.3698 -10.3480 -10.3480 -10.3078 -10.3078 -10.1753 -10.1753 -10.1494 -10.1494 -10.0947 -10.0947 -10.0859 -10.0859 -4.3484 -4.3484 -4.3466 -4.3466 3.0574 3.0574 3.0680 3.0680 3.1575 3.1575 3.2073 3.2073 3.7629 3.7629 3.8107 3.8107 5.6834 5.6834 5.7050 5.7050 6.2711 6.2711 6.2756 6.2756 7.5513 7.5513 7.5956 7.5956 Writing output data file K3As.save init_run : 0.53s CPU 0.66s WALL ( 1 calls) electrons : 323.48s CPU 326.88s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.04s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 323.48s CPU 326.87s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.11s CPU 0.16s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.09s CPU 0.12s WALL ( 233 calls) cegterg : 293.66s CPU 296.28s WALL ( 432 calls) Called by sum_band: Called by *egterg: h_psi : 173.68s CPU 175.35s WALL ( 6754 calls) s_psi : 15.16s CPU 15.13s WALL ( 6754 calls) g_psi : 0.58s CPU 0.53s WALL ( 6089 calls) cdiaghg : 83.48s CPU 84.52s WALL ( 6322 calls) cegterg:over : 15.76s CPU 15.87s WALL ( 6089 calls) cegterg:upda : 15.58s CPU 15.73s WALL ( 6089 calls) cegterg:last : 7.38s CPU 7.38s WALL ( 898 calls) cdiaghg:chol : 4.86s CPU 4.94s WALL ( 6322 calls) cdiaghg:inve : 3.64s CPU 3.61s WALL ( 6322 calls) cdiaghg:para : 6.20s CPU 6.27s WALL ( 12644 calls) Called by h_psi: h_psi:vloc : 144.28s CPU 145.84s WALL ( 6754 calls) h_psi:vnl : 28.71s CPU 28.85s WALL ( 6754 calls) add_vuspsi : 15.32s CPU 15.41s WALL ( 6754 calls) General routines calbec : 13.38s CPU 13.42s WALL ( 6754 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 135.16s CPU 136.66s WALL ( 891220 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.30s CPU 0.40s WALL ( 466 calls) Parallel routines fft_scatter : 43.62s CPU 43.77s WALL ( 891243 calls) PWSCF : 5m49.21s CPU 6m 7.95s WALL This run was terminated on: 19:42:58 27Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=