Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 19:54:32 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./MoH.save/ file Mo.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 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 18 12 3 606 312 51 Max 19 13 4 615 326 60 Sum 649 433 127 21855 11513 1985 bravais-lattice index = 14 lattice parameter (alat) = 5.5501 a.u. unit-cell volume = 239.8609 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 30.00 number of Kohn-Sham states= 38 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 307.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.550125 celldm(2)= 1.000000 celldm(3)= 1.620020 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 1.620020 ) 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 0.617276 ) PseudoPot. # 1 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Mo read from file: /users/gautes/Pseudo/Mo.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 20113fa3d0a6ce27e798500ceb8a7ae4 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1229 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 H 1.00 1.00790 H( 1.00) Mo 14.00 95.94000 Mo( 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 ) ( 0.8100102 ) 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 ) ( 0.8100102 ) 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 ) ( 0.8100102 ) 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 ) ( 0.8100102 ) 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 ) ( 0.8100102 ) 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 ) ( 0.8100102 ) 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 ) ( 0.8100102 ) 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 ) ( 0.8100102 ) 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 ) ( 0.8100102 ) 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 ) ( 0.8100102 ) 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 ) ( 0.8100102 ) 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 ) ( 0.8100102 ) 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= 451 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022173 k( 2) = ( 0.0080645 0.0046561 -0.0000000), wk = 0.0022173 k( 3) = ( 0.0161290 0.0093121 -0.0000000), wk = 0.0022173 k( 4) = ( 0.0241936 0.0139682 -0.0000000), wk = 0.0022173 k( 5) = ( 0.0322581 0.0186242 -0.0000000), wk = 0.0022173 k( 6) = ( 0.0403226 0.0232803 -0.0000000), wk = 0.0022173 k( 7) = ( 0.0483871 0.0279363 -0.0000000), wk = 0.0022173 k( 8) = ( 0.0564516 0.0325924 -0.0000000), wk = 0.0022173 k( 9) = ( 0.0645161 0.0372484 -0.0000000), wk = 0.0022173 k( 10) = ( 0.0725806 0.0419045 -0.0000000), wk = 0.0022173 k( 11) = ( 0.0806452 0.0465605 -0.0000000), wk = 0.0022173 k( 12) = ( 0.0887097 0.0512166 -0.0000000), wk = 0.0022173 k( 13) = ( 0.0967742 0.0558726 -0.0000000), wk = 0.0022173 k( 14) = ( 0.1048387 0.0605287 -0.0000000), wk = 0.0022173 k( 15) = ( 0.1129032 0.0651847 -0.0000000), wk = 0.0022173 k( 16) = ( 0.1209677 0.0698408 -0.0000000), wk = 0.0022173 k( 17) = ( 0.1290323 0.0744968 -0.0000000), wk = 0.0022173 k( 18) = ( 0.1370968 0.0791529 -0.0000000), wk = 0.0022173 k( 19) = ( 0.1451613 0.0838089 -0.0000000), wk = 0.0022173 k( 20) = ( 0.1532258 0.0884650 -0.0000000), wk = 0.0022173 k( 21) = ( 0.1612903 0.0931210 -0.0000000), wk = 0.0022173 k( 22) = ( 0.1693548 0.0977771 -0.0000000), wk = 0.0022173 k( 23) = ( 0.1774194 0.1024331 -0.0000000), wk = 0.0022173 k( 24) = ( 0.1854839 0.1070892 -0.0000000), wk = 0.0022173 k( 25) = ( 0.1935484 0.1117452 -0.0000000), wk = 0.0022173 k( 26) = ( 0.2016129 0.1164013 -0.0000000), wk = 0.0022173 k( 27) = ( 0.2096774 0.1210573 -0.0000000), wk = 0.0022173 k( 28) = ( 0.2177419 0.1257134 -0.0000000), wk = 0.0022173 k( 29) = ( 0.2258064 0.1303694 -0.0000000), wk = 0.0022173 k( 30) = ( 0.2338710 0.1350255 -0.0000000), wk = 0.0022173 k( 31) = ( 0.2419355 0.1396815 -0.0000000), wk = 0.0022173 k( 32) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0022173 k( 33) = ( 0.2580645 0.1489936 -0.0000000), wk = 0.0022173 k( 34) = ( 0.2661290 0.1536497 -0.0000000), wk = 0.0022173 k( 35) = ( 0.2741936 0.1583057 -0.0000000), wk = 0.0022173 k( 36) = ( 0.2822581 0.1629618 -0.0000000), wk = 0.0022173 k( 37) = ( 0.2903226 0.1676178 -0.0000000), wk = 0.0022173 k( 38) = ( 0.2983871 0.1722739 -0.0000000), wk = 0.0022173 k( 39) = ( 0.3064516 0.1769299 -0.0000000), wk = 0.0022173 k( 40) = ( 0.3145161 0.1815860 -0.0000000), wk = 0.0022173 k( 41) = ( 0.3225807 0.1862420 -0.0000000), wk = 0.0022173 k( 42) = ( 0.3306452 0.1908981 -0.0000000), wk = 0.0022173 k( 43) = ( 0.3387097 0.1955541 -0.0000000), wk = 0.0022173 k( 44) = ( 0.3467742 0.2002102 -0.0000000), wk = 0.0022173 k( 45) = ( 0.3548387 0.2048662 -0.0000000), wk = 0.0022173 k( 46) = ( 0.3629032 0.2095223 -0.0000000), wk = 0.0022173 k( 47) = ( 0.3709677 0.2141783 -0.0000000), wk = 0.0022173 k( 48) = ( 0.3790323 0.2188344 -0.0000000), wk = 0.0022173 k( 49) = ( 0.3870968 0.2234904 -0.0000000), wk = 0.0022173 k( 50) = ( 0.3951613 0.2281465 -0.0000000), wk = 0.0022173 k( 51) = ( 0.4032258 0.2328025 -0.0000000), wk = 0.0022173 k( 52) = ( 0.4112903 0.2374586 -0.0000000), wk = 0.0022173 k( 53) = ( 0.4193548 0.2421146 -0.0000000), wk = 0.0022173 k( 54) = ( 0.4274193 0.2467707 -0.0000000), wk = 0.0022173 k( 55) = ( 0.4354839 0.2514267 -0.0000000), wk = 0.0022173 k( 56) = ( 0.4435484 0.2560828 -0.0000000), wk = 0.0022173 k( 57) = ( 0.4516129 0.2607388 -0.0000000), wk = 0.0022173 k( 58) = ( 0.4596774 0.2653949 -0.0000000), wk = 0.0022173 k( 59) = ( 0.4677419 0.2700509 -0.0000000), wk = 0.0022173 k( 60) = ( 0.4758064 0.2747070 -0.0000000), wk = 0.0022173 k( 61) = ( 0.4838710 0.2793630 -0.0000000), wk = 0.0022173 k( 62) = ( 0.4919355 0.2840191 -0.0000000), wk = 0.0022173 k( 63) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0022173 k( 64) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0022173 k( 65) = ( 0.4953704 0.2966939 -0.0000000), wk = 0.0022173 k( 66) = ( 0.4907407 0.3047126 -0.0000000), wk = 0.0022173 k( 67) = ( 0.4861111 0.3127314 -0.0000000), wk = 0.0022173 k( 68) = ( 0.4814815 0.3207502 -0.0000000), wk = 0.0022173 k( 69) = ( 0.4768519 0.3287689 -0.0000000), wk = 0.0022173 k( 70) = ( 0.4722222 0.3367877 -0.0000000), wk = 0.0022173 k( 71) = ( 0.4675926 0.3448064 -0.0000000), wk = 0.0022173 k( 72) = ( 0.4629630 0.3528252 -0.0000000), wk = 0.0022173 k( 73) = ( 0.4583333 0.3608439 -0.0000000), wk = 0.0022173 k( 74) = ( 0.4537037 0.3688627 -0.0000000), wk = 0.0022173 k( 75) = ( 0.4490741 0.3768814 -0.0000000), wk = 0.0022173 k( 76) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0022173 k( 77) = ( 0.4398148 0.3929189 -0.0000000), wk = 0.0022173 k( 78) = ( 0.4351852 0.4009377 -0.0000000), wk = 0.0022173 k( 79) = ( 0.4305556 0.4089564 -0.0000000), wk = 0.0022173 k( 80) = ( 0.4259259 0.4169752 -0.0000000), wk = 0.0022173 k( 81) = ( 0.4212963 0.4249940 -0.0000000), wk = 0.0022173 k( 82) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0022173 k( 83) = ( 0.4120370 0.4410315 -0.0000000), wk = 0.0022173 k( 84) = ( 0.4074074 0.4490502 -0.0000000), wk = 0.0022173 k( 85) = ( 0.4027778 0.4570690 -0.0000000), wk = 0.0022173 k( 86) = ( 0.3981481 0.4650877 -0.0000000), wk = 0.0022173 k( 87) = ( 0.3935185 0.4731065 -0.0000000), wk = 0.0022173 k( 88) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0022173 k( 89) = ( 0.3842593 0.4891440 -0.0000000), wk = 0.0022173 k( 90) = ( 0.3796296 0.4971627 -0.0000000), wk = 0.0022173 k( 91) = ( 0.3750000 0.5051815 -0.0000000), wk = 0.0022173 k( 92) = ( 0.3703704 0.5132002 -0.0000000), wk = 0.0022173 k( 93) = ( 0.3657407 0.5212190 -0.0000000), wk = 0.0022173 k( 94) = ( 0.3611111 0.5292377 -0.0000000), wk = 0.0022173 k( 95) = ( 0.3564815 0.5372565 -0.0000000), wk = 0.0022173 k( 96) = ( 0.3518519 0.5452753 -0.0000000), wk = 0.0022173 k( 97) = ( 0.3472222 0.5532940 -0.0000000), wk = 0.0022173 k( 98) = ( 0.3425926 0.5613128 -0.0000000), wk = 0.0022173 k( 99) = ( 0.3379630 0.5693315 -0.0000000), wk = 0.0022173 k( 100) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0022173 k( 101) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0022173 k( 102) = ( 0.3287037 0.5693315 -0.0000000), wk = 0.0022173 k( 103) = ( 0.3240741 0.5613128 -0.0000000), wk = 0.0022173 k( 104) = ( 0.3194444 0.5532940 -0.0000000), wk = 0.0022173 k( 105) = ( 0.3148148 0.5452752 -0.0000000), wk = 0.0022173 k( 106) = ( 0.3101852 0.5372565 -0.0000000), wk = 0.0022173 k( 107) = ( 0.3055556 0.5292378 -0.0000000), wk = 0.0022173 k( 108) = ( 0.3009259 0.5212190 -0.0000000), wk = 0.0022173 k( 109) = ( 0.2962963 0.5132002 -0.0000000), wk = 0.0022173 k( 110) = ( 0.2916667 0.5051815 -0.0000000), wk = 0.0022173 k( 111) = ( 0.2870370 0.4971627 -0.0000000), wk = 0.0022173 k( 112) = ( 0.2824074 0.4891440 -0.0000000), wk = 0.0022173 k( 113) = ( 0.2777778 0.4811252 -0.0000000), wk = 0.0022173 k( 114) = ( 0.2731481 0.4731065 -0.0000000), wk = 0.0022173 k( 115) = ( 0.2685185 0.4650877 -0.0000000), wk = 0.0022173 k( 116) = ( 0.2638889 0.4570690 -0.0000000), wk = 0.0022173 k( 117) = ( 0.2592593 0.4490502 -0.0000000), wk = 0.0022173 k( 118) = ( 0.2546296 0.4410315 -0.0000000), wk = 0.0022173 k( 119) = ( 0.2500000 0.4330127 -0.0000000), wk = 0.0022173 k( 120) = ( 0.2453704 0.4249939 -0.0000000), wk = 0.0022173 k( 121) = ( 0.2407407 0.4169752 -0.0000000), wk = 0.0022173 k( 122) = ( 0.2361111 0.4089564 -0.0000000), wk = 0.0022173 k( 123) = ( 0.2314815 0.4009377 -0.0000000), wk = 0.0022173 k( 124) = ( 0.2268518 0.3929189 -0.0000000), wk = 0.0022173 k( 125) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0022173 k( 126) = ( 0.2175926 0.3768814 -0.0000000), wk = 0.0022173 k( 127) = ( 0.2129630 0.3688627 -0.0000000), wk = 0.0022173 k( 128) = ( 0.2083333 0.3608439 -0.0000000), wk = 0.0022173 k( 129) = ( 0.2037037 0.3528252 -0.0000000), wk = 0.0022173 k( 130) = ( 0.1990741 0.3448064 -0.0000000), wk = 0.0022173 k( 131) = ( 0.1944444 0.3367876 -0.0000000), wk = 0.0022173 k( 132) = ( 0.1898148 0.3287689 -0.0000000), wk = 0.0022173 k( 133) = ( 0.1851852 0.3207502 -0.0000000), wk = 0.0022173 k( 134) = ( 0.1805556 0.3127314 -0.0000000), wk = 0.0022173 k( 135) = ( 0.1759259 0.3047126 -0.0000000), wk = 0.0022173 k( 136) = ( 0.1712963 0.2966939 -0.0000000), wk = 0.0022173 k( 137) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0022173 k( 138) = ( 0.1620370 0.2806564 -0.0000000), wk = 0.0022173 k( 139) = ( 0.1574074 0.2726376 -0.0000000), wk = 0.0022173 k( 140) = ( 0.1527778 0.2646189 -0.0000000), wk = 0.0022173 k( 141) = ( 0.1481482 0.2566001 -0.0000000), wk = 0.0022173 k( 142) = ( 0.1435185 0.2485814 -0.0000000), wk = 0.0022173 k( 143) = ( 0.1388889 0.2405626 -0.0000000), wk = 0.0022173 k( 144) = ( 0.1342593 0.2325439 -0.0000000), wk = 0.0022173 k( 145) = ( 0.1296296 0.2245251 -0.0000000), wk = 0.0022173 k( 146) = ( 0.1250000 0.2165064 -0.0000000), wk = 0.0022173 k( 147) = ( 0.1203704 0.2084876 -0.0000000), wk = 0.0022173 k( 148) = ( 0.1157407 0.2004688 -0.0000000), wk = 0.0022173 k( 149) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0022173 k( 150) = ( 0.1064815 0.1844313 -0.0000000), wk = 0.0022173 k( 151) = ( 0.1018518 0.1764126 -0.0000000), wk = 0.0022173 k( 152) = ( 0.0972222 0.1683938 -0.0000000), wk = 0.0022173 k( 153) = ( 0.0925926 0.1603751 -0.0000000), wk = 0.0022173 k( 154) = ( 0.0879630 0.1523563 -0.0000000), wk = 0.0022173 k( 155) = ( 0.0833333 0.1443376 -0.0000000), wk = 0.0022173 k( 156) = ( 0.0787037 0.1363188 -0.0000000), wk = 0.0022173 k( 157) = ( 0.0740741 0.1283001 -0.0000000), wk = 0.0022173 k( 158) = ( 0.0694444 0.1202813 -0.0000000), wk = 0.0022173 k( 159) = ( 0.0648148 0.1122625 -0.0000000), wk = 0.0022173 k( 160) = ( 0.0601852 0.1042438 -0.0000000), wk = 0.0022173 k( 161) = ( 0.0555556 0.0962251 -0.0000000), wk = 0.0022173 k( 162) = ( 0.0509259 0.0882063 -0.0000000), wk = 0.0022173 k( 163) = ( 0.0462963 0.0801875 -0.0000000), wk = 0.0022173 k( 164) = ( 0.0416667 0.0721688 -0.0000000), wk = 0.0022173 k( 165) = ( 0.0370370 0.0641500 -0.0000000), wk = 0.0022173 k( 166) = ( 0.0324074 0.0561313 -0.0000000), wk = 0.0022173 k( 167) = ( 0.0277778 0.0481125 -0.0000000), wk = 0.0022173 k( 168) = ( 0.0231481 0.0400938 -0.0000000), wk = 0.0022173 k( 169) = ( 0.0185185 0.0320750 -0.0000000), wk = 0.0022173 k( 170) = ( 0.0138889 0.0240563 -0.0000000), wk = 0.0022173 k( 171) = ( 0.0092593 0.0160375 -0.0000000), wk = 0.0022173 k( 172) = ( 0.0046296 0.0080188 -0.0000000), wk = 0.0022173 k( 173) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022173 k( 174) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022173 k( 175) = ( 0.0000000 0.0000000 0.0090776), wk = 0.0022173 k( 176) = ( 0.0000000 0.0000000 0.0181552), wk = 0.0022173 k( 177) = ( 0.0000000 0.0000000 0.0272328), wk = 0.0022173 k( 178) = ( 0.0000000 0.0000000 0.0363104), wk = 0.0022173 k( 179) = ( 0.0000000 0.0000000 0.0453880), wk = 0.0022173 k( 180) = ( 0.0000000 0.0000000 0.0544655), wk = 0.0022173 k( 181) = ( 0.0000000 0.0000000 0.0635431), wk = 0.0022173 k( 182) = ( 0.0000000 0.0000000 0.0726207), wk = 0.0022173 k( 183) = ( 0.0000000 0.0000000 0.0816983), wk = 0.0022173 k( 184) = ( 0.0000000 0.0000000 0.0907759), wk = 0.0022173 k( 185) = ( 0.0000000 0.0000000 0.0998535), wk = 0.0022173 k( 186) = ( 0.0000000 0.0000000 0.1089311), wk = 0.0022173 k( 187) = ( 0.0000000 0.0000000 0.1180087), wk = 0.0022173 k( 188) = ( 0.0000000 0.0000000 0.1270863), wk = 0.0022173 k( 189) = ( 0.0000000 0.0000000 0.1361639), wk = 0.0022173 k( 190) = ( 0.0000000 0.0000000 0.1452415), wk = 0.0022173 k( 191) = ( 0.0000000 0.0000000 0.1543190), wk = 0.0022173 k( 192) = ( 0.0000000 0.0000000 0.1633966), wk = 0.0022173 k( 193) = ( 0.0000000 0.0000000 0.1724742), wk = 0.0022173 k( 194) = ( 0.0000000 0.0000000 0.1815518), wk = 0.0022173 k( 195) = ( 0.0000000 0.0000000 0.1906294), wk = 0.0022173 k( 196) = ( 0.0000000 0.0000000 0.1997070), wk = 0.0022173 k( 197) = ( 0.0000000 0.0000000 0.2087846), wk = 0.0022173 k( 198) = ( 0.0000000 0.0000000 0.2178622), wk = 0.0022173 k( 199) = ( 0.0000000 0.0000000 0.2269398), wk = 0.0022173 k( 200) = ( 0.0000000 0.0000000 0.2360174), wk = 0.0022173 k( 201) = ( 0.0000000 0.0000000 0.2450949), wk = 0.0022173 k( 202) = ( 0.0000000 0.0000000 0.2541725), wk = 0.0022173 k( 203) = ( 0.0000000 0.0000000 0.2632501), wk = 0.0022173 k( 204) = ( 0.0000000 0.0000000 0.2723277), wk = 0.0022173 k( 205) = ( 0.0000000 0.0000000 0.2814053), wk = 0.0022173 k( 206) = ( 0.0000000 0.0000000 0.2904829), wk = 0.0022173 k( 207) = ( 0.0000000 0.0000000 0.2995605), wk = 0.0022173 k( 208) = ( 0.0000000 0.0000000 0.3086381), wk = 0.0022173 k( 209) = ( 0.0000000 0.0000000 0.3086381), wk = 0.0022173 k( 210) = ( 0.0080645 0.0046561 0.3086381), wk = 0.0022173 k( 211) = ( 0.0161290 0.0093121 0.3086381), wk = 0.0022173 k( 212) = ( 0.0241936 0.0139682 0.3086381), wk = 0.0022173 k( 213) = ( 0.0322581 0.0186242 0.3086381), wk = 0.0022173 k( 214) = ( 0.0403226 0.0232803 0.3086381), wk = 0.0022173 k( 215) = ( 0.0483871 0.0279363 0.3086381), wk = 0.0022173 k( 216) = ( 0.0564516 0.0325924 0.3086381), wk = 0.0022173 k( 217) = ( 0.0645161 0.0372484 0.3086381), wk = 0.0022173 k( 218) = ( 0.0725806 0.0419045 0.3086381), wk = 0.0022173 k( 219) = ( 0.0806452 0.0465605 0.3086381), wk = 0.0022173 k( 220) = ( 0.0887097 0.0512166 0.3086381), wk = 0.0022173 k( 221) = ( 0.0967742 0.0558726 0.3086381), wk = 0.0022173 k( 222) = ( 0.1048387 0.0605287 0.3086381), wk = 0.0022173 k( 223) = ( 0.1129032 0.0651847 0.3086381), wk = 0.0022173 k( 224) = ( 0.1209677 0.0698408 0.3086381), wk = 0.0022173 k( 225) = ( 0.1290323 0.0744968 0.3086381), wk = 0.0022173 k( 226) = ( 0.1370968 0.0791529 0.3086381), wk = 0.0022173 k( 227) = ( 0.1451613 0.0838089 0.3086381), wk = 0.0022173 k( 228) = ( 0.1532258 0.0884650 0.3086381), wk = 0.0022173 k( 229) = ( 0.1612903 0.0931210 0.3086381), wk = 0.0022173 k( 230) = ( 0.1693548 0.0977771 0.3086381), wk = 0.0022173 k( 231) = ( 0.1774194 0.1024331 0.3086381), wk = 0.0022173 k( 232) = ( 0.1854839 0.1070892 0.3086381), wk = 0.0022173 k( 233) = ( 0.1935484 0.1117452 0.3086381), wk = 0.0022173 k( 234) = ( 0.2016129 0.1164013 0.3086381), wk = 0.0022173 k( 235) = ( 0.2096774 0.1210573 0.3086381), wk = 0.0022173 k( 236) = ( 0.2177419 0.1257134 0.3086381), wk = 0.0022173 k( 237) = ( 0.2258064 0.1303694 0.3086381), wk = 0.0022173 k( 238) = ( 0.2338710 0.1350255 0.3086381), wk = 0.0022173 k( 239) = ( 0.2419355 0.1396815 0.3086381), wk = 0.0022173 k( 240) = ( 0.2500000 0.1443376 0.3086381), wk = 0.0022173 k( 241) = ( 0.2580645 0.1489936 0.3086381), wk = 0.0022173 k( 242) = ( 0.2661290 0.1536497 0.3086381), wk = 0.0022173 k( 243) = ( 0.2741936 0.1583057 0.3086381), wk = 0.0022173 k( 244) = ( 0.2822581 0.1629618 0.3086381), wk = 0.0022173 k( 245) = ( 0.2903226 0.1676178 0.3086381), wk = 0.0022173 k( 246) = ( 0.2983871 0.1722739 0.3086381), wk = 0.0022173 k( 247) = ( 0.3064516 0.1769299 0.3086381), wk = 0.0022173 k( 248) = ( 0.3145161 0.1815860 0.3086381), wk = 0.0022173 k( 249) = ( 0.3225807 0.1862420 0.3086381), wk = 0.0022173 k( 250) = ( 0.3306452 0.1908981 0.3086381), wk = 0.0022173 k( 251) = ( 0.3387097 0.1955541 0.3086381), wk = 0.0022173 k( 252) = ( 0.3467742 0.2002102 0.3086381), wk = 0.0022173 k( 253) = ( 0.3548387 0.2048662 0.3086381), wk = 0.0022173 k( 254) = ( 0.3629032 0.2095223 0.3086381), wk = 0.0022173 k( 255) = ( 0.3709677 0.2141783 0.3086381), wk = 0.0022173 k( 256) = ( 0.3790323 0.2188344 0.3086381), wk = 0.0022173 k( 257) = ( 0.3870968 0.2234904 0.3086381), wk = 0.0022173 k( 258) = ( 0.3951613 0.2281465 0.3086381), wk = 0.0022173 k( 259) = ( 0.4032258 0.2328025 0.3086381), wk = 0.0022173 k( 260) = ( 0.4112903 0.2374586 0.3086381), wk = 0.0022173 k( 261) = ( 0.4193548 0.2421146 0.3086381), wk = 0.0022173 k( 262) = ( 0.4274193 0.2467707 0.3086381), wk = 0.0022173 k( 263) = ( 0.4354839 0.2514267 0.3086381), wk = 0.0022173 k( 264) = ( 0.4435484 0.2560828 0.3086381), wk = 0.0022173 k( 265) = ( 0.4516129 0.2607388 0.3086381), wk = 0.0022173 k( 266) = ( 0.4596774 0.2653949 0.3086381), wk = 0.0022173 k( 267) = ( 0.4677419 0.2700509 0.3086381), wk = 0.0022173 k( 268) = ( 0.4758064 0.2747070 0.3086381), wk = 0.0022173 k( 269) = ( 0.4838710 0.2793630 0.3086381), wk = 0.0022173 k( 270) = ( 0.4919355 0.2840191 0.3086381), wk = 0.0022173 k( 271) = ( 0.5000000 0.2886751 0.3086381), wk = 0.0022173 k( 272) = ( 0.5000000 0.2886751 0.3086381), wk = 0.0022173 k( 273) = ( 0.4953704 0.2966939 0.3086381), wk = 0.0022173 k( 274) = ( 0.4907407 0.3047126 0.3086381), wk = 0.0022173 k( 275) = ( 0.4861111 0.3127314 0.3086381), wk = 0.0022173 k( 276) = ( 0.4814815 0.3207502 0.3086381), wk = 0.0022173 k( 277) = ( 0.4768519 0.3287689 0.3086381), wk = 0.0022173 k( 278) = ( 0.4722222 0.3367877 0.3086381), wk = 0.0022173 k( 279) = ( 0.4675926 0.3448064 0.3086381), wk = 0.0022173 k( 280) = ( 0.4629630 0.3528252 0.3086381), wk = 0.0022173 k( 281) = ( 0.4583333 0.3608439 0.3086381), wk = 0.0022173 k( 282) = ( 0.4537037 0.3688627 0.3086381), wk = 0.0022173 k( 283) = ( 0.4490741 0.3768814 0.3086381), wk = 0.0022173 k( 284) = ( 0.4444444 0.3849002 0.3086381), wk = 0.0022173 k( 285) = ( 0.4398148 0.3929189 0.3086381), wk = 0.0022173 k( 286) = ( 0.4351852 0.4009377 0.3086381), wk = 0.0022173 k( 287) = ( 0.4305556 0.4089564 0.3086381), wk = 0.0022173 k( 288) = ( 0.4259259 0.4169752 0.3086381), wk = 0.0022173 k( 289) = ( 0.4212963 0.4249940 0.3086381), wk = 0.0022173 k( 290) = ( 0.4166667 0.4330127 0.3086381), wk = 0.0022173 k( 291) = ( 0.4120370 0.4410315 0.3086381), wk = 0.0022173 k( 292) = ( 0.4074074 0.4490502 0.3086381), wk = 0.0022173 k( 293) = ( 0.4027778 0.4570690 0.3086381), wk = 0.0022173 k( 294) = ( 0.3981481 0.4650877 0.3086381), wk = 0.0022173 k( 295) = ( 0.3935185 0.4731065 0.3086381), wk = 0.0022173 k( 296) = ( 0.3888889 0.4811252 0.3086381), wk = 0.0022173 k( 297) = ( 0.3842593 0.4891440 0.3086381), wk = 0.0022173 k( 298) = ( 0.3796296 0.4971627 0.3086381), wk = 0.0022173 k( 299) = ( 0.3750000 0.5051815 0.3086381), wk = 0.0022173 k( 300) = ( 0.3703704 0.5132002 0.3086381), wk = 0.0022173 k( 301) = ( 0.3657407 0.5212190 0.3086381), wk = 0.0022173 k( 302) = ( 0.3611111 0.5292377 0.3086381), wk = 0.0022173 k( 303) = ( 0.3564815 0.5372565 0.3086381), wk = 0.0022173 k( 304) = ( 0.3518519 0.5452753 0.3086381), wk = 0.0022173 k( 305) = ( 0.3472222 0.5532940 0.3086381), wk = 0.0022173 k( 306) = ( 0.3425926 0.5613128 0.3086381), wk = 0.0022173 k( 307) = ( 0.3379630 0.5693315 0.3086381), wk = 0.0022173 k( 308) = ( 0.3333333 0.5773503 0.3086381), wk = 0.0022173 k( 309) = ( 0.3333333 0.5773503 0.3086381), wk = 0.0022173 k( 310) = ( 0.3287037 0.5693315 0.3086381), wk = 0.0022173 k( 311) = ( 0.3240741 0.5613128 0.3086381), wk = 0.0022173 k( 312) = ( 0.3194444 0.5532940 0.3086381), wk = 0.0022173 k( 313) = ( 0.3148148 0.5452752 0.3086381), wk = 0.0022173 k( 314) = ( 0.3101852 0.5372565 0.3086381), wk = 0.0022173 k( 315) = ( 0.3055556 0.5292378 0.3086381), wk = 0.0022173 k( 316) = ( 0.3009259 0.5212190 0.3086381), wk = 0.0022173 k( 317) = ( 0.2962963 0.5132002 0.3086381), wk = 0.0022173 k( 318) = ( 0.2916667 0.5051815 0.3086381), wk = 0.0022173 k( 319) = ( 0.2870370 0.4971627 0.3086381), wk = 0.0022173 k( 320) = ( 0.2824074 0.4891440 0.3086381), wk = 0.0022173 k( 321) = ( 0.2777778 0.4811252 0.3086381), wk = 0.0022173 k( 322) = ( 0.2731481 0.4731065 0.3086381), wk = 0.0022173 k( 323) = ( 0.2685185 0.4650877 0.3086381), wk = 0.0022173 k( 324) = ( 0.2638889 0.4570690 0.3086381), wk = 0.0022173 k( 325) = ( 0.2592593 0.4490502 0.3086381), wk = 0.0022173 k( 326) = ( 0.2546296 0.4410315 0.3086381), wk = 0.0022173 k( 327) = ( 0.2500000 0.4330127 0.3086381), wk = 0.0022173 k( 328) = ( 0.2453704 0.4249939 0.3086381), wk = 0.0022173 k( 329) = ( 0.2407407 0.4169752 0.3086381), wk = 0.0022173 k( 330) = ( 0.2361111 0.4089564 0.3086381), wk = 0.0022173 k( 331) = ( 0.2314815 0.4009377 0.3086381), wk = 0.0022173 k( 332) = ( 0.2268518 0.3929189 0.3086381), wk = 0.0022173 k( 333) = ( 0.2222222 0.3849002 0.3086381), wk = 0.0022173 k( 334) = ( 0.2175926 0.3768814 0.3086381), wk = 0.0022173 k( 335) = ( 0.2129630 0.3688627 0.3086381), wk = 0.0022173 k( 336) = ( 0.2083333 0.3608439 0.3086381), wk = 0.0022173 k( 337) = ( 0.2037037 0.3528252 0.3086381), wk = 0.0022173 k( 338) = ( 0.1990741 0.3448064 0.3086381), wk = 0.0022173 k( 339) = ( 0.1944444 0.3367876 0.3086381), wk = 0.0022173 k( 340) = ( 0.1898148 0.3287689 0.3086381), wk = 0.0022173 k( 341) = ( 0.1851852 0.3207502 0.3086381), wk = 0.0022173 k( 342) = ( 0.1805556 0.3127314 0.3086381), wk = 0.0022173 k( 343) = ( 0.1759259 0.3047126 0.3086381), wk = 0.0022173 k( 344) = ( 0.1712963 0.2966939 0.3086381), wk = 0.0022173 k( 345) = ( 0.1666667 0.2886751 0.3086381), wk = 0.0022173 k( 346) = ( 0.1620370 0.2806564 0.3086381), wk = 0.0022173 k( 347) = ( 0.1574074 0.2726376 0.3086381), wk = 0.0022173 k( 348) = ( 0.1527778 0.2646189 0.3086381), wk = 0.0022173 k( 349) = ( 0.1481482 0.2566001 0.3086381), wk = 0.0022173 k( 350) = ( 0.1435185 0.2485814 0.3086381), wk = 0.0022173 k( 351) = ( 0.1388889 0.2405626 0.3086381), wk = 0.0022173 k( 352) = ( 0.1342593 0.2325439 0.3086381), wk = 0.0022173 k( 353) = ( 0.1296296 0.2245251 0.3086381), wk = 0.0022173 k( 354) = ( 0.1250000 0.2165064 0.3086381), wk = 0.0022173 k( 355) = ( 0.1203704 0.2084876 0.3086381), wk = 0.0022173 k( 356) = ( 0.1157407 0.2004688 0.3086381), wk = 0.0022173 k( 357) = ( 0.1111111 0.1924501 0.3086381), wk = 0.0022173 k( 358) = ( 0.1064815 0.1844313 0.3086381), wk = 0.0022173 k( 359) = ( 0.1018518 0.1764126 0.3086381), wk = 0.0022173 k( 360) = ( 0.0972222 0.1683938 0.3086381), wk = 0.0022173 k( 361) = ( 0.0925926 0.1603751 0.3086381), wk = 0.0022173 k( 362) = ( 0.0879630 0.1523563 0.3086381), wk = 0.0022173 k( 363) = ( 0.0833333 0.1443376 0.3086381), wk = 0.0022173 k( 364) = ( 0.0787037 0.1363188 0.3086381), wk = 0.0022173 k( 365) = ( 0.0740741 0.1283001 0.3086381), wk = 0.0022173 k( 366) = ( 0.0694444 0.1202813 0.3086381), wk = 0.0022173 k( 367) = ( 0.0648148 0.1122625 0.3086381), wk = 0.0022173 k( 368) = ( 0.0601852 0.1042438 0.3086381), wk = 0.0022173 k( 369) = ( 0.0555556 0.0962251 0.3086381), wk = 0.0022173 k( 370) = ( 0.0509259 0.0882063 0.3086381), wk = 0.0022173 k( 371) = ( 0.0462963 0.0801875 0.3086381), wk = 0.0022173 k( 372) = ( 0.0416667 0.0721688 0.3086381), wk = 0.0022173 k( 373) = ( 0.0370370 0.0641500 0.3086381), wk = 0.0022173 k( 374) = ( 0.0324074 0.0561313 0.3086381), wk = 0.0022173 k( 375) = ( 0.0277778 0.0481125 0.3086381), wk = 0.0022173 k( 376) = ( 0.0231481 0.0400938 0.3086381), wk = 0.0022173 k( 377) = ( 0.0185185 0.0320750 0.3086381), wk = 0.0022173 k( 378) = ( 0.0138889 0.0240563 0.3086381), wk = 0.0022173 k( 379) = ( 0.0092593 0.0160375 0.3086381), wk = 0.0022173 k( 380) = ( 0.0046296 0.0080188 0.3086381), wk = 0.0022173 k( 381) = ( 0.0000000 0.0000000 0.3086381), wk = 0.0022173 k( 382) = ( 0.5000000 0.2886751 0.3086381), wk = 0.0022173 k( 383) = ( 0.5000000 0.2886751 0.2995605), wk = 0.0022173 k( 384) = ( 0.5000000 0.2886751 0.2904829), wk = 0.0022173 k( 385) = ( 0.5000000 0.2886751 0.2814053), wk = 0.0022173 k( 386) = ( 0.5000000 0.2886751 0.2723277), wk = 0.0022173 k( 387) = ( 0.5000000 0.2886751 0.2632501), wk = 0.0022173 k( 388) = ( 0.5000000 0.2886751 0.2541725), wk = 0.0022173 k( 389) = ( 0.5000000 0.2886751 0.2450949), wk = 0.0022173 k( 390) = ( 0.5000000 0.2886751 0.2360174), wk = 0.0022173 k( 391) = ( 0.5000000 0.2886751 0.2269398), wk = 0.0022173 k( 392) = ( 0.5000000 0.2886751 0.2178622), wk = 0.0022173 k( 393) = ( 0.5000000 0.2886751 0.2087846), wk = 0.0022173 k( 394) = ( 0.5000000 0.2886751 0.1997070), wk = 0.0022173 k( 395) = ( 0.5000000 0.2886751 0.1906294), wk = 0.0022173 k( 396) = ( 0.5000000 0.2886751 0.1815518), wk = 0.0022173 k( 397) = ( 0.5000000 0.2886751 0.1724742), wk = 0.0022173 k( 398) = ( 0.5000000 0.2886751 0.1633966), wk = 0.0022173 k( 399) = ( 0.5000000 0.2886751 0.1543190), wk = 0.0022173 k( 400) = ( 0.5000000 0.2886751 0.1452415), wk = 0.0022173 k( 401) = ( 0.5000000 0.2886751 0.1361639), wk = 0.0022173 k( 402) = ( 0.5000000 0.2886751 0.1270863), wk = 0.0022173 k( 403) = ( 0.5000000 0.2886751 0.1180087), wk = 0.0022173 k( 404) = ( 0.5000000 0.2886751 0.1089311), wk = 0.0022173 k( 405) = ( 0.5000000 0.2886751 0.0998535), wk = 0.0022173 k( 406) = ( 0.5000000 0.2886751 0.0907759), wk = 0.0022173 k( 407) = ( 0.5000000 0.2886751 0.0816983), wk = 0.0022173 k( 408) = ( 0.5000000 0.2886751 0.0726207), wk = 0.0022173 k( 409) = ( 0.5000000 0.2886751 0.0635431), wk = 0.0022173 k( 410) = ( 0.5000000 0.2886751 0.0544655), wk = 0.0022173 k( 411) = ( 0.5000000 0.2886751 0.0453880), wk = 0.0022173 k( 412) = ( 0.5000000 0.2886751 0.0363104), wk = 0.0022173 k( 413) = ( 0.5000000 0.2886751 0.0272328), wk = 0.0022173 k( 414) = ( 0.5000000 0.2886751 0.0181552), wk = 0.0022173 k( 415) = ( 0.5000000 0.2886751 0.0090776), wk = 0.0022173 k( 416) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0022173 k( 417) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0022173 k( 418) = ( 0.3333333 0.5773503 0.0090776), wk = 0.0022173 k( 419) = ( 0.3333333 0.5773503 0.0181552), wk = 0.0022173 k( 420) = ( 0.3333333 0.5773503 0.0272328), wk = 0.0022173 k( 421) = ( 0.3333333 0.5773503 0.0363104), wk = 0.0022173 k( 422) = ( 0.3333333 0.5773503 0.0453880), wk = 0.0022173 k( 423) = ( 0.3333333 0.5773503 0.0544655), wk = 0.0022173 k( 424) = ( 0.3333333 0.5773503 0.0635431), wk = 0.0022173 k( 425) = ( 0.3333333 0.5773503 0.0726207), wk = 0.0022173 k( 426) = ( 0.3333333 0.5773503 0.0816983), wk = 0.0022173 k( 427) = ( 0.3333333 0.5773503 0.0907759), wk = 0.0022173 k( 428) = ( 0.3333333 0.5773503 0.0998535), wk = 0.0022173 k( 429) = ( 0.3333333 0.5773503 0.1089311), wk = 0.0022173 k( 430) = ( 0.3333333 0.5773503 0.1180087), wk = 0.0022173 k( 431) = ( 0.3333333 0.5773503 0.1270863), wk = 0.0022173 k( 432) = ( 0.3333333 0.5773503 0.1361639), wk = 0.0022173 k( 433) = ( 0.3333333 0.5773503 0.1452415), wk = 0.0022173 k( 434) = ( 0.3333333 0.5773503 0.1543190), wk = 0.0022173 k( 435) = ( 0.3333333 0.5773503 0.1633966), wk = 0.0022173 k( 436) = ( 0.3333333 0.5773503 0.1724742), wk = 0.0022173 k( 437) = ( 0.3333333 0.5773503 0.1815518), wk = 0.0022173 k( 438) = ( 0.3333333 0.5773503 0.1906294), wk = 0.0022173 k( 439) = ( 0.3333333 0.5773503 0.1997070), wk = 0.0022173 k( 440) = ( 0.3333333 0.5773503 0.2087846), wk = 0.0022173 k( 441) = ( 0.3333333 0.5773503 0.2178622), wk = 0.0022173 k( 442) = ( 0.3333333 0.5773503 0.2269398), wk = 0.0022173 k( 443) = ( 0.3333333 0.5773503 0.2360174), wk = 0.0022173 k( 444) = ( 0.3333333 0.5773503 0.2450949), wk = 0.0022173 k( 445) = ( 0.3333333 0.5773503 0.2541725), wk = 0.0022173 k( 446) = ( 0.3333333 0.5773503 0.2632501), wk = 0.0022173 k( 447) = ( 0.3333333 0.5773503 0.2723277), wk = 0.0022173 k( 448) = ( 0.3333333 0.5773503 0.2814053), wk = 0.0022173 k( 449) = ( 0.3333333 0.5773503 0.2904829), wk = 0.0022173 k( 450) = ( 0.3333333 0.5773503 0.2995605), wk = 0.0022173 k( 451) = ( 0.3333333 0.5773503 0.3086381), wk = 0.0022173 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022173 k( 2) = ( 0.0080645 -0.0000000 -0.0000000), wk = 0.0022173 k( 3) = ( 0.0161290 0.0000000 0.0000000), wk = 0.0022173 k( 4) = ( 0.0241936 -0.0000000 -0.0000000), wk = 0.0022173 k( 5) = ( 0.0322581 0.0000000 0.0000000), wk = 0.0022173 k( 6) = ( 0.0403226 -0.0000000 -0.0000000), wk = 0.0022173 k( 7) = ( 0.0483871 -0.0000000 -0.0000000), wk = 0.0022173 k( 8) = ( 0.0564516 -0.0000000 -0.0000000), wk = 0.0022173 k( 9) = ( 0.0645161 0.0000000 -0.0000000), wk = 0.0022173 k( 10) = ( 0.0725806 0.0000000 -0.0000000), wk = 0.0022173 k( 11) = ( 0.0806452 -0.0000000 -0.0000000), wk = 0.0022173 k( 12) = ( 0.0887097 -0.0000000 -0.0000000), wk = 0.0022173 k( 13) = ( 0.0967742 -0.0000000 -0.0000000), wk = 0.0022173 k( 14) = ( 0.1048387 0.0000000 -0.0000000), wk = 0.0022173 k( 15) = ( 0.1129032 -0.0000000 -0.0000000), wk = 0.0022173 k( 16) = ( 0.1209677 -0.0000000 -0.0000000), wk = 0.0022173 k( 17) = ( 0.1290323 0.0000000 -0.0000000), wk = 0.0022173 k( 18) = ( 0.1370968 0.0000000 -0.0000000), wk = 0.0022173 k( 19) = ( 0.1451613 0.0000000 0.0000000), wk = 0.0022173 k( 20) = ( 0.1532258 -0.0000000 -0.0000000), wk = 0.0022173 k( 21) = ( 0.1612903 -0.0000000 -0.0000000), wk = 0.0022173 k( 22) = ( 0.1693548 0.0000000 -0.0000000), wk = 0.0022173 k( 23) = ( 0.1774194 -0.0000000 -0.0000000), wk = 0.0022173 k( 24) = ( 0.1854839 -0.0000000 -0.0000000), wk = 0.0022173 k( 25) = ( 0.1935484 -0.0000000 -0.0000000), wk = 0.0022173 k( 26) = ( 0.2016129 -0.0000000 -0.0000000), wk = 0.0022173 k( 27) = ( 0.2096774 0.0000000 -0.0000000), wk = 0.0022173 k( 28) = ( 0.2177419 -0.0000000 -0.0000000), wk = 0.0022173 k( 29) = ( 0.2258064 0.0000000 -0.0000000), wk = 0.0022173 k( 30) = ( 0.2338710 -0.0000000 -0.0000000), wk = 0.0022173 k( 31) = ( 0.2419355 -0.0000000 -0.0000000), wk = 0.0022173 k( 32) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0022173 k( 33) = ( 0.2580645 0.0000000 -0.0000000), wk = 0.0022173 k( 34) = ( 0.2661290 0.0000000 -0.0000000), wk = 0.0022173 k( 35) = ( 0.2741936 -0.0000000 -0.0000000), wk = 0.0022173 k( 36) = ( 0.2822581 -0.0000000 -0.0000000), wk = 0.0022173 k( 37) = ( 0.2903226 0.0000000 0.0000000), wk = 0.0022173 k( 38) = ( 0.2983871 -0.0000000 -0.0000000), wk = 0.0022173 k( 39) = ( 0.3064516 -0.0000000 -0.0000000), wk = 0.0022173 k( 40) = ( 0.3145161 -0.0000000 -0.0000000), wk = 0.0022173 k( 41) = ( 0.3225807 -0.0000000 -0.0000000), wk = 0.0022173 k( 42) = ( 0.3306452 -0.0000000 -0.0000000), wk = 0.0022173 k( 43) = ( 0.3387097 0.0000000 -0.0000000), wk = 0.0022173 k( 44) = ( 0.3467742 0.0000000 -0.0000000), wk = 0.0022173 k( 45) = ( 0.3548387 0.0000000 -0.0000000), wk = 0.0022173 k( 46) = ( 0.3629032 -0.0000000 -0.0000000), wk = 0.0022173 k( 47) = ( 0.3709677 -0.0000000 -0.0000000), wk = 0.0022173 k( 48) = ( 0.3790323 -0.0000000 0.0000000), wk = 0.0022173 k( 49) = ( 0.3870968 -0.0000000 -0.0000000), wk = 0.0022173 k( 50) = ( 0.3951613 -0.0000000 -0.0000000), wk = 0.0022173 k( 51) = ( 0.4032258 -0.0000000 -0.0000000), wk = 0.0022173 k( 52) = ( 0.4112903 -0.0000000 -0.0000000), wk = 0.0022173 k( 53) = ( 0.4193548 0.0000000 -0.0000000), wk = 0.0022173 k( 54) = ( 0.4274193 0.0000000 -0.0000000), wk = 0.0022173 k( 55) = ( 0.4354839 -0.0000000 -0.0000000), wk = 0.0022173 k( 56) = ( 0.4435484 -0.0000000 -0.0000000), wk = 0.0022173 k( 57) = ( 0.4516129 0.0000000 -0.0000000), wk = 0.0022173 k( 58) = ( 0.4596774 -0.0000000 -0.0000000), wk = 0.0022173 k( 59) = ( 0.4677419 -0.0000000 -0.0000000), wk = 0.0022173 k( 60) = ( 0.4758064 -0.0000000 -0.0000000), wk = 0.0022173 k( 61) = ( 0.4838710 -0.0000000 -0.0000000), wk = 0.0022173 k( 62) = ( 0.4919355 -0.0000000 -0.0000000), wk = 0.0022173 k( 63) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0022173 k( 64) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0022173 k( 65) = ( 0.4953704 0.0092593 -0.0000000), wk = 0.0022173 k( 66) = ( 0.4907407 0.0185185 -0.0000000), wk = 0.0022173 k( 67) = ( 0.4861111 0.0277778 -0.0000000), wk = 0.0022173 k( 68) = ( 0.4814815 0.0370370 -0.0000000), wk = 0.0022173 k( 69) = ( 0.4768519 0.0462963 -0.0000000), wk = 0.0022173 k( 70) = ( 0.4722222 0.0555556 -0.0000000), wk = 0.0022173 k( 71) = ( 0.4675926 0.0648148 -0.0000000), wk = 0.0022173 k( 72) = ( 0.4629630 0.0740741 -0.0000000), wk = 0.0022173 k( 73) = ( 0.4583333 0.0833333 -0.0000000), wk = 0.0022173 k( 74) = ( 0.4537037 0.0925926 -0.0000000), wk = 0.0022173 k( 75) = ( 0.4490741 0.1018519 -0.0000000), wk = 0.0022173 k( 76) = ( 0.4444444 0.1111111 -0.0000000), wk = 0.0022173 k( 77) = ( 0.4398148 0.1203704 -0.0000000), wk = 0.0022173 k( 78) = ( 0.4351852 0.1296296 -0.0000000), wk = 0.0022173 k( 79) = ( 0.4305556 0.1388889 -0.0000000), wk = 0.0022173 k( 80) = ( 0.4259259 0.1481482 -0.0000000), wk = 0.0022173 k( 81) = ( 0.4212963 0.1574074 -0.0000000), wk = 0.0022173 k( 82) = ( 0.4166667 0.1666667 0.0000000), wk = 0.0022173 k( 83) = ( 0.4120370 0.1759259 -0.0000000), wk = 0.0022173 k( 84) = ( 0.4074074 0.1851852 0.0000000), wk = 0.0022173 k( 85) = ( 0.4027778 0.1944444 -0.0000000), wk = 0.0022173 k( 86) = ( 0.3981481 0.2037037 -0.0000000), wk = 0.0022173 k( 87) = ( 0.3935185 0.2129630 0.0000000), wk = 0.0022173 k( 88) = ( 0.3888889 0.2222222 -0.0000000), wk = 0.0022173 k( 89) = ( 0.3842593 0.2314815 -0.0000000), wk = 0.0022173 k( 90) = ( 0.3796296 0.2407407 0.0000000), wk = 0.0022173 k( 91) = ( 0.3750000 0.2500000 -0.0000000), wk = 0.0022173 k( 92) = ( 0.3703704 0.2592593 -0.0000000), wk = 0.0022173 k( 93) = ( 0.3657407 0.2685185 -0.0000000), wk = 0.0022173 k( 94) = ( 0.3611111 0.2777778 -0.0000000), wk = 0.0022173 k( 95) = ( 0.3564815 0.2870370 -0.0000000), wk = 0.0022173 k( 96) = ( 0.3518519 0.2962963 0.0000000), wk = 0.0022173 k( 97) = ( 0.3472222 0.3055556 0.0000000), wk = 0.0022173 k( 98) = ( 0.3425926 0.3148148 -0.0000000), wk = 0.0022173 k( 99) = ( 0.3379630 0.3240741 0.0000000), wk = 0.0022173 k( 100) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0022173 k( 101) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0022173 k( 102) = ( 0.3287037 0.3287037 -0.0000000), wk = 0.0022173 k( 103) = ( 0.3240741 0.3240741 0.0000000), wk = 0.0022173 k( 104) = ( 0.3194444 0.3194444 -0.0000000), wk = 0.0022173 k( 105) = ( 0.3148148 0.3148148 -0.0000000), wk = 0.0022173 k( 106) = ( 0.3101852 0.3101852 0.0000000), wk = 0.0022173 k( 107) = ( 0.3055556 0.3055556 0.0000000), wk = 0.0022173 k( 108) = ( 0.3009259 0.3009259 0.0000000), wk = 0.0022173 k( 109) = ( 0.2962963 0.2962963 0.0000000), wk = 0.0022173 k( 110) = ( 0.2916667 0.2916667 -0.0000000), wk = 0.0022173 k( 111) = ( 0.2870370 0.2870370 -0.0000000), wk = 0.0022173 k( 112) = ( 0.2824074 0.2824074 0.0000000), wk = 0.0022173 k( 113) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0022173 k( 114) = ( 0.2731481 0.2731481 -0.0000000), wk = 0.0022173 k( 115) = ( 0.2685185 0.2685185 0.0000000), wk = 0.0022173 k( 116) = ( 0.2638889 0.2638889 -0.0000000), wk = 0.0022173 k( 117) = ( 0.2592593 0.2592593 -0.0000000), wk = 0.0022173 k( 118) = ( 0.2546296 0.2546296 -0.0000000), wk = 0.0022173 k( 119) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0022173 k( 120) = ( 0.2453704 0.2453704 -0.0000000), wk = 0.0022173 k( 121) = ( 0.2407407 0.2407407 0.0000000), wk = 0.0022173 k( 122) = ( 0.2361111 0.2361111 -0.0000000), wk = 0.0022173 k( 123) = ( 0.2314815 0.2314815 -0.0000000), wk = 0.0022173 k( 124) = ( 0.2268518 0.2268519 0.0000000), wk = 0.0022173 k( 125) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0022173 k( 126) = ( 0.2175926 0.2175926 0.0000000), wk = 0.0022173 k( 127) = ( 0.2129630 0.2129630 -0.0000000), wk = 0.0022173 k( 128) = ( 0.2083333 0.2083333 -0.0000000), wk = 0.0022173 k( 129) = ( 0.2037037 0.2037037 0.0000000), wk = 0.0022173 k( 130) = ( 0.1990741 0.1990741 -0.0000000), wk = 0.0022173 k( 131) = ( 0.1944444 0.1944444 0.0000000), wk = 0.0022173 k( 132) = ( 0.1898148 0.1898148 -0.0000000), wk = 0.0022173 k( 133) = ( 0.1851852 0.1851852 0.0000000), wk = 0.0022173 k( 134) = ( 0.1805556 0.1805556 -0.0000000), wk = 0.0022173 k( 135) = ( 0.1759259 0.1759259 0.0000000), wk = 0.0022173 k( 136) = ( 0.1712963 0.1712963 -0.0000000), wk = 0.0022173 k( 137) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0022173 k( 138) = ( 0.1620370 0.1620370 -0.0000000), wk = 0.0022173 k( 139) = ( 0.1574074 0.1574074 -0.0000000), wk = 0.0022173 k( 140) = ( 0.1527778 0.1527778 0.0000000), wk = 0.0022173 k( 141) = ( 0.1481482 0.1481482 0.0000000), wk = 0.0022173 k( 142) = ( 0.1435185 0.1435185 -0.0000000), wk = 0.0022173 k( 143) = ( 0.1388889 0.1388889 -0.0000000), wk = 0.0022173 k( 144) = ( 0.1342593 0.1342593 0.0000000), wk = 0.0022173 k( 145) = ( 0.1296296 0.1296296 -0.0000000), wk = 0.0022173 k( 146) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0022173 k( 147) = ( 0.1203704 0.1203704 0.0000000), wk = 0.0022173 k( 148) = ( 0.1157407 0.1157407 -0.0000000), wk = 0.0022173 k( 149) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0022173 k( 150) = ( 0.1064815 0.1064815 -0.0000000), wk = 0.0022173 k( 151) = ( 0.1018518 0.1018519 0.0000000), wk = 0.0022173 k( 152) = ( 0.0972222 0.0972222 0.0000000), wk = 0.0022173 k( 153) = ( 0.0925926 0.0925926 -0.0000000), wk = 0.0022173 k( 154) = ( 0.0879630 0.0879630 0.0000000), wk = 0.0022173 k( 155) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0022173 k( 156) = ( 0.0787037 0.0787037 -0.0000000), wk = 0.0022173 k( 157) = ( 0.0740741 0.0740741 0.0000000), wk = 0.0022173 k( 158) = ( 0.0694444 0.0694444 -0.0000000), wk = 0.0022173 k( 159) = ( 0.0648148 0.0648148 0.0000000), wk = 0.0022173 k( 160) = ( 0.0601852 0.0601852 -0.0000000), wk = 0.0022173 k( 161) = ( 0.0555556 0.0555556 -0.0000000), wk = 0.0022173 k( 162) = ( 0.0509259 0.0509259 0.0000000), wk = 0.0022173 k( 163) = ( 0.0462963 0.0462963 -0.0000000), wk = 0.0022173 k( 164) = ( 0.0416667 0.0416667 -0.0000000), wk = 0.0022173 k( 165) = ( 0.0370370 0.0370370 -0.0000000), wk = 0.0022173 k( 166) = ( 0.0324074 0.0324074 -0.0000000), wk = 0.0022173 k( 167) = ( 0.0277778 0.0277778 -0.0000000), wk = 0.0022173 k( 168) = ( 0.0231481 0.0231482 -0.0000000), wk = 0.0022173 k( 169) = ( 0.0185185 0.0185185 -0.0000000), wk = 0.0022173 k( 170) = ( 0.0138889 0.0138889 -0.0000000), wk = 0.0022173 k( 171) = ( 0.0092593 0.0092593 -0.0000000), wk = 0.0022173 k( 172) = ( 0.0046296 0.0046296 -0.0000000), wk = 0.0022173 k( 173) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022173 k( 174) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022173 k( 175) = ( 0.0000000 0.0000000 0.0147059), wk = 0.0022173 k( 176) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0022173 k( 177) = ( 0.0000000 0.0000000 0.0441177), wk = 0.0022173 k( 178) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0022173 k( 179) = ( 0.0000000 0.0000000 0.0735294), wk = 0.0022173 k( 180) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0022173 k( 181) = ( 0.0000000 0.0000000 0.1029412), wk = 0.0022173 k( 182) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0022173 k( 183) = ( 0.0000000 0.0000000 0.1323529), wk = 0.0022173 k( 184) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0022173 k( 185) = ( 0.0000000 0.0000000 0.1617647), wk = 0.0022173 k( 186) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0022173 k( 187) = ( 0.0000000 0.0000000 0.1911765), wk = 0.0022173 k( 188) = ( 0.0000000 0.0000000 0.2058823), wk = 0.0022173 k( 189) = ( 0.0000000 0.0000000 0.2205882), wk = 0.0022173 k( 190) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0022173 k( 191) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0022173 k( 192) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0022173 k( 193) = ( 0.0000000 0.0000000 0.2794118), wk = 0.0022173 k( 194) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0022173 k( 195) = ( 0.0000000 0.0000000 0.3088235), wk = 0.0022173 k( 196) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0022173 k( 197) = ( 0.0000000 0.0000000 0.3382353), wk = 0.0022173 k( 198) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0022173 k( 199) = ( 0.0000000 0.0000000 0.3676471), wk = 0.0022173 k( 200) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0022173 k( 201) = ( 0.0000000 0.0000000 0.3970588), wk = 0.0022173 k( 202) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0022173 k( 203) = ( 0.0000000 0.0000000 0.4264706), wk = 0.0022173 k( 204) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0022173 k( 205) = ( 0.0000000 0.0000000 0.4558823), wk = 0.0022173 k( 206) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0022173 k( 207) = ( 0.0000000 0.0000000 0.4852941), wk = 0.0022173 k( 208) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022173 k( 209) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022173 k( 210) = ( 0.0080645 -0.0000000 0.5000000), wk = 0.0022173 k( 211) = ( 0.0161290 0.0000000 0.5000000), wk = 0.0022173 k( 212) = ( 0.0241936 -0.0000000 0.5000000), wk = 0.0022173 k( 213) = ( 0.0322581 0.0000000 0.5000000), wk = 0.0022173 k( 214) = ( 0.0403226 -0.0000000 0.5000000), wk = 0.0022173 k( 215) = ( 0.0483871 -0.0000000 0.5000000), wk = 0.0022173 k( 216) = ( 0.0564516 -0.0000000 0.5000000), wk = 0.0022173 k( 217) = ( 0.0645161 0.0000000 0.5000000), wk = 0.0022173 k( 218) = ( 0.0725806 0.0000000 0.5000000), wk = 0.0022173 k( 219) = ( 0.0806452 -0.0000000 0.5000000), wk = 0.0022173 k( 220) = ( 0.0887097 -0.0000000 0.5000000), wk = 0.0022173 k( 221) = ( 0.0967742 -0.0000000 0.5000000), wk = 0.0022173 k( 222) = ( 0.1048387 0.0000000 0.5000000), wk = 0.0022173 k( 223) = ( 0.1129032 -0.0000000 0.5000000), wk = 0.0022173 k( 224) = ( 0.1209677 -0.0000000 0.5000000), wk = 0.0022173 k( 225) = ( 0.1290323 0.0000000 0.5000000), wk = 0.0022173 k( 226) = ( 0.1370968 0.0000000 0.5000000), wk = 0.0022173 k( 227) = ( 0.1451613 0.0000000 0.5000000), wk = 0.0022173 k( 228) = ( 0.1532258 -0.0000000 0.5000000), wk = 0.0022173 k( 229) = ( 0.1612903 -0.0000000 0.5000000), wk = 0.0022173 k( 230) = ( 0.1693548 0.0000000 0.5000000), wk = 0.0022173 k( 231) = ( 0.1774194 -0.0000000 0.5000000), wk = 0.0022173 k( 232) = ( 0.1854839 -0.0000000 0.5000000), wk = 0.0022173 k( 233) = ( 0.1935484 -0.0000000 0.5000000), wk = 0.0022173 k( 234) = ( 0.2016129 -0.0000000 0.5000000), wk = 0.0022173 k( 235) = ( 0.2096774 0.0000000 0.5000000), wk = 0.0022173 k( 236) = ( 0.2177419 -0.0000000 0.5000000), wk = 0.0022173 k( 237) = ( 0.2258064 0.0000000 0.5000000), wk = 0.0022173 k( 238) = ( 0.2338710 -0.0000000 0.5000000), wk = 0.0022173 k( 239) = ( 0.2419355 -0.0000000 0.5000000), wk = 0.0022173 k( 240) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0022173 k( 241) = ( 0.2580645 0.0000000 0.5000000), wk = 0.0022173 k( 242) = ( 0.2661290 0.0000000 0.5000000), wk = 0.0022173 k( 243) = ( 0.2741936 -0.0000000 0.5000000), wk = 0.0022173 k( 244) = ( 0.2822581 -0.0000000 0.5000000), wk = 0.0022173 k( 245) = ( 0.2903226 0.0000000 0.5000000), wk = 0.0022173 k( 246) = ( 0.2983871 -0.0000000 0.5000000), wk = 0.0022173 k( 247) = ( 0.3064516 -0.0000000 0.5000000), wk = 0.0022173 k( 248) = ( 0.3145161 -0.0000000 0.5000000), wk = 0.0022173 k( 249) = ( 0.3225807 -0.0000000 0.5000000), wk = 0.0022173 k( 250) = ( 0.3306452 -0.0000000 0.5000000), wk = 0.0022173 k( 251) = ( 0.3387097 0.0000000 0.5000000), wk = 0.0022173 k( 252) = ( 0.3467742 0.0000000 0.5000000), wk = 0.0022173 k( 253) = ( 0.3548387 0.0000000 0.5000000), wk = 0.0022173 k( 254) = ( 0.3629032 -0.0000000 0.5000000), wk = 0.0022173 k( 255) = ( 0.3709677 -0.0000000 0.5000000), wk = 0.0022173 k( 256) = ( 0.3790323 -0.0000000 0.5000000), wk = 0.0022173 k( 257) = ( 0.3870968 -0.0000000 0.5000000), wk = 0.0022173 k( 258) = ( 0.3951613 -0.0000000 0.5000000), wk = 0.0022173 k( 259) = ( 0.4032258 -0.0000000 0.5000000), wk = 0.0022173 k( 260) = ( 0.4112903 -0.0000000 0.5000000), wk = 0.0022173 k( 261) = ( 0.4193548 0.0000000 0.5000000), wk = 0.0022173 k( 262) = ( 0.4274193 0.0000000 0.5000000), wk = 0.0022173 k( 263) = ( 0.4354839 -0.0000000 0.5000000), wk = 0.0022173 k( 264) = ( 0.4435484 -0.0000000 0.5000000), wk = 0.0022173 k( 265) = ( 0.4516129 0.0000000 0.5000000), wk = 0.0022173 k( 266) = ( 0.4596774 -0.0000000 0.5000000), wk = 0.0022173 k( 267) = ( 0.4677419 -0.0000000 0.5000000), wk = 0.0022173 k( 268) = ( 0.4758064 -0.0000000 0.5000000), wk = 0.0022173 k( 269) = ( 0.4838710 -0.0000000 0.5000000), wk = 0.0022173 k( 270) = ( 0.4919355 -0.0000000 0.5000000), wk = 0.0022173 k( 271) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022173 k( 272) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022173 k( 273) = ( 0.4953704 0.0092593 0.5000000), wk = 0.0022173 k( 274) = ( 0.4907407 0.0185185 0.5000000), wk = 0.0022173 k( 275) = ( 0.4861111 0.0277778 0.5000000), wk = 0.0022173 k( 276) = ( 0.4814815 0.0370370 0.5000000), wk = 0.0022173 k( 277) = ( 0.4768519 0.0462963 0.5000000), wk = 0.0022173 k( 278) = ( 0.4722222 0.0555556 0.5000000), wk = 0.0022173 k( 279) = ( 0.4675926 0.0648148 0.5000000), wk = 0.0022173 k( 280) = ( 0.4629630 0.0740741 0.5000000), wk = 0.0022173 k( 281) = ( 0.4583333 0.0833333 0.5000000), wk = 0.0022173 k( 282) = ( 0.4537037 0.0925926 0.5000000), wk = 0.0022173 k( 283) = ( 0.4490741 0.1018519 0.5000000), wk = 0.0022173 k( 284) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0022173 k( 285) = ( 0.4398148 0.1203704 0.5000000), wk = 0.0022173 k( 286) = ( 0.4351852 0.1296296 0.5000000), wk = 0.0022173 k( 287) = ( 0.4305556 0.1388889 0.5000000), wk = 0.0022173 k( 288) = ( 0.4259259 0.1481482 0.5000000), wk = 0.0022173 k( 289) = ( 0.4212963 0.1574074 0.5000000), wk = 0.0022173 k( 290) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0022173 k( 291) = ( 0.4120370 0.1759259 0.5000000), wk = 0.0022173 k( 292) = ( 0.4074074 0.1851852 0.5000000), wk = 0.0022173 k( 293) = ( 0.4027778 0.1944444 0.5000000), wk = 0.0022173 k( 294) = ( 0.3981481 0.2037037 0.5000000), wk = 0.0022173 k( 295) = ( 0.3935185 0.2129630 0.5000000), wk = 0.0022173 k( 296) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0022173 k( 297) = ( 0.3842593 0.2314815 0.5000000), wk = 0.0022173 k( 298) = ( 0.3796296 0.2407407 0.5000000), wk = 0.0022173 k( 299) = ( 0.3750000 0.2500000 0.5000000), wk = 0.0022173 k( 300) = ( 0.3703704 0.2592593 0.5000000), wk = 0.0022173 k( 301) = ( 0.3657407 0.2685185 0.5000000), wk = 0.0022173 k( 302) = ( 0.3611111 0.2777778 0.5000000), wk = 0.0022173 k( 303) = ( 0.3564815 0.2870370 0.5000000), wk = 0.0022173 k( 304) = ( 0.3518519 0.2962963 0.5000000), wk = 0.0022173 k( 305) = ( 0.3472222 0.3055556 0.5000000), wk = 0.0022173 k( 306) = ( 0.3425926 0.3148148 0.5000000), wk = 0.0022173 k( 307) = ( 0.3379630 0.3240741 0.5000000), wk = 0.0022173 k( 308) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0022173 k( 309) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0022173 k( 310) = ( 0.3287037 0.3287037 0.5000000), wk = 0.0022173 k( 311) = ( 0.3240741 0.3240741 0.5000000), wk = 0.0022173 k( 312) = ( 0.3194444 0.3194444 0.5000000), wk = 0.0022173 k( 313) = ( 0.3148148 0.3148148 0.5000000), wk = 0.0022173 k( 314) = ( 0.3101852 0.3101852 0.5000000), wk = 0.0022173 k( 315) = ( 0.3055556 0.3055556 0.5000000), wk = 0.0022173 k( 316) = ( 0.3009259 0.3009259 0.5000000), wk = 0.0022173 k( 317) = ( 0.2962963 0.2962963 0.5000000), wk = 0.0022173 k( 318) = ( 0.2916667 0.2916667 0.5000000), wk = 0.0022173 k( 319) = ( 0.2870370 0.2870370 0.5000000), wk = 0.0022173 k( 320) = ( 0.2824074 0.2824074 0.5000000), wk = 0.0022173 k( 321) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0022173 k( 322) = ( 0.2731481 0.2731481 0.5000000), wk = 0.0022173 k( 323) = ( 0.2685185 0.2685185 0.5000000), wk = 0.0022173 k( 324) = ( 0.2638889 0.2638889 0.5000000), wk = 0.0022173 k( 325) = ( 0.2592593 0.2592593 0.5000000), wk = 0.0022173 k( 326) = ( 0.2546296 0.2546296 0.5000000), wk = 0.0022173 k( 327) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0022173 k( 328) = ( 0.2453704 0.2453704 0.5000000), wk = 0.0022173 k( 329) = ( 0.2407407 0.2407407 0.5000000), wk = 0.0022173 k( 330) = ( 0.2361111 0.2361111 0.5000000), wk = 0.0022173 k( 331) = ( 0.2314815 0.2314815 0.5000000), wk = 0.0022173 k( 332) = ( 0.2268518 0.2268519 0.5000000), wk = 0.0022173 k( 333) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0022173 k( 334) = ( 0.2175926 0.2175926 0.5000000), wk = 0.0022173 k( 335) = ( 0.2129630 0.2129630 0.5000000), wk = 0.0022173 k( 336) = ( 0.2083333 0.2083333 0.5000000), wk = 0.0022173 k( 337) = ( 0.2037037 0.2037037 0.5000000), wk = 0.0022173 k( 338) = ( 0.1990741 0.1990741 0.5000000), wk = 0.0022173 k( 339) = ( 0.1944444 0.1944444 0.5000000), wk = 0.0022173 k( 340) = ( 0.1898148 0.1898148 0.5000000), wk = 0.0022173 k( 341) = ( 0.1851852 0.1851852 0.5000000), wk = 0.0022173 k( 342) = ( 0.1805556 0.1805556 0.5000000), wk = 0.0022173 k( 343) = ( 0.1759259 0.1759259 0.5000000), wk = 0.0022173 k( 344) = ( 0.1712963 0.1712963 0.5000000), wk = 0.0022173 k( 345) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0022173 k( 346) = ( 0.1620370 0.1620370 0.5000000), wk = 0.0022173 k( 347) = ( 0.1574074 0.1574074 0.5000000), wk = 0.0022173 k( 348) = ( 0.1527778 0.1527778 0.5000000), wk = 0.0022173 k( 349) = ( 0.1481482 0.1481482 0.5000000), wk = 0.0022173 k( 350) = ( 0.1435185 0.1435185 0.5000000), wk = 0.0022173 k( 351) = ( 0.1388889 0.1388889 0.5000000), wk = 0.0022173 k( 352) = ( 0.1342593 0.1342593 0.5000000), wk = 0.0022173 k( 353) = ( 0.1296296 0.1296296 0.5000000), wk = 0.0022173 k( 354) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0022173 k( 355) = ( 0.1203704 0.1203704 0.5000000), wk = 0.0022173 k( 356) = ( 0.1157407 0.1157407 0.5000000), wk = 0.0022173 k( 357) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0022173 k( 358) = ( 0.1064815 0.1064815 0.5000000), wk = 0.0022173 k( 359) = ( 0.1018518 0.1018519 0.5000000), wk = 0.0022173 k( 360) = ( 0.0972222 0.0972222 0.5000000), wk = 0.0022173 k( 361) = ( 0.0925926 0.0925926 0.5000000), wk = 0.0022173 k( 362) = ( 0.0879630 0.0879630 0.5000000), wk = 0.0022173 k( 363) = ( 0.0833333 0.0833333 0.5000000), wk = 0.0022173 k( 364) = ( 0.0787037 0.0787037 0.5000000), wk = 0.0022173 k( 365) = ( 0.0740741 0.0740741 0.5000000), wk = 0.0022173 k( 366) = ( 0.0694444 0.0694444 0.5000000), wk = 0.0022173 k( 367) = ( 0.0648148 0.0648148 0.5000000), wk = 0.0022173 k( 368) = ( 0.0601852 0.0601852 0.5000000), wk = 0.0022173 k( 369) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0022173 k( 370) = ( 0.0509259 0.0509259 0.5000000), wk = 0.0022173 k( 371) = ( 0.0462963 0.0462963 0.5000000), wk = 0.0022173 k( 372) = ( 0.0416667 0.0416667 0.5000000), wk = 0.0022173 k( 373) = ( 0.0370370 0.0370370 0.5000000), wk = 0.0022173 k( 374) = ( 0.0324074 0.0324074 0.5000000), wk = 0.0022173 k( 375) = ( 0.0277778 0.0277778 0.5000000), wk = 0.0022173 k( 376) = ( 0.0231481 0.0231482 0.5000000), wk = 0.0022173 k( 377) = ( 0.0185185 0.0185185 0.5000000), wk = 0.0022173 k( 378) = ( 0.0138889 0.0138889 0.5000000), wk = 0.0022173 k( 379) = ( 0.0092593 0.0092593 0.5000000), wk = 0.0022173 k( 380) = ( 0.0046296 0.0046296 0.5000000), wk = 0.0022173 k( 381) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022173 k( 382) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022173 k( 383) = ( 0.5000000 0.0000000 0.4852941), wk = 0.0022173 k( 384) = ( 0.5000000 0.0000000 0.4705882), wk = 0.0022173 k( 385) = ( 0.5000000 0.0000000 0.4558823), wk = 0.0022173 k( 386) = ( 0.5000000 0.0000000 0.4411765), wk = 0.0022173 k( 387) = ( 0.5000000 0.0000000 0.4264706), wk = 0.0022173 k( 388) = ( 0.5000000 0.0000000 0.4117647), wk = 0.0022173 k( 389) = ( 0.5000000 0.0000000 0.3970588), wk = 0.0022173 k( 390) = ( 0.5000000 0.0000000 0.3823529), wk = 0.0022173 k( 391) = ( 0.5000000 0.0000000 0.3676471), wk = 0.0022173 k( 392) = ( 0.5000000 0.0000000 0.3529412), wk = 0.0022173 k( 393) = ( 0.5000000 0.0000000 0.3382353), wk = 0.0022173 k( 394) = ( 0.5000000 0.0000000 0.3235294), wk = 0.0022173 k( 395) = ( 0.5000000 0.0000000 0.3088235), wk = 0.0022173 k( 396) = ( 0.5000000 0.0000000 0.2941177), wk = 0.0022173 k( 397) = ( 0.5000000 0.0000000 0.2794118), wk = 0.0022173 k( 398) = ( 0.5000000 0.0000000 0.2647059), wk = 0.0022173 k( 399) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0022173 k( 400) = ( 0.5000000 0.0000000 0.2352941), wk = 0.0022173 k( 401) = ( 0.5000000 0.0000000 0.2205882), wk = 0.0022173 k( 402) = ( 0.5000000 0.0000000 0.2058824), wk = 0.0022173 k( 403) = ( 0.5000000 0.0000000 0.1911765), wk = 0.0022173 k( 404) = ( 0.5000000 0.0000000 0.1764706), wk = 0.0022173 k( 405) = ( 0.5000000 0.0000000 0.1617647), wk = 0.0022173 k( 406) = ( 0.5000000 0.0000000 0.1470588), wk = 0.0022173 k( 407) = ( 0.5000000 0.0000000 0.1323529), wk = 0.0022173 k( 408) = ( 0.5000000 0.0000000 0.1176471), wk = 0.0022173 k( 409) = ( 0.5000000 0.0000000 0.1029412), wk = 0.0022173 k( 410) = ( 0.5000000 0.0000000 0.0882353), wk = 0.0022173 k( 411) = ( 0.5000000 0.0000000 0.0735294), wk = 0.0022173 k( 412) = ( 0.5000000 0.0000000 0.0588235), wk = 0.0022173 k( 413) = ( 0.5000000 0.0000000 0.0441177), wk = 0.0022173 k( 414) = ( 0.5000000 0.0000000 0.0294118), wk = 0.0022173 k( 415) = ( 0.5000000 0.0000000 0.0147059), wk = 0.0022173 k( 416) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0022173 k( 417) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0022173 k( 418) = ( 0.3333333 0.3333333 0.0147059), wk = 0.0022173 k( 419) = ( 0.3333333 0.3333333 0.0294118), wk = 0.0022173 k( 420) = ( 0.3333333 0.3333333 0.0441177), wk = 0.0022173 k( 421) = ( 0.3333333 0.3333333 0.0588235), wk = 0.0022173 k( 422) = ( 0.3333333 0.3333333 0.0735294), wk = 0.0022173 k( 423) = ( 0.3333333 0.3333333 0.0882353), wk = 0.0022173 k( 424) = ( 0.3333333 0.3333333 0.1029412), wk = 0.0022173 k( 425) = ( 0.3333333 0.3333333 0.1176471), wk = 0.0022173 k( 426) = ( 0.3333333 0.3333333 0.1323529), wk = 0.0022173 k( 427) = ( 0.3333333 0.3333333 0.1470588), wk = 0.0022173 k( 428) = ( 0.3333333 0.3333333 0.1617647), wk = 0.0022173 k( 429) = ( 0.3333333 0.3333333 0.1764706), wk = 0.0022173 k( 430) = ( 0.3333333 0.3333333 0.1911765), wk = 0.0022173 k( 431) = ( 0.3333333 0.3333333 0.2058823), wk = 0.0022173 k( 432) = ( 0.3333333 0.3333333 0.2205882), wk = 0.0022173 k( 433) = ( 0.3333333 0.3333333 0.2352941), wk = 0.0022173 k( 434) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0022173 k( 435) = ( 0.3333333 0.3333333 0.2647059), wk = 0.0022173 k( 436) = ( 0.3333333 0.3333333 0.2794118), wk = 0.0022173 k( 437) = ( 0.3333333 0.3333333 0.2941177), wk = 0.0022173 k( 438) = ( 0.3333333 0.3333333 0.3088235), wk = 0.0022173 k( 439) = ( 0.3333333 0.3333333 0.3235294), wk = 0.0022173 k( 440) = ( 0.3333333 0.3333333 0.3382353), wk = 0.0022173 k( 441) = ( 0.3333333 0.3333333 0.3529412), wk = 0.0022173 k( 442) = ( 0.3333333 0.3333333 0.3676471), wk = 0.0022173 k( 443) = ( 0.3333333 0.3333333 0.3823529), wk = 0.0022173 k( 444) = ( 0.3333333 0.3333333 0.3970588), wk = 0.0022173 k( 445) = ( 0.3333333 0.3333333 0.4117647), wk = 0.0022173 k( 446) = ( 0.3333333 0.3333333 0.4264706), wk = 0.0022173 k( 447) = ( 0.3333333 0.3333333 0.4411765), wk = 0.0022173 k( 448) = ( 0.3333333 0.3333333 0.4558823), wk = 0.0022173 k( 449) = ( 0.3333333 0.3333333 0.4705882), wk = 0.0022173 k( 450) = ( 0.3333333 0.3333333 0.4852941), wk = 0.0022173 k( 451) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0022173 Dense grid: 21855 G-vectors FFT dimensions: ( 32, 32, 54) Smooth grid: 11513 G-vectors FFT dimensions: ( 25, 25, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.05 Mb ( 88, 38) NL pseudopotentials 0.05 Mb ( 44, 72) Each V/rho on FFT grid 0.03 Mb ( 2048) Each G-vector array 0.00 Mb ( 608) G-vector shells 0.00 Mb ( 313) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.20 Mb ( 88, 152) Each subspace H/S matrix 0.02 Mb ( 38, 38) Each matrix 0.08 Mb ( 72, 2, 38) The potential is recalculated from file : ./MoH.save/charge-density.dat Starting wfc are 44 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.4 secs Computing kpt #: 2 total cpu time spent up to now is 1.5 secs Computing kpt #: 3 total cpu time spent up to now is 1.7 secs Computing kpt #: 4 total cpu time spent up to now is 1.8 secs Computing kpt #: 5 total cpu time spent up to now is 2.0 secs Computing kpt #: 6 total cpu time spent up to now is 2.1 secs Computing kpt #: 7 total cpu time spent up to now is 2.2 secs Computing kpt #: 8 total cpu time spent up to now is 2.4 secs Computing kpt #: 9 total cpu time spent up to now is 2.5 secs Computing kpt #: 10 total cpu time spent up to now is 2.6 secs Computing kpt #: 11 total cpu time spent up to now is 2.8 secs Computing kpt #: 12 total cpu time spent up to now is 2.9 secs Computing kpt #: 13 total cpu time spent up to now is 3.0 secs Computing kpt #: 14 total cpu time spent up to now is 3.2 secs Computing kpt #: 15 total cpu time spent up to now is 3.3 secs Computing kpt #: 16 total cpu time spent up to now is 3.4 secs Computing kpt #: 17 total cpu time spent up to now is 3.6 secs Computing kpt #: 18 total cpu time spent up to now is 3.7 secs Computing kpt #: 19 total cpu time spent up to now is 3.8 secs Computing kpt #: 20 total cpu time spent up to now is 4.0 secs Computing kpt #: 21 total cpu time spent up to now is 4.1 secs Computing kpt #: 22 total cpu time spent up to now is 4.2 secs Computing kpt #: 23 total cpu time spent up to now is 4.3 secs Computing kpt #: 24 total cpu time spent up to now is 4.5 secs Computing kpt #: 25 total cpu time spent up to now is 4.6 secs Computing kpt #: 26 total cpu time spent up to now is 4.7 secs Computing kpt #: 27 total cpu time spent up to now is 4.9 secs Computing kpt #: 28 total cpu time spent up to now is 5.0 secs Computing kpt #: 29 total cpu time spent up to now is 5.1 secs Computing kpt #: 30 total cpu time spent up to now is 5.2 secs Computing kpt #: 31 total cpu time spent up to now is 5.4 secs Computing kpt #: 32 total cpu time spent up to now is 5.5 secs Computing kpt #: 33 total cpu time spent up to now is 5.6 secs Computing kpt #: 34 total cpu time spent up to now is 5.8 secs Computing kpt #: 35 total cpu time spent up to now is 5.9 secs Computing kpt #: 36 total cpu time spent up to now is 6.1 secs Computing kpt #: 37 total cpu time spent up to now is 6.2 secs Computing kpt #: 38 total cpu time spent up to now is 6.4 secs Computing kpt #: 39 total cpu time spent up to now is 6.5 secs Computing kpt #: 40 total cpu time spent up to now is 6.7 secs Computing kpt #: 41 total cpu time spent up to now is 6.9 secs Computing kpt #: 42 total cpu time spent up to now is 7.1 secs Computing kpt #: 43 total cpu time spent up to now is 7.2 secs Computing kpt #: 44 total cpu time spent up to now is 7.4 secs Computing kpt #: 45 total cpu time spent up to now is 7.6 secs Computing kpt #: 46 total cpu time spent up to now is 7.8 secs Computing kpt #: 47 total cpu time spent up to now is 7.9 secs Computing kpt #: 48 total cpu time spent up to now is 8.1 secs Computing kpt #: 49 total cpu time spent up to now is 8.3 secs Computing kpt #: 50 total cpu time spent up to now is 8.5 secs Computing kpt #: 51 total cpu time spent up to now is 8.7 secs Computing kpt #: 52 total cpu time spent up to now is 8.8 secs Computing kpt #: 53 total cpu time spent up to now is 9.0 secs Computing kpt #: 54 total cpu time spent up to now is 9.2 secs Computing kpt #: 55 total cpu time spent up to now is 9.4 secs Computing kpt #: 56 total cpu time spent up to now is 9.6 secs Computing kpt #: 57 total cpu time spent up to now is 9.7 secs Computing kpt #: 58 total cpu time spent up to now is 9.9 secs Computing kpt #: 59 total cpu time spent up to now is 10.1 secs Computing kpt #: 60 total cpu time spent up to now is 10.2 secs Computing kpt #: 61 total cpu time spent up to now is 10.4 secs Computing kpt #: 62 total cpu time spent up to now is 10.6 secs Computing kpt #: 63 total cpu time spent up to now is 10.7 secs Computing kpt #: 64 total cpu time spent up to now is 10.9 secs Computing kpt #: 65 total cpu time spent up to now is 11.0 secs Computing kpt #: 66 total cpu time spent up to now is 11.1 secs Computing kpt #: 67 total cpu time spent up to now is 11.3 secs Computing kpt #: 68 total cpu time spent up to now is 11.4 secs Computing kpt #: 69 total cpu time spent up to now is 11.5 secs Computing kpt #: 70 total cpu time spent up to now is 11.7 secs Computing kpt #: 71 total cpu time spent up to now is 11.8 secs Computing kpt #: 72 total cpu time spent up to now is 11.9 secs Computing kpt #: 73 total cpu time spent up to now is 12.1 secs Computing kpt #: 74 total cpu time spent up to now is 12.2 secs Computing kpt #: 75 total cpu time spent up to now is 12.3 secs Computing kpt #: 76 total cpu time spent up to now is 12.5 secs Computing kpt #: 77 total cpu time spent up to now is 12.6 secs Computing kpt #: 78 total cpu time spent up to now is 12.8 secs Computing kpt #: 79 total cpu time spent up to now is 12.9 secs Computing kpt #: 80 total cpu time spent up to now is 13.1 secs Computing kpt #: 81 total cpu time spent up to now is 13.3 secs Computing kpt #: 82 total cpu time spent up to now is 13.5 secs Computing kpt #: 83 total cpu time spent up to now is 13.7 secs Computing kpt #: 84 total cpu time spent up to now is 13.9 secs Computing kpt #: 85 total cpu time spent up to now is 14.2 secs Computing kpt #: 86 total cpu time spent up to now is 14.5 secs Computing kpt #: 87 total cpu time spent up to now is 14.8 secs Computing kpt #: 88 total cpu time spent up to now is 15.0 secs Computing kpt #: 89 total cpu time spent up to now is 15.3 secs Computing kpt #: 90 total cpu time spent up to now is 15.5 secs Computing kpt #: 91 total cpu time spent up to now is 15.8 secs Computing kpt #: 92 total cpu time spent up to now is 16.1 secs Computing kpt #: 93 total cpu time spent up to now is 16.4 secs Computing kpt #: 94 total cpu time spent up to now is 16.6 secs Computing kpt #: 95 total cpu time spent up to now is 16.8 secs Computing kpt #: 96 total cpu time spent up to now is 17.1 secs Computing kpt #: 97 total cpu time spent up to now is 17.3 secs Computing kpt #: 98 total cpu time spent up to now is 17.5 secs Computing kpt #: 99 total cpu time spent up to now is 17.7 secs Computing kpt #: 100 total cpu time spent up to now is 17.8 secs Computing kpt #: 101 total cpu time spent up to now is 18.0 secs Computing kpt #: 102 total cpu time spent up to now is 18.2 secs Computing kpt #: 103 total cpu time spent up to now is 18.4 secs Computing kpt #: 104 total cpu time spent up to now is 18.6 secs Computing kpt #: 105 total cpu time spent up to now is 18.8 secs Computing kpt #: 106 total cpu time spent up to now is 19.0 secs Computing kpt #: 107 total cpu time spent up to now is 19.2 secs Computing kpt #: 108 total cpu time spent up to now is 19.4 secs Computing kpt #: 109 total cpu time spent up to now is 19.6 secs Computing kpt #: 110 total cpu time spent up to now is 19.8 secs Computing kpt #: 111 total cpu time spent up to now is 20.0 secs Computing kpt #: 112 total cpu time spent up to now is 20.2 secs Computing kpt #: 113 total cpu time spent up to now is 20.4 secs Computing kpt #: 114 total cpu time spent up to now is 20.6 secs Computing kpt #: 115 total cpu time spent up to now is 20.8 secs Computing kpt #: 116 total cpu time spent up to now is 21.0 secs Computing kpt #: 117 total cpu time spent up to now is 21.2 secs Computing kpt #: 118 total cpu time spent up to now is 21.4 secs Computing kpt #: 119 total cpu time spent up to now is 21.6 secs Computing kpt #: 120 total cpu time spent up to now is 21.9 secs Computing kpt #: 121 total cpu time spent up to now is 22.1 secs Computing kpt #: 122 total cpu time spent up to now is 22.3 secs Computing kpt #: 123 total cpu time spent up to now is 22.5 secs Computing kpt #: 124 total cpu time spent up to now is 22.7 secs Computing kpt #: 125 total cpu time spent up to now is 22.9 secs Computing kpt #: 126 total cpu time spent up to now is 23.1 secs Computing kpt #: 127 total cpu time spent up to now is 23.3 secs Computing kpt #: 128 total cpu time spent up to now is 23.5 secs Computing kpt #: 129 total cpu time spent up to now is 23.6 secs Computing kpt #: 130 total cpu time spent up to now is 23.8 secs Computing kpt #: 131 total cpu time spent up to now is 24.0 secs Computing kpt #: 132 total cpu time spent up to now is 24.2 secs Computing kpt #: 133 total cpu time spent up to now is 24.4 secs Computing kpt #: 134 total cpu time spent up to now is 24.6 secs Computing kpt #: 135 total cpu time spent up to now is 24.7 secs Computing kpt #: 136 total cpu time spent up to now is 24.9 secs Computing kpt #: 137 total cpu time spent up to now is 25.1 secs Computing kpt #: 138 total cpu time spent up to now is 25.3 secs Computing kpt #: 139 total cpu time spent up to now is 25.4 secs Computing kpt #: 140 total cpu time spent up to now is 25.6 secs Computing kpt #: 141 total cpu time spent up to now is 25.7 secs Computing kpt #: 142 total cpu time spent up to now is 25.8 secs Computing kpt #: 143 total cpu time spent up to now is 26.0 secs Computing kpt #: 144 total cpu time spent up to now is 26.1 secs Computing kpt #: 145 total cpu time spent up to now is 26.2 secs Computing kpt #: 146 total cpu time spent up to now is 26.3 secs Computing kpt #: 147 total cpu time spent up to now is 26.5 secs Computing kpt #: 148 total cpu time spent up to now is 26.6 secs Computing kpt #: 149 total cpu time spent up to now is 26.7 secs Computing kpt #: 150 total cpu time spent up to now is 26.9 secs Computing kpt #: 151 total cpu time spent up to now is 27.0 secs Computing kpt #: 152 total cpu time spent up to now is 27.1 secs Computing kpt #: 153 total cpu time spent up to now is 27.2 secs Computing kpt #: 154 total cpu time spent up to now is 27.4 secs Computing kpt #: 155 total cpu time spent up to now is 27.5 secs Computing kpt #: 156 total cpu time spent up to now is 27.6 secs Computing kpt #: 157 total cpu time spent up to now is 27.8 secs Computing kpt #: 158 total cpu time spent up to now is 27.9 secs Computing kpt #: 159 total cpu time spent up to now is 28.0 secs Computing kpt #: 160 total cpu time spent up to now is 28.2 secs Computing kpt #: 161 total cpu time spent up to now is 28.3 secs Computing kpt #: 162 total cpu time spent up to now is 28.4 secs Computing kpt #: 163 total cpu time spent up to now is 28.6 secs Computing kpt #: 164 total cpu time spent up to now is 28.7 secs Computing kpt #: 165 total cpu time spent up to now is 28.8 secs Computing kpt #: 166 total cpu time spent up to now is 29.0 secs Computing kpt #: 167 total cpu time spent up to now is 29.1 secs Computing kpt #: 168 total cpu time spent up to now is 29.2 secs Computing kpt #: 169 total cpu time spent up to now is 29.4 secs Computing kpt #: 170 total cpu time spent up to now is 29.5 secs Computing kpt #: 171 total cpu time spent up to now is 29.7 secs Computing kpt #: 172 total cpu time spent up to now is 29.8 secs Computing kpt #: 173 total cpu time spent up to now is 29.9 secs Computing kpt #: 174 total cpu time spent up to now is 30.1 secs Computing kpt #: 175 total cpu time spent up to now is 30.2 secs Computing kpt #: 176 total cpu time spent up to now is 30.3 secs Computing kpt #: 177 total cpu time spent up to now is 30.5 secs Computing kpt #: 178 total cpu time spent up to now is 30.6 secs Computing kpt #: 179 total cpu time spent up to now is 30.8 secs Computing kpt #: 180 total cpu time spent up to now is 30.9 secs Computing kpt #: 181 total cpu time spent up to now is 31.0 secs Computing kpt #: 182 total cpu time spent up to now is 31.1 secs Computing kpt #: 183 total cpu time spent up to now is 31.3 secs Computing kpt #: 184 total cpu time spent up to now is 31.4 secs Computing kpt #: 185 total cpu time spent up to now is 31.6 secs Computing kpt #: 186 total cpu time spent up to now is 31.7 secs Computing kpt #: 187 total cpu time spent up to now is 31.9 secs Computing kpt #: 188 total cpu time spent up to now is 32.1 secs Computing kpt #: 189 total cpu time spent up to now is 32.3 secs Computing kpt #: 190 total cpu time spent up to now is 32.4 secs Computing kpt #: 191 total cpu time spent up to now is 32.6 secs Computing kpt #: 192 total cpu time spent up to now is 32.7 secs Computing kpt #: 193 total cpu time spent up to now is 32.9 secs Computing kpt #: 194 total cpu time spent up to now is 33.0 secs Computing kpt #: 195 total cpu time spent up to now is 33.2 secs Computing kpt #: 196 total cpu time spent up to now is 33.3 secs Computing kpt #: 197 total cpu time spent up to now is 33.5 secs Computing kpt #: 198 total cpu time spent up to now is 33.7 secs Computing kpt #: 199 total cpu time spent up to now is 33.8 secs Computing kpt #: 200 total cpu time spent up to now is 34.0 secs Computing kpt #: 201 total cpu time spent up to now is 34.1 secs Computing kpt #: 202 total cpu time spent up to now is 34.3 secs Computing kpt #: 203 total cpu time spent up to now is 34.4 secs Computing kpt #: 204 total cpu time spent up to now is 34.6 secs Computing kpt #: 205 total cpu time spent up to now is 34.7 secs Computing kpt #: 206 total cpu time spent up to now is 34.9 secs Computing kpt #: 207 total cpu time spent up to now is 35.0 secs Computing kpt #: 208 total cpu time spent up to now is 35.2 secs Computing kpt #: 209 total cpu time spent up to now is 35.3 secs Computing kpt #: 210 total cpu time spent up to now is 35.5 secs Computing kpt #: 211 total cpu time spent up to now is 35.6 secs Computing kpt #: 212 total cpu time spent up to now is 35.7 secs Computing kpt #: 213 total cpu time spent up to now is 35.9 secs Computing kpt #: 214 total cpu time spent up to now is 36.0 secs Computing kpt #: 215 total cpu time spent up to now is 36.1 secs Computing kpt #: 216 total cpu time spent up to now is 36.3 secs Computing kpt #: 217 total cpu time spent up to now is 36.4 secs Computing kpt #: 218 total cpu time spent up to now is 36.6 secs Computing kpt #: 219 total cpu time spent up to now is 36.7 secs Computing kpt #: 220 total cpu time spent up to now is 36.8 secs Computing kpt #: 221 total cpu time spent up to now is 37.0 secs Computing kpt #: 222 total cpu time spent up to now is 37.1 secs Computing kpt #: 223 total cpu time spent up to now is 37.3 secs Computing kpt #: 224 total cpu time spent up to now is 37.4 secs Computing kpt #: 225 total cpu time spent up to now is 37.6 secs Computing kpt #: 226 total cpu time spent up to now is 37.7 secs Computing kpt #: 227 total cpu time spent up to now is 37.9 secs Computing kpt #: 228 total cpu time spent up to now is 38.0 secs Computing kpt #: 229 total cpu time spent up to now is 38.1 secs Computing kpt #: 230 total cpu time spent up to now is 38.3 secs Computing kpt #: 231 total cpu time spent up to now is 38.4 secs Computing kpt #: 232 total cpu time spent up to now is 38.6 secs Computing kpt #: 233 total cpu time spent up to now is 38.7 secs Computing kpt #: 234 total cpu time spent up to now is 38.9 secs Computing kpt #: 235 total cpu time spent up to now is 39.2 secs Computing kpt #: 236 total cpu time spent up to now is 39.4 secs Computing kpt #: 237 total cpu time spent up to now is 39.5 secs Computing kpt #: 238 total cpu time spent up to now is 39.7 secs Computing kpt #: 239 total cpu time spent up to now is 39.8 secs Computing kpt #: 240 total cpu time spent up to now is 39.9 secs Computing kpt #: 241 total cpu time spent up to now is 40.1 secs Computing kpt #: 242 total cpu time spent up to now is 40.2 secs Computing kpt #: 243 total cpu time spent up to now is 40.3 secs Computing kpt #: 244 total cpu time spent up to now is 40.5 secs Computing kpt #: 245 total cpu time spent up to now is 40.6 secs Computing kpt #: 246 total cpu time spent up to now is 40.7 secs Computing kpt #: 247 total cpu time spent up to now is 40.9 secs Computing kpt #: 248 total cpu time spent up to now is 41.0 secs Computing kpt #: 249 total cpu time spent up to now is 41.1 secs Computing kpt #: 250 total cpu time spent up to now is 41.3 secs Computing kpt #: 251 total cpu time spent up to now is 41.4 secs Computing kpt #: 252 total cpu time spent up to now is 41.5 secs Computing kpt #: 253 total cpu time spent up to now is 41.7 secs Computing kpt #: 254 total cpu time spent up to now is 41.9 secs Computing kpt #: 255 total cpu time spent up to now is 42.0 secs Computing kpt #: 256 total cpu time spent up to now is 42.2 secs Computing kpt #: 257 total cpu time spent up to now is 42.4 secs Computing kpt #: 258 total cpu time spent up to now is 42.5 secs Computing kpt #: 259 total cpu time spent up to now is 42.7 secs Computing kpt #: 260 total cpu time spent up to now is 42.9 secs Computing kpt #: 261 total cpu time spent up to now is 43.1 secs Computing kpt #: 262 total cpu time spent up to now is 43.3 secs Computing kpt #: 263 total cpu time spent up to now is 43.4 secs Computing kpt #: 264 total cpu time spent up to now is 43.6 secs Computing kpt #: 265 total cpu time spent up to now is 43.8 secs Computing kpt #: 266 total cpu time spent up to now is 44.0 secs Computing kpt #: 267 total cpu time spent up to now is 44.1 secs Computing kpt #: 268 total cpu time spent up to now is 44.3 secs Computing kpt #: 269 total cpu time spent up to now is 44.5 secs Computing kpt #: 270 total cpu time spent up to now is 44.7 secs Computing kpt #: 271 total cpu time spent up to now is 44.9 secs Computing kpt #: 272 total cpu time spent up to now is 45.0 secs Computing kpt #: 273 total cpu time spent up to now is 45.2 secs Computing kpt #: 274 total cpu time spent up to now is 45.4 secs Computing kpt #: 275 total cpu time spent up to now is 45.6 secs Computing kpt #: 276 total cpu time spent up to now is 45.8 secs Computing kpt #: 277 total cpu time spent up to now is 46.0 secs Computing kpt #: 278 total cpu time spent up to now is 46.1 secs Computing kpt #: 279 total cpu time spent up to now is 46.3 secs Computing kpt #: 280 total cpu time spent up to now is 46.5 secs Computing kpt #: 281 total cpu time spent up to now is 46.7 secs Computing kpt #: 282 total cpu time spent up to now is 46.8 secs Computing kpt #: 283 total cpu time spent up to now is 47.0 secs Computing kpt #: 284 total cpu time spent up to now is 47.2 secs Computing kpt #: 285 total cpu time spent up to now is 47.4 secs Computing kpt #: 286 total cpu time spent up to now is 47.5 secs Computing kpt #: 287 total cpu time spent up to now is 47.7 secs Computing kpt #: 288 total cpu time spent up to now is 47.9 secs Computing kpt #: 289 total cpu time spent up to now is 48.1 secs Computing kpt #: 290 total cpu time spent up to now is 48.2 secs Computing kpt #: 291 total cpu time spent up to now is 48.4 secs Computing kpt #: 292 total cpu time spent up to now is 48.6 secs Computing kpt #: 293 total cpu time spent up to now is 48.8 secs Computing kpt #: 294 total cpu time spent up to now is 48.9 secs Computing kpt #: 295 total cpu time spent up to now is 49.1 secs Computing kpt #: 296 total cpu time spent up to now is 49.3 secs Computing kpt #: 297 total cpu time spent up to now is 49.5 secs Computing kpt #: 298 total cpu time spent up to now is 49.6 secs Computing kpt #: 299 total cpu time spent up to now is 49.8 secs Computing kpt #: 300 total cpu time spent up to now is 50.0 secs Computing kpt #: 301 total cpu time spent up to now is 50.2 secs Computing kpt #: 302 total cpu time spent up to now is 50.4 secs Computing kpt #: 303 total cpu time spent up to now is 50.6 secs Computing kpt #: 304 total cpu time spent up to now is 50.8 secs Computing kpt #: 305 total cpu time spent up to now is 51.1 secs Computing kpt #: 306 total cpu time spent up to now is 51.4 secs Computing kpt #: 307 total cpu time spent up to now is 51.9 secs Computing kpt #: 308 total cpu time spent up to now is 52.1 secs Computing kpt #: 309 total cpu time spent up to now is 52.4 secs Computing kpt #: 310 total cpu time spent up to now is 52.7 secs Computing kpt #: 311 total cpu time spent up to now is 53.1 secs Computing kpt #: 312 total cpu time spent up to now is 53.3 secs Computing kpt #: 313 total cpu time spent up to now is 53.5 secs Computing kpt #: 314 total cpu time spent up to now is 53.7 secs Computing kpt #: 315 total cpu time spent up to now is 53.9 secs Computing kpt #: 316 total cpu time spent up to now is 54.1 secs Computing kpt #: 317 total cpu time spent up to now is 54.3 secs Computing kpt #: 318 total cpu time spent up to now is 54.5 secs Computing kpt #: 319 total cpu time spent up to now is 54.7 secs Computing kpt #: 320 total cpu time spent up to now is 54.9 secs Computing kpt #: 321 total cpu time spent up to now is 55.1 secs Computing kpt #: 322 total cpu time spent up to now is 55.2 secs Computing kpt #: 323 total cpu time spent up to now is 55.4 secs Computing kpt #: 324 total cpu time spent up to now is 55.6 secs Computing kpt #: 325 total cpu time spent up to now is 55.7 secs Computing kpt #: 326 total cpu time spent up to now is 55.9 secs Computing kpt #: 327 total cpu time spent up to now is 56.1 secs Computing kpt #: 328 total cpu time spent up to now is 56.3 secs Computing kpt #: 329 total cpu time spent up to now is 56.4 secs Computing kpt #: 330 total cpu time spent up to now is 56.6 secs Computing kpt #: 331 total cpu time spent up to now is 56.8 secs Computing kpt #: 332 total cpu time spent up to now is 56.9 secs Computing kpt #: 333 total cpu time spent up to now is 57.1 secs Computing kpt #: 334 total cpu time spent up to now is 57.3 secs Computing kpt #: 335 total cpu time spent up to now is 57.5 secs Computing kpt #: 336 total cpu time spent up to now is 57.6 secs Computing kpt #: 337 total cpu time spent up to now is 57.8 secs Computing kpt #: 338 total cpu time spent up to now is 58.0 secs Computing kpt #: 339 total cpu time spent up to now is 58.1 secs Computing kpt #: 340 total cpu time spent up to now is 58.3 secs Computing kpt #: 341 total cpu time spent up to now is 58.5 secs Computing kpt #: 342 total cpu time spent up to now is 58.6 secs Computing kpt #: 343 total cpu time spent up to now is 58.8 secs Computing kpt #: 344 total cpu time spent up to now is 59.0 secs Computing kpt #: 345 total cpu time spent up to now is 59.2 secs Computing kpt #: 346 total cpu time spent up to now is 59.3 secs Computing kpt #: 347 total cpu time spent up to now is 59.5 secs Computing kpt #: 348 total cpu time spent up to now is 59.7 secs Computing kpt #: 349 total cpu time spent up to now is 59.9 secs Computing kpt #: 350 total cpu time spent up to now is 60.1 secs Computing kpt #: 351 total cpu time spent up to now is 60.3 secs Computing kpt #: 352 total cpu time spent up to now is 60.4 secs Computing kpt #: 353 total cpu time spent up to now is 60.6 secs Computing kpt #: 354 total cpu time spent up to now is 60.8 secs Computing kpt #: 355 total cpu time spent up to now is 61.0 secs Computing kpt #: 356 total cpu time spent up to now is 61.2 secs Computing kpt #: 357 total cpu time spent up to now is 61.4 secs Computing kpt #: 358 total cpu time spent up to now is 61.6 secs Computing kpt #: 359 total cpu time spent up to now is 61.8 secs Computing kpt #: 360 total cpu time spent up to now is 62.0 secs Computing kpt #: 361 total cpu time spent up to now is 62.2 secs Computing kpt #: 362 total cpu time spent up to now is 62.3 secs Computing kpt #: 363 total cpu time spent up to now is 62.5 secs Computing kpt #: 364 total cpu time spent up to now is 62.7 secs Computing kpt #: 365 total cpu time spent up to now is 62.9 secs Computing kpt #: 366 total cpu time spent up to now is 63.1 secs Computing kpt #: 367 total cpu time spent up to now is 63.3 secs Computing kpt #: 368 total cpu time spent up to now is 63.4 secs Computing kpt #: 369 total cpu time spent up to now is 63.6 secs Computing kpt #: 370 total cpu time spent up to now is 63.8 secs Computing kpt #: 371 total cpu time spent up to now is 63.9 secs Computing kpt #: 372 total cpu time spent up to now is 64.1 secs Computing kpt #: 373 total cpu time spent up to now is 64.3 secs Computing kpt #: 374 total cpu time spent up to now is 64.5 secs Computing kpt #: 375 total cpu time spent up to now is 64.6 secs Computing kpt #: 376 total cpu time spent up to now is 64.8 secs Computing kpt #: 377 total cpu time spent up to now is 64.9 secs Computing kpt #: 378 total cpu time spent up to now is 65.0 secs Computing kpt #: 379 total cpu time spent up to now is 65.2 secs Computing kpt #: 380 total cpu time spent up to now is 65.3 secs Computing kpt #: 381 total cpu time spent up to now is 65.5 secs Computing kpt #: 382 total cpu time spent up to now is 65.7 secs Computing kpt #: 383 total cpu time spent up to now is 65.8 secs Computing kpt #: 384 total cpu time spent up to now is 66.0 secs Computing kpt #: 385 total cpu time spent up to now is 66.2 secs Computing kpt #: 386 total cpu time spent up to now is 66.4 secs Computing kpt #: 387 total cpu time spent up to now is 66.6 secs Computing kpt #: 388 total cpu time spent up to now is 66.8 secs Computing kpt #: 389 total cpu time spent up to now is 66.9 secs Computing kpt #: 390 total cpu time spent up to now is 67.1 secs Computing kpt #: 391 total cpu time spent up to now is 67.3 secs Computing kpt #: 392 total cpu time spent up to now is 67.4 secs Computing kpt #: 393 total cpu time spent up to now is 67.6 secs Computing kpt #: 394 total cpu time spent up to now is 67.8 secs Computing kpt #: 395 total cpu time spent up to now is 67.9 secs Computing kpt #: 396 total cpu time spent up to now is 68.1 secs Computing kpt #: 397 total cpu time spent up to now is 68.2 secs Computing kpt #: 398 total cpu time spent up to now is 68.4 secs Computing kpt #: 399 total cpu time spent up to now is 68.5 secs Computing kpt #: 400 total cpu time spent up to now is 68.7 secs Computing kpt #: 401 total cpu time spent up to now is 68.8 secs Computing kpt #: 402 total cpu time spent up to now is 69.3 secs Computing kpt #: 403 total cpu time spent up to now is 69.4 secs Computing kpt #: 404 total cpu time spent up to now is 69.6 secs Computing kpt #: 405 total cpu time spent up to now is 69.7 secs Computing kpt #: 406 total cpu time spent up to now is 69.8 secs Computing kpt #: 407 total cpu time spent up to now is 70.0 secs Computing kpt #: 408 total cpu time spent up to now is 70.1 secs Computing kpt #: 409 total cpu time spent up to now is 70.2 secs Computing kpt #: 410 total cpu time spent up to now is 70.4 secs Computing kpt #: 411 total cpu time spent up to now is 70.5 secs Computing kpt #: 412 total cpu time spent up to now is 70.7 secs Computing kpt #: 413 total cpu time spent up to now is 70.8 secs Computing kpt #: 414 total cpu time spent up to now is 70.9 secs Computing kpt #: 415 total cpu time spent up to now is 71.1 secs Computing kpt #: 416 total cpu time spent up to now is 71.2 secs Computing kpt #: 417 total cpu time spent up to now is 71.4 secs Computing kpt #: 418 total cpu time spent up to now is 71.6 secs Computing kpt #: 419 total cpu time spent up to now is 71.8 secs Computing kpt #: 420 total cpu time spent up to now is 71.9 secs Computing kpt #: 421 total cpu time spent up to now is 72.1 secs Computing kpt #: 422 total cpu time spent up to now is 72.3 secs Computing kpt #: 423 total cpu time spent up to now is 72.5 secs Computing kpt #: 424 total cpu time spent up to now is 72.7 secs Computing kpt #: 425 total cpu time spent up to now is 72.9 secs Computing kpt #: 426 total cpu time spent up to now is 73.1 secs Computing kpt #: 427 total cpu time spent up to now is 73.2 secs Computing kpt #: 428 total cpu time spent up to now is 73.4 secs Computing kpt #: 429 total cpu time spent up to now is 73.6 secs Computing kpt #: 430 total cpu time spent up to now is 73.8 secs Computing kpt #: 431 total cpu time spent up to now is 74.0 secs Computing kpt #: 432 total cpu time spent up to now is 74.2 secs Computing kpt #: 433 total cpu time spent up to now is 74.4 secs Computing kpt #: 434 total cpu time spent up to now is 74.6 secs Computing kpt #: 435 total cpu time spent up to now is 74.7 secs Computing kpt #: 436 total cpu time spent up to now is 74.9 secs Computing kpt #: 437 total cpu time spent up to now is 75.2 secs Computing kpt #: 438 total cpu time spent up to now is 75.4 secs Computing kpt #: 439 total cpu time spent up to now is 75.6 secs Computing kpt #: 440 total cpu time spent up to now is 75.8 secs Computing kpt #: 441 total cpu time spent up to now is 76.0 secs Computing kpt #: 442 total cpu time spent up to now is 76.3 secs Computing kpt #: 443 total cpu time spent up to now is 76.5 secs Computing kpt #: 444 total cpu time spent up to now is 76.7 secs Computing kpt #: 445 total cpu time spent up to now is 77.0 secs Computing kpt #: 446 total cpu time spent up to now is 77.2 secs Computing kpt #: 447 total cpu time spent up to now is 77.5 secs Computing kpt #: 448 total cpu time spent up to now is 77.8 secs Computing kpt #: 449 total cpu time spent up to now is 78.1 secs Computing kpt #: 450 total cpu time spent up to now is 78.4 secs Computing kpt #: 451 total cpu time spent up to now is 78.7 secs ethr = 3.33E-08, avg # of iterations = 17.4 total cpu time spent up to now is 78.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1413 PWs) bands (ev): -41.4213 -41.4213 -40.9224 -40.9224 -17.7056 -17.7056 -16.5516 -16.5516 -15.0112 -15.0112 -14.2690 -14.2690 -13.9005 -13.9005 -13.5138 -13.5138 9.3350 9.3350 14.3299 14.3299 14.9077 14.9077 16.2537 16.2537 17.8264 17.8264 17.9338 17.9338 18.3950 18.3950 18.4268 18.4268 19.5657 19.5657 19.7470 19.7470 23.7988 23.7988 k = 0.0081 0.0047-0.0000 ( 1421 PWs) bands (ev): -41.4216 -41.4216 -40.9223 -40.9223 -17.7055 -17.7055 -16.5519 -16.5519 -15.0114 -15.0114 -14.2695 -14.2695 -13.9008 -13.9008 -13.5140 -13.5140 9.3370 9.3370 14.3247 14.3247 14.9083 14.9083 16.2561 16.2561 17.8282 17.8282 17.9362 17.9362 18.3948 18.3948 18.4272 18.4272 19.5657 19.5657 19.7471 19.7471 23.7979 23.7979 k = 0.0161 0.0093-0.0000 ( 1413 PWs) bands (ev): -41.4210 -41.4210 -40.9221 -40.9221 -17.7054 -17.7054 -16.5524 -16.5524 -15.0119 -15.0119 -14.2704 -14.2704 -13.9017 -13.9017 -13.5140 -13.5140 9.3428 9.3428 14.3094 14.3094 14.9101 14.9101 16.2634 16.2634 17.8331 17.8331 17.9431 17.9431 18.3945 18.3945 18.4289 18.4289 19.5658 19.5658 19.7477 19.7477 23.7951 23.7951 k = 0.0242 0.0140-0.0000 ( 1413 PWs) bands (ev): -41.4207 -41.4207 -40.9218 -40.9218 -17.7053 -17.7053 -16.5536 -16.5536 -15.0128 -15.0128 -14.2722 -14.2722 -13.9032 -13.9032 -13.5143 -13.5143 9.3524 9.3524 14.2843 14.2843 14.9132 14.9132 16.2754 16.2754 17.8405 17.8405 17.9536 17.9536 18.3944 18.3944 18.4329 18.4329 19.5654 19.5654 19.7491 19.7491 23.7903 23.7903 k = 0.0323 0.0186-0.0000 ( 1419 PWs) bands (ev): -41.4205 -41.4205 -40.9214 -40.9214 -17.7051 -17.7051 -16.5553 -16.5553 -15.0141 -15.0141 -14.2748 -14.2748 -13.9052 -13.9052 -13.5146 -13.5146 9.3659 9.3659 14.2499 14.2499 14.9174 14.9174 16.2922 16.2922 17.8492 17.8492 17.9661 17.9661 18.3946 18.3946 18.4414 18.4414 19.5637 19.5637 19.7523 19.7523 23.7834 23.7834 k = 0.0403 0.0233-0.0000 ( 1423 PWs) bands (ev): -41.4199 -41.4199 -40.9211 -40.9211 -17.7049 -17.7049 -16.5573 -16.5573 -15.0158 -15.0158 -14.2780 -14.2780 -13.9080 -13.9080 -13.5150 -13.5150 9.3833 9.3833 14.2069 14.2069 14.9228 14.9228 16.3137 16.3137 17.8576 17.8576 17.9783 17.9783 18.3951 18.3951 18.4577 18.4577 19.5599 19.5599 19.7583 19.7583 23.7741 23.7741 k = 0.0484 0.0279-0.0000 ( 1423 PWs) bands (ev): -41.4191 -41.4191 -40.9204 -40.9204 -17.7046 -17.7046 -16.5598 -16.5598 -15.0177 -15.0177 -14.2819 -14.2819 -13.9112 -13.9112 -13.5154 -13.5154 9.4043 9.4043 14.1561 14.1561 14.9294 14.9294 16.3399 16.3399 17.8641 17.8641 17.9882 17.9882 18.3957 18.3957 18.4851 18.4851 19.5530 19.5530 19.7681 19.7681 23.7623 23.7623 k = 0.0565 0.0326-0.0000 ( 1423 PWs) bands (ev): -41.4183 -41.4183 -40.9197 -40.9197 -17.7042 -17.7042 -16.5627 -16.5627 -15.0201 -15.0201 -14.2865 -14.2865 -13.9150 -13.9150 -13.5159 -13.5159 9.4292 9.4292 14.0983 14.0983 14.9371 14.9371 16.3707 16.3707 17.8660 17.8660 17.9952 17.9952 18.3967 18.3967 18.5261 18.5261 19.5426 19.5426 19.7822 19.7822 23.7476 23.7476 k = 0.0645 0.0372-0.0000 ( 1423 PWs) bands (ev): -41.4173 -41.4173 -40.9188 -40.9188 -17.7038 -17.7038 -16.5661 -16.5661 -15.0227 -15.0227 -14.2918 -14.2918 -13.9194 -13.9194 -13.5165 -13.5165 9.4577 9.4577 14.0344 14.0344 14.9460 14.9460 16.4059 16.4059 17.8600 17.8600 18.0009 18.0009 18.3987 18.3987 18.5809 18.5809 19.5287 19.5287 19.8011 19.8011 23.7300 23.7300 k = 0.0726 0.0419-0.0000 ( 1423 PWs) bands (ev): -41.4162 -41.4162 -40.9178 -40.9178 -17.7034 -17.7034 -16.5699 -16.5699 -15.0257 -15.0257 -14.2977 -14.2977 -13.9242 -13.9242 -13.5171 -13.5171 9.4898 9.4898 13.9652 13.9652 14.9559 14.9559 16.4455 16.4455 17.8438 17.8438 18.0072 18.0072 18.4025 18.4025 18.6487 18.6487 19.5114 19.5114 19.8246 19.8246 23.7093 23.7093 k = 0.0806 0.0466-0.0000 ( 1423 PWs) bands (ev): -41.4150 -41.4150 -40.9167 -40.9167 -17.7029 -17.7029 -16.5741 -16.5741 -15.0291 -15.0291 -14.3043 -14.3043 -13.9296 -13.9296 -13.5178 -13.5178 9.5255 9.5255 13.8916 13.8916 14.9669 14.9669 16.4893 16.4893 17.8167 17.8167 18.0148 18.0148 18.4093 18.4093 18.7276 18.7276 19.4913 19.4913 19.8525 19.8525 23.6855 23.6855 k = 0.0887 0.0512-0.0000 ( 1423 PWs) bands (ev): -41.4136 -41.4136 -40.9155 -40.9155 -17.7024 -17.7024 -16.5788 -16.5788 -15.0327 -15.0327 -14.3114 -14.3114 -13.9355 -13.9355 -13.5185 -13.5185 9.5647 9.5647 13.8142 13.8142 14.9789 14.9789 16.5371 16.5371 17.7799 17.7799 18.0229 18.0229 18.4200 18.4200 18.8158 18.8158 19.4690 19.4690 19.8847 19.8847 23.6588 23.6588 k = 0.0968 0.0559-0.0000 ( 1421 PWs) bands (ev): -41.4122 -41.4122 -40.9141 -40.9141 -17.7018 -17.7018 -16.5838 -16.5838 -15.0366 -15.0366 -14.3192 -14.3192 -13.9417 -13.9417 -13.5193 -13.5193 9.6073 9.6073 13.7337 13.7337 14.9919 14.9919 16.5888 16.5888 17.7351 17.7351 18.0299 18.0299 18.4358 18.4358 18.9115 18.9115 19.4451 19.4451 19.9208 19.9208 23.6293 23.6293 k = 0.1048 0.0605-0.0000 ( 1421 PWs) bands (ev): -41.4106 -41.4106 -40.9127 -40.9127 -17.7012 -17.7012 -16.5893 -16.5893 -15.0409 -15.0409 -14.3276 -14.3276 -13.9485 -13.9485 -13.5201 -13.5201 9.6532 9.6532 13.6509 13.6509 15.0057 15.0057 16.6440 16.6440 17.6839 17.6839 18.0344 18.0344 18.4576 18.4576 19.0127 19.0127 19.4207 19.4207 19.9608 19.9608 23.5972 23.5972 k = 0.1129 0.0652-0.0000 ( 1421 PWs) bands (ev): -41.4089 -41.4089 -40.9112 -40.9112 -17.7006 -17.7006 -16.5951 -16.5951 -15.0455 -15.0455 -14.3364 -14.3364 -13.9557 -13.9557 -13.5209 -13.5209 9.7024 9.7024 13.5663 13.5663 15.0205 15.0205 16.7025 16.7025 17.6275 17.6275 18.0355 18.0355 18.4860 18.4860 19.1169 19.1169 19.3977 19.3977 20.0044 20.0044 23.5627 23.5627 k = 0.1210 0.0698-0.0000 ( 1417 PWs) bands (ev): -41.4071 -41.4071 -40.9094 -40.9094 -17.6999 -17.6999 -16.6013 -16.6013 -15.0503 -15.0503 -14.3459 -14.3459 -13.9632 -13.9632 -13.5218 -13.5218 9.7546 9.7546 13.4803 13.4803 15.0360 15.0360 16.7640 16.7640 17.5668 17.5668 18.0329 18.0329 18.5210 18.5210 19.2176 19.2176 19.3821 19.3821 20.0514 20.0514 23.5260 23.5260 k = 0.1290 0.0745-0.0000 ( 1407 PWs) bands (ev): -41.4050 -41.4050 -40.9076 -40.9076 -17.6992 -17.6992 -16.6078 -16.6078 -15.0554 -15.0554 -14.3556 -14.3556 -13.9711 -13.9711 -13.5226 -13.5226 9.8098 9.8098 13.3936 13.3936 15.0522 15.0522 16.8280 16.8280 17.5026 17.5026 18.0266 18.0266 18.5626 18.5626 19.2831 19.2831 19.4055 19.4055 20.1018 20.1018 23.4873 23.4873 k = 0.1371 0.0792-0.0000 ( 1411 PWs) bands (ev): -41.4030 -41.4030 -40.9060 -40.9060 -17.6985 -17.6985 -16.6147 -16.6147 -15.0609 -15.0609 -14.3660 -14.3660 -13.9795 -13.9795 -13.5235 -13.5235 9.8678 9.8678 13.3064 13.3064 15.0691 15.0691 16.8940 16.8940 17.4356 17.4356 18.0170 18.0170 18.6103 18.6103 19.2849 19.2849 19.4962 19.4962 20.1554 20.1554 23.4468 23.4468 k = 0.1452 0.0838-0.0000 ( 1411 PWs) bands (ev): -41.4010 -41.4010 -40.9042 -40.9042 -17.6978 -17.6978 -16.6219 -16.6219 -15.0666 -15.0666 -14.3768 -14.3768 -13.9881 -13.9881 -13.5244 -13.5244 9.9285 9.9285 13.2193 13.2193 15.0866 15.0866 16.9613 16.9613 17.3662 17.3662 18.0045 18.0045 18.6637 18.6637 19.2681 19.2681 19.6093 19.6093 20.2122 20.2122 23.4048 23.4048 k = 0.1532 0.0885-0.0000 ( 1411 PWs) bands (ev): -41.3988 -41.3988 -40.9022 -40.9022 -17.6971 -17.6971 -16.6295 -16.6295 -15.0725 -15.0725 -14.3879 -14.3879 -13.9970 -13.9970 -13.5253 -13.5253 9.9917 9.9917 13.1326 13.1326 15.1046 15.1046 17.0294 17.0294 17.2950 17.2950 17.9895 17.9895 18.7223 18.7223 19.2495 19.2495 19.7281 19.7281 20.2720 20.2720 23.3614 23.3614 k = 0.1613 0.0931-0.0000 ( 1411 PWs) bands (ev): -41.3966 -41.3966 -40.9003 -40.9003 -17.6963 -17.6963 -16.6374 -16.6374 -15.0787 -15.0787 -14.3995 -14.3995 -14.0062 -14.0062 -13.5262 -13.5262 10.0572 10.0572 13.0467 13.0467 15.1230 15.1230 17.0972 17.0972 17.2224 17.2224 17.9725 17.9725 18.7856 18.7856 19.2331 19.2331 19.8491 19.8491 20.3347 20.3347 23.3168 23.3168 k = 0.1694 0.0978-0.0000 ( 1413 PWs) bands (ev): -41.3943 -41.3943 -40.8983 -40.8983 -17.6956 -17.6956 -16.6456 -16.6456 -15.0851 -15.0851 -14.4113 -14.4113 -14.0156 -14.0156 -13.5271 -13.5271 10.1247 10.1247 12.9618 12.9618 15.1417 15.1417 17.1458 17.1458 17.1667 17.1667 17.9538 17.9538 18.8534 18.8534 19.2209 19.2209 19.9709 19.9709 20.4004 20.4004 23.2711 23.2711 k = 0.1774 0.1024-0.0000 ( 1419 PWs) bands (ev): -41.3922 -41.3922 -40.8962 -40.8962 -17.6949 -17.6949 -16.6541 -16.6541 -15.0917 -15.0917 -14.4235 -14.4235 -14.0252 -14.0252 -13.5281 -13.5281 10.1942 10.1942 12.8785 12.8785 15.1606 15.1606 17.0730 17.0730 17.2292 17.2292 17.9338 17.9338 18.9252 18.9252 19.2143 19.2143 20.0926 20.0926 20.4688 20.4688 23.2246 23.2246 k = 0.1855 0.1071-0.0000 ( 1419 PWs) bands (ev): -41.3898 -41.3898 -40.8940 -40.8940 -17.6943 -17.6943 -16.6628 -16.6628 -15.0984 -15.0984 -14.4359 -14.4359 -14.0349 -14.0349 -13.5290 -13.5290 10.2652 10.2652 12.7970 12.7970 15.1796 15.1796 16.9979 16.9979 17.2901 17.2901 17.9127 17.9127 19.0009 19.0009 19.2149 19.2149 20.2138 20.2138 20.5400 20.5400 23.1775 23.1775 k = 0.1935 0.1117-0.0000 ( 1423 PWs) bands (ev): -41.3873 -41.3873 -40.8920 -40.8920 -17.6936 -17.6936 -16.6717 -16.6717 -15.1054 -15.1054 -14.4485 -14.4485 -14.0448 -14.0448 -13.5298 -13.5298 10.3374 10.3374 12.7177 12.7177 15.1985 15.1985 16.9223 16.9223 17.3464 17.3464 17.8908 17.8908 19.0803 19.0803 19.2241 19.2241 20.3336 20.3336 20.6138 20.6138 23.1297 23.1297 k = 0.2016 0.1164-0.0000 ( 1427 PWs) bands (ev): -41.3848 -41.3848 -40.8899 -40.8899 -17.6929 -17.6929 -16.6809 -16.6809 -15.1126 -15.1126 -14.4613 -14.4613 -14.0548 -14.0548 -13.5306 -13.5306 10.4105 10.4105 12.6410 12.6410 15.2173 15.2173 16.8467 16.8467 17.3965 17.3965 17.8683 17.8683 19.1630 19.1630 19.2435 19.2435 20.4517 20.4517 20.6902 20.6902 23.0816 23.0816 k = 0.2097 0.1211-0.0000 ( 1427 PWs) bands (ev): -41.3823 -41.3823 -40.8876 -40.8876 -17.6923 -17.6923 -16.6902 -16.6902 -15.1198 -15.1198 -14.4742 -14.4742 -14.0649 -14.0649 -13.5314 -13.5314 10.4840 10.4840 12.5674 12.5674 15.2358 15.2358 16.7713 16.7713 17.4392 17.4392 17.8455 17.8455 19.2490 19.2490 19.2741 19.2741 20.5675 20.5675 20.7692 20.7692 23.0333 23.0333 k = 0.2177 0.1257-0.0000 ( 1423 PWs) bands (ev): -41.3797 -41.3797 -40.8852 -40.8852 -17.6916 -17.6916 -16.6997 -16.6997 -15.1271 -15.1271 -14.4872 -14.4872 -14.0749 -14.0749 -13.5321 -13.5321 10.5573 10.5573 12.4975 12.4975 15.2539 15.2539 16.6963 16.6963 17.4738 17.4738 17.8223 17.8223 19.3171 19.3171 19.3381 19.3381 20.6805 20.6805 20.8507 20.8507 22.9849 22.9849 k = 0.2258 0.1304-0.0000 ( 1423 PWs) bands (ev): -41.3770 -41.3770 -40.8828 -40.8828 -17.6909 -17.6909 -16.7094 -16.7094 -15.1345 -15.1345 -14.5003 -14.5003 -14.0850 -14.0850 -13.5329 -13.5329 10.6298 10.6298 12.4320 12.4320 15.2713 15.2713 16.6218 16.6218 17.4995 17.4995 17.7991 17.7991 19.3731 19.3731 19.4300 19.4300 20.7904 20.7904 20.9347 20.9347 22.9365 22.9365 k = 0.2339 0.1350-0.0000 ( 1427 PWs) bands (ev): -41.3746 -41.3746 -40.8804 -40.8804 -17.6903 -17.6903 -16.7192 -16.7192 -15.1420 -15.1420 -14.5135 -14.5135 -14.0951 -14.0951 -13.5336 -13.5336 10.7006 10.7006 12.3715 12.3715 15.2880 15.2880 16.5481 16.5481 17.5163 17.5163 17.7758 17.7758 19.4424 19.4424 19.5246 19.5246 20.8967 20.8967 21.0209 21.0209 22.8883 22.8883 k = 0.2419 0.1397-0.0000 ( 1431 PWs) bands (ev): -41.3719 -41.3719 -40.8782 -40.8782 -17.6899 -17.6899 -16.7291 -16.7291 -15.1496 -15.1496 -14.5267 -14.5267 -14.1052 -14.1052 -13.5343 -13.5343 10.7688 10.7688 12.3171 12.3171 15.3038 15.3038 16.4754 16.4754 17.5246 17.5246 17.7525 17.7525 19.5246 19.5246 19.6219 19.6219 20.9994 20.9994 21.1090 21.1090 22.8403 22.8403 k = 0.2500 0.1443-0.0000 ( 1429 PWs) bands (ev): -41.3692 -41.3692 -40.8759 -40.8759 -17.6893 -17.6893 -16.7390 -16.7390 -15.1572 -15.1572 -14.5397 -14.5397 -14.1151 -14.1151 -13.5349 -13.5349 10.8331 10.8331 12.2700 12.2700 15.3184 15.3184 16.4038 16.4038 17.5252 17.5252 17.7291 17.7291 19.6193 19.6193 19.7215 19.7215 21.0987 21.0987 21.1985 21.1985 22.7928 22.7928 k = 0.2581 0.1490-0.0000 ( 1431 PWs) bands (ev): -41.3666 -41.3666 -40.8735 -40.8735 -17.6888 -17.6888 -16.7491 -16.7491 -15.1649 -15.1649 -14.5528 -14.5528 -14.1250 -14.1250 -13.5355 -13.5355 10.8920 10.8920 12.2315 12.2315 15.3317 15.3317 16.3334 16.3334 17.5190 17.5190 17.7055 17.7055 19.7256 19.7256 19.8234 19.8234 21.1950 21.1950 21.2886 21.2886 22.7458 22.7458 k = 0.2661 0.1536-0.0000 ( 1435 PWs) bands (ev): -41.3641 -41.3641 -40.8711 -40.8711 -17.6883 -17.6883 -16.7592 -16.7592 -15.1725 -15.1725 -14.5657 -14.5657 -14.1348 -14.1348 -13.5361 -13.5361 10.9439 10.9439 12.2033 12.2033 15.3434 15.3434 16.2646 16.2646 17.5072 17.5072 17.6815 17.6815 19.8427 19.8427 19.9274 19.9274 21.2887 21.2887 21.3786 21.3786 22.6995 22.6995 k = 0.2742 0.1583-0.0000 ( 1439 PWs) bands (ev): -41.3616 -41.3616 -40.8687 -40.8687 -17.6878 -17.6878 -16.7693 -16.7693 -15.1801 -15.1801 -14.5786 -14.5786 -14.1445 -14.1445 -13.5366 -13.5366 10.9873 10.9873 12.1868 12.1868 15.3533 15.3533 16.1974 16.1974 17.4909 17.4909 17.6573 17.6573 19.9695 19.9695 20.0332 20.0332 21.3802 21.3802 21.4680 21.4680 22.6538 22.6538 k = 0.2823 0.1630-0.0000 ( 1439 PWs) bands (ev): -41.3590 -41.3590 -40.8664 -40.8664 -17.6874 -17.6874 -16.7793 -16.7793 -15.1877 -15.1877 -14.5912 -14.5912 -14.1539 -14.1539 -13.5371 -13.5371 11.0205 11.0205 12.1835 12.1835 15.3612 15.3612 16.1321 16.1321 17.4710 17.4710 17.6327 17.6327 20.1052 20.1052 20.1408 20.1408 21.4694 21.4694 21.5566 21.5566 22.6091 22.6091 k = 0.2903 0.1676-0.0000 ( 1439 PWs) bands (ev): -41.3564 -41.3564 -40.8640 -40.8640 -17.6870 -17.6870 -16.7892 -16.7892 -15.1952 -15.1952 -14.6036 -14.6036 -14.1632 -14.1632 -13.5376 -13.5376 11.0428 11.0428 12.1942 12.1942 15.3666 15.3666 16.0690 16.0690 17.4484 17.4484 17.6079 17.6079 20.2465 20.2465 20.2524 20.2524 21.5562 21.5562 21.6445 21.6445 22.5653 22.5653 k = 0.2984 0.1723-0.0000 ( 1441 PWs) bands (ev): -41.3538 -41.3538 -40.8618 -40.8618 -17.6867 -17.6867 -16.7990 -16.7990 -15.2026 -15.2026 -14.6157 -14.6157 -14.1723 -14.1723 -13.5380 -13.5380 11.0540 11.0540 12.2189 12.2189 15.3692 15.3692 16.0083 16.0083 17.4236 17.4236 17.5831 17.5831 20.3597 20.3597 20.4005 20.4005 21.6402 21.6402 21.7320 21.7320 22.5225 22.5225 k = 0.3065 0.1769-0.0000 ( 1447 PWs) bands (ev): -41.3513 -41.3513 -40.8597 -40.8597 -17.6865 -17.6865 -16.8088 -16.8088 -15.2100 -15.2100 -14.6276 -14.6276 -14.1813 -14.1813 -13.5385 -13.5385 11.0547 11.0547 12.2568 12.2568 15.3686 15.3686 15.9504 15.9504 17.3973 17.3973 17.5584 17.5584 20.4711 20.4711 20.5580 20.5580 21.7212 21.7212 21.8194 21.8194 22.4809 22.4809 k = 0.3145 0.1816-0.0000 ( 1441 PWs) bands (ev): -41.3487 -41.3487 -40.8573 -40.8573 -17.6861 -17.6861 -16.8183 -16.8183 -15.2171 -15.2171 -14.6392 -14.6392 -14.1899 -14.1899 -13.5388 -13.5388 11.0464 11.0464 12.3065 12.3065 15.3643 15.3643 15.8957 15.8957 17.3698 17.3698 17.5340 17.5340 20.5832 20.5832 20.7215 20.7215 21.7990 21.7990 21.9070 21.9070 22.4406 22.4406 k = 0.3226 0.1862-0.0000 ( 1437 PWs) bands (ev): -41.3463 -41.3463 -40.8549 -40.8549 -17.6858 -17.6858 -16.8278 -16.8278 -15.2241 -15.2241 -14.6505 -14.6505 -14.1981 -14.1981 -13.5392 -13.5392 11.0308 11.0308 12.3662 12.3662 15.3558 15.3558 15.8446 15.8446 17.3416 17.3416 17.5101 17.5101 20.6958 20.6958 20.8904 20.8904 21.8737 21.8737 21.9947 21.9947 22.4016 22.4016 k = 0.3306 0.1909-0.0000 ( 1437 PWs) bands (ev): -41.3439 -41.3439 -40.8528 -40.8528 -17.6856 -17.6856 -16.8370 -16.8370 -15.2310 -15.2310 -14.6615 -14.6615 -14.2062 -14.2062 -13.5395 -13.5395 11.0095 11.0095 12.4340 12.4340 15.3424 15.3424 15.7978 15.7978 17.3130 17.3130 17.4868 17.4868 20.8086 20.8086 21.0640 21.0640 21.9457 21.9457 22.0822 22.0822 22.3643 22.3643 k = 0.3387 0.1956-0.0000 ( 1433 PWs) bands (ev): -41.3416 -41.3416 -40.8506 -40.8506 -17.6854 -17.6854 -16.8460 -16.8460 -15.2376 -15.2376 -14.6721 -14.6721 -14.2139 -14.2139 -13.5398 -13.5398 10.9842 10.9842 12.5082 12.5082 15.3238 15.3238 15.7554 15.7554 17.2842 17.2842 17.4642 17.4642 20.9213 20.9213 21.2417 21.2417 22.0155 22.0155 22.1692 22.1692 22.3290 22.3290 k = 0.3468 0.2002-0.0000 ( 1437 PWs) bands (ev): -41.3395 -41.3395 -40.8486 -40.8486 -17.6853 -17.6853 -16.8549 -16.8549 -15.2441 -15.2441 -14.6823 -14.6823 -14.2214 -14.2214 -13.5400 -13.5400 10.9561 10.9561 12.5875 12.5875 15.2996 15.2996 15.7179 15.7179 17.2555 17.2555 17.4424 17.4424 21.0335 21.0335 21.4229 21.4229 22.0830 22.0830 22.2541 22.2541 22.2974 22.2974 k = 0.3548 0.2049-0.0000 ( 1437 PWs) bands (ev): -41.3374 -41.3374 -40.8466 -40.8466 -17.6852 -17.6852 -16.8633 -16.8633 -15.2504 -15.2504 -14.6921 -14.6921 -14.2286 -14.2286 -13.5403 -13.5403 10.9263 10.9263 12.6707 12.6707 15.2699 15.2699 15.6851 15.6851 17.2272 17.2272 17.4215 17.4215 21.1449 21.1449 21.6064 21.6064 22.1469 22.1469 22.2671 22.2671 22.3419 22.3419 k = 0.3629 0.2095-0.0000 ( 1439 PWs) bands (ev): -41.3354 -41.3354 -40.8448 -40.8448 -17.6851 -17.6851 -16.8715 -16.8715 -15.2565 -15.2565 -14.7016 -14.7016 -14.2354 -14.2354 -13.5405 -13.5405 10.8957 10.8957 12.7567 12.7567 15.2349 15.2349 15.6566 15.6566 17.1995 17.1995 17.4016 17.4016 21.2550 21.2550 21.7903 21.7903 22.1904 22.1904 22.2640 22.2640 22.4249 22.4249 k = 0.3710 0.2142-0.0000 ( 1439 PWs) bands (ev): -41.3334 -41.3334 -40.8430 -40.8430 -17.6851 -17.6851 -16.8794 -16.8794 -15.2623 -15.2623 -14.7105 -14.7105 -14.2419 -14.2419 -13.5407 -13.5407 10.8651 10.8651 12.8448 12.8448 15.1952 15.1952 15.6320 15.6320 17.1725 17.1725 17.3826 17.3826 21.3634 21.3634 21.9703 21.9703 22.1845 22.1845 22.3177 22.3177 22.5065 22.5065 k = 0.3790 0.2188-0.0000 ( 1435 PWs) bands (ev): -41.3315 -41.3315 -40.8411 -40.8411 -17.6850 -17.6850 -16.8869 -16.8869 -15.2677 -15.2677 -14.7190 -14.7190 -14.2480 -14.2480 -13.5409 -13.5409 10.8348 10.8348 12.9344 12.9344 15.1516 15.1516 15.6104 15.6104 17.1465 17.1465 17.3646 17.3646 21.4695 21.4695 22.1217 22.1217 22.1803 22.1803 22.4017 22.4017 22.5867 22.5867 k = 0.3871 0.2235-0.0000 ( 1433 PWs) bands (ev): -41.3297 -41.3297 -40.8394 -40.8394 -17.6849 -17.6849 -16.8941 -16.8941 -15.2729 -15.2729 -14.7270 -14.7270 -14.2538 -14.2538 -13.5410 -13.5410 10.8053 10.8053 13.0249 13.0249 15.1046 15.1046 15.5912 15.5912 17.1216 17.1216 17.3477 17.3477 21.5728 21.5728 22.1276 22.1276 22.2917 22.2917 22.5172 22.5172 22.6666 22.6666 k = 0.3952 0.2281-0.0000 ( 1429 PWs) bands (ev): -41.3278 -41.3278 -40.8379 -40.8379 -17.6850 -17.6850 -16.9007 -16.9007 -15.2778 -15.2778 -14.7344 -14.7344 -14.2592 -14.2592 -13.5411 -13.5411 10.7769 10.7769 13.1159 13.1159 15.0548 15.0548 15.5739 15.5739 17.0979 17.0979 17.3318 17.3318 21.6724 21.6724 22.1067 22.1067 22.3932 22.3932 22.6613 22.6613 22.7558 22.7558 k = 0.4032 0.2328-0.0000 ( 1429 PWs) bands (ev): -41.3262 -41.3262 -40.8365 -40.8365 -17.6850 -17.6850 -16.9071 -16.9071 -15.2825 -15.2825 -14.7414 -14.7414 -14.2643 -14.2643 -13.5413 -13.5413 10.7500 10.7500 13.2071 13.2071 15.0026 15.0026 15.5581 15.5581 17.0756 17.0756 17.3170 17.3170 21.7673 21.7673 22.0867 22.0867 22.4726 22.4726 22.7746 22.7746 22.8978 22.8978 k = 0.4113 0.2375-0.0000 ( 1428 PWs) bands (ev): -41.3247 -41.3247 -40.8351 -40.8351 -17.6850 -17.6850 -16.9130 -16.9130 -15.2868 -15.2868 -14.7479 -14.7479 -14.2689 -14.2689 -13.5414 -13.5414 10.7246 10.7246 13.2980 13.2980 14.9482 14.9482 15.5436 15.5436 17.0547 17.0547 17.3033 17.3033 21.8553 21.8553 22.0704 22.0704 22.5418 22.5418 22.8494 22.8494 23.0866 23.0866 k = 0.4194 0.2421-0.0000 ( 1424 PWs) bands (ev): -41.3233 -41.3233 -40.8337 -40.8337 -17.6850 -17.6850 -16.9184 -16.9184 -15.2908 -15.2908 -14.7539 -14.7539 -14.2731 -14.2731 -13.5414 -13.5414 10.7011 10.7011 13.3886 13.3886 14.8920 14.8920 15.5301 15.5301 17.0353 17.0353 17.2907 17.2907 21.9304 21.9304 22.0638 22.0638 22.6054 22.6054 22.9127 22.9127 23.2887 23.2887 k = 0.4274 0.2468-0.0000 ( 1420 PWs) bands (ev): -41.3220 -41.3220 -40.8324 -40.8324 -17.6850 -17.6850 -16.9234 -16.9234 -15.2943 -15.2943 -14.7593 -14.7593 -14.2770 -14.2770 -13.5415 -13.5415 10.6795 10.6795 13.4784 13.4784 14.8338 14.8338 15.5176 15.5176 17.0176 17.0176 17.2793 17.2793 21.9738 21.9738 22.0850 22.0850 22.6653 22.6653 22.9693 22.9693 23.4906 23.4906 k = 0.4355 0.2514-0.0000 ( 1420 PWs) bands (ev): -41.3209 -41.3209 -40.8314 -40.8314 -17.6850 -17.6850 -16.9279 -16.9279 -15.2976 -15.2976 -14.7642 -14.7642 -14.2805 -14.2805 -13.5416 -13.5416 10.6599 10.6599 13.5673 13.5673 14.7739 14.7739 15.5061 15.5061 17.0016 17.0016 17.2691 17.2691 21.9797 21.9797 22.1392 22.1392 22.7216 22.7216 23.0202 23.0202 23.4935 23.4935 k = 0.4435 0.2561-0.0000 ( 1428 PWs) bands (ev): -41.3203 -41.3203 -40.8305 -40.8305 -17.6851 -17.6851 -16.9321 -16.9321 -15.3005 -15.3005 -14.7686 -14.7686 -14.2836 -14.2836 -13.5417 -13.5417 10.6424 10.6424 13.6551 13.6551 14.7123 14.7123 15.4958 15.4958 16.9873 16.9873 17.2600 17.2600 21.9728 21.9728 22.2012 22.2012 22.7740 22.7740 23.0653 23.0653 23.4916 23.4916 k = 0.4516 0.2607-0.0000 ( 1432 PWs) bands (ev): -41.3196 -41.3196 -40.8298 -40.8298 -17.6851 -17.6851 -16.9357 -16.9357 -15.3030 -15.3030 -14.7724 -14.7724 -14.2863 -14.2863 -13.5419 -13.5419 10.6271 10.6271 13.7417 13.7417 14.6487 14.6487 15.4865 15.4865 16.9749 16.9749 17.2521 17.2521 21.9635 21.9635 22.2599 22.2599 22.8220 22.8220 23.1046 23.1046 23.4903 23.4903 k = 0.4597 0.2654-0.0000 ( 1432 PWs) bands (ev): -41.3188 -41.3188 -40.8291 -40.8291 -17.6852 -17.6852 -16.9387 -16.9387 -15.3052 -15.3052 -14.7756 -14.7756 -14.2885 -14.2885 -13.5419 -13.5419 10.6141 10.6141 13.8269 13.8269 14.5834 14.5834 15.4785 15.4785 16.9642 16.9642 17.2454 17.2454 21.9546 21.9546 22.3119 22.3119 22.8648 22.8648 23.1378 23.1378 23.4896 23.4896 k = 0.4677 0.2701-0.0000 ( 1432 PWs) bands (ev): -41.3182 -41.3182 -40.8285 -40.8285 -17.6852 -17.6852 -16.9411 -16.9411 -15.3070 -15.3070 -14.7783 -14.7783 -14.2904 -14.2904 -13.5419 -13.5419 10.6034 10.6034 13.9105 13.9105 14.5162 14.5162 15.4718 15.4718 16.9555 16.9555 17.2399 17.2399 21.9468 21.9468 22.3559 22.3559 22.9015 22.9015 23.1650 23.1650 23.4893 23.4893 k = 0.4758 0.2747-0.0000 ( 1430 PWs) bands (ev): -41.3178 -41.3178 -40.8280 -40.8280 -17.6852 -17.6852 -16.9430 -16.9430 -15.3083 -15.3083 -14.7803 -14.7803 -14.2919 -14.2919 -13.5420 -13.5420 10.5950 10.5950 13.9926 13.9926 14.4471 14.4471 15.4665 15.4665 16.9487 16.9487 17.2356 17.2356 21.9406 21.9406 22.3908 22.3908 22.9313 22.9313 23.1860 23.1860 23.4893 23.4893 k = 0.4839 0.2794-0.0000 ( 1430 PWs) bands (ev): -41.3174 -41.3174 -40.8277 -40.8277 -17.6852 -17.6852 -16.9444 -16.9444 -15.3093 -15.3093 -14.7818 -14.7818 -14.2929 -14.2929 -13.5420 -13.5420 10.5890 10.5890 14.0729 14.0729 14.3761 14.3761 15.4626 15.4626 16.9438 16.9438 17.2326 17.2326 21.9361 21.9361 22.4162 22.4162 22.9532 22.9532 23.2010 23.2010 23.4895 23.4895 k = 0.4919 0.2840-0.0000 ( 1430 PWs) bands (ev): -41.3172 -41.3172 -40.8275 -40.8275 -17.6852 -17.6852 -16.9452 -16.9452 -15.3099 -15.3099 -14.7826 -14.7826 -14.2935 -14.2935 -13.5420 -13.5420 10.5854 10.5854 14.1514 14.1514 14.3033 14.3033 15.4603 15.4603 16.9409 16.9409 17.2307 17.2307 21.9334 21.9334 22.4316 22.4316 22.9667 22.9667 23.2100 23.2100 23.4896 23.4896 k = 0.5000 0.2887-0.0000 ( 1436 PWs) bands (ev): -41.3172 -41.3172 -40.8277 -40.8277 -17.6853 -17.6853 -16.9455 -16.9455 -15.3102 -15.3102 -14.7830 -14.7830 -14.2938 -14.2938 -13.5420 -13.5420 10.5842 10.5842 14.2240 14.2240 14.2326 14.2326 15.4595 15.4595 16.9399 16.9399 17.2301 17.2301 21.9324 21.9324 22.4368 22.4368 22.9712 22.9712 23.2129 23.2129 23.4897 23.4897 k = 0.5000 0.2887-0.0000 ( 1436 PWs) bands (ev): -41.3172 -41.3172 -40.8277 -40.8277 -17.6853 -17.6853 -16.9455 -16.9455 -15.3102 -15.3102 -14.7830 -14.7830 -14.2938 -14.2938 -13.5420 -13.5420 10.5842 10.5842 14.2240 14.2240 14.2326 14.2326 15.4595 15.4595 16.9399 16.9399 17.2301 17.2301 21.9324 21.9324 22.4368 22.4368 22.9712 22.9712 23.2129 23.2129 23.4897 23.4897 k = 0.4954 0.2967-0.0000 ( 1430 PWs) bands (ev): -41.3171 -41.3171 -40.8275 -40.8275 -17.6852 -17.6852 -16.9455 -16.9455 -15.3101 -15.3101 -14.7831 -14.7831 -14.2939 -14.2939 -13.5420 -13.5420 10.5856 10.5856 14.2254 14.2254 14.2296 14.2296 15.4597 15.4597 16.9424 16.9424 17.2286 17.2286 21.9329 21.9329 22.4295 22.4295 22.9869 22.9869 23.1999 23.1999 23.4878 23.4878 k = 0.4907 0.3047-0.0000 ( 1430 PWs) bands (ev): -41.3171 -41.3171 -40.8274 -40.8274 -17.6852 -17.6852 -16.9455 -16.9455 -15.3099 -15.3099 -14.7836 -14.7836 -14.2946 -14.2946 -13.5422 -13.5422 10.5899 10.5899 14.2183 14.2183 14.2321 14.2321 15.4605 15.4605 16.9499 16.9499 17.2240 17.2240 21.9342 21.9342 22.4103 22.4103 23.0309 23.0309 23.1622 23.1622 23.4824 23.4824 k = 0.4861 0.3127-0.0000 ( 1430 PWs) bands (ev): -41.3169 -41.3169 -40.8273 -40.8273 -17.6851 -17.6851 -16.9456 -16.9456 -15.3097 -15.3097 -14.7845 -14.7845 -14.2957 -14.2957 -13.5424 -13.5424 10.5969 10.5969 14.2014 14.2014 14.2412 14.2412 15.4617 15.4617 16.9624 16.9624 17.2164 17.2164 21.9365 21.9365 22.3849 22.3849 23.0815 23.0815 23.1181 23.1181 23.4746 23.4746 k = 0.4815 0.3208-0.0000 ( 1432 PWs) bands (ev): -41.3167 -41.3167 -40.8273 -40.8273 -17.6851 -17.6851 -16.9457 -16.9457 -15.3094 -15.3094 -14.7856 -14.7856 -14.2973 -14.2973 -13.5427 -13.5427 10.6068 10.6068 14.1778 14.1778 14.2542 14.2542 15.4634 15.4634 16.9796 16.9796 17.2060 17.2060 21.9397 21.9397 22.3584 22.3584 23.0150 23.0150 23.1895 23.1895 23.4650 23.4650 k = 0.4769 0.3288-0.0000 ( 1434 PWs) bands (ev): -41.3166 -41.3166 -40.8272 -40.8272 -17.6850 -17.6850 -16.9458 -16.9458 -15.3090 -15.3090 -14.7871 -14.7871 -14.2992 -14.2992 -13.5431 -13.5431 10.6195 10.6195 14.1479 14.1479 14.2708 14.2708 15.4656 15.4656 17.0011 17.0011 17.1931 17.1931 21.9438 21.9438 22.3343 22.3343 22.9199 22.9199 23.2874 23.2874 23.4548 23.4548 k = 0.4722 0.3368-0.0000 ( 1426 PWs) bands (ev): -41.3160 -41.3160 -40.8269 -40.8269 -17.6849 -17.6849 -16.9458 -16.9458 -15.3085 -15.3085 -14.7888 -14.7888 -14.3015 -14.3015 -13.5435 -13.5435 10.6349 10.6349 14.1119 14.1119 14.2911 14.2911 15.4682 15.4682 17.0258 17.0258 17.1789 17.1789 21.9489 21.9489 22.3147 22.3147 22.8128 22.8128 23.3876 23.3876 23.4527 23.4527 k = 0.4676 0.3448-0.0000 ( 1430 PWs) bands (ev): -41.3157 -41.3157 -40.8269 -40.8269 -17.6849 -17.6849 -16.9459 -16.9459 -15.3080 -15.3080 -14.7909 -14.7909 -14.3043 -14.3043 -13.5440 -13.5440 10.6530 10.6530 14.0702 14.0702 14.3149 14.3149 15.4713 15.4713 17.0510 17.0510 17.1661 17.1661 21.9549 21.9549 22.3010 22.3010 22.6973 22.6973 23.4124 23.4124 23.5344 23.5344 k = 0.4630 0.3528-0.0000 ( 1426 PWs) bands (ev): -41.3152 -41.3152 -40.8266 -40.8266 -17.6847 -17.6847 -16.9460 -16.9460 -15.3073 -15.3073 -14.7932 -14.7932 -14.3074 -14.3074 -13.5446 -13.5446 10.6738 10.6738 14.0232 14.0232 14.3421 14.3421 15.4748 15.4748 17.0678 17.0678 17.1634 17.1634 21.9621 21.9621 22.2935 22.2935 22.5762 22.5762 23.3986 23.3986 23.6620 23.6620 k = 0.4583 0.3608-0.0000 ( 1426 PWs) bands (ev): -41.3148 -41.3148 -40.8263 -40.8263 -17.6846 -17.6846 -16.9462 -16.9462 -15.3066 -15.3066 -14.7959 -14.7959 -14.3108 -14.3108 -13.5453 -13.5453 10.6973 10.6973 13.9713 13.9713 14.3728 14.3728 15.4788 15.4788 17.0640 17.0640 17.1832 17.1832 21.9703 21.9703 22.2917 22.2917 22.4522 22.4522 23.3800 23.3800 23.8006 23.8006 k = 0.4537 0.3689-0.0000 ( 1430 PWs) bands (ev): -41.3145 -41.3145 -40.8261 -40.8261 -17.6845 -17.6845 -16.9465 -16.9465 -15.3059 -15.3059 -14.7988 -14.7988 -14.3146 -14.3146 -13.5460 -13.5460 10.7233 10.7233 13.9148 13.9148 14.4067 14.4067 15.4831 15.4831 17.0432 17.0432 17.2217 17.2217 21.9796 21.9796 22.2854 22.2854 22.3371 22.3371 23.3591 23.3591 23.9472 23.9472 k = 0.4491 0.3769-0.0000 ( 1426 PWs) bands (ev): -41.3139 -41.3139 -40.8257 -40.8257 -17.6843 -17.6843 -16.9467 -16.9467 -15.3050 -15.3050 -14.8019 -14.8019 -14.3186 -14.3186 -13.5468 -13.5468 10.7518 10.7518 13.8542 13.8542 14.4437 14.4437 15.4878 15.4878 17.0141 17.0141 17.2704 17.2704 21.9899 21.9899 22.1857 22.1857 22.3206 22.3206 23.3362 23.3362 24.1010 24.1010 k = 0.4444 0.3849-0.0000 ( 1430 PWs) bands (ev): -41.3136 -41.3136 -40.8253 -40.8253 -17.6842 -17.6842 -16.9470 -16.9470 -15.3042 -15.3042 -14.8053 -14.8053 -14.3228 -14.3228 -13.5476 -13.5476 10.7828 10.7828 13.7899 13.7899 14.4838 14.4838 15.4928 15.4928 16.9802 16.9802 17.3258 17.3258 22.0008 22.0008 22.0581 22.0581 22.3387 22.3387 23.3115 23.3115 24.2614 24.2614 k = 0.4398 0.3929-0.0000 ( 1430 PWs) bands (ev): -41.3129 -41.3129 -40.8251 -40.8251 -17.6841 -17.6841 -16.9473 -16.9473 -15.3033 -15.3033 -14.8088 -14.8088 -14.3273 -14.3273 -13.5484 -13.5484 10.8163 10.8163 13.7224 13.7224 14.5268 14.5268 15.4982 15.4982 16.9428 16.9428 17.3867 17.3867 21.9268 21.9268 22.0147 22.0147 22.3649 22.3649 23.2853 23.2853 24.4279 24.4279 k = 0.4352 0.4009-0.0000 ( 1434 PWs) bands (ev): -41.3126 -41.3126 -40.8246 -40.8246 -17.6839 -17.6839 -16.9478 -16.9478 -15.3024 -15.3024 -14.8127 -14.8127 -14.3320 -14.3320 -13.5493 -13.5493 10.8520 10.8520 13.6520 13.6520 14.5724 14.5724 15.5038 15.5038 16.9026 16.9026 17.4523 17.4523 21.7973 21.7973 22.0279 22.0279 22.3977 22.3977 23.2576 23.2576 24.6002 24.6002 k = 0.4306 0.4090-0.0000 ( 1434 PWs) bands (ev): -41.3121 -41.3121 -40.8242 -40.8242 -17.6837 -17.6837 -16.9482 -16.9482 -15.3014 -15.3014 -14.8165 -14.8165 -14.3368 -14.3368 -13.5502 -13.5502 10.8900 10.8900 13.5792 13.5792 14.6206 14.6206 15.5098 15.5098 16.8601 16.8601 17.5224 17.5224 21.6681 21.6681 22.0423 22.0423 22.4366 22.4366 23.2287 23.2287 24.7777 24.7777 k = 0.4259 0.4170-0.0000 ( 1444 PWs) bands (ev): -41.3115 -41.3115 -40.8242 -40.8242 -17.6837 -17.6837 -16.9486 -16.9486 -15.3006 -15.3006 -14.8205 -14.8205 -14.3420 -14.3420 -13.5511 -13.5511 10.9301 10.9301 13.5044 13.5044 14.6711 14.6711 15.5159 15.5159 16.8155 16.8155 17.5966 17.5966 21.5400 21.5400 22.0576 22.0576 22.4812 22.4812 23.1986 23.1986 24.9600 24.9600 k = 0.4213 0.4250-0.0000 ( 1444 PWs) bands (ev): -41.3110 -41.3110 -40.8237 -40.8237 -17.6835 -17.6835 -16.9491 -16.9491 -15.2996 -15.2996 -14.8246 -14.8246 -14.3470 -14.3470 -13.5520 -13.5520 10.9723 10.9723 13.4279 13.4279 14.7237 14.7237 15.5223 15.5223 16.7692 16.7692 17.6747 17.6747 21.4132 21.4132 22.0738 22.0738 22.5310 22.5310 23.1675 23.1675 25.1461 25.1461 k = 0.4167 0.4330-0.0000 ( 1436 PWs) bands (ev): -41.3104 -41.3104 -40.8228 -40.8228 -17.6832 -17.6832 -16.9496 -16.9496 -15.2986 -15.2986 -14.8287 -14.8287 -14.3519 -14.3519 -13.5529 -13.5529 11.0166 11.0166 13.3501 13.3501 14.7782 14.7782 15.5289 15.5289 16.7215 16.7215 17.7564 17.7564 21.2880 21.2880 22.0908 22.0908 22.5856 22.5856 23.1357 23.1357 25.3185 25.3185 k = 0.4120 0.4410-0.0000 ( 1436 PWs) bands (ev): -41.3099 -41.3099 -40.8223 -40.8223 -17.6830 -17.6830 -16.9501 -16.9501 -15.2976 -15.2976 -14.8328 -14.8328 -14.3570 -14.3570 -13.5538 -13.5538 11.0627 11.0627 13.2713 13.2713 14.8341 14.8341 15.5357 15.5357 16.6727 16.6727 17.8414 17.8414 21.1647 21.1647 22.1086 22.1086 22.6446 22.6446 23.1035 23.1035 25.3145 25.3145 k = 0.4074 0.4491-0.0000 ( 1436 PWs) bands (ev): -41.3093 -41.3093 -40.8218 -40.8218 -17.6828 -17.6828 -16.9507 -16.9507 -15.2967 -15.2967 -14.8369 -14.8369 -14.3621 -14.3621 -13.5547 -13.5547 11.1107 11.1107 13.1918 13.1918 14.8914 14.8914 15.5428 15.5428 16.6230 16.6230 17.9294 17.9294 21.0432 21.0432 22.1272 22.1272 22.7071 22.7071 23.0714 23.0714 25.2830 25.2830 k = 0.4028 0.4571-0.0000 ( 1432 PWs) bands (ev): -41.3087 -41.3087 -40.8211 -40.8211 -17.6826 -17.6826 -16.9513 -16.9513 -15.2958 -15.2958 -14.8410 -14.8410 -14.3669 -14.3669 -13.5555 -13.5555 11.1603 11.1603 13.1121 13.1121 14.9495 14.9495 15.5500 15.5500 16.5727 16.5727 18.0202 18.0202 20.9239 20.9239 22.1465 22.1465 22.7719 22.7719 23.0402 23.0402 25.2483 25.2483 k = 0.3981 0.4651-0.0000 ( 1430 PWs) bands (ev): -41.3081 -41.3081 -40.8206 -40.8206 -17.6824 -17.6824 -16.9519 -16.9519 -15.2950 -15.2950 -14.8450 -14.8450 -14.3718 -14.3718 -13.5563 -13.5563 11.2116 11.2116 13.0322 13.0322 15.0080 15.0080 15.5575 15.5575 16.5219 16.5219 18.1135 18.1135 20.8068 20.8068 22.1664 22.1664 22.8360 22.8360 23.0132 23.0132 25.2092 25.2092 k = 0.3935 0.4731-0.0000 ( 1430 PWs) bands (ev): -41.3075 -41.3075 -40.8201 -40.8201 -17.6823 -17.6823 -16.9525 -16.9525 -15.2942 -15.2942 -14.8489 -14.8489 -14.3766 -14.3766 -13.5571 -13.5571 11.2644 11.2644 12.9525 12.9525 15.0667 15.0667 15.5653 15.5653 16.4711 16.4711 18.2088 18.2088 20.6919 20.6919 22.1871 22.1871 22.8863 22.8863 23.0029 23.0029 25.1623 25.1623 k = 0.3889 0.4811-0.0000 ( 1432 PWs) bands (ev): -41.3071 -41.3071 -40.8196 -40.8196 -17.6821 -17.6821 -16.9532 -16.9532 -15.2935 -15.2935 -14.8527 -14.8527 -14.3811 -14.3811 -13.5579 -13.5579 11.3186 11.3186 12.8733 12.8733 15.1248 15.1248 15.5736 15.5736 16.4203 16.4203 18.3059 18.3059 20.5795 20.5795 22.2084 22.2084 22.8938 22.8938 23.0381 23.0381 25.1041 25.1041 k = 0.3843 0.4891-0.0000 ( 1432 PWs) bands (ev): -41.3066 -41.3066 -40.8192 -40.8192 -17.6820 -17.6820 -16.9539 -16.9539 -15.2928 -15.2928 -14.8563 -14.8563 -14.3855 -14.3855 -13.5586 -13.5586 11.3740 11.3740 12.7948 12.7948 15.1817 15.1817 15.5827 15.5827 16.3698 16.3698 18.4044 18.4044 20.4696 20.4696 22.2303 22.2303 22.8714 22.8714 23.1060 23.1060 25.0345 25.0345 k = 0.3796 0.4972-0.0000 ( 1432 PWs) bands (ev): -41.3061 -41.3061 -40.8187 -40.8187 -17.6818 -17.6818 -16.9546 -16.9546 -15.2922 -15.2922 -14.8597 -14.8597 -14.3896 -14.3896 -13.5592 -13.5592 11.4306 11.4306 12.7172 12.7172 15.2367 15.2367 15.5929 15.5929 16.3197 16.3197 18.5037 18.5037 20.3622 20.3622 22.2528 22.2528 22.8412 22.8412 23.1843 23.1843 24.9558 24.9558 k = 0.3750 0.5052-0.0000 ( 1432 PWs) bands (ev): -41.3056 -41.3056 -40.8183 -40.8183 -17.6817 -17.6817 -16.9552 -16.9552 -15.2917 -15.2917 -14.8630 -14.8630 -14.3934 -14.3934 -13.5598 -13.5598 11.4881 11.4881 12.6407 12.6407 15.2888 15.2888 15.6049 15.6049 16.2704 16.2704 18.6036 18.6036 20.2575 20.2575 22.2758 22.2758 22.8087 22.8087 23.2670 23.2670 24.8708 24.8708 k = 0.3704 0.5132-0.0000 ( 1428 PWs) bands (ev): -41.3050 -41.3050 -40.8179 -40.8179 -17.6816 -17.6816 -16.9558 -16.9558 -15.2913 -15.2913 -14.8658 -14.8658 -14.3969 -14.3969 -13.5603 -13.5603 11.5465 11.5465 12.5655 12.5655 15.3367 15.3367 15.6193 15.6193 16.2220 16.2220 18.7034 18.7034 20.1554 20.1554 22.2993 22.2993 22.7757 22.7757 23.3525 23.3525 24.7821 24.7821 k = 0.3657 0.5212-0.0000 ( 1428 PWs) bands (ev): -41.3046 -41.3046 -40.8176 -40.8176 -17.6815 -17.6815 -16.9564 -16.9564 -15.2909 -15.2909 -14.8686 -14.8686 -14.4001 -14.4001 -13.5607 -13.5607 11.6056 11.6056 12.4918 12.4918 15.3789 15.3789 15.6374 15.6374 16.1746 16.1746 18.8028 18.8028 20.0561 20.0561 22.3231 22.3231 22.7428 22.7428 23.4399 23.4399 24.6919 24.6919 k = 0.3611 0.5292-0.0000 ( 1424 PWs) bands (ev): -41.3042 -41.3042 -40.8171 -40.8171 -17.6813 -17.6813 -16.9570 -16.9570 -15.2906 -15.2906 -14.8710 -14.8710 -14.4028 -14.4028 -13.5611 -13.5611 11.6651 11.6651 12.4198 12.4198 15.4141 15.4141 15.6599 15.6599 16.1286 16.1286 18.9011 18.9011 19.9596 19.9596 22.3472 22.3472 22.7105 22.7105 23.5286 23.5286 24.6015 24.6015 k = 0.3565 0.5373-0.0000 ( 1424 PWs) bands (ev): -41.3039 -41.3039 -40.8168 -40.8168 -17.6812 -17.6812 -16.9575 -16.9575 -15.2903 -15.2903 -14.8731 -14.8731 -14.4052 -14.4052 -13.5615 -13.5615 11.7250 11.7250 12.3497 12.3497 15.4416 15.4416 15.6872 15.6872 16.0840 16.0840 18.9977 18.9977 19.8660 19.8660 22.3713 22.3713 22.6791 22.6791 23.6182 23.6182 24.5120 24.5120 k = 0.3519 0.5453-0.0000 ( 1432 PWs) bands (ev): -41.3038 -41.3038 -40.8167 -40.8167 -17.6812 -17.6812 -16.9581 -16.9581 -15.2902 -15.2902 -14.8749 -14.8749 -14.4073 -14.4073 -13.5618 -13.5618 11.7848 11.7848 12.2816 12.2816 15.4615 15.4615 15.7186 15.7186 16.0414 16.0414 19.0921 19.0921 19.7754 19.7754 22.3952 22.3952 22.6490 22.6490 23.7081 23.7081 24.4234 24.4234 k = 0.3472 0.5533-0.0000 ( 1432 PWs) bands (ev): -41.3036 -41.3036 -40.8165 -40.8165 -17.6812 -17.6812 -16.9585 -16.9585 -15.2901 -15.2901 -14.8763 -14.8763 -14.4089 -14.4089 -13.5620 -13.5620 11.8443 11.8443 12.2159 12.2159 15.4750 15.4750 15.7521 15.7521 16.0012 16.0012 19.1836 19.1836 19.6878 19.6878 22.4182 22.4182 22.6211 22.6211 23.7979 23.7979 24.3361 24.3361 k = 0.3426 0.5613-0.0000 ( 1428 PWs) bands (ev): -41.3034 -41.3034 -40.8162 -40.8162 -17.6811 -17.6811 -16.9588 -16.9588 -15.2900 -15.2900 -14.8773 -14.8773 -14.4100 -14.4100 -13.5621 -13.5621 11.9028 11.9028 12.1533 12.1533 15.4833 15.4833 15.7853 15.7853 15.9646 15.9646 19.2712 19.2712 19.6036 19.6036 22.4391 22.4391 22.5966 22.5966 23.8865 23.8865 24.2502 24.2502 k = 0.3380 0.5693-0.0000 ( 1428 PWs) bands (ev): -41.3033 -41.3033 -40.8161 -40.8161 -17.6811 -17.6811 -16.9590 -16.9590 -15.2900 -15.2900 -14.8779 -14.8779 -14.4107 -14.4107 -13.5622 -13.5622 11.9578 11.9578 12.0959 12.0959 15.4877 15.4877 15.8135 15.8135 15.9350 15.9350 19.3530 19.3530 19.5244 19.5244 22.4553 22.4553 22.5783 22.5783 23.9711 23.9711 24.1679 24.1679 k = 0.3333 0.5774-0.0000 ( 1428 PWs) bands (ev): -41.3033 -41.3033 -40.8161 -40.8161 -17.6811 -17.6811 -16.9590 -16.9590 -15.2900 -15.2900 -14.8781 -14.8781 -14.4109 -14.4109 -13.5623 -13.5623 11.9910 11.9910 12.0619 12.0619 15.4890 15.4890 15.8261 15.8261 15.9221 15.9221 19.4077 19.4077 19.4706 19.4706 22.4617 22.4617 22.5711 22.5711 24.0258 24.0258 24.1141 24.1141 k = 0.3333 0.5774-0.0000 ( 1428 PWs) bands (ev): -41.3033 -41.3033 -40.8161 -40.8161 -17.6811 -17.6811 -16.9590 -16.9590 -15.2900 -15.2900 -14.8781 -14.8781 -14.4109 -14.4109 -13.5623 -13.5623 11.9910 11.9910 12.0619 12.0619 15.4890 15.4890 15.8261 15.8261 15.9221 15.9221 19.4077 19.4077 19.4706 19.4706 22.4617 22.4617 22.5711 22.5711 24.0258 24.0258 24.1141 24.1141 k = 0.3287 0.5693-0.0000 ( 1428 PWs) bands (ev): -41.3033 -41.3033 -40.8161 -40.8161 -17.6811 -17.6811 -16.9590 -16.9590 -15.2900 -15.2900 -14.8779 -14.8779 -14.4107 -14.4107 -13.5622 -13.5622 11.9592 11.9592 12.0944 12.0944 15.4879 15.4879 15.8145 15.8145 15.9339 15.9339 19.3567 19.3567 19.5206 19.5206 22.4555 22.4555 22.5781 22.5781 23.9716 23.9716 24.1671 24.1671 k = 0.3241 0.5613-0.0000 ( 1428 PWs) bands (ev): -41.3035 -41.3035 -40.8162 -40.8162 -17.6811 -17.6811 -16.9587 -16.9587 -15.2900 -15.2900 -14.8773 -14.8773 -14.4100 -14.4100 -13.5621 -13.5621 11.9093 11.9093 12.1463 12.1463 15.4848 15.4848 15.7902 15.7902 15.9584 15.9584 19.2864 19.2864 19.5871 19.5871 22.4406 22.4406 22.5953 22.5953 23.8882 23.8882 24.2462 24.2462 k = 0.3194 0.5533-0.0000 ( 1428 PWs) bands (ev): -41.3036 -41.3036 -40.8164 -40.8164 -17.6811 -17.6811 -16.9583 -16.9583 -15.2899 -15.2899 -14.8762 -14.8762 -14.4088 -14.4088 -13.5620 -13.5620 11.8590 11.8590 12.1994 12.1994 15.4803 15.4803 15.7631 15.7631 15.9858 15.9858 19.2172 19.2172 19.6494 19.6494 22.4220 22.4220 22.6177 22.6177 23.8008 23.8008 24.3253 24.3253 k = 0.3148 0.5453-0.0000 ( 1428 PWs) bands (ev): -41.3039 -41.3039 -40.8166 -40.8166 -17.6812 -17.6812 -16.9577 -16.9577 -15.2899 -15.2899 -14.8746 -14.8746 -14.4072 -14.4072 -13.5618 -13.5618 11.8107 11.8107 12.2513 12.2513 15.4745 15.4745 15.7363 15.7363 16.0128 16.0128 19.1506 19.1506 19.7057 19.7057 22.4025 22.4025 22.6427 22.6427 23.7116 23.7116 24.4013 24.4013 k = 0.3102 0.5373-0.0000 ( 1432 PWs) bands (ev): -41.3042 -41.3042 -40.8171 -40.8171 -17.6813 -17.6813 -16.9569 -16.9569 -15.2898 -15.2898 -14.8726 -14.8726 -14.4051 -14.4051 -13.5616 -13.5616 11.7648 11.7648 12.3010 12.3010 15.4678 15.4678 15.7108 15.7108 16.0384 16.0384 19.0869 19.0869 19.7552 19.7552 22.3832 22.3832 22.6691 22.6691 23.6210 23.6210 24.4727 24.4727 k = 0.3056 0.5292-0.0000 ( 1428 PWs) bands (ev): -41.3046 -41.3046 -40.8173 -40.8173 -17.6813 -17.6813 -16.9559 -16.9559 -15.2896 -15.2896 -14.8702 -14.8702 -14.4025 -14.4025 -13.5613 -13.5613 11.7217 11.7217 12.3481 12.3481 15.4606 15.4606 15.6872 15.6872 16.0622 16.0622 19.0261 19.0261 19.7977 19.7977 22.3649 22.3649 22.6961 22.6961 23.5291 23.5291 24.5384 24.5384 k = 0.3009 0.5212-0.0000 ( 1432 PWs) bands (ev): -41.3052 -41.3052 -40.8179 -40.8179 -17.6814 -17.6814 -16.9546 -16.9546 -15.2894 -15.2894 -14.8673 -14.8673 -14.3995 -14.3995 -13.5609 -13.5609 11.6814 11.6814 12.3919 12.3919 15.4532 15.4532 15.6657 15.6657 16.0842 16.0842 18.9683 18.9683 19.8328 19.8328 22.3477 22.3477 22.7235 22.7235 23.4361 23.4361 24.5971 24.5971 k = 0.2963 0.5132-0.0000 ( 1428 PWs) bands (ev): -41.3056 -41.3056 -40.8184 -40.8184 -17.6815 -17.6815 -16.9531 -16.9531 -15.2890 -15.2890 -14.8638 -14.8638 -14.3960 -14.3960 -13.5605 -13.5605 11.6440 11.6440 12.4319 12.4319 15.4459 15.4459 15.6464 15.6464 16.1044 16.1044 18.9137 18.9137 19.8605 19.8605 22.3320 22.3320 22.7510 22.7510 23.3421 23.3421 24.6477 24.6477 k = 0.2917 0.5052-0.0000 ( 1428 PWs) bands (ev): -41.3062 -41.3062 -40.8190 -40.8190 -17.6815 -17.6815 -16.9513 -16.9513 -15.2885 -15.2885 -14.8599 -14.8599 -14.3921 -14.3921 -13.5601 -13.5601 11.6097 11.6097 12.4677 12.4677 15.4391 15.4391 15.6294 15.6294 16.1230 16.1230 18.8621 18.8621 19.8806 19.8806 22.3178 22.3178 22.7782 22.7782 23.2473 23.2473 24.6889 24.6889 k = 0.2870 0.4972-0.0000 ( 1432 PWs) bands (ev): -41.3070 -41.3070 -40.8199 -40.8199 -17.6817 -17.6817 -16.9492 -16.9492 -15.2878 -15.2878 -14.8556 -14.8556 -14.3879 -14.3879 -13.5596 -13.5596 11.5784 11.5784 12.4987 12.4987 15.4332 15.4332 15.6149 15.6149 16.1402 16.1402 18.8135 18.8135 19.8934 19.8934 22.3052 22.3052 22.8044 22.8044 23.1522 23.1522 24.7193 24.7193 k = 0.2824 0.4891-0.0000 ( 1430 PWs) bands (ev): -41.3079 -41.3079 -40.8206 -40.8206 -17.6817 -17.6817 -16.9469 -16.9469 -15.2870 -15.2870 -14.8508 -14.8508 -14.3832 -14.3832 -13.5591 -13.5591 11.5502 11.5502 12.5245 12.5245 15.4285 15.4285 15.6028 15.6028 16.1564 16.1564 18.7681 18.7681 19.8988 19.8988 22.2944 22.2944 22.8279 22.8279 23.0588 23.0588 24.7377 24.7377 k = 0.2778 0.4811-0.0000 ( 1430 PWs) bands (ev): -41.3088 -41.3088 -40.8214 -40.8214 -17.6818 -17.6818 -16.9442 -16.9442 -15.2860 -15.2860 -14.8456 -14.8456 -14.3780 -14.3780 -13.5586 -13.5586 11.5251 11.5251 12.5446 12.5446 15.4253 15.4253 15.5933 15.5933 16.1717 16.1717 18.7258 18.7258 19.8971 19.8971 22.2852 22.2852 22.8404 22.8404 22.9751 22.9751 24.7431 24.7431 k = 0.2731 0.4731-0.0000 ( 1430 PWs) bands (ev): -41.3099 -41.3099 -40.8224 -40.8224 -17.6818 -17.6818 -16.9412 -16.9412 -15.2848 -15.2848 -14.8399 -14.8399 -14.3725 -14.3725 -13.5580 -13.5580 11.5033 11.5033 12.5586 12.5586 15.4239 15.4239 15.5864 15.5864 16.1865 16.1865 18.6865 18.6865 19.8887 19.8887 22.2777 22.2777 22.8073 22.8073 22.9357 22.9357 24.7345 24.7345 k = 0.2685 0.4651-0.0000 ( 1432 PWs) bands (ev): -41.3111 -41.3111 -40.8234 -40.8234 -17.6819 -17.6819 -16.9379 -16.9379 -15.2834 -15.2834 -14.8339 -14.8339 -14.3667 -14.3667 -13.5574 -13.5574 11.4847 11.4847 12.5661 12.5661 15.4244 15.4244 15.5820 15.5820 16.2012 16.2012 18.6504 18.6504 19.8736 19.8736 22.2719 22.2719 22.7239 22.7239 22.9457 22.9457 24.7117 24.7117 k = 0.2639 0.4571-0.0000 ( 1432 PWs) bands (ev): -41.3123 -41.3123 -40.8245 -40.8245 -17.6820 -17.6820 -16.9343 -16.9343 -15.2817 -15.2817 -14.8273 -14.8273 -14.3604 -14.3604 -13.5568 -13.5568 11.4693 11.4693 12.5670 12.5670 15.4270 15.4270 15.5804 15.5804 16.2162 16.2162 18.6173 18.6173 19.8524 19.8524 22.2675 22.2675 22.6266 22.6266 22.9686 22.9686 24.6746 24.6746 k = 0.2593 0.4491-0.0000 ( 1428 PWs) bands (ev): -41.3136 -41.3136 -40.8255 -40.8255 -17.6820 -17.6820 -16.9303 -16.9303 -15.2798 -15.2798 -14.8203 -14.8203 -14.3538 -14.3538 -13.5562 -13.5562 11.4571 11.4571 12.5609 12.5609 15.4316 15.4316 15.5814 15.5814 16.2318 16.2318 18.5873 18.5873 19.8253 19.8253 22.2639 22.2639 22.5259 22.5259 22.9946 22.9946 24.6235 24.6235 k = 0.2546 0.4410-0.0000 ( 1430 PWs) bands (ev): -41.3150 -41.3150 -40.8268 -40.8268 -17.6821 -17.6821 -16.9260 -16.9260 -15.2777 -15.2777 -14.8129 -14.8129 -14.3470 -14.3470 -13.5555 -13.5555 11.4483 11.4483 12.5479 12.5479 15.4380 15.4380 15.5852 15.5852 16.2486 16.2486 18.5603 18.5603 19.7927 19.7927 22.2591 22.2591 22.4260 22.4260 23.0217 23.0217 24.5593 24.5593 k = 0.2500 0.4330-0.0000 ( 1434 PWs) bands (ev): -41.3165 -41.3165 -40.8283 -40.8283 -17.6823 -17.6823 -16.9213 -16.9213 -15.2754 -15.2754 -14.8050 -14.8050 -14.3398 -14.3398 -13.5548 -13.5548 11.4427 11.4427 12.5279 12.5279 15.4460 15.4460 15.5917 15.5917 16.2670 16.2670 18.5364 18.5364 19.7550 19.7550 22.2414 22.2414 22.3390 22.3390 23.0492 23.0492 24.4829 24.4829 k = 0.2454 0.4250-0.0000 ( 1422 PWs) bands (ev): -41.3180 -41.3180 -40.8294 -40.8294 -17.6823 -17.6823 -16.9162 -16.9162 -15.2727 -15.2727 -14.7967 -14.7967 -14.3321 -14.3321 -13.5540 -13.5540 11.4405 11.4405 12.5012 12.5012 15.4551 15.4551 15.6010 15.6010 16.2874 16.2874 18.5154 18.5154 19.7125 19.7125 22.1747 22.1747 22.3017 22.3017 23.0768 23.0768 24.3955 24.3955 k = 0.2407 0.4170-0.0000 ( 1422 PWs) bands (ev): -41.3196 -41.3196 -40.8309 -40.8309 -17.6824 -17.6824 -16.9108 -16.9108 -15.2698 -15.2698 -14.7881 -14.7881 -14.3244 -14.3244 -13.5533 -13.5533 11.4416 11.4416 12.4678 12.4678 15.4649 15.4649 15.6130 15.6130 16.3103 16.3103 18.4975 18.4975 19.6656 19.6656 22.0747 22.0747 22.2982 22.2982 23.1043 23.1043 24.2983 24.2983 k = 0.2361 0.4090-0.0000 ( 1422 PWs) bands (ev): -41.3214 -41.3214 -40.8325 -40.8325 -17.6825 -17.6825 -16.9051 -16.9051 -15.2666 -15.2666 -14.7791 -14.7791 -14.3163 -14.3163 -13.5526 -13.5526 11.4459 11.4459 12.4281 12.4281 15.4748 15.4748 15.6279 15.6279 16.3362 16.3362 18.4825 18.4825 19.6145 19.6145 21.9668 21.9668 22.3034 22.3034 23.1317 23.1317 24.1925 24.1925 k = 0.2315 0.4009-0.0000 ( 1436 PWs) bands (ev): -41.3237 -41.3237 -40.8343 -40.8343 -17.6827 -17.6827 -16.8992 -16.8992 -15.2632 -15.2632 -14.7699 -14.7699 -14.3080 -14.3080 -13.5520 -13.5520 11.4536 11.4536 12.3823 12.3823 15.4844 15.4844 15.6455 15.6455 16.3653 16.3653 18.4704 18.4704 19.5596 19.5596 21.8561 21.8561 22.3125 22.3125 23.1589 23.1589 24.0791 24.0791 k = 0.2269 0.3929-0.0000 ( 1436 PWs) bands (ev): -41.3256 -41.3256 -40.8360 -40.8360 -17.6828 -17.6828 -16.8928 -16.8928 -15.2595 -15.2595 -14.7601 -14.7601 -14.2995 -14.2995 -13.5512 -13.5512 11.4646 11.4646 12.3310 12.3310 15.4930 15.4930 15.6659 15.6659 16.3981 16.3981 18.4612 18.4612 19.5012 19.5012 21.7436 21.7436 22.3242 22.3242 23.1858 23.1858 23.9593 23.9593 k = 0.2222 0.3849-0.0000 ( 1436 PWs) bands (ev): -41.3277 -41.3277 -40.8378 -40.8378 -17.6830 -17.6830 -16.8861 -16.8861 -15.2554 -15.2554 -14.7500 -14.7500 -14.2907 -14.2907 -13.5505 -13.5505 11.4788 11.4788 12.2746 12.2746 15.5003 15.5003 15.6890 15.6890 16.4345 16.4345 18.4549 18.4549 19.4396 19.4396 21.6300 21.6300 22.3383 22.3383 23.2123 23.2123 23.8339 23.8339 k = 0.2176 0.3769-0.0000 ( 1436 PWs) bands (ev): -41.3297 -41.3297 -40.8397 -40.8397 -17.6831 -17.6831 -16.8790 -16.8790 -15.2512 -15.2512 -14.7396 -14.7396 -14.2817 -14.2817 -13.5497 -13.5497 11.4964 11.4964 12.2134 12.2134 15.5058 15.5058 15.7149 15.7149 16.4748 16.4748 18.4514 18.4514 19.3749 19.3749 21.5154 21.5154 22.3546 22.3546 23.2384 23.2384 23.7036 23.7036 k = 0.2130 0.3689-0.0000 ( 1436 PWs) bands (ev): -41.3319 -41.3319 -40.8416 -40.8416 -17.6833 -17.6833 -16.8717 -16.8717 -15.2466 -15.2466 -14.7288 -14.7288 -14.2725 -14.2725 -13.5490 -13.5490 11.5172 11.5172 12.1480 12.1480 15.5093 15.5093 15.7436 15.7436 16.5189 16.5189 18.4507 18.4507 19.3075 19.3075 21.4002 21.4002 22.3729 22.3729 23.2638 23.2638 23.5691 23.5691 k = 0.2083 0.3608-0.0000 ( 1436 PWs) bands (ev): -41.3341 -41.3341 -40.8436 -40.8436 -17.6835 -17.6835 -16.8640 -16.8640 -15.2418 -15.2418 -14.7177 -14.7177 -14.2630 -14.2630 -13.5482 -13.5482 11.5412 11.5412 12.0787 12.0787 15.5107 15.5107 15.7749 15.7749 16.5665 16.5665 18.4526 18.4526 19.2375 19.2375 21.2844 21.2844 22.3931 22.3931 23.2883 23.2883 23.4311 23.4311 k = 0.2037 0.3528-0.0000 ( 1444 PWs) bands (ev): -41.3366 -41.3366 -40.8458 -40.8458 -17.6838 -17.6838 -16.8561 -16.8561 -15.2367 -15.2367 -14.7064 -14.7064 -14.2536 -14.2536 -13.5475 -13.5475 11.5684 11.5684 12.0061 12.0061 15.5098 15.5098 15.8089 15.8089 16.6174 16.6174 18.4572 18.4572 19.1652 19.1652 21.1684 21.1684 22.4153 22.4153 23.2878 23.2878 23.3129 23.3129 k = 0.1991 0.3448-0.0000 ( 1444 PWs) bands (ev): -41.3390 -41.3390 -40.8479 -40.8479 -17.6840 -17.6840 -16.8479 -16.8479 -15.2314 -15.2314 -14.6948 -14.6948 -14.2438 -14.2438 -13.5467 -13.5467 11.5987 11.5987 11.9306 11.9306 15.5067 15.5067 15.8455 15.8455 16.6713 16.6713 18.4645 18.4645 19.0906 19.0906 21.0522 21.0522 22.4392 22.4392 23.1455 23.1455 23.3187 23.3187 k = 0.1944 0.3368-0.0000 ( 1444 PWs) bands (ev): -41.3414 -41.3414 -40.8501 -40.8501 -17.6843 -17.6843 -16.8395 -16.8395 -15.2259 -15.2259 -14.6829 -14.6829 -14.2339 -14.2339 -13.5459 -13.5459 11.6320 11.6320 11.8527 11.8527 15.5015 15.5015 15.8848 15.8848 16.7278 16.7278 18.4742 18.4742 19.0141 19.0141 20.9361 20.9361 22.4649 22.4649 22.9998 22.9998 23.2107 23.2107 k = 0.1898 0.3288-0.0000 ( 1442 PWs) bands (ev): -41.3438 -41.3438 -40.8523 -40.8523 -17.6846 -17.6846 -16.8307 -16.8307 -15.2201 -15.2201 -14.6707 -14.6707 -14.2238 -14.2238 -13.5451 -13.5451 11.6675 11.6675 11.7735 11.7735 15.4943 15.4943 15.9266 15.9266 16.7864 16.7864 18.4864 18.4864 18.9358 18.9358 20.8202 20.8202 22.4921 22.4921 22.8526 22.8526 23.0573 23.0573 k = 0.1852 0.3208-0.0000 ( 1438 PWs) bands (ev): -41.3461 -41.3461 -40.8546 -40.8546 -17.6849 -17.6849 -16.8218 -16.8218 -15.2140 -15.2140 -14.6583 -14.6583 -14.2137 -14.2137 -13.5442 -13.5442 11.6802 11.6802 11.7184 11.7184 15.4851 15.4851 15.9709 15.9709 16.8467 16.8467 18.5010 18.5010 18.8558 18.8558 20.7047 20.7047 22.5202 22.5202 22.7052 22.7052 22.9016 22.9016 k = 0.1806 0.3127-0.0000 ( 1438 PWs) bands (ev): -41.3487 -41.3487 -40.8568 -40.8568 -17.6852 -17.6852 -16.8127 -16.8127 -15.2078 -15.2078 -14.6457 -14.6457 -14.2034 -14.2034 -13.5434 -13.5434 11.6031 11.6031 11.7545 11.7545 15.4743 15.4743 16.0177 16.0177 16.9084 16.9084 18.5177 18.5177 18.7743 18.7743 20.5899 20.5899 22.5324 22.5324 22.5749 22.5749 22.7465 22.7465 k = 0.1759 0.3047-0.0000 ( 1434 PWs) bands (ev): -41.3509 -41.3509 -40.8593 -40.8593 -17.6857 -17.6857 -16.8034 -16.8034 -15.2015 -15.2015 -14.6329 -14.6329 -14.1930 -14.1930 -13.5424 -13.5424 11.5188 11.5188 11.7997 11.7997 15.4619 15.4619 16.0669 16.0669 16.9709 16.9709 18.5362 18.5362 18.6920 18.6920 20.4758 20.4758 22.4024 22.4024 22.5841 22.5841 22.5971 22.5971 k = 0.1713 0.2967-0.0000 ( 1434 PWs) bands (ev): -41.3535 -41.3535 -40.8617 -40.8617 -17.6861 -17.6861 -16.7940 -16.7940 -15.1950 -15.1950 -14.6199 -14.6199 -14.1825 -14.1825 -13.5416 -13.5416 11.4331 11.4331 11.8483 11.8483 15.4481 15.4481 16.1184 16.1184 17.0339 17.0339 18.5537 18.5537 18.6115 18.6115 20.3628 20.3628 22.2556 22.2556 22.4395 22.4395 22.6219 22.6219 k = 0.1667 0.2887-0.0000 ( 1434 PWs) bands (ev): -41.3562 -41.3562 -40.8641 -40.8641 -17.6865 -17.6865 -16.7845 -16.7845 -15.1883 -15.1883 -14.6069 -14.6069 -14.1719 -14.1719 -13.5408 -13.5408 11.3466 11.3466 11.9000 11.9000 15.4330 15.4330 16.1721 16.1721 17.0969 17.0969 18.5152 18.5152 18.5879 18.5879 20.2509 20.2509 22.1091 22.1091 22.2885 22.2885 22.6568 22.6568 k = 0.1620 0.2807-0.0000 ( 1430 PWs) bands (ev): -41.3587 -41.3587 -40.8664 -40.8664 -17.6870 -17.6870 -16.7748 -16.7748 -15.1814 -15.1814 -14.5936 -14.5936 -14.1613 -14.1613 -13.5399 -13.5399 11.2597 11.2597 11.9546 11.9546 15.4168 15.4168 16.2280 16.2280 17.1598 17.1598 18.4315 18.4315 18.6107 18.6107 20.1405 20.1405 21.9640 21.9640 22.1391 22.1391 22.6934 22.6934 k = 0.1574 0.2726-0.0000 ( 1426 PWs) bands (ev): -41.3613 -41.3613 -40.8687 -40.8687 -17.6873 -17.6873 -16.7651 -16.7651 -15.1744 -15.1744 -14.5803 -14.5803 -14.1506 -14.1506 -13.5391 -13.5391 11.1727 11.1727 12.0120 12.0120 15.3997 15.3997 16.2860 16.2860 17.2220 17.2220 18.3447 18.3447 18.6374 18.6374 20.0316 20.0316 21.8207 21.8207 21.9917 21.9917 22.7313 22.7313 k = 0.1528 0.2646-0.0000 ( 1426 PWs) bands (ev): -41.3640 -41.3640 -40.8711 -40.8711 -17.6879 -17.6879 -16.7554 -16.7554 -15.1674 -15.1674 -14.5669 -14.5669 -14.1399 -14.1399 -13.5383 -13.5383 11.0857 11.0857 12.0721 12.0721 15.3818 15.3818 16.3460 16.3460 17.2832 17.2832 18.2570 18.2570 18.6663 18.6663 19.9245 19.9245 21.6792 21.6792 21.8464 21.8464 22.7704 22.7704 k = 0.1481 0.2566-0.0000 ( 1430 PWs) bands (ev): -41.3668 -41.3668 -40.8737 -40.8737 -17.6884 -17.6884 -16.7457 -16.7457 -15.1604 -15.1604 -14.5534 -14.5534 -14.1292 -14.1292 -13.5374 -13.5374 10.9991 10.9991 12.1348 12.1348 15.3631 15.3631 16.4078 16.4078 17.3433 17.3433 18.1687 18.1687 18.6970 18.6970 19.8193 19.8193 21.5394 21.5394 21.7039 21.7039 22.8107 22.8107 k = 0.1435 0.2486-0.0000 ( 1430 PWs) bands (ev): -41.3694 -41.3694 -40.8761 -40.8761 -17.6890 -17.6890 -16.7360 -16.7360 -15.1532 -15.1532 -14.5400 -14.5400 -14.1185 -14.1185 -13.5365 -13.5365 10.9130 10.9130 12.2001 12.2001 15.3439 15.3439 16.4714 16.4714 17.4017 17.4017 18.0801 18.0801 18.7293 18.7293 19.7162 19.7162 21.4010 21.4010 21.5648 21.5648 22.8518 22.8518 k = 0.1389 0.2406-0.0000 ( 1422 PWs) bands (ev): -41.3720 -41.3720 -40.8783 -40.8783 -17.6896 -17.6896 -16.7262 -16.7262 -15.1460 -15.1460 -14.5265 -14.5265 -14.1077 -14.1077 -13.5356 -13.5356 10.8277 10.8277 12.2679 12.2679 15.3242 15.3242 16.5366 16.5366 17.4582 17.4582 17.9917 17.9917 18.7631 18.7631 19.6154 19.6154 21.2634 21.2634 21.4299 21.4299 22.8939 22.8939 k = 0.1343 0.2325-0.0000 ( 1422 PWs) bands (ev): -41.3746 -41.3746 -40.8807 -40.8807 -17.6902 -17.6902 -16.7166 -16.7166 -15.1388 -15.1388 -14.5130 -14.5130 -14.0970 -14.0970 -13.5347 -13.5347 10.7433 10.7433 12.3381 12.3381 15.3042 15.3042 16.6033 16.6033 17.5120 17.5120 17.9042 17.9042 18.7981 18.7981 19.5171 19.5171 21.1260 21.1260 21.2999 21.2999 22.9367 22.9367 k = 0.1296 0.2245-0.0000 ( 1420 PWs) bands (ev): -41.3772 -41.3772 -40.8831 -40.8831 -17.6909 -17.6909 -16.7070 -16.7070 -15.1317 -15.1317 -14.4996 -14.4996 -14.0864 -14.0864 -13.5338 -13.5338 10.6600 10.6600 12.4105 12.4105 15.2839 15.2839 16.6713 16.6713 17.5617 17.5617 17.8189 17.8189 18.8343 18.8343 19.4214 19.4214 20.9884 20.9884 21.1756 21.1756 22.9801 22.9801 k = 0.1250 0.2165-0.0000 ( 1420 PWs) bands (ev): -41.3798 -41.3798 -40.8854 -40.8854 -17.6915 -17.6915 -16.6975 -16.6975 -15.1246 -15.1246 -14.4863 -14.4863 -14.0758 -14.0758 -13.5329 -13.5329 10.5780 10.5780 12.4850 12.4850 15.2634 15.2634 16.7404 16.7404 17.6010 17.6010 17.7423 17.7423 18.8714 18.8714 19.3286 19.3286 20.8503 20.8503 21.0573 21.0573 23.0239 23.0239 k = 0.1204 0.2085-0.0000 ( 1421 PWs) bands (ev): -41.3825 -41.3825 -40.8877 -40.8877 -17.6922 -17.6922 -16.6882 -16.6882 -15.1176 -15.1176 -14.4732 -14.4732 -14.0653 -14.0653 -13.5320 -13.5320 10.4975 10.4975 12.5616 12.5616 15.2428 15.2428 16.8105 16.8105 17.5948 17.5948 17.7095 17.7095 18.9094 18.9094 19.2387 19.2387 20.7118 20.7118 20.9451 20.9451 23.0682 23.0682 k = 0.1157 0.2005-0.0000 ( 1419 PWs) bands (ev): -41.3850 -41.3850 -40.8900 -40.8900 -17.6929 -17.6929 -16.6791 -16.6791 -15.1106 -15.1106 -14.4602 -14.4602 -14.0549 -14.0549 -13.5310 -13.5310 10.4186 10.4186 12.6401 12.6401 15.2223 15.2223 16.8814 16.8814 17.5281 17.5281 17.7357 17.7357 18.9480 18.9480 19.1520 19.1520 20.5731 20.5731 20.8390 20.8390 23.1126 23.1126 k = 0.1111 0.1925-0.0000 ( 1411 PWs) bands (ev): -41.3875 -41.3875 -40.8919 -40.8919 -17.6936 -17.6936 -16.6701 -16.6701 -15.1036 -15.1036 -14.4473 -14.4473 -14.0446 -14.0446 -13.5301 -13.5301 10.3415 10.3415 12.7203 12.7203 15.2019 15.2019 16.9528 16.9528 17.4473 17.4473 17.7743 17.7743 18.9869 18.9869 19.0688 19.0688 20.4347 20.4347 20.7388 20.7388 23.1571 23.1571 k = 0.1065 0.1844-0.0000 ( 1417 PWs) bands (ev): -41.3899 -41.3899 -40.8944 -40.8944 -17.6943 -17.6943 -16.6613 -16.6613 -15.0970 -15.0970 -14.4347 -14.4347 -14.0346 -14.0346 -13.5291 -13.5291 10.2663 10.2663 12.8021 12.8021 15.1816 15.1816 17.0245 17.0245 17.3647 17.3647 17.8135 17.8135 18.9878 18.9878 19.0274 19.0274 20.2968 20.2968 20.6441 20.6441 23.2015 23.2015 k = 0.1019 0.1764-0.0000 ( 1415 PWs) bands (ev): -41.3924 -41.3924 -40.8963 -40.8963 -17.6949 -17.6949 -16.6528 -16.6528 -15.0904 -15.0904 -14.4223 -14.4223 -14.0247 -14.0247 -13.5282 -13.5282 10.1932 10.1932 12.8853 12.8853 15.1617 15.1617 17.0962 17.0962 17.2826 17.2826 17.8509 17.8509 18.9122 18.9122 19.0664 19.0664 20.1599 20.1599 20.5548 20.5548 23.2457 23.2457 k = 0.0972 0.1684-0.0000 ( 1413 PWs) bands (ev): -41.3947 -41.3947 -40.8984 -40.8984 -17.6957 -17.6957 -16.6444 -16.6444 -15.0840 -15.0840 -14.4102 -14.4102 -14.0150 -14.0150 -13.5273 -13.5273 10.1223 10.1223 12.9697 12.9697 15.1420 15.1420 17.1667 17.1667 17.2028 17.2028 17.8857 17.8857 18.8401 18.8401 19.1057 19.1057 20.0244 20.0244 20.4707 20.4707 23.2894 23.2894 k = 0.0926 0.1604-0.0000 ( 1413 PWs) bands (ev): -41.3970 -41.3970 -40.9005 -40.9005 -17.6964 -17.6964 -16.6364 -16.6364 -15.0777 -15.0777 -14.3983 -14.3983 -14.0056 -14.0056 -13.5263 -13.5263 10.0538 10.0538 13.0551 13.0551 15.1228 15.1228 17.1219 17.1219 17.2396 17.2396 17.9176 17.9176 18.7722 18.7722 19.1446 19.1446 19.8907 19.8907 20.3916 20.3916 23.3325 23.3325 k = 0.0880 0.1524-0.0000 ( 1417 PWs) bands (ev): -41.3992 -41.3992 -40.9026 -40.9026 -17.6972 -17.6972 -16.6286 -16.6286 -15.0718 -15.0718 -14.3869 -14.3869 -13.9964 -13.9964 -13.5254 -13.5254 9.9877 9.9877 13.1413 13.1413 15.1040 15.1040 17.0451 17.0451 17.3096 17.3096 17.9462 17.9462 18.7089 18.7089 19.1827 19.1827 19.7593 19.7593 20.3173 20.3173 23.3749 23.3749 k = 0.0833 0.1443-0.0000 ( 1415 PWs) bands (ev): -41.4012 -41.4012 -40.9045 -40.9045 -17.6979 -17.6979 -16.6211 -16.6211 -15.0659 -15.0659 -14.3757 -14.3757 -13.9875 -13.9875 -13.5244 -13.5244 9.9243 9.9243 13.2279 13.2279 15.0857 15.0857 16.9705 16.9705 17.3786 17.3786 17.9712 17.9712 18.6505 18.6505 19.2193 19.2193 19.6312 19.6312 20.2478 20.2478 23.4162 23.4162 k = 0.0787 0.1363-0.0000 ( 1419 PWs) bands (ev): -41.4032 -41.4032 -40.9065 -40.9065 -17.6987 -17.6987 -16.6139 -16.6139 -15.0604 -15.0604 -14.3650 -14.3650 -13.9790 -13.9790 -13.5235 -13.5235 9.8635 9.8635 13.3148 13.3148 15.0681 15.0681 16.8986 16.8986 17.4459 17.4459 17.9921 17.9921 18.5975 18.5975 19.2525 19.2525 19.5083 19.5083 20.1830 20.1830 23.4564 23.4564 k = 0.0741 0.1283-0.0000 ( 1419 PWs) bands (ev): -41.4052 -41.4052 -40.9083 -40.9083 -17.6994 -17.6994 -16.6071 -16.6071 -15.0551 -15.0551 -14.3548 -14.3548 -13.9707 -13.9707 -13.5226 -13.5226 9.8056 9.8056 13.4016 13.4016 15.0511 15.0511 16.8295 16.8295 17.5112 17.5112 18.0087 18.0087 18.5503 18.5503 19.2724 19.2724 19.4009 19.4009 20.1227 20.1227 23.4953 23.4953 k = 0.0694 0.1203-0.0000 ( 1419 PWs) bands (ev): -41.4070 -41.4070 -40.9099 -40.9099 -17.7000 -17.7000 -16.6006 -16.6006 -15.0500 -15.0500 -14.3449 -14.3449 -13.9628 -13.9628 -13.5217 -13.5217 9.7507 9.7507 13.4878 13.4878 15.0349 15.0349 16.7636 16.7636 17.5738 17.5738 18.0206 18.0206 18.5096 18.5096 19.2260 19.2260 19.3621 19.3621 20.0668 20.0668 23.5326 23.5326 k = 0.0648 0.1123-0.0000 ( 1421 PWs) bands (ev): -41.4089 -41.4089 -40.9115 -40.9115 -17.7007 -17.7007 -16.5945 -16.5945 -15.0452 -15.0452 -14.3357 -14.3357 -13.9552 -13.9552 -13.5209 -13.5209 9.6988 9.6988 13.5732 13.5732 15.0194 15.0194 16.7009 16.7009 17.6331 17.6331 18.0274 18.0274 18.4756 18.4756 19.1240 19.1240 19.3818 19.3818 20.0155 20.0155 23.5680 23.5680 k = 0.0602 0.1042-0.0000 ( 1419 PWs) bands (ev): -41.4106 -41.4106 -40.9128 -40.9128 -17.7012 -17.7012 -16.5888 -16.5888 -15.0406 -15.0406 -14.3269 -14.3269 -13.9480 -13.9480 -13.5201 -13.5201 9.6500 9.6500 13.6572 13.6572 15.0048 15.0048 16.6418 16.6418 17.6883 17.6883 18.0293 18.0293 18.4487 18.4487 19.0170 19.0170 19.4098 19.4098 19.9685 19.9685 23.6015 23.6015 k = 0.0556 0.0962-0.0000 ( 1419 PWs) bands (ev): -41.4122 -41.4122 -40.9142 -40.9142 -17.7018 -17.7018 -16.5834 -16.5834 -15.0364 -15.0364 -14.3186 -14.3186 -13.9413 -13.9413 -13.5192 -13.5192 9.6045 9.6045 13.7394 13.7394 14.9910 14.9910 16.5863 16.5863 17.7385 17.7385 18.0269 18.0269 18.4284 18.4284 18.9137 18.9137 19.4379 19.4379 19.9259 19.9259 23.6327 23.6327 k = 0.0509 0.0882-0.0000 ( 1423 PWs) bands (ev): -41.4136 -41.4136 -40.9157 -40.9157 -17.7024 -17.7024 -16.5784 -16.5784 -15.0325 -15.0325 -14.3109 -14.3109 -13.9351 -13.9351 -13.5185 -13.5185 9.5623 9.5623 13.8192 13.8192 14.9781 14.9781 16.5347 16.5347 17.7823 17.7823 18.0211 18.0211 18.4143 18.4143 18.8166 18.8166 19.4645 19.4645 19.8878 19.8878 23.6614 23.6614 k = 0.0463 0.0802-0.0000 ( 1423 PWs) bands (ev): -41.4150 -41.4150 -40.9168 -40.9168 -17.7030 -17.7030 -16.5738 -16.5738 -15.0289 -15.0289 -14.3038 -14.3038 -13.9293 -13.9293 -13.5178 -13.5178 9.5235 9.5235 13.8959 13.8959 14.9663 14.9663 16.4871 16.4871 17.8183 17.8183 18.0138 18.0138 18.4051 18.4051 18.7274 18.7274 19.4887 19.4887 19.8542 19.8542 23.6875 23.6875 k = 0.0417 0.0722-0.0000 ( 1423 PWs) bands (ev): -41.4162 -41.4162 -40.9179 -40.9179 -17.7034 -17.7034 -16.5697 -16.5697 -15.0256 -15.0256 -14.2974 -14.2974 -13.9240 -13.9240 -13.5171 -13.5171 9.4881 9.4881 13.9689 13.9689 14.9554 14.9554 16.4436 16.4436 17.8447 17.8447 18.0065 18.0065 18.3997 18.3997 18.6480 18.6480 19.5101 19.5101 19.8254 19.8254 23.7107 23.7107 k = 0.0370 0.0642-0.0000 ( 1423 PWs) bands (ev): -41.4173 -41.4173 -40.9189 -40.9189 -17.7039 -17.7039 -16.5659 -16.5659 -15.0226 -15.0226 -14.2915 -14.2915 -13.9192 -13.9192 -13.5165 -13.5165 9.4563 9.4563 14.0375 14.0375 14.9456 14.9456 16.4043 16.4043 17.8604 17.8604 18.0004 18.0004 18.3969 18.3969 18.5801 18.5801 19.5281 19.5281 19.8013 19.8013 23.7310 23.7310 k = 0.0324 0.0561-0.0000 ( 1419 PWs) bands (ev): -41.4182 -41.4182 -40.9196 -40.9196 -17.7042 -17.7042 -16.5626 -16.5626 -15.0199 -15.0199 -14.2863 -14.2863 -13.9148 -13.9148 -13.5159 -13.5159 9.4281 9.4281 14.1008 14.1008 14.9368 14.9368 16.3694 16.3694 17.8659 17.8659 17.9949 17.9949 18.3957 18.3957 18.5253 18.5253 19.5425 19.5425 19.7822 19.7822 23.7483 23.7483 k = 0.0278 0.0481-0.0000 ( 1419 PWs) bands (ev): -41.4191 -41.4191 -40.9204 -40.9204 -17.7046 -17.7046 -16.5597 -16.5597 -15.0176 -15.0176 -14.2817 -14.2817 -13.9111 -13.9111 -13.5154 -13.5154 9.4036 9.4036 14.1580 14.1580 14.9292 14.9292 16.3390 16.3390 17.8639 17.8639 17.9878 17.9878 18.3952 18.3952 18.4846 18.4846 19.5530 19.5530 19.7680 19.7680 23.7628 23.7628 k = 0.0231 0.0401-0.0000 ( 1419 PWs) bands (ev): -41.4198 -41.4198 -40.9210 -40.9210 -17.7049 -17.7049 -16.5572 -16.5572 -15.0157 -15.0157 -14.2778 -14.2778 -13.9079 -13.9079 -13.5150 -13.5150 9.3827 9.3827 14.2083 14.2083 14.9227 14.9227 16.3131 16.3131 17.8574 17.8574 17.9780 17.9780 18.3949 18.3949 18.4573 18.4573 19.5599 19.5599 19.7582 19.7582 23.7744 23.7744 k = 0.0185 0.0321-0.0000 ( 1419 PWs) bands (ev): -41.4204 -41.4204 -40.9215 -40.9215 -17.7051 -17.7051 -16.5552 -16.5552 -15.0141 -15.0141 -14.2747 -14.2747 -13.9052 -13.9052 -13.5146 -13.5146 9.3656 9.3656 14.2508 14.2508 14.9173 14.9173 16.2918 16.2918 17.8490 17.8490 17.9658 17.9658 18.3945 18.3945 18.4412 18.4412 19.5638 19.5638 19.7522 19.7522 23.7836 23.7836 k = 0.0139 0.0241-0.0000 ( 1417 PWs) bands (ev): -41.4209 -41.4209 -40.9219 -40.9219 -17.7053 -17.7053 -16.5536 -16.5536 -15.0128 -15.0128 -14.2722 -14.2722 -13.9031 -13.9031 -13.5143 -13.5143 9.3522 9.3522 14.2848 14.2848 14.9131 14.9131 16.2752 16.2752 17.8404 17.8404 17.9534 17.9534 18.3943 18.3943 18.4328 18.4328 19.5654 19.5654 19.7491 19.7491 23.7904 23.7904 k = 0.0093 0.0160-0.0000 ( 1421 PWs) bands (ev): -41.4214 -41.4214 -40.9222 -40.9222 -17.7054 -17.7054 -16.5526 -16.5526 -15.0119 -15.0119 -14.2705 -14.2705 -13.9017 -13.9017 -13.5141 -13.5141 9.3427 9.3427 14.3096 14.3096 14.9101 14.9101 16.2633 16.2633 17.8331 17.8331 17.9430 17.9430 18.3945 18.3945 18.4289 18.4289 19.5658 19.5658 19.7476 19.7476 23.7952 23.7952 k = 0.0046 0.0080-0.0000 ( 1425 PWs) bands (ev): -41.4217 -41.4217 -40.9223 -40.9223 -17.7055 -17.7055 -16.5520 -16.5520 -15.0114 -15.0114 -14.2695 -14.2695 -13.9008 -13.9008 -13.5140 -13.5140 9.3370 9.3370 14.3247 14.3247 14.9083 14.9083 16.2561 16.2561 17.8281 17.8281 17.9362 17.9362 18.3948 18.3948 18.4272 18.4272 19.5657 19.5657 19.7471 19.7471 23.7979 23.7979 k = 0.0000 0.0000 0.0000 ( 1413 PWs) bands (ev): -41.4213 -41.4213 -40.9224 -40.9224 -17.7056 -17.7056 -16.5516 -16.5516 -15.0112 -15.0112 -14.2690 -14.2690 -13.9005 -13.9005 -13.5138 -13.5138 9.3350 9.3350 14.3299 14.3299 14.9077 14.9077 16.2537 16.2537 17.8264 17.8264 17.9338 17.9338 18.3950 18.3950 18.4268 18.4268 19.5657 19.5657 19.7470 19.7470 23.7988 23.7988 k = 0.0000 0.0000 0.0000 ( 1413 PWs) bands (ev): -41.4213 -41.4213 -40.9224 -40.9224 -17.7056 -17.7056 -16.5516 -16.5516 -15.0112 -15.0112 -14.2690 -14.2690 -13.9005 -13.9005 -13.5138 -13.5138 9.3350 9.3350 14.3299 14.3299 14.9077 14.9077 16.2537 16.2537 17.8264 17.8264 17.9338 17.9338 18.3950 18.3950 18.4268 18.4268 19.5657 19.5657 19.7470 19.7470 23.7988 23.7988 k = 0.0000 0.0000 0.0091 ( 1425 PWs) bands (ev): -41.4216 -41.4216 -40.9227 -40.9227 -17.7045 -17.7045 -16.5519 -16.5519 -15.0110 -15.0110 -14.2690 -14.2690 -13.9007 -13.9007 -13.5155 -13.5155 9.3368 9.3368 14.3202 14.3202 14.9110 14.9110 16.2631 16.2631 17.8273 17.8273 17.9350 17.9350 18.3966 18.3966 18.4286 18.4286 19.5646 19.5646 19.7459 19.7459 23.7939 23.7939 k = 0.0000 0.0000 0.0182 ( 1425 PWs) bands (ev): -41.4208 -41.4208 -40.9235 -40.9235 -17.7015 -17.7015 -16.5525 -16.5525 -15.0103 -15.0103 -14.2684 -14.2684 -13.9013 -13.9013 -13.5199 -13.5199 9.3422 9.3422 14.2919 14.2919 14.9207 14.9207 16.2907 16.2907 17.8301 17.8301 17.9384 17.9384 18.4016 18.4016 18.4342 18.4342 19.5613 19.5613 19.7425 19.7425 23.7791 23.7791 k = 0.0000 0.0000 0.0272 ( 1425 PWs) bands (ev): -41.4195 -41.4195 -40.9249 -40.9249 -17.6964 -17.6964 -16.5534 -16.5534 -15.0093 -15.0093 -14.2674 -14.2674 -13.9023 -13.9023 -13.5272 -13.5272 9.3511 9.3511 14.2465 14.2465 14.9369 14.9369 16.3349 16.3349 17.8348 17.8348 17.9440 17.9440 18.4099 18.4099 18.4435 18.4435 19.5560 19.5560 19.7369 19.7369 23.7546 23.7546 k = 0.0000 0.0000 0.0363 ( 1431 PWs) bands (ev): -41.4180 -41.4180 -40.9269 -40.9269 -17.6892 -17.6892 -16.5547 -16.5547 -15.0078 -15.0078 -14.2661 -14.2661 -13.9037 -13.9037 -13.5376 -13.5376 9.3636 9.3636 14.1863 14.1863 14.9595 14.9595 16.3933 16.3933 17.8412 17.8412 17.9519 17.9519 18.4215 18.4215 18.4565 18.4565 19.5485 19.5485 19.7291 19.7291 23.7205 23.7205 k = 0.0000 0.0000 0.0454 ( 1431 PWs) bands (ev): -41.4157 -41.4157 -40.9294 -40.9294 -17.6801 -17.6801 -16.5564 -16.5564 -15.0058 -15.0058 -14.2644 -14.2644 -13.9055 -13.9055 -13.5506 -13.5506 9.3795 9.3795 14.1137 14.1137 14.9886 14.9886 16.4634 16.4634 17.8495 17.8495 17.9619 17.9619 18.4366 18.4366 18.4733 18.4733 19.5389 19.5389 19.7190 19.7190 23.6772 23.6772 k = 0.0000 0.0000 0.0545 ( 1431 PWs) bands (ev): -41.4130 -41.4130 -40.9324 -40.9324 -17.6691 -17.6691 -16.5585 -16.5585 -15.0034 -15.0034 -14.2624 -14.2624 -13.9078 -13.9078 -13.5664 -13.5664 9.3990 9.3990 14.0310 14.0310 15.0239 15.0239 16.5427 16.5427 17.8594 17.8594 17.9739 17.9739 18.4552 18.4552 18.4939 18.4939 19.5273 19.5273 19.7068 19.7068 23.6251 23.6251 k = 0.0000 0.0000 0.0635 ( 1419 PWs) bands (ev): -41.4092 -41.4092 -40.9360 -40.9360 -17.6561 -17.6561 -16.5607 -16.5607 -15.0005 -15.0005 -14.2596 -14.2596 -13.9104 -13.9104 -13.5848 -13.5848 9.4218 9.4218 13.9405 13.9405 15.0655 15.0655 16.6290 16.6290 17.8711 17.8711 17.9878 17.9878 18.4774 18.4774 18.5182 18.5182 19.5136 19.5136 19.6925 19.6925 23.5644 23.5644 k = 0.0000 0.0000 0.0726 ( 1419 PWs) bands (ev): -41.4054 -41.4054 -40.9401 -40.9401 -17.6412 -17.6412 -16.5636 -16.5636 -14.9971 -14.9971 -14.2568 -14.2568 -13.9133 -13.9133 -13.6059 -13.6059 9.4480 9.4480 13.8436 13.8436 15.1132 15.1132 16.7203 16.7203 17.8844 17.8844 18.0036 18.0036 18.5032 18.5032 18.5463 18.5463 19.4981 19.4981 19.6762 19.6762 23.4958 23.4958 k = 0.0000 0.0000 0.0817 ( 1418 PWs) bands (ev): -41.4012 -41.4012 -40.9448 -40.9448 -17.6246 -17.6246 -16.5670 -16.5670 -14.9931 -14.9931 -14.2537 -14.2537 -13.9167 -13.9167 -13.6295 -13.6295 9.4776 9.4776 13.7420 13.7420 15.1670 15.1670 16.8149 16.8149 17.8993 17.8993 18.0211 18.0211 18.5327 18.5327 18.5782 18.5782 19.4807 19.4807 19.6578 19.6578 23.4196 23.4196 k = 0.0000 0.0000 0.0908 ( 1424 PWs) bands (ev): -41.3968 -41.3968 -40.9499 -40.9499 -17.6061 -17.6061 -16.5710 -16.5710 -14.9885 -14.9885 -14.2503 -14.2503 -13.9204 -13.9204 -13.6555 -13.6555 9.5104 9.5104 13.6367 13.6367 15.2267 15.2267 16.9114 16.9114 17.9157 17.9157 18.0403 18.0403 18.5660 18.5660 18.6139 18.6139 19.4616 19.4616 19.6376 19.6376 23.3365 23.3365 k = 0.0000 0.0000 0.0999 ( 1424 PWs) bands (ev): -41.3916 -41.3916 -40.9555 -40.9555 -17.5860 -17.5860 -16.5753 -16.5753 -14.9834 -14.9834 -14.2464 -14.2464 -13.9245 -13.9245 -13.6838 -13.6838 9.5463 9.5463 13.5286 13.5286 15.2921 15.2921 17.0085 17.0085 17.9335 17.9335 18.0609 18.0609 18.6032 18.6032 18.6534 18.6534 19.4408 19.4408 19.6155 19.6155 23.2468 23.2468 k = 0.0000 0.0000 0.1089 ( 1436 PWs) bands (ev): -41.3860 -41.3860 -40.9622 -40.9622 -17.5647 -17.5647 -16.5803 -16.5803 -14.9777 -14.9777 -14.2422 -14.2422 -13.9290 -13.9290 -13.7141 -13.7141 9.5854 9.5854 13.4186 13.4186 15.3630 15.3630 17.1052 17.1052 17.9527 17.9527 18.0829 18.0829 18.6443 18.6443 18.6966 18.6966 19.4185 19.4185 19.5916 19.5916 23.1513 23.1513 k = 0.0000 0.0000 0.1180 ( 1448 PWs) bands (ev): -41.3800 -41.3800 -40.9693 -40.9693 -17.5417 -17.5417 -16.5858 -16.5858 -14.9714 -14.9714 -14.2377 -14.2377 -13.9340 -13.9340 -13.7465 -13.7465 9.6275 9.6275 13.3072 13.3072 15.4393 15.4393 17.2004 17.2004 17.9733 17.9733 18.1062 18.1062 18.6893 18.6893 18.7434 18.7434 19.3948 19.3948 19.5660 19.5660 23.0504 23.0504 k = 0.0000 0.0000 0.1271 ( 1448 PWs) bands (ev): -41.3735 -41.3735 -40.9763 -40.9763 -17.5170 -17.5170 -16.5919 -16.5919 -14.9642 -14.9642 -14.2329 -14.2329 -13.9391 -13.9391 -13.7807 -13.7807 9.6726 9.6726 13.1949 13.1949 15.5208 15.5208 17.2932 17.2932 17.9952 17.9952 18.1308 18.1308 18.7383 18.7383 18.7937 18.7937 19.3701 19.3701 19.5388 19.5388 22.9446 22.9446 k = 0.0000 0.0000 0.1362 ( 1448 PWs) bands (ev): -41.3666 -41.3666 -40.9838 -40.9838 -17.4911 -17.4911 -16.5987 -16.5987 -14.9561 -14.9561 -14.2277 -14.2277 -13.9446 -13.9446 -13.8166 -13.8166 9.7205 9.7205 13.0821 13.0821 15.6072 15.6072 17.3829 17.3829 18.0183 18.0183 18.1564 18.1564 18.7913 18.7913 18.8472 18.8472 19.3445 19.3445 19.5101 19.5101 22.8346 22.8346 k = 0.0000 0.0000 0.1452 ( 1454 PWs) bands (ev): -41.3596 -41.3596 -40.9917 -40.9917 -17.4638 -17.4638 -16.6062 -16.6062 -14.9472 -14.9472 -14.2223 -14.2223 -13.9503 -13.9503 -13.8540 -13.8540 9.7713 9.7713 12.9692 12.9692 15.6982 15.6982 17.4684 17.4684 18.0426 18.0426 18.1832 18.1832 18.8483 18.8483 18.9033 18.9033 19.3188 19.3188 19.4800 19.4800 22.7208 22.7208 k = 0.0000 0.0000 0.1543 ( 1454 PWs) bands (ev): -41.3519 -41.3519 -40.9999 -40.9999 -17.4355 -17.4355 -16.6145 -16.6145 -14.9374 -14.9374 -14.2166 -14.2166 -13.9563 -13.9563 -13.8927 -13.8927 9.8248 9.8248 12.8563 12.8563 15.7935 15.7935 17.5490 17.5490 18.0680 18.0680 18.2109 18.2109 18.9092 18.9092 18.9611 18.9611 19.2941 19.2941 19.4485 19.4485 22.6036 22.6036 k = 0.0000 0.0000 0.1634 ( 1454 PWs) bands (ev): -41.3438 -41.3438 -41.0086 -41.0086 -17.4062 -17.4062 -16.6235 -16.6235 -14.9267 -14.9267 -14.2106 -14.2106 -13.9626 -13.9626 -13.9326 -13.9326 9.8810 9.8810 12.7438 12.7438 15.8928 15.8928 17.6240 17.6240 18.0945 18.0945 18.2397 18.2397 18.9741 18.9741 19.0178 19.0178 19.2730 19.2730 19.4158 19.4158 22.4837 22.4837 k = 0.0000 0.0000 0.1725 ( 1454 PWs) bands (ev): -41.3354 -41.3354 -41.0176 -41.0176 -17.3760 -17.3760 -16.6334 -16.6334 -14.9149 -14.9149 -14.2043 -14.2043 -13.9734 -13.9734 -13.9692 -13.9692 9.9397 9.9397 12.6318 12.6318 15.9957 15.9957 17.6925 17.6925 18.1221 18.1221 18.2694 18.2694 19.0428 19.0428 19.0667 19.0667 19.2624 19.2624 19.3820 19.3820 22.3614 22.3614 k = 0.0000 0.0000 0.1816 ( 1454 PWs) bands (ev): -41.3266 -41.3266 -41.0269 -41.0269 -17.3451 -17.3451 -16.6441 -16.6441 -14.9021 -14.9021 -14.1978 -14.1978 -14.0149 -14.0149 -13.9760 -13.9760 10.0010 10.0010 12.5205 12.5205 16.1017 16.1017 17.7537 17.7537 18.1508 18.1508 18.2999 18.2999 19.0935 19.0935 19.1154 19.1154 19.2766 19.2766 19.3471 19.3471 22.2371 22.2371 k = 0.0000 0.0000 0.1906 ( 1454 PWs) bands (ev): -41.3175 -41.3175 -41.0366 -41.0366 -17.3136 -17.3136 -16.6558 -16.6558 -14.8880 -14.8880 -14.1910 -14.1910 -14.0571 -14.0571 -13.9830 -13.9830 10.0647 10.0647 12.4100 12.4100 16.2105 16.2105 17.8071 17.8071 18.1803 18.1803 18.3314 18.3314 19.0909 19.0909 19.1917 19.1917 19.3113 19.3113 19.3229 19.3229 22.1113 22.1113 k = 0.0000 0.0000 0.1997 ( 1454 PWs) bands (ev): -41.3081 -41.3081 -41.0465 -41.0465 -17.2815 -17.2815 -16.6685 -16.6685 -14.8728 -14.8728 -14.1840 -14.1840 -14.0997 -14.0997 -13.9903 -13.9903 10.1308 10.1308 12.3005 12.3005 16.3216 16.3216 17.8517 17.8517 18.2109 18.2109 18.3636 18.3636 19.0702 19.0702 19.2717 19.2717 19.2747 19.2747 19.3900 19.3900 21.9843 21.9843 k = 0.0000 0.0000 0.2088 ( 1454 PWs) bands (ev): -41.2984 -41.2984 -41.0567 -41.0567 -17.2492 -17.2492 -16.6822 -16.6822 -14.8563 -14.8563 -14.1768 -14.1768 -14.1424 -14.1424 -13.9978 -13.9978 10.1992 10.1992 12.1920 12.1920 16.4343 16.4343 17.8872 17.8872 18.2423 18.2423 18.3967 18.3967 19.0416 19.0416 19.2373 19.2373 19.3553 19.3553 19.4679 19.4679 21.8566 21.8566 k = 0.0000 0.0000 0.2179 ( 1454 PWs) bands (ev): -41.2884 -41.2884 -41.0672 -41.0672 -17.2166 -17.2166 -16.6970 -16.6970 -14.8385 -14.8385 -14.1852 -14.1852 -14.1694 -14.1694 -14.0054 -14.0054 10.2699 10.2699 12.0847 12.0847 16.5482 16.5482 17.9127 17.9127 18.2746 18.2746 18.4305 18.4305 19.0090 19.0090 19.1993 19.1993 19.4423 19.4423 19.5524 19.5524 21.7284 21.7284 k = 0.0000 0.0000 0.2269 ( 1454 PWs) bands (ev): -41.2782 -41.2782 -41.0778 -41.0778 -17.1840 -17.1840 -16.7128 -16.7128 -14.8193 -14.8193 -14.2279 -14.2279 -14.1618 -14.1618 -14.0132 -14.0132 10.3428 10.3428 11.9786 11.9786 16.6626 16.6626 17.9281 17.9281 18.3077 18.3077 18.4651 18.4651 18.9744 18.9744 19.1607 19.1607 19.5328 19.5328 19.6419 19.6419 21.6000 21.6000 k = 0.0000 0.0000 0.2360 ( 1442 PWs) bands (ev): -41.2678 -41.2678 -41.0882 -41.0882 -17.1513 -17.1513 -16.7298 -16.7298 -14.7985 -14.7985 -14.2702 -14.2702 -14.1540 -14.1540 -14.0210 -14.0210 10.4178 10.4178 11.8739 11.8739 16.7769 16.7769 17.9327 17.9327 18.3416 18.3416 18.5004 18.5004 18.9384 18.9384 19.1217 19.1217 19.6266 19.6266 19.7356 19.7356 21.4719 21.4719 k = 0.0000 0.0000 0.2451 ( 1442 PWs) bands (ev): -41.2571 -41.2571 -41.0992 -41.0992 -17.1190 -17.1190 -16.7480 -16.7480 -14.7764 -14.7764 -14.3119 -14.3119 -14.1461 -14.1461 -14.0291 -14.0291 10.4949 10.4949 11.7705 11.7705 16.8902 16.8902 17.9265 17.9265 18.3762 18.3762 18.5364 18.5364 18.9014 18.9014 19.0823 19.0823 19.7236 19.7236 19.8330 19.8330 21.3441 21.3441 k = 0.0000 0.0000 0.2542 ( 1436 PWs) bands (ev): -41.2462 -41.2462 -41.1101 -41.1101 -17.0868 -17.0868 -16.7674 -16.7674 -14.7527 -14.7527 -14.3531 -14.3531 -14.1380 -14.1380 -14.0373 -14.0373 10.5741 10.5741 11.6685 11.6685 17.0020 17.0020 17.9094 17.9094 18.4114 18.4114 18.5730 18.5730 18.8638 18.8638 19.0426 19.0426 19.8237 19.8237 19.9337 19.9337 21.2171 21.2171 k = 0.0000 0.0000 0.2633 ( 1436 PWs) bands (ev): -41.2352 -41.2352 -41.1214 -41.1214 -17.0553 -17.0553 -16.7880 -16.7880 -14.7275 -14.7275 -14.3933 -14.3933 -14.1298 -14.1298 -14.0456 -14.0456 10.6553 10.6553 11.5680 11.5680 17.1112 17.1112 17.8814 17.8814 18.4473 18.4473 18.6102 18.6102 18.8258 18.8258 19.0027 19.0027 19.9268 19.9268 20.0377 20.0377 21.0910 21.0910 k = 0.0000 0.0000 0.2723 ( 1436 PWs) bands (ev): -41.2240 -41.2240 -41.1328 -41.1328 -17.0244 -17.0244 -16.8098 -16.8098 -14.7008 -14.7008 -14.4327 -14.4327 -14.1216 -14.1216 -14.0540 -14.0540 10.7384 10.7384 11.4691 11.4691 17.2172 17.2172 17.8427 17.8427 18.4837 18.4837 18.6479 18.6479 18.7875 18.7875 18.9627 18.9627 20.0327 20.0327 20.1446 20.1446 20.9661 20.9661 k = 0.0000 0.0000 0.2814 ( 1436 PWs) bands (ev): -41.2127 -41.2127 -41.1443 -41.1443 -16.9942 -16.9942 -16.8328 -16.8328 -14.6725 -14.6725 -14.4709 -14.4709 -14.1132 -14.1132 -14.0624 -14.0624 10.8235 10.8235 11.3718 11.3718 17.3190 17.3190 17.7938 17.7938 18.5207 18.5207 18.6861 18.6861 18.7491 18.7491 18.9227 18.9227 20.1414 20.1414 20.2544 20.2544 20.8426 20.8426 k = 0.0000 0.0000 0.2905 ( 1448 PWs) bands (ev): -41.2019 -41.2019 -41.1558 -41.1558 -16.9649 -16.9649 -16.8571 -16.8571 -14.6426 -14.6426 -14.5082 -14.5082 -14.1049 -14.1049 -14.0709 -14.0709 10.9104 10.9104 11.2760 11.2760 17.4158 17.4158 17.7350 17.7350 18.5581 18.5581 18.7106 18.7106 18.7248 18.7248 18.8828 18.8828 20.2526 20.2526 20.3668 20.3668 20.7207 20.7207 k = 0.0000 0.0000 0.2996 ( 1448 PWs) bands (ev): -41.1904 -41.1904 -41.1674 -41.1674 -16.9364 -16.9364 -16.8825 -16.8825 -14.6112 -14.6112 -14.5439 -14.5439 -14.0964 -14.0964 -14.0794 -14.0794 10.9991 10.9991 11.1820 11.1820 17.5067 17.5067 17.6671 17.6671 18.5958 18.5958 18.6722 18.6722 18.7639 18.7639 18.8429 18.8429 20.3664 20.3664 20.4817 20.4817 20.6005 20.6005 k = 0.0000 0.0000 0.3086 ( 1448 PWs) bands (ev): -41.1789 -41.1789 -41.1789 -41.1789 -16.9089 -16.9089 -16.9089 -16.9089 -14.5783 -14.5783 -14.5783 -14.5783 -14.0879 -14.0879 -14.0879 -14.0879 11.0897 11.0897 11.0897 11.0897 17.5907 17.5907 17.5907 17.5907 18.6339 18.6339 18.6339 18.6339 18.8033 18.8033 18.8033 18.8033 20.4824 20.4824 20.4824 20.4824 20.5989 20.5989 k = 0.0000 0.0000 0.3086 ( 1448 PWs) bands (ev): -41.1789 -41.1789 -41.1789 -41.1789 -16.9089 -16.9089 -16.9089 -16.9089 -14.5783 -14.5783 -14.5783 -14.5783 -14.0879 -14.0879 -14.0879 -14.0879 11.0897 11.0897 11.0897 11.0897 17.5907 17.5907 17.5907 17.5907 18.6339 18.6339 18.6339 18.6339 18.8033 18.8033 18.8033 18.8033 20.4824 20.4824 20.4824 20.4824 20.5989 20.5989 k = 0.0081 0.0047 0.3086 ( 1448 PWs) bands (ev): -41.1789 -41.1789 -41.1789 -41.1789 -16.9090 -16.9090 -16.9090 -16.9090 -14.5784 -14.5784 -14.5784 -14.5784 -14.0883 -14.0883 -14.0883 -14.0883 11.0908 11.0908 11.0908 11.0908 17.5909 17.5909 17.5909 17.5909 18.6336 18.6336 18.6336 18.6336 18.8030 18.8030 18.8030 18.8030 20.4819 20.4819 20.4819 20.4819 20.5984 20.5984 k = 0.0161 0.0093 0.3086 ( 1448 PWs) bands (ev): -41.1787 -41.1787 -41.1787 -41.1787 -16.9093 -16.9093 -16.9093 -16.9093 -14.5787 -14.5787 -14.5787 -14.5787 -14.0893 -14.0893 -14.0893 -14.0893 11.0942 11.0942 11.0942 11.0942 17.5913 17.5913 17.5913 17.5913 18.6327 18.6327 18.6327 18.6327 18.8026 18.8026 18.8026 18.8026 20.4803 20.4803 20.4803 20.4803 20.5969 20.5969 k = 0.0242 0.0140 0.3086 ( 1448 PWs) bands (ev): -41.1783 -41.1783 -41.1783 -41.1783 -16.9098 -16.9098 -16.9098 -16.9098 -14.5792 -14.5792 -14.5792 -14.5792 -14.0909 -14.0909 -14.0909 -14.0909 11.0997 11.0997 11.0997 11.0997 17.5920 17.5920 17.5920 17.5920 18.6303 18.6303 18.6303 18.6303 18.8027 18.8027 18.8027 18.8027 20.4777 20.4777 20.4777 20.4777 20.5944 20.5944 k = 0.0323 0.0186 0.3086 ( 1444 PWs) bands (ev): -41.1778 -41.1778 -41.1778 -41.1778 -16.9105 -16.9105 -16.9105 -16.9105 -14.5800 -14.5800 -14.5800 -14.5800 -14.0932 -14.0932 -14.0932 -14.0932 11.1075 11.1075 11.1075 11.1075 17.5930 17.5930 17.5930 17.5930 18.6255 18.6255 18.6255 18.6255 18.8045 18.8045 18.8045 18.8045 20.4741 20.4741 20.4741 20.4741 20.5910 20.5910 k = 0.0403 0.0233 0.3086 ( 1440 PWs) bands (ev): -41.1771 -41.1771 -41.1771 -41.1771 -16.9114 -16.9114 -16.9114 -16.9114 -14.5809 -14.5809 -14.5809 -14.5809 -14.0961 -14.0961 -14.0961 -14.0961 11.1174 11.1174 11.1174 11.1174 17.5941 17.5941 17.5941 17.5941 18.6172 18.6172 18.6172 18.6172 18.8095 18.8095 18.8095 18.8095 20.4696 20.4696 20.4696 20.4696 20.5867 20.5867 k = 0.0484 0.0279 0.3086 ( 1444 PWs) bands (ev): -41.1765 -41.1765 -41.1765 -41.1765 -16.9125 -16.9125 -16.9125 -16.9125 -14.5821 -14.5821 -14.5821 -14.5821 -14.0996 -14.0996 -14.0996 -14.0996 11.1294 11.1294 11.1294 11.1294 17.5953 17.5953 17.5953 17.5953 18.6046 18.6046 18.6046 18.6046 18.8184 18.8184 18.8184 18.8184 20.4641 20.4641 20.4641 20.4641 20.5816 20.5816 k = 0.0565 0.0326 0.3086 ( 1444 PWs) bands (ev): -41.1757 -41.1757 -41.1757 -41.1757 -16.9138 -16.9138 -16.9138 -16.9138 -14.5835 -14.5835 -14.5835 -14.5835 -14.1038 -14.1038 -14.1038 -14.1038 11.1434 11.1434 11.1434 11.1434 17.5964 17.5964 17.5964 17.5964 18.5875 18.5875 18.5875 18.5875 18.8320 18.8320 18.8320 18.8320 20.4578 20.4578 20.4578 20.4578 20.5757 20.5757 k = 0.0645 0.0372 0.3086 ( 1440 PWs) bands (ev): -41.1747 -41.1747 -41.1747 -41.1747 -16.9153 -16.9153 -16.9153 -16.9153 -14.5851 -14.5851 -14.5851 -14.5851 -14.1084 -14.1084 -14.1084 -14.1084 11.1594 11.1594 11.1594 11.1594 17.5972 17.5972 17.5972 17.5972 18.5663 18.5663 18.5663 18.5663 18.8503 18.8503 18.8503 18.8503 20.4507 20.4507 20.4507 20.4507 20.5692 20.5692 k = 0.0726 0.0419 0.3086 ( 1450 PWs) bands (ev): -41.1739 -41.1739 -41.1739 -41.1739 -16.9171 -16.9171 -16.9171 -16.9171 -14.5870 -14.5870 -14.5870 -14.5870 -14.1138 -14.1138 -14.1138 -14.1138 11.1772 11.1772 11.1772 11.1772 17.5975 17.5975 17.5975 17.5975 18.5416 18.5416 18.5416 18.5416 18.8728 18.8728 18.8728 18.8728 20.4429 20.4429 20.4429 20.4429 20.5620 20.5620 k = 0.0806 0.0466 0.3086 ( 1444 PWs) bands (ev): -41.1726 -41.1726 -41.1726 -41.1726 -16.9189 -16.9189 -16.9189 -16.9189 -14.5890 -14.5890 -14.5890 -14.5890 -14.1196 -14.1196 -14.1196 -14.1196 11.1969 11.1969 11.1969 11.1969 17.5971 17.5971 17.5971 17.5971 18.5145 18.5145 18.5145 18.5145 18.8995 18.8995 18.8995 18.8995 20.4345 20.4345 20.4345 20.4345 20.5544 20.5544 k = 0.0887 0.0512 0.3086 ( 1444 PWs) bands (ev): -41.1713 -41.1713 -41.1713 -41.1713 -16.9210 -16.9210 -16.9210 -16.9210 -14.5912 -14.5912 -14.5912 -14.5912 -14.1259 -14.1259 -14.1259 -14.1259 11.2182 11.2182 11.2182 11.2182 17.5954 17.5954 17.5954 17.5954 18.4859 18.4859 18.4859 18.4859 18.9298 18.9298 18.9298 18.9298 20.4256 20.4256 20.4256 20.4257 20.5464 20.5464 k = 0.0968 0.0559 0.3086 ( 1440 PWs) bands (ev): -41.1698 -41.1698 -41.1698 -41.1698 -16.9233 -16.9233 -16.9233 -16.9233 -14.5937 -14.5937 -14.5937 -14.5937 -14.1327 -14.1327 -14.1327 -14.1327 11.2411 11.2411 11.2411 11.2411 17.5920 17.5920 17.5920 17.5920 18.4568 18.4568 18.4568 18.4568 18.9634 18.9634 18.9634 18.9634 20.4164 20.4164 20.4164 20.4164 20.5381 20.5381 k = 0.1048 0.0605 0.3086 ( 1440 PWs) bands (ev): -41.1683 -41.1683 -41.1683 -41.1683 -16.9257 -16.9257 -16.9257 -16.9257 -14.5964 -14.5964 -14.5964 -14.5964 -14.1400 -14.1400 -14.1400 -14.1400 11.2655 11.2655 11.2655 11.2655 17.5864 17.5864 17.5864 17.5864 18.4283 18.4283 18.4283 18.4283 19.0001 19.0001 19.0001 19.0001 20.4068 20.4068 20.4068 20.4069 20.5297 20.5297 k = 0.1129 0.0652 0.3086 ( 1440 PWs) bands (ev): -41.1668 -41.1668 -41.1668 -41.1668 -16.9284 -16.9284 -16.9284 -16.9284 -14.5993 -14.5993 -14.5993 -14.5993 -14.1477 -14.1477 -14.1477 -14.1477 11.2912 11.2912 11.2912 11.2912 17.5779 17.5779 17.5779 17.5779 18.4015 18.4015 18.4015 18.4015 19.0397 19.0397 19.0397 19.0397 20.3972 20.3972 20.3972 20.3972 20.5214 20.5214 k = 0.1210 0.0698 0.3086 ( 1436 PWs) bands (ev): -41.1650 -41.1650 -41.1650 -41.1650 -16.9312 -16.9312 -16.9312 -16.9312 -14.6023 -14.6023 -14.6023 -14.6023 -14.1557 -14.1557 -14.1557 -14.1557 11.3180 11.3180 11.3180 11.3180 17.5659 17.5659 17.5659 17.5659 18.3776 18.3776 18.3776 18.3776 19.0817 19.0817 19.0817 19.0817 20.3876 20.3876 20.3876 20.3876 20.5134 20.5134 k = 0.1290 0.0745 0.3086 ( 1436 PWs) bands (ev): -41.1632 -41.1632 -41.1632 -41.1632 -16.9343 -16.9343 -16.9343 -16.9343 -14.6057 -14.6057 -14.6057 -14.6057 -14.1641 -14.1641 -14.1641 -14.1641 11.3459 11.3459 11.3459 11.3459 17.5495 17.5495 17.5495 17.5495 18.3577 18.3577 18.3577 18.3577 19.1260 19.1260 19.1260 19.1260 20.3782 20.3782 20.3782 20.3782 20.5057 20.5057 k = 0.1371 0.0792 0.3086 ( 1444 PWs) bands (ev): -41.1615 -41.1615 -41.1615 -41.1615 -16.9375 -16.9375 -16.9375 -16.9375 -14.6093 -14.6093 -14.6093 -14.6093 -14.1729 -14.1729 -14.1729 -14.1729 11.3747 11.3747 11.3747 11.3747 17.5283 17.5283 17.5283 17.5283 18.3428 18.3428 18.3428 18.3428 19.1722 19.1722 19.1722 19.1722 20.3692 20.3692 20.3692 20.3692 20.4987 20.4987 k = 0.1452 0.0838 0.3086 ( 1450 PWs) bands (ev): -41.1597 -41.1597 -41.1597 -41.1597 -16.9410 -16.9410 -16.9410 -16.9410 -14.6131 -14.6131 -14.6131 -14.6131 -14.1819 -14.1819 -14.1819 -14.1819 11.4043 11.4043 11.4043 11.4043 17.5018 17.5018 17.5018 17.5018 18.3337 18.3337 18.3337 18.3337 19.2200 19.2200 19.2200 19.2200 20.3608 20.3608 20.3608 20.3608 20.4927 20.4927 k = 0.1532 0.0885 0.3086 ( 1436 PWs) bands (ev): -41.1573 -41.1573 -41.1573 -41.1573 -16.9444 -16.9444 -16.9444 -16.9444 -14.6170 -14.6170 -14.6170 -14.6170 -14.1910 -14.1910 -14.1910 -14.1910 11.4345 11.4345 11.4345 11.4345 17.4700 17.4700 17.4700 17.4700 18.3308 18.3308 18.3308 18.3308 19.2689 19.2689 19.2689 19.2689 20.3531 20.3531 20.3531 20.3531 20.4879 20.4879 k = 0.1613 0.0931 0.3086 ( 1438 PWs) bands (ev): -41.1553 -41.1553 -41.1553 -41.1553 -16.9482 -16.9482 -16.9482 -16.9482 -14.6212 -14.6212 -14.6212 -14.6212 -14.2005 -14.2005 -14.2005 -14.2005 11.4651 11.4651 11.4651 11.4651 17.4329 17.4329 17.4329 17.4329 18.3344 18.3344 18.3344 18.3344 19.3185 19.3185 19.3185 19.3185 20.3464 20.3464 20.3464 20.3465 20.4848 20.4848 k = 0.1694 0.0978 0.3086 ( 1442 PWs) bands (ev): -41.1532 -41.1532 -41.1532 -41.1532 -16.9521 -16.9521 -16.9521 -16.9521 -14.6256 -14.6256 -14.6256 -14.6256 -14.2101 -14.2101 -14.2101 -14.2101 11.4960 11.4960 11.4960 11.4960 17.3909 17.3909 17.3909 17.3909 18.3443 18.3443 18.3443 18.3443 19.3681 19.3681 19.3681 19.3681 20.3410 20.3410 20.3410 20.3410 20.4838 20.4838 k = 0.1774 0.1024 0.3086 ( 1438 PWs) bands (ev): -41.1509 -41.1509 -41.1509 -41.1509 -16.9561 -16.9561 -16.9561 -16.9561 -14.6302 -14.6302 -14.6302 -14.6302 -14.2197 -14.2197 -14.2197 -14.2197 11.5271 11.5271 11.5271 11.5271 17.3445 17.3445 17.3445 17.3445 18.3605 18.3605 18.3605 18.3605 19.4171 19.4171 19.4171 19.4171 20.3369 20.3369 20.3369 20.3369 20.4856 20.4856 k = 0.1855 0.1071 0.3086 ( 1438 PWs) bands (ev): -41.1486 -41.1486 -41.1486 -41.1486 -16.9603 -16.9603 -16.9603 -16.9603 -14.6350 -14.6350 -14.6350 -14.6350 -14.2294 -14.2294 -14.2294 -14.2294 11.5582 11.5582 11.5582 11.5582 17.2943 17.2943 17.2943 17.2943 18.3824 18.3824 18.3824 18.3824 19.4648 19.4648 19.4648 19.4648 20.3345 20.3345 20.3345 20.3345 20.4907 20.4907 k = 0.1935 0.1117 0.3086 ( 1434 PWs) bands (ev): -41.1461 -41.1461 -41.1461 -41.1461 -16.9646 -16.9646 -16.9646 -16.9646 -14.6400 -14.6400 -14.6400 -14.6400 -14.2391 -14.2391 -14.2391 -14.2391 11.5891 11.5891 11.5891 11.5891 17.2410 17.2410 17.2410 17.2410 18.4097 18.4097 18.4097 18.4097 19.5102 19.5102 19.5102 19.5102 20.3340 20.3340 20.3340 20.3340 20.5000 20.5000 k = 0.2016 0.1164 0.3086 ( 1430 PWs) bands (ev): -41.1436 -41.1436 -41.1436 -41.1436 -16.9690 -16.9690 -16.9690 -16.9690 -14.6452 -14.6452 -14.6452 -14.6452 -14.2488 -14.2488 -14.2488 -14.2488 11.6197 11.6197 11.6197 11.6197 17.1852 17.1852 17.1852 17.1852 18.4420 18.4420 18.4420 18.4420 19.5525 19.5525 19.5525 19.5525 20.3354 20.3354 20.3354 20.3354 20.5145 20.5145 k = 0.2097 0.1211 0.3086 ( 1430 PWs) bands (ev): -41.1412 -41.1412 -41.1412 -41.1412 -16.9736 -16.9736 -16.9736 -16.9736 -14.6506 -14.6506 -14.6506 -14.6506 -14.2585 -14.2585 -14.2585 -14.2585 11.6499 11.6499 11.6499 11.6499 17.1274 17.1274 17.1274 17.1274 18.4787 18.4787 18.4787 18.4787 19.5909 19.5909 19.5909 19.5909 20.3388 20.3388 20.3388 20.3388 20.5349 20.5349 k = 0.2177 0.1257 0.3086 ( 1430 PWs) bands (ev): -41.1387 -41.1387 -41.1387 -41.1387 -16.9782 -16.9782 -16.9782 -16.9782 -14.6563 -14.6563 -14.6563 -14.6563 -14.2681 -14.2681 -14.2681 -14.2681 11.6795 11.6795 11.6795 11.6795 17.0681 17.0681 17.0681 17.0681 18.5195 18.5195 18.5195 18.5195 19.6246 19.6246 19.6246 19.6246 20.3444 20.3444 20.3444 20.3444 20.5622 20.5622 k = 0.2258 0.1304 0.3086 ( 1430 PWs) bands (ev): -41.1363 -41.1363 -41.1363 -41.1363 -16.9830 -16.9830 -16.9830 -16.9830 -14.6621 -14.6621 -14.6621 -14.6621 -14.2775 -14.2775 -14.2775 -14.2775 11.7085 11.7085 11.7085 11.7085 17.0078 17.0078 17.0078 17.0078 18.5639 18.5639 18.5639 18.5639 19.6530 19.6530 19.6530 19.6530 20.3524 20.3524 20.3524 20.3524 20.5970 20.5970 k = 0.2339 0.1350 0.3086 ( 1438 PWs) bands (ev): -41.1339 -41.1339 -41.1339 -41.1339 -16.9880 -16.9880 -16.9880 -16.9880 -14.6681 -14.6681 -14.6681 -14.6681 -14.2869 -14.2869 -14.2869 -14.2869 11.7367 11.7367 11.7367 11.7367 16.9469 16.9469 16.9469 16.9469 18.6114 18.6114 18.6114 18.6114 19.6760 19.6760 19.6760 19.6760 20.3627 20.3627 20.3627 20.3627 20.6394 20.6394 k = 0.2419 0.1397 0.3086 ( 1432 PWs) bands (ev): -41.1313 -41.1313 -41.1313 -41.1313 -16.9929 -16.9929 -16.9929 -16.9929 -14.6742 -14.6742 -14.6742 -14.6742 -14.2959 -14.2959 -14.2959 -14.2959 11.7640 11.7640 11.7640 11.7640 16.8856 16.8856 16.8856 16.8856 18.6617 18.6617 18.6617 18.6617 19.6936 19.6936 19.6936 19.6936 20.3758 20.3758 20.3758 20.3758 20.6894 20.6894 k = 0.2500 0.1443 0.3086 ( 1432 PWs) bands (ev): -41.1287 -41.1287 -41.1287 -41.1287 -16.9980 -16.9980 -16.9980 -16.9980 -14.6805 -14.6805 -14.6805 -14.6805 -14.3048 -14.3048 -14.3048 -14.3048 11.7904 11.7904 11.7904 11.7904 16.8244 16.8244 16.8244 16.8244 18.7143 18.7143 18.7143 18.7143 19.7062 19.7062 19.7062 19.7062 20.3918 20.3918 20.3918 20.3918 20.7467 20.7467 k = 0.2581 0.1490 0.3086 ( 1432 PWs) bands (ev): -41.1262 -41.1262 -41.1262 -41.1262 -17.0031 -17.0031 -17.0031 -17.0031 -14.6869 -14.6869 -14.6869 -14.6869 -14.3135 -14.3135 -14.3135 -14.3135 11.8158 11.8158 11.8158 11.8158 16.7635 16.7635 16.7635 16.7635 18.7685 18.7685 18.7685 18.7685 19.7143 19.7143 19.7143 19.7143 20.4113 20.4113 20.4113 20.4113 20.8105 20.8105 k = 0.2661 0.1536 0.3086 ( 1432 PWs) bands (ev): -41.1237 -41.1237 -41.1237 -41.1237 -17.0082 -17.0082 -17.0082 -17.0082 -14.6934 -14.6934 -14.6934 -14.6934 -14.3219 -14.3219 -14.3219 -14.3219 11.8400 11.8400 11.8400 11.8400 16.7030 16.7030 16.7030 16.7030 18.8239 18.8239 18.8239 18.8239 19.7184 19.7184 19.7184 19.7184 20.4347 20.4347 20.4347 20.4347 20.8801 20.8801 k = 0.2742 0.1583 0.3086 ( 1432 PWs) bands (ev): -41.1211 -41.1211 -41.1211 -41.1211 -17.0134 -17.0134 -17.0134 -17.0134 -14.7001 -14.7001 -14.7001 -14.7001 -14.3300 -14.3300 -14.3300 -14.3300 11.8631 11.8631 11.8631 11.8631 16.6433 16.6433 16.6433 16.6433 18.8798 18.8798 18.8798 18.8798 19.7193 19.7193 19.7193 19.7193 20.4625 20.4625 20.4625 20.4625 20.9548 20.9548 k = 0.2823 0.1630 0.3086 ( 1428 PWs) bands (ev): -41.1185 -41.1185 -41.1185 -41.1185 -17.0185 -17.0185 -17.0185 -17.0185 -14.7068 -14.7068 -14.7068 -14.7068 -14.3377 -14.3377 -14.3377 -14.3377 11.8851 11.8851 11.8851 11.8851 16.5845 16.5845 16.5845 16.5845 18.9357 18.9357 18.9357 18.9357 19.7174 19.7174 19.7174 19.7174 20.4952 20.4952 20.4952 20.4952 21.0338 21.0338 k = 0.2903 0.1676 0.3086 ( 1428 PWs) bands (ev): -41.1161 -41.1161 -41.1161 -41.1161 -17.0237 -17.0237 -17.0237 -17.0237 -14.7135 -14.7135 -14.7135 -14.7135 -14.3452 -14.3452 -14.3452 -14.3452 11.9058 11.9058 11.9058 11.9058 16.5268 16.5268 16.5268 16.5268 18.9908 18.9908 18.9908 18.9908 19.7133 19.7133 19.7133 19.7133 20.5334 20.5334 20.5334 20.5334 21.1163 21.1163 k = 0.2984 0.1723 0.3086 ( 1432 PWs) bands (ev): -41.1137 -41.1137 -41.1137 -41.1137 -17.0289 -17.0289 -17.0289 -17.0289 -14.7204 -14.7204 -14.7204 -14.7204 -14.3525 -14.3525 -14.3525 -14.3525 11.9253 11.9253 11.9253 11.9253 16.4703 16.4703 16.4703 16.4703 19.0445 19.0445 19.0445 19.0445 19.7074 19.7074 19.7074 19.7074 20.5775 20.5775 20.5775 20.5775 21.2017 21.2017 k = 0.3065 0.1769 0.3086 ( 1428 PWs) bands (ev): -41.1112 -41.1112 -41.1112 -41.1112 -17.0340 -17.0340 -17.0340 -17.0340 -14.7271 -14.7271 -14.7271 -14.7271 -14.3593 -14.3593 -14.3593 -14.3593 11.9436 11.9436 11.9436 11.9436 16.4151 16.4151 16.4151 16.4151 19.0962 19.0962 19.0962 19.0962 19.7003 19.7003 19.7003 19.7003 20.6280 20.6280 20.6280 20.6280 21.2894 21.2894 k = 0.3145 0.1816 0.3086 ( 1432 PWs) bands (ev): -41.1089 -41.1089 -41.1089 -41.1089 -17.0392 -17.0392 -17.0392 -17.0392 -14.7339 -14.7339 -14.7339 -14.7339 -14.3659 -14.3659 -14.3659 -14.3659 11.9607 11.9607 11.9607 11.9607 16.3615 16.3615 16.3615 16.3615 19.1453 19.1453 19.1453 19.1453 19.6920 19.6920 19.6920 19.6920 20.6852 20.6852 20.6852 20.6852 21.3788 21.3788 k = 0.3226 0.1862 0.3086 ( 1436 PWs) bands (ev): -41.1067 -41.1067 -41.1067 -41.1067 -17.0442 -17.0442 -17.0442 -17.0442 -14.7407 -14.7407 -14.7407 -14.7407 -14.3722 -14.3722 -14.3722 -14.3722 11.9766 11.9766 11.9766 11.9766 16.3094 16.3094 16.3094 16.3094 19.1914 19.1914 19.1914 19.1914 19.6831 19.6831 19.6831 19.6831 20.7493 20.7493 20.7493 20.7493 21.4693 21.4693 k = 0.3306 0.1909 0.3086 ( 1444 PWs) bands (ev): -41.1046 -41.1046 -41.1046 -41.1046 -17.0493 -17.0493 -17.0493 -17.0493 -14.7475 -14.7475 -14.7475 -14.7475 -14.3781 -14.3781 -14.3781 -14.3781 11.9914 11.9914 11.9914 11.9914 16.2590 16.2590 16.2590 16.2590 19.2342 19.2342 19.2342 19.2342 19.6736 19.6736 19.6736 19.6736 20.8203 20.8203 20.8203 20.8203 21.5606 21.5606 k = 0.3387 0.1956 0.3086 ( 1444 PWs) bands (ev): -41.1024 -41.1024 -41.1024 -41.1024 -17.0541 -17.0541 -17.0541 -17.0541 -14.7541 -14.7541 -14.7541 -14.7541 -14.3837 -14.3837 -14.3837 -14.3837 12.0050 12.0050 12.0050 12.0050 16.2105 16.2105 16.2105 16.2105 19.2734 19.2734 19.2734 19.2734 19.6639 19.6639 19.6639 19.6639 20.8982 20.8982 20.8982 20.8982 21.6520 21.6520 k = 0.3468 0.2002 0.3086 ( 1444 PWs) bands (ev): -41.1003 -41.1003 -41.1003 -41.1003 -17.0589 -17.0589 -17.0589 -17.0589 -14.7605 -14.7605 -14.7605 -14.7605 -14.3889 -14.3889 -14.3889 -14.3889 12.0175 12.0175 12.0175 12.0175 16.1638 16.1638 16.1638 16.1638 19.3090 19.3090 19.3090 19.3090 19.6541 19.6541 19.6541 19.6541 20.9827 20.9827 20.9827 20.9827 21.7433 21.7433 k = 0.3548 0.2049 0.3086 ( 1442 PWs) bands (ev): -41.0982 -41.0982 -41.0982 -41.0982 -17.0635 -17.0635 -17.0635 -17.0635 -14.7668 -14.7668 -14.7668 -14.7668 -14.3938 -14.3938 -14.3938 -14.3938 12.0290 12.0290 12.0290 12.0290 16.1191 16.1191 16.1191 16.1191 19.3409 19.3409 19.3409 19.3409 19.6443 19.6443 19.6443 19.6443 21.0734 21.0734 21.0734 21.0734 21.8338 21.8338 k = 0.3629 0.2095 0.3086 ( 1446 PWs) bands (ev): -41.0963 -41.0963 -41.0963 -41.0963 -17.0680 -17.0680 -17.0680 -17.0680 -14.7729 -14.7729 -14.7729 -14.7729 -14.3984 -14.3984 -14.3984 -14.3984 12.0394 12.0394 12.0394 12.0394 16.0764 16.0764 16.0764 16.0764 19.3692 19.3692 19.3692 19.3692 19.6347 19.6347 19.6347 19.6347 21.1695 21.1695 21.1695 21.1695 21.9231 21.9231 k = 0.3710 0.2142 0.3086 ( 1444 PWs) bands (ev): -41.0944 -41.0944 -41.0944 -41.0944 -17.0723 -17.0723 -17.0723 -17.0723 -14.7788 -14.7788 -14.7788 -14.7788 -14.4027 -14.4027 -14.4027 -14.4027 12.0489 12.0489 12.0489 12.0489 16.0359 16.0359 16.0359 16.0359 19.3942 19.3942 19.3942 19.3942 19.6255 19.6255 19.6255 19.6255 21.2706 21.2706 21.2706 21.2706 22.0108 22.0108 k = 0.3790 0.2188 0.3086 ( 1444 PWs) bands (ev): -41.0925 -41.0925 -41.0925 -41.0925 -17.0765 -17.0765 -17.0765 -17.0765 -14.7845 -14.7845 -14.7845 -14.7845 -14.4067 -14.4067 -14.4067 -14.4067 12.0575 12.0575 12.0575 12.0575 15.9975 15.9975 15.9975 15.9975 19.4160 19.4160 19.4160 19.4160 19.6168 19.6168 19.6168 19.6168 21.3757 21.3757 21.3757 21.3757 22.0965 22.0965 k = 0.3871 0.2235 0.3086 ( 1444 PWs) bands (ev): -41.0908 -41.0908 -41.0908 -41.0908 -17.0805 -17.0805 -17.0805 -17.0805 -14.7900 -14.7900 -14.7900 -14.7900 -14.4104 -14.4104 -14.4104 -14.4104 12.0652 12.0652 12.0652 12.0652 15.9613 15.9613 15.9613 15.9613 19.4347 19.4347 19.4347 19.4347 19.6088 19.6088 19.6088 19.6088 21.4840 21.4840 21.4840 21.4840 22.1796 22.1796 k = 0.3952 0.2281 0.3086 ( 1440 PWs) bands (ev): -41.0891 -41.0891 -41.0891 -41.0891 -17.0842 -17.0842 -17.0842 -17.0842 -14.7951 -14.7951 -14.7951 -14.7951 -14.4137 -14.4137 -14.4137 -14.4137 12.0722 12.0722 12.0722 12.0722 15.9274 15.9274 15.9274 15.9274 19.4506 19.4506 19.4506 19.4506 19.6015 19.6015 19.6015 19.6015 21.5945 21.5945 21.5945 21.5945 22.2598 22.2598 k = 0.4032 0.2328 0.3086 ( 1438 PWs) bands (ev): -41.0876 -41.0876 -41.0876 -41.0876 -17.0877 -17.0877 -17.0877 -17.0877 -14.7999 -14.7999 -14.7999 -14.7999 -14.4168 -14.4168 -14.4168 -14.4168 12.0783 12.0783 12.0783 12.0783 15.8959 15.8959 15.8959 15.8959 19.4639 19.4639 19.4639 19.4639 19.5952 19.5952 19.5952 19.5952 21.7061 21.7061 21.7061 21.7061 22.3365 22.3365 k = 0.4113 0.2375 0.3086 ( 1442 PWs) bands (ev): -41.0862 -41.0862 -41.0862 -41.0862 -17.0911 -17.0911 -17.0911 -17.0911 -14.8045 -14.8045 -14.8045 -14.8045 -14.4197 -14.4197 -14.4197 -14.4197 12.0838 12.0838 12.0838 12.0838 15.8667 15.8667 15.8667 15.8667 19.4746 19.4746 19.4746 19.4746 19.5899 19.5899 19.5899 19.5899 21.8177 21.8177 21.8177 21.8177 22.4093 22.4093 k = 0.4194 0.2421 0.3086 ( 1442 PWs) bands (ev): -41.0849 -41.0849 -41.0849 -41.0849 -17.0942 -17.0942 -17.0942 -17.0942 -14.8087 -14.8087 -14.8087 -14.8087 -14.4222 -14.4222 -14.4222 -14.4222 12.0886 12.0886 12.0886 12.0886 15.8399 15.8399 15.8399 15.8399 19.4829 19.4829 19.4829 19.4829 19.5858 19.5858 19.5858 19.5858 21.9280 21.9280 21.9280 21.9280 22.4777 22.4777 k = 0.4274 0.2468 0.3086 ( 1442 PWs) bands (ev): -41.0838 -41.0838 -41.0838 -41.0838 -17.0970 -17.0970 -17.0970 -17.0970 -14.8126 -14.8126 -14.8126 -14.8126 -14.4245 -14.4245 -14.4245 -14.4245 12.0928 12.0928 12.0928 12.0928 15.8156 15.8156 15.8156 15.8156 19.4889 19.4889 19.4889 19.4889 19.5830 19.5830 19.5830 19.5830 22.0357 22.0357 22.0357 22.0357 22.5413 22.5413 k = 0.4355 0.2514 0.3086 ( 1442 PWs) bands (ev): -41.0827 -41.0827 -41.0827 -41.0827 -17.0995 -17.0995 -17.0995 -17.0995 -14.8161 -14.8161 -14.8161 -14.8161 -14.4266 -14.4266 -14.4266 -14.4266 12.0964 12.0964 12.0964 12.0964 15.7937 15.7937 15.7937 15.7937 19.4929 19.4929 19.4929 19.4929 19.5814 19.5814 19.5814 19.5814 22.1392 22.1392 22.1392 22.1392 22.5997 22.5997 k = 0.4435 0.2561 0.3086 ( 1442 PWs) bands (ev): -41.0817 -41.0817 -41.0817 -41.0817 -17.1018 -17.1018 -17.1018 -17.1018 -14.8192 -14.8192 -14.8192 -14.8192 -14.4284 -14.4284 -14.4284 -14.4284 12.0996 12.0996 12.0996 12.0996 15.7744 15.7744 15.7744 15.7744 19.4953 19.4953 19.4953 19.4953 19.5808 19.5808 19.5808 19.5808 22.2370 22.2370 22.2370 22.2370 22.6524 22.6524 k = 0.4516 0.2607 0.3086 ( 1446 PWs) bands (ev): -41.0810 -41.0810 -41.0810 -41.0810 -17.1038 -17.1038 -17.1038 -17.1038 -14.8220 -14.8220 -14.8220 -14.8220 -14.4299 -14.4299 -14.4299 -14.4299 12.1022 12.1022 12.1022 12.1022 15.7576 15.7576 15.7576 15.7576 19.4965 19.4965 19.4965 19.4965 19.5809 19.5809 19.5809 19.5809 22.3272 22.3272 22.3272 22.3272 22.6992 22.6992 k = 0.4597 0.2654 0.3086 ( 1444 PWs) bands (ev): -41.0802 -41.0802 -41.0802 -41.0802 -17.1055 -17.1055 -17.1055 -17.1055 -14.8243 -14.8243 -14.8243 -14.8243 -14.4312 -14.4312 -14.4312 -14.4312 12.1044 12.1044 12.1044 12.1044 15.7433 15.7433 15.7433 15.7433 19.4967 19.4967 19.4967 19.4967 19.5816 19.5816 19.5816 19.5816 22.4079 22.4079 22.4079 22.4079 22.7395 22.7395 k = 0.4677 0.2701 0.3086 ( 1444 PWs) bands (ev): -41.0797 -41.0797 -41.0797 -41.0797 -17.1069 -17.1069 -17.1069 -17.1069 -14.8262 -14.8262 -14.8262 -14.8262 -14.4322 -14.4322 -14.4322 -14.4322 12.1061 12.1061 12.1061 12.1061 15.7316 15.7316 15.7316 15.7316 19.4965 19.4965 19.4965 19.4965 19.5824 19.5824 19.5824 19.5824 22.4774 22.4774 22.4774 22.4774 22.7731 22.7731 k = 0.4758 0.2747 0.3086 ( 1448 PWs) bands (ev): -41.0793 -41.0793 -41.0793 -41.0793 -17.1081 -17.1081 -17.1081 -17.1081 -14.8278 -14.8278 -14.8278 -14.8278 -14.4331 -14.4331 -14.4331 -14.4331 12.1074 12.1074 12.1074 12.1074 15.7225 15.7225 15.7225 15.7225 19.4961 19.4961 19.4961 19.4961 19.5832 19.5832 19.5832 19.5832 22.5337 22.5337 22.5337 22.5337 22.7997 22.7997 k = 0.4839 0.2794 0.3086 ( 1444 PWs) bands (ev): -41.0789 -41.0789 -41.0789 -41.0789 -17.1088 -17.1088 -17.1088 -17.1088 -14.8288 -14.8288 -14.8288 -14.8288 -14.4336 -14.4336 -14.4336 -14.4336 12.1083 12.1083 12.1083 12.1083 15.7160 15.7160 15.7160 15.7160 19.4957 19.4957 19.4957 19.4957 19.5839 19.5839 19.5839 19.5839 22.5752 22.5752 22.5752 22.5752 22.8189 22.8189 k = 0.4919 0.2840 0.3086 ( 1444 PWs) bands (ev): -41.0787 -41.0787 -41.0787 -41.0787 -17.1093 -17.1093 -17.1093 -17.1093 -14.8295 -14.8295 -14.8295 -14.8295 -14.4339 -14.4339 -14.4339 -14.4339 12.1089 12.1089 12.1089 12.1089 15.7120 15.7120 15.7120 15.7120 19.4953 19.4953 19.4953 19.4953 19.5844 19.5844 19.5844 19.5844 22.6007 22.6007 22.6007 22.6007 22.8306 22.8306 k = 0.5000 0.2887 0.3086 ( 1448 PWs) bands (ev): -41.0787 -41.0787 -41.0787 -41.0787 -17.1095 -17.1095 -17.1095 -17.1095 -14.8297 -14.8297 -14.8297 -14.8297 -14.4341 -14.4341 -14.4341 -14.4341 12.1091 12.1091 12.1091 12.1091 15.7107 15.7107 15.7107 15.7107 19.4952 19.4952 19.4952 19.4952 19.5845 19.5845 19.5845 19.5845 22.6092 22.6092 22.6092 22.6092 22.8345 22.8345 k = 0.5000 0.2887 0.3086 ( 1448 PWs) bands (ev): -41.0787 -41.0787 -41.0787 -41.0787 -17.1095 -17.1095 -17.1095 -17.1095 -14.8297 -14.8297 -14.8297 -14.8297 -14.4341 -14.4341 -14.4341 -14.4341 12.1091 12.1091 12.1091 12.1091 15.7107 15.7107 15.7107 15.7107 19.4952 19.4952 19.4952 19.4952 19.5845 19.5845 19.5845 19.5845 22.6092 22.6092 22.6092 22.6092 22.8345 22.8345 k = 0.4954 0.2967 0.3086 ( 1448 PWs) bands (ev): -41.0787 -41.0787 -41.0787 -41.0787 -17.1097 -17.1097 -17.1093 -17.1093 -14.8296 -14.8296 -14.8295 -14.8295 -14.4346 -14.4346 -14.4342 -14.4342 12.1074 12.1074 12.1118 12.1118 15.7104 15.7104 15.7141 15.7141 19.4776 19.4776 19.4882 19.4882 19.5905 19.5905 19.6002 19.6002 22.5408 22.5408 22.5824 22.5824 22.8580 22.8580 k = 0.4907 0.3047 0.3086 ( 1448 PWs) bands (ev): -41.0786 -41.0786 -41.0786 -41.0786 -17.1099 -17.1099 -17.1092 -17.1092 -14.8293 -14.8293 -14.8291 -14.8291 -14.4358 -14.4358 -14.4349 -14.4349 12.1067 12.1067 12.1155 12.1155 15.7132 15.7132 15.7206 15.7206 19.4476 19.4476 19.4624 19.4624 19.6124 19.6124 19.6254 19.6254 22.4408 22.4408 22.4899 22.4899 22.9477 22.9477 k = 0.4861 0.3127 0.3086 ( 1444 PWs) bands (ev): -41.0784 -41.0784 -41.0784 -41.0784 -17.1101 -17.1101 -17.1090 -17.1090 -14.8288 -14.8288 -14.8284 -14.8284 -14.4374 -14.4374 -14.4361 -14.4361 12.1070 12.1070 12.1203 12.1203 15.7190 15.7190 15.7301 15.7301 19.4129 19.4129 19.4293 19.4293 19.6387 19.6387 19.6525 19.6525 22.3335 22.3335 22.3819 22.3819 23.0536 23.0536 k = 0.4815 0.3208 0.3086 ( 1448 PWs) bands (ev): -41.0784 -41.0784 -41.0784 -41.0784 -17.1104 -17.1104 -17.1089 -17.1089 -14.8280 -14.8280 -14.8275 -14.8275 -14.4398 -14.4398 -14.4381 -14.4381 12.1083 12.1083 12.1260 12.1260 15.7277 15.7277 15.7425 15.7425 19.3758 19.3758 19.3931 19.3931 19.6655 19.6655 19.6794 19.6794 22.2240 22.2240 22.2699 22.2699 23.1642 23.1642 k = 0.4769 0.3288 0.3086 ( 1448 PWs) bands (ev): -41.0782 -41.0782 -41.0782 -41.0782 -17.1107 -17.1107 -17.1089 -17.1089 -14.8269 -14.8269 -14.8264 -14.8264 -14.4427 -14.4427 -14.4405 -14.4405 12.1106 12.1106 12.1326 12.1326 15.7394 15.7394 15.7579 15.7579 19.3374 19.3374 19.3552 19.3552 19.6916 19.6916 19.7052 19.7052 22.1139 22.1139 22.1568 22.1568 23.2766 23.2766 k = 0.4722 0.3368 0.3086 ( 1448 PWs) bands (ev): -41.0780 -41.0780 -41.0780 -41.0780 -17.1110 -17.1110 -17.1088 -17.1088 -14.8256 -14.8256 -14.8250 -14.8250 -14.4462 -14.4462 -14.4436 -14.4436 12.1138 12.1138 12.1401 12.1401 15.7538 15.7538 15.7760 15.7760 19.2983 19.2983 19.3163 19.3163 19.7163 19.7163 19.7296 19.7296 22.0040 22.0040 22.0436 22.0436 23.3898 23.3898 k = 0.4676 0.3448 0.3086 ( 1448 PWs) bands (ev): -41.0777 -41.0777 -41.0777 -41.0777 -17.1113 -17.1113 -17.1088 -17.1088 -14.8241 -14.8241 -14.8234 -14.8234 -14.4502 -14.4502 -14.4472 -14.4472 12.1178 12.1178 12.1485 12.1485 15.7708 15.7708 15.7969 15.7969 19.2588 19.2588 19.2770 19.2770 19.7396 19.7396 19.7525 19.7525 21.8946 21.8946 21.9308 21.9308 23.5032 23.5032 k = 0.4630 0.3528 0.3086 ( 1444 PWs) bands (ev): -41.0773 -41.0773 -41.0773 -41.0773 -17.1116 -17.1116 -17.1087 -17.1087 -14.8223 -14.8223 -14.8214 -14.8214 -14.4548 -14.4548 -14.4514 -14.4514 12.1228 12.1228 12.1576 12.1576 15.7904 15.7904 15.8202 15.8202 19.2194 19.2194 19.2376 19.2376 19.7614 19.7614 19.7739 19.7739 21.7859 21.7859 21.8189 21.8189 23.6165 23.6165 k = 0.4583 0.3608 0.3086 ( 1444 PWs) bands (ev): -41.0770 -41.0770 -41.0770 -41.0770 -17.1120 -17.1120 -17.1088 -17.1088 -14.8203 -14.8203 -14.8193 -14.8193 -14.4599 -14.4599 -14.4560 -14.4560 12.1285 12.1285 12.1675 12.1675 15.8122 15.8122 15.8459 15.8459 19.1805 19.1805 19.1986 19.1986 19.7815 19.7815 19.7937 19.7937 21.6782 21.6782 21.7079 21.7079 23.7294 23.7294 k = 0.4537 0.3689 0.3086 ( 1444 PWs) bands (ev): -41.0766 -41.0766 -41.0766 -41.0766 -17.1124 -17.1124 -17.1088 -17.1088 -14.8180 -14.8180 -14.8170 -14.8170 -14.4655 -14.4655 -14.4612 -14.4612 12.1349 12.1349 12.1780 12.1780 15.8361 15.8361 15.8737 15.8737 19.1426 19.1426 19.1604 19.1604 19.8001 19.8001 19.8119 19.8119 21.5716 21.5716 21.5982 21.5982 23.8418 23.8418 k = 0.4491 0.3769 0.3086 ( 1440 PWs) bands (ev): -41.0761 -41.0761 -41.0761 -41.0761 -17.1128 -17.1128 -17.1089 -17.1089 -14.8156 -14.8156 -14.8144 -14.8144 -14.4715 -14.4715 -14.4668 -14.4668 12.1419 12.1419 12.1891 12.1891 15.8619 15.8619 15.9033 15.9033 19.1060 19.1060 19.1235 19.1235 19.8172 19.8172 19.8287 19.8287 21.4663 21.4663 21.4898 21.4898 23.9534 23.9534 k = 0.4444 0.3849 0.3086 ( 1440 PWs) bands (ev): -41.0757 -41.0757 -41.0757 -41.0757 -17.1132 -17.1132 -17.1090 -17.1090 -14.8129 -14.8129 -14.8116 -14.8116 -14.4779 -14.4779 -14.4729 -14.4729 12.1496 12.1496 12.2007 12.2007 15.8892 15.8892 15.9346 15.9346 19.0712 19.0712 19.0882 19.0882 19.8327 19.8327 19.8440 19.8440 21.3624 21.3624 21.3829 21.3829 24.0640 24.0640 k = 0.4398 0.3929 0.3086 ( 1432 PWs) bands (ev): -41.0751 -41.0751 -41.0751 -41.0751 -17.1136 -17.1136 -17.1091 -17.1091 -14.8099 -14.8099 -14.8086 -14.8086 -14.4847 -14.4847 -14.4793 -14.4793 12.1577 12.1577 12.2127 12.2127 15.9178 15.9178 15.9671 15.9671 19.0386 19.0386 19.0550 19.0550 19.8468 19.8468 19.8578 19.8578 21.2601 21.2601 21.2777 21.2777 24.1734 24.1734 k = 0.4352 0.4009 0.3086 ( 1432 PWs) bands (ev): -41.0746 -41.0746 -41.0746 -41.0746 -17.1141 -17.1141 -17.1092 -17.1092 -14.8068 -14.8068 -14.8054 -14.8054 -14.4920 -14.4920 -14.4861 -14.4861 12.1662 12.1662 12.2251 12.2251 15.9473 15.9473 16.0007 16.0007 19.0088 19.0088 19.0244 19.0244 19.8594 19.8594 19.8703 19.8703 21.1595 21.1595 21.1743 21.1743 24.2814 24.2814 k = 0.4306 0.4090 0.3086 ( 1436 PWs) bands (ev): -41.0742 -41.0742 -41.0742 -41.0742 -17.1146 -17.1146 -17.1095 -17.1095 -14.8034 -14.8034 -14.8021 -14.8021 -14.4997 -14.4997 -14.4934 -14.4934 12.1751 12.1751 12.2376 12.2376 15.9773 15.9773 16.0348 16.0348 18.9822 18.9822 18.9968 18.9968 19.8706 19.8706 19.8815 19.8815 21.0608 21.0608 21.0728 21.0728 24.3877 24.3877 k = 0.4259 0.4170 0.3086 ( 1436 PWs) bands (ev): -41.0737 -41.0737 -41.0737 -41.0737 -17.1151 -17.1151 -17.1097 -17.1097 -14.7999 -14.7999 -14.7985 -14.7985 -14.5076 -14.5076 -14.5009 -14.5009 12.1843 12.1843 12.2503 12.2503 16.0076 16.0076 16.0692 16.0692 18.9592 18.9592 18.9727 18.9727 19.8805 19.8805 19.8913 19.8913 20.9642 20.9642 20.9734 20.9734 24.4923 24.4923 k = 0.4213 0.4250 0.3086 ( 1424 PWs) bands (ev): -41.0729 -41.0729 -41.0729 -41.0729 -17.1156 -17.1156 -17.1098 -17.1098 -14.7960 -14.7960 -14.7946 -14.7946 -14.5157 -14.5157 -14.5086 -14.5086 12.1936 12.1936 12.2631 12.2631 16.0377 16.0377 16.1033 16.1033 18.9402 18.9402 18.9525 18.9525 19.8889 19.8889 19.8999 19.8999 20.8697 20.8697 20.8763 20.8763 24.5947 24.5947 k = 0.4167 0.4330 0.3086 ( 1424 PWs) bands (ev): -41.0723 -41.0723 -41.0723 -41.0723 -17.1161 -17.1161 -17.1101 -17.1101 -14.7920 -14.7920 -14.7906 -14.7906 -14.5241 -14.5241 -14.5167 -14.5167 12.2030 12.2030 12.2759 12.2759 16.0672 16.0672 16.1370 16.1370 18.9258 18.9258 18.9366 18.9366 19.8960 19.8960 19.9073 19.9073 20.7776 20.7776 20.7815 20.7815 24.6948 24.6948 k = 0.4120 0.4410 0.3086 ( 1428 PWs) bands (ev): -41.0719 -41.0719 -41.0719 -41.0719 -17.1167 -17.1167 -17.1105 -17.1105 -14.7879 -14.7879 -14.7865 -14.7865 -14.5328 -14.5328 -14.5250 -14.5250 12.2125 12.2125 12.2885 12.2885 16.0958 16.0958 16.1696 16.1696 18.9161 18.9161 18.9255 18.9255 19.9017 19.9017 19.9135 19.9135 20.6882 20.6882 20.6893 20.6893 24.7924 24.7924 k = 0.4074 0.4491 0.3086 ( 1436 PWs) bands (ev): -41.0715 -41.0715 -41.0715 -41.0715 -17.1174 -17.1174 -17.1109 -17.1109 -14.7836 -14.7836 -14.7822 -14.7822 -14.5417 -14.5417 -14.5335 -14.5335 12.2218 12.2218 12.3009 12.3009 16.1230 16.1230 16.2009 16.2009 18.9116 18.9116 18.9193 18.9193 19.9059 19.9059 19.9184 19.9184 20.5998 20.5998 20.6016 20.6016 24.8871 24.8871 k = 0.4028 0.4571 0.3086 ( 1428 PWs) bands (ev): -41.0708 -41.0708 -41.0708 -41.0708 -17.1179 -17.1179 -17.1111 -17.1111 -14.7790 -14.7790 -14.7777 -14.7777 -14.5506 -14.5506 -14.5420 -14.5420 12.2310 12.2310 12.3130 12.3130 16.1487 16.1487 16.2305 16.2305 18.9125 18.9125 18.9184 18.9184 19.9086 19.9086 19.9221 19.9221 20.5132 20.5132 20.5180 20.5180 24.9790 24.9790 k = 0.3981 0.4651 0.3086 ( 1432 PWs) bands (ev): -41.0704 -41.0704 -41.0704 -41.0704 -17.1185 -17.1185 -17.1115 -17.1115 -14.7743 -14.7743 -14.7730 -14.7730 -14.5597 -14.5597 -14.5507 -14.5507 12.2399 12.2399 12.3247 12.3247 16.1724 16.1724 16.2580 16.2580 18.9188 18.9188 18.9229 18.9229 19.9096 19.9096 19.9245 19.9245 20.4297 20.4297 20.4380 20.4380 25.0676 25.0676 k = 0.3935 0.4731 0.3086 ( 1428 PWs) bands (ev): -41.0698 -41.0698 -41.0698 -41.0698 -17.1191 -17.1191 -17.1119 -17.1119 -14.7694 -14.7694 -14.7683 -14.7683 -14.5687 -14.5687 -14.5593 -14.5593 12.2486 12.2486 12.3360 12.3360 16.1940 16.1940 16.2833 16.2833 18.9306 18.9306 18.9328 18.9328 19.9087 19.9087 19.9255 19.9255 20.3497 20.3497 20.3619 20.3619 25.1530 25.1530 k = 0.3889 0.4811 0.3086 ( 1430 PWs) bands (ev): -41.0693 -41.0693 -41.0693 -41.0693 -17.1197 -17.1197 -17.1123 -17.1123 -14.7644 -14.7644 -14.7635 -14.7635 -14.5778 -14.5778 -14.5679 -14.5679 12.2569 12.2569 12.3467 12.3467 16.2132 16.2132 16.3060 16.3060 18.9478 18.9478 18.9480 18.9480 19.9056 19.9056 19.9249 19.9249 20.2735 20.2735 20.2902 20.2902 25.2349 25.2349 k = 0.3843 0.4891 0.3086 ( 1434 PWs) bands (ev): -41.0689 -41.0689 -41.0689 -41.0689 -17.1203 -17.1203 -17.1127 -17.1127 -14.7592 -14.7592 -14.7586 -14.7586 -14.5869 -14.5869 -14.5765 -14.5765 12.2647 12.2647 12.3568 12.3568 16.2301 16.2301 16.3262 16.3262 18.9683 18.9683 18.9701 18.9701 19.8995 19.8995 19.9223 19.9223 20.2018 20.2018 20.2240 20.2240 25.3132 25.3132 k = 0.3796 0.4972 0.3086 ( 1434 PWs) bands (ev): -41.0684 -41.0684 -41.0684 -41.0684 -17.1208 -17.1208 -17.1131 -17.1131 -14.7540 -14.7540 -14.7536 -14.7536 -14.5958 -14.5958 -14.5849 -14.5849 12.2720 12.2720 12.3662 12.3662 16.2446 16.2446 16.3437 16.3437 18.9931 18.9931 18.9971 18.9971 19.8897 19.8897 19.9171 19.9171 20.1354 20.1354 20.1642 20.1642 25.3879 25.3879 k = 0.3750 0.5052 0.3086 ( 1428 PWs) bands (ev): -41.0678 -41.0678 -41.0678 -41.0678 -17.1213 -17.1213 -17.1135 -17.1135 -14.7486 -14.7486 -14.7485 -14.7485 -14.6046 -14.6046 -14.5931 -14.5931 12.2788 12.2788 12.3749 12.3749 16.2567 16.2567 16.3586 16.3586 19.0220 19.0220 19.0282 19.0282 19.8750 19.8750 19.9077 19.9077 20.0763 20.0763 20.1124 20.1124 25.4591 25.4591 k = 0.3704 0.5132 0.3086 ( 1424 PWs) bands (ev): -41.0673 -41.0673 -41.0673 -41.0673 -17.1218 -17.1218 -17.1138 -17.1138 -14.7435 -14.7435 -14.7431 -14.7431 -14.6132 -14.6132 -14.6011 -14.6011 12.2850 12.2850 12.3829 12.3829 16.2666 16.2666 16.3709 16.3709 19.0541 19.0541 19.0625 19.0625 19.8545 19.8545 19.8916 19.8916 20.0274 20.0274 20.0700 20.0700 25.5268 25.5268 k = 0.3657 0.5212 0.3086 ( 1424 PWs) bands (ev): -41.0670 -41.0670 -41.0670 -41.0670 -17.1223 -17.1223 -17.1142 -17.1142 -14.7385 -14.7385 -14.7376 -14.7376 -14.6215 -14.6215 -14.6087 -14.6087 12.2906 12.2906 12.3899 12.3899 16.2744 16.2744 16.3810 16.3810 19.0883 19.0883 19.0991 19.0991 19.8283 19.8283 19.8661 19.8661 19.9918 19.9918 20.0374 20.0374 25.5913 25.5913 k = 0.3611 0.5292 0.3086 ( 1428 PWs) bands (ev): -41.0667 -41.0667 -41.0667 -41.0667 -17.1228 -17.1228 -17.1146 -17.1146 -14.7338 -14.7338 -14.7322 -14.7322 -14.6295 -14.6295 -14.6159 -14.6159 12.2954 12.2954 12.3961 12.3961 16.2804 16.2804 16.3888 16.3888 19.1233 19.1233 19.1367 19.1367 19.7984 19.7984 19.8325 19.8325 19.9690 19.9690 20.0133 20.0133 25.6529 25.6529 k = 0.3565 0.5373 0.3086 ( 1428 PWs) bands (ev): -41.0664 -41.0664 -41.0664 -41.0664 -17.1232 -17.1232 -17.1149 -17.1149 -14.7293 -14.7293 -14.7269 -14.7269 -14.6371 -14.6371 -14.6225 -14.6225 12.2996 12.2996 12.4014 12.4014 16.2848 16.2848 16.3947 16.3947 19.1576 19.1576 19.1735 19.1735 19.7678 19.7678 19.7964 19.7964 19.9543 19.9543 19.9957 19.9957 25.7119 25.7119 k = 0.3519 0.5453 0.3086 ( 1432 PWs) bands (ev): -41.0662 -41.0662 -41.0662 -41.0662 -17.1236 -17.1236 -17.1152 -17.1152 -14.7252 -14.7252 -14.7219 -14.7219 -14.6440 -14.6440 -14.6284 -14.6284 12.3030 12.3030 12.4057 12.4057 16.2877 16.2877 16.3990 16.3990 19.1892 19.1892 19.2078 19.2078 19.7396 19.7396 19.7630 19.7630 19.9439 19.9439 19.9826 19.9826 25.7688 25.7688 k = 0.3472 0.5533 0.3086 ( 1428 PWs) bands (ev): -41.0659 -41.0659 -41.0659 -41.0659 -17.1238 -17.1238 -17.1154 -17.1154 -14.7217 -14.7217 -14.7172 -14.7172 -14.6500 -14.6500 -14.6333 -14.6333 12.3056 12.3056 12.4091 12.4091 16.2896 16.2896 16.4018 16.4018 19.2161 19.2161 19.2372 19.2372 19.7164 19.7164 19.7356 19.7356 19.9358 19.9358 19.9727 19.9727 25.8244 25.8244 k = 0.3426 0.5613 0.3086 ( 1428 PWs) bands (ev): -41.0658 -41.0658 -41.0658 -41.0658 -17.1240 -17.1240 -17.1156 -17.1156 -14.7190 -14.7190 -14.7135 -14.7135 -14.6549 -14.6549 -14.6370 -14.6370 12.3075 12.3075 12.4115 12.4115 16.2907 16.2907 16.4036 16.4036 19.2362 19.2362 19.2595 19.2595 19.7001 19.7001 19.7162 19.7162 19.9294 19.9294 19.9655 19.9655 25.8793 25.8793 k = 0.3380 0.5693 0.3086 ( 1428 PWs) bands (ev): -41.0657 -41.0657 -41.0657 -41.0657 -17.1242 -17.1242 -17.1157 -17.1157 -14.7173 -14.7173 -14.7109 -14.7109 -14.6581 -14.6581 -14.6393 -14.6393 12.3087 12.3087 12.4130 12.4130 16.2911 16.2911 16.4044 16.4044 19.2482 19.2482 19.2729 19.2729 19.6912 19.6912 19.7057 19.7057 19.9251 19.9251 19.9608 19.9608 25.9339 25.9340 k = 0.3333 0.5774 0.3086 ( 1428 PWs) bands (ev): -41.0657 -41.0657 -41.0657 -41.0657 -17.1242 -17.1242 -17.1157 -17.1157 -14.7167 -14.7167 -14.7100 -14.7100 -14.6592 -14.6592 -14.6401 -14.6401 12.3091 12.3091 12.4135 12.4135 16.2912 16.2912 16.4047 16.4047 19.2521 19.2521 19.2772 19.2772 19.6888 19.6888 19.7028 19.7028 19.9234 19.9234 19.9592 19.9592 25.9776 25.9776 k = 0.3333 0.5774 0.3086 ( 1428 PWs) bands (ev): -41.0657 -41.0657 -41.0657 -41.0657 -17.1242 -17.1242 -17.1157 -17.1157 -14.7167 -14.7167 -14.7100 -14.7100 -14.6592 -14.6592 -14.6401 -14.6401 12.3091 12.3091 12.4135 12.4135 16.2912 16.2912 16.4047 16.4047 19.2521 19.2521 19.2772 19.2772 19.6888 19.6888 19.7028 19.7028 19.9234 19.9234 19.9592 19.9592 25.9776 25.9776 k = 0.3287 0.5693 0.3086 ( 1428 PWs) bands (ev): -41.0657 -41.0657 -41.0657 -41.0657 -17.1242 -17.1242 -17.1157 -17.1157 -14.7173 -14.7173 -14.7109 -14.7109 -14.6581 -14.6581 -14.6394 -14.6394 12.3087 12.3087 12.4130 12.4130 16.2912 16.2912 16.4045 16.4045 19.2488 19.2488 19.2735 19.2735 19.6902 19.6902 19.7044 19.7044 19.9255 19.9255 19.9611 19.9611 25.9319 25.9319 k = 0.3241 0.5613 0.3086 ( 1428 PWs) bands (ev): -41.0658 -41.0658 -41.0658 -41.0658 -17.1240 -17.1240 -17.1156 -17.1156 -14.7188 -14.7188 -14.7133 -14.7133 -14.6551 -14.6551 -14.6371 -14.6371 12.3076 12.3076 12.4116 12.4116 16.2912 16.2912 16.4042 16.4042 19.2402 19.2402 19.2641 19.2641 19.6925 19.6925 19.7067 19.7067 19.9325 19.9325 19.9672 19.9672 25.8713 25.8713 k = 0.3194 0.5533 0.3086 ( 1432 PWs) bands (ev): -41.0661 -41.0661 -41.0661 -41.0661 -17.1238 -17.1238 -17.1154 -17.1154 -14.7212 -14.7212 -14.7166 -14.7166 -14.6506 -14.6506 -14.6337 -14.6337 12.3057 12.3057 12.4092 12.4092 16.2915 16.2915 16.4038 16.4038 19.2284 19.2284 19.2510 19.2510 19.6928 19.6928 19.7063 19.7063 19.9448 19.9448 19.9776 19.9776 25.8070 25.8070 k = 0.3148 0.5453 0.3086 ( 1432 PWs) bands (ev): -41.0663 -41.0663 -41.0663 -41.0663 -17.1234 -17.1234 -17.1150 -17.1150 -14.7241 -14.7241 -14.7205 -14.7205 -14.6451 -14.6451 -14.6292 -14.6292 12.3032 12.3032 12.4060 12.4060 16.2922 16.2922 16.4036 16.4036 19.2148 19.2148 19.2362 19.2362 19.6894 19.6894 19.7014 19.7014 19.9620 19.9620 19.9920 19.9920 25.7392 25.7392 k = 0.3102 0.5373 0.3086 ( 1428 PWs) bands (ev): -41.0665 -41.0665 -41.0665 -41.0665 -17.1228 -17.1228 -17.1145 -17.1145 -14.7273 -14.7273 -14.7245 -14.7245 -14.6389 -14.6389 -14.6239 -14.6239 12.2999 12.2999 12.4019 12.4019 16.2934 16.2934 16.4038 16.4038 19.2009 19.2009 19.2210 19.2210 19.6817 19.6817 19.6917 19.6917 19.9824 19.9824 20.0093 20.0093 25.6673 25.6673 k = 0.3056 0.5292 0.3086 ( 1422 PWs) bands (ev): -41.0668 -41.0668 -41.0668 -41.0668 -17.1221 -17.1221 -17.1139 -17.1139 -14.7306 -14.7306 -14.7285 -14.7285 -14.6321 -14.6321 -14.6180 -14.6180 12.2960 12.2960 12.3969 12.3969 16.2953 16.2953 16.4044 16.4044 19.1873 19.1873 19.2063 19.2063 19.6698 19.6698 19.6777 19.6777 20.0044 20.0044 20.0280 20.0280 25.5911 25.5911 k = 0.3009 0.5212 0.3086 ( 1422 PWs) bands (ev): -41.0673 -41.0673 -41.0673 -41.0673 -17.1213 -17.1213 -17.1131 -17.1131 -14.7340 -14.7340 -14.7324 -14.7324 -14.6251 -14.6251 -14.6116 -14.6116 12.2915 12.2915 12.3912 12.3912 16.2979 16.2979 16.4055 16.4055 19.1746 19.1746 19.1926 19.1926 19.6543 19.6543 19.6601 19.6601 20.0264 20.0264 20.0469 20.0469 25.5102 25.5102 k = 0.2963 0.5132 0.3086 ( 1426 PWs) bands (ev): -41.0679 -41.0679 -41.0679 -41.0679 -17.1203 -17.1203 -17.1123 -17.1123 -14.7372 -14.7372 -14.7361 -14.7361 -14.6178 -14.6178 -14.6049 -14.6049 12.2864 12.2864 12.3846 12.3846 16.3014 16.3014 16.4074 16.4074 19.1631 19.1631 19.1802 19.1802 19.6357 19.6357 19.6396 19.6396 20.0473 20.0473 20.0649 20.0649 25.4241 25.4241 k = 0.2917 0.5052 0.3086 ( 1426 PWs) bands (ev): -41.0686 -41.0686 -41.0686 -41.0686 -17.1192 -17.1192 -17.1112 -17.1112 -14.7402 -14.7402 -14.7395 -14.7395 -14.6103 -14.6103 -14.5979 -14.5979 12.2806 12.2806 12.3774 12.3774 16.3059 16.3059 16.4100 16.4100 19.1529 19.1529 19.1691 19.1691 19.6147 19.6147 19.6168 19.6168 20.0663 20.0663 20.0814 20.0814 25.3328 25.3328 k = 0.2870 0.4972 0.3086 ( 1426 PWs) bands (ev): -41.0693 -41.0693 -41.0693 -41.0693 -17.1178 -17.1178 -17.1100 -17.1100 -14.7430 -14.7430 -14.7426 -14.7426 -14.6025 -14.6025 -14.5907 -14.5907 12.2744 12.2744 12.3694 12.3694 16.3113 16.3113 16.4134 16.4134 19.1438 19.1438 19.1593 19.1593 19.5919 19.5919 19.5923 19.5923 20.0830 20.0830 20.0958 20.0958 25.2361 25.2361 k = 0.2824 0.4891 0.3086 ( 1426 PWs) bands (ev): -41.0701 -41.0701 -41.0701 -41.0701 -17.1163 -17.1163 -17.1087 -17.1087 -14.7455 -14.7455 -14.7453 -14.7453 -14.5947 -14.5947 -14.5832 -14.5832 12.2676 12.2676 12.3608 12.3608 16.3179 16.3179 16.4178 16.4178 19.1356 19.1356 19.1505 19.1505 19.5667 19.5667 19.5678 19.5678 20.0971 20.0971 20.1079 20.1079 25.1340 25.1340 k = 0.2778 0.4811 0.3086 ( 1430 PWs) bands (ev): -41.0711 -41.0711 -41.0711 -41.0711 -17.1147 -17.1147 -17.1072 -17.1072 -14.7478 -14.7478 -14.7476 -14.7476 -14.5867 -14.5867 -14.5755 -14.5755 12.2602 12.2602 12.3515 12.3515 16.3255 16.3255 16.4231 16.4231 19.1279 19.1279 19.1421 19.1421 19.5407 19.5407 19.5433 19.5433 20.1085 20.1085 20.1174 20.1174 25.0264 25.0264 k = 0.2731 0.4731 0.3086 ( 1430 PWs) bands (ev): -41.0721 -41.0721 -41.0721 -41.0721 -17.1128 -17.1128 -17.1055 -17.1055 -14.7496 -14.7496 -14.7496 -14.7496 -14.5785 -14.5785 -14.5677 -14.5677 12.2524 12.2524 12.3417 12.3417 16.3344 16.3344 16.4295 16.4295 19.1200 19.1200 19.1337 19.1337 19.5152 19.5152 19.5191 19.5191 20.1174 20.1174 20.1246 20.1246 24.9135 24.9135 k = 0.2685 0.4651 0.3086 ( 1426 PWs) bands (ev): -41.0731 -41.0731 -41.0731 -41.0731 -17.1107 -17.1107 -17.1035 -17.1035 -14.7511 -14.7511 -14.7510 -14.7510 -14.5703 -14.5703 -14.5597 -14.5597 12.2442 12.2442 12.3312 12.3312 16.3445 16.3445 16.4370 16.4370 19.1112 19.1112 19.1242 19.1242 19.4911 19.4911 19.4962 19.4962 20.1237 20.1237 20.1294 20.1294 24.7954 24.7954 k = 0.2639 0.4571 0.3086 ( 1430 PWs) bands (ev): -41.0743 -41.0743 -41.0743 -41.0743 -17.1085 -17.1085 -17.1015 -17.1015 -14.7523 -14.7523 -14.7522 -14.7522 -14.5619 -14.5619 -14.5517 -14.5517 12.2354 12.2354 12.3202 12.3202 16.3558 16.3558 16.4457 16.4457 19.1003 19.1003 19.1126 19.1126 19.4697 19.4697 19.4758 19.4758 20.1278 20.1278 20.1320 20.1320 24.6725 24.6725 k = 0.2593 0.4491 0.3086 ( 1426 PWs) bands (ev): -41.0755 -41.0755 -41.0755 -41.0755 -17.1060 -17.1060 -17.0992 -17.0992 -14.7530 -14.7530 -14.7529 -14.7529 -14.5535 -14.5535 -14.5435 -14.5435 12.2262 12.2262 12.3086 12.3086 16.3684 16.3684 16.4555 16.4555 19.0864 19.0864 19.0978 19.0978 19.4521 19.4521 19.4590 19.4590 20.1298 20.1298 20.1327 20.1327 24.5450 24.5450 k = 0.2546 0.4410 0.3086 ( 1426 PWs) bands (ev): -41.0768 -41.0768 -41.0768 -41.0768 -17.1033 -17.1033 -17.0967 -17.0967 -14.7533 -14.7533 -14.7533 -14.7533 -14.5449 -14.5449 -14.5352 -14.5352 12.2165 12.2165 12.2965 12.2965 16.3824 16.3824 16.4666 16.4666 19.0684 19.0684 19.0788 19.0788 19.4395 19.4395 19.4469 19.4469 20.1300 20.1300 20.1315 20.1315 24.4132 24.4132 k = 0.2500 0.4330 0.3086 ( 1422 PWs) bands (ev): -41.0782 -41.0782 -41.0782 -41.0782 -17.1005 -17.1005 -17.0940 -17.0940 -14.7532 -14.7532 -14.7532 -14.7532 -14.5363 -14.5363 -14.5268 -14.5268 12.2064 12.2064 12.2839 12.2839 16.3978 16.3978 16.4790 16.4790 19.0458 19.0458 19.0549 19.0549 19.4325 19.4325 19.4402 19.4402 20.1285 20.1285 20.1288 20.1288 24.2775 24.2775 k = 0.2454 0.4250 0.3086 ( 1418 PWs) bands (ev): -41.0796 -41.0796 -41.0796 -41.0796 -17.0974 -17.0974 -17.0912 -17.0912 -14.7528 -14.7528 -14.7528 -14.7528 -14.5275 -14.5275 -14.5183 -14.5183 12.1958 12.1958 12.2707 12.2707 16.4145 16.4145 16.4927 16.4927 19.0186 19.0186 19.0261 19.0261 19.4313 19.4313 19.4390 19.4390 20.1248 20.1248 20.1257 20.1257 24.1384 24.1384 k = 0.2407 0.4170 0.3086 ( 1418 PWs) bands (ev): -41.0812 -41.0812 -41.0812 -41.0812 -17.0942 -17.0942 -17.0881 -17.0881 -14.7521 -14.7521 -14.7520 -14.7520 -14.5188 -14.5188 -14.5097 -14.5097 12.1847 12.1847 12.2570 12.2570 16.4327 16.4327 16.5077 16.5077 18.9869 18.9869 18.9929 18.9929 19.4355 19.4355 19.4433 19.4433 20.1196 20.1196 20.1217 20.1217 23.9962 23.9962 k = 0.2361 0.4090 0.3086 ( 1426 PWs) bands (ev): -41.0831 -41.0831 -41.0831 -41.0831 -17.0908 -17.0908 -17.0850 -17.0850 -14.7510 -14.7510 -14.7508 -14.7508 -14.5099 -14.5099 -14.5011 -14.5011 12.1732 12.1732 12.2428 12.2428 16.4523 16.4523 16.5242 16.5242 18.9514 18.9514 18.9558 18.9558 19.4445 19.4445 19.4523 19.4523 20.1134 20.1134 20.1167 20.1167 23.8514 23.8514 k = 0.2315 0.4009 0.3086 ( 1426 PWs) bands (ev): -41.0848 -41.0848 -41.0848 -41.0848 -17.0872 -17.0872 -17.0816 -17.0816 -14.7495 -14.7495 -14.7493 -14.7493 -14.5010 -14.5010 -14.4924 -14.4924 12.1611 12.1611 12.2280 12.2280 16.4733 16.4733 16.5420 16.5420 18.9129 18.9129 18.9158 18.9158 19.4576 19.4576 19.4654 19.4654 20.1066 20.1066 20.1109 20.1109 23.7045 23.7045 k = 0.2269 0.3929 0.3086 ( 1430 PWs) bands (ev): -41.0867 -41.0867 -41.0867 -41.0867 -17.0835 -17.0835 -17.0781 -17.0781 -14.7477 -14.7477 -14.7474 -14.7474 -14.4920 -14.4920 -14.4836 -14.4836 12.1484 12.1484 12.2126 12.2126 16.4959 16.4959 16.5612 16.5612 18.8722 18.8722 18.8735 18.8735 19.4741 19.4741 19.4821 19.4821 20.0991 20.0991 20.1046 20.1046 23.5558 23.5558 k = 0.2222 0.3849 0.3086 ( 1434 PWs) bands (ev): -41.0887 -41.0887 -41.0887 -41.0887 -17.0796 -17.0796 -17.0744 -17.0744 -14.7456 -14.7456 -14.7452 -14.7452 -14.4829 -14.4829 -14.4748 -14.4748 12.1352 12.1352 12.1967 12.1967 16.5199 16.5199 16.5819 16.5819 18.8297 18.8297 18.8298 18.8298 19.4933 19.4933 19.5015 19.5015 20.0912 20.0912 20.0979 20.0979 23.4059 23.4059 k = 0.2176 0.3769 0.3086 ( 1434 PWs) bands (ev): -41.0907 -41.0907 -41.0907 -41.0907 -17.0755 -17.0755 -17.0705 -17.0705 -14.7431 -14.7431 -14.7426 -14.7426 -14.4737 -14.4737 -14.4658 -14.4658 12.1214 12.1214 12.1801 12.1801 16.5454 16.5454 16.6041 16.6041 18.7848 18.7848 18.7863 18.7863 19.5147 19.5147 19.5232 19.5232 20.0830 20.0830 20.0909 20.0909 23.2552 23.2552 k = 0.2130 0.3689 0.3086 ( 1430 PWs) bands (ev): -41.0927 -41.0927 -41.0927 -41.0927 -17.0712 -17.0712 -17.0665 -17.0665 -14.7403 -14.7403 -14.7397 -14.7397 -14.4644 -14.4644 -14.4568 -14.4568 12.1069 12.1069 12.1629 12.1629 16.5725 16.5725 16.6277 16.6277 18.7394 18.7394 18.7423 18.7423 19.5378 19.5378 19.5468 19.5468 20.0748 20.0748 20.0838 20.0838 23.1041 23.1041 k = 0.2083 0.3608 0.3086 ( 1430 PWs) bands (ev): -41.0948 -41.0948 -41.0948 -41.0948 -17.0668 -17.0668 -17.0623 -17.0623 -14.7372 -14.7372 -14.7365 -14.7365 -14.4550 -14.4550 -14.4476 -14.4476 12.0918 12.0918 12.1451 12.1451 16.6010 16.6010 16.6528 16.6528 18.6939 18.6939 18.6982 18.6982 19.5621 19.5621 19.5717 19.5717 20.0665 20.0665 20.0768 20.0768 22.9531 22.9531 k = 0.2037 0.3528 0.3086 ( 1430 PWs) bands (ev): -41.0970 -41.0970 -41.0970 -41.0970 -17.0623 -17.0623 -17.0580 -17.0580 -14.7338 -14.7338 -14.7331 -14.7331 -14.4456 -14.4456 -14.4384 -14.4384 12.0759 12.0759 12.1265 12.1265 16.6310 16.6310 16.6794 16.6794 18.6486 18.6486 18.6543 18.6543 19.5874 19.5874 19.5976 19.5976 20.0585 20.0585 20.0701 20.0701 22.8026 22.8026 k = 0.1991 0.3448 0.3086 ( 1424 PWs) bands (ev): -41.0991 -41.0991 -41.0991 -41.0991 -17.0576 -17.0576 -17.0535 -17.0535 -14.7301 -14.7301 -14.7293 -14.7293 -14.4360 -14.4360 -14.4291 -14.4291 12.0593 12.0593 12.1072 12.1072 16.6625 16.6625 16.7074 16.7074 18.6039 18.6039 18.6109 18.6109 19.6131 19.6131 19.6241 19.6241 20.0508 20.0508 20.0638 20.0638 22.6530 22.6530 k = 0.1944 0.3368 0.3086 ( 1424 PWs) bands (ev): -41.1014 -41.1014 -41.1014 -41.1014 -17.0529 -17.0529 -17.0490 -17.0490 -14.7262 -14.7262 -14.7254 -14.7254 -14.4264 -14.4264 -14.4197 -14.4197 12.0420 12.0420 12.0871 12.0871 16.6955 16.6955 16.7368 16.7368 18.5600 18.5600 18.5684 18.5684 19.6388 19.6388 19.6506 19.6506 20.0436 20.0436 20.0582 20.0582 22.5047 22.5047 k = 0.1898 0.3288 0.3086 ( 1424 PWs) bands (ev): -41.1037 -41.1037 -41.1037 -41.1037 -17.0480 -17.0480 -17.0444 -17.0444 -14.7221 -14.7221 -14.7212 -14.7212 -14.4166 -14.4166 -14.4103 -14.4103 12.0237 12.0237 12.0663 12.0663 16.7299 16.7299 16.7677 16.7677 18.5171 18.5171 18.5270 18.5270 19.6640 19.6640 19.6768 19.6768 20.0373 20.0373 20.0535 20.0535 22.3581 22.3581 k = 0.1852 0.3208 0.3086 ( 1424 PWs) bands (ev): -41.1061 -41.1061 -41.1061 -41.1061 -17.0431 -17.0431 -17.0396 -17.0396 -14.7178 -14.7178 -14.7168 -14.7168 -14.4068 -14.4068 -14.4007 -14.4007 12.0047 12.0047 12.0447 12.0447 16.7656 16.7656 16.7999 16.7999 18.4755 18.4755 18.4869 18.4869 19.6883 19.6883 19.7022 19.7022 20.0322 20.0322 20.0500 20.0500 22.2137 22.2137 k = 0.1806 0.3127 0.3086 ( 1432 PWs) bands (ev): -41.1087 -41.1087 -41.1087 -41.1087 -17.0382 -17.0382 -17.0349 -17.0349 -14.7133 -14.7133 -14.7123 -14.7123 -14.3970 -14.3970 -14.3912 -14.3912 11.9847 11.9847 12.0222 12.0222 16.8028 16.8028 16.8334 16.8334 18.4353 18.4353 18.4483 18.4483 19.7111 19.7111 19.7260 19.7260 20.0285 20.0285 20.0480 20.0480 22.0719 22.0719 k = 0.1759 0.3047 0.3086 ( 1432 PWs) bands (ev): -41.1112 -41.1112 -41.1112 -41.1112 -17.0331 -17.0331 -17.0301 -17.0301 -14.7086 -14.7086 -14.7076 -14.7076 -14.3870 -14.3870 -14.3815 -14.3815 11.9638 11.9638 11.9989 11.9989 16.8412 16.8412 16.8683 16.8683 18.3968 18.3968 18.4114 18.4114 19.7317 19.7317 19.7475 19.7475 20.0270 20.0270 20.0480 20.0480 21.9331 21.9331 k = 0.1713 0.2967 0.3086 ( 1432 PWs) bands (ev): -41.1137 -41.1137 -41.1137 -41.1137 -17.0280 -17.0280 -17.0252 -17.0252 -14.7038 -14.7038 -14.7028 -14.7028 -14.3770 -14.3770 -14.3717 -14.3717 11.9421 11.9421 11.9747 11.9747 16.8808 16.8808 16.9043 16.9043 18.3601 18.3601 18.3764 18.3764 19.7494 19.7494 19.7658 19.7658 20.0281 20.0281 20.0505 20.0505 21.7976 21.7976 k = 0.1667 0.2887 0.3086 ( 1444 PWs) bands (ev): -41.1164 -41.1164 -41.1164 -41.1164 -17.0230 -17.0230 -17.0203 -17.0203 -14.6989 -14.6989 -14.6979 -14.6979 -14.3669 -14.3669 -14.3619 -14.3619 11.9194 11.9194 11.9497 11.9497 16.9215 16.9215 16.9414 16.9414 18.3253 18.3253 18.3433 18.3433 19.7634 19.7634 19.7801 19.7801 20.0325 20.0325 20.0557 20.0557 21.6660 21.6660 k = 0.1620 0.2807 0.3086 ( 1440 PWs) bands (ev): -41.1189 -41.1189 -41.1189 -41.1189 -17.0178 -17.0178 -17.0154 -17.0154 -14.6938 -14.6938 -14.6928 -14.6928 -14.3566 -14.3566 -14.3519 -14.3519 11.8957 11.8957 11.9238 11.9238 16.9632 16.9632 16.9795 16.9795 18.2926 18.2926 18.3124 18.3124 19.7733 19.7733 19.7895 19.7895 20.0406 20.0406 20.0641 20.0641 21.5388 21.5388 k = 0.1574 0.2726 0.3086 ( 1448 PWs) bands (ev): -41.1216 -41.1216 -41.1216 -41.1216 -17.0128 -17.0128 -17.0105 -17.0105 -14.6888 -14.6888 -14.6878 -14.6878 -14.3464 -14.3464 -14.3419 -14.3419 11.8712 11.8712 11.8971 11.8971 17.0058 17.0058 17.0185 17.0185 18.2621 18.2621 18.2838 18.2838 19.7785 19.7785 19.7937 19.7937 20.0525 20.0525 20.0757 20.0757 21.4165 21.4165 k = 0.1528 0.2646 0.3086 ( 1448 PWs) bands (ev): -41.1242 -41.1242 -41.1242 -41.1242 -17.0077 -17.0077 -17.0055 -17.0055 -14.6836 -14.6836 -14.6826 -14.6826 -14.3360 -14.3360 -14.3318 -14.3318 11.8458 11.8458 11.8696 11.8696 17.0491 17.0491 17.0582 17.0582 18.2339 18.2339 18.2575 18.2575 19.7789 19.7789 19.7924 19.7924 20.0679 20.0679 20.0902 20.0902 21.2996 21.2996 k = 0.1481 0.2566 0.3086 ( 1444 PWs) bands (ev): -41.1267 -41.1267 -41.1267 -41.1267 -17.0025 -17.0025 -17.0006 -17.0006 -14.6784 -14.6784 -14.6774 -14.6774 -14.3255 -14.3255 -14.3215 -14.3215 11.8195 11.8195 11.8413 11.8413 17.0930 17.0930 17.0985 17.0985 18.2082 18.2082 18.2338 18.2338 19.7744 19.7744 19.7860 19.7860 20.0860 20.0860 20.1072 20.1072 21.1887 21.1887 k = 0.1435 0.2486 0.3086 ( 1440 PWs) bands (ev): -41.1291 -41.1291 -41.1291 -41.1291 -16.9975 -16.9975 -16.9957 -16.9957 -14.6731 -14.6731 -14.6722 -14.6722 -14.3150 -14.3150 -14.3113 -14.3113 11.7923 11.7923 11.8123 11.8123 17.1372 17.1372 17.1391 17.1391 18.1852 18.1852 18.2127 18.2127 19.7650 19.7650 19.7745 19.7745 20.1061 20.1061 20.1261 20.1261 21.0845 21.0845 k = 0.1389 0.2406 0.3086 ( 1440 PWs) bands (ev): -41.1317 -41.1317 -41.1317 -41.1317 -16.9925 -16.9925 -16.9908 -16.9908 -14.6679 -14.6679 -14.6671 -14.6671 -14.3044 -14.3044 -14.3010 -14.3010 11.7644 11.7644 11.7826 11.7826 17.1799 17.1799 17.1814 17.1814 18.1649 18.1649 18.1945 18.1945 19.7507 19.7507 19.7582 19.7582 20.1275 20.1275 20.1464 20.1464 20.9877 20.9877 k = 0.1343 0.2325 0.3086 ( 1440 PWs) bands (ev): -41.1342 -41.1342 -41.1342 -41.1342 -16.9876 -16.9876 -16.9861 -16.9861 -14.6628 -14.6628 -14.6619 -14.6619 -14.2938 -14.2938 -14.2907 -14.2907 11.7358 11.7358 11.7522 11.7522 17.2204 17.2204 17.2254 17.2254 18.1476 18.1476 18.1792 18.1792 19.7315 19.7315 19.7370 19.7370 20.1496 20.1496 20.1675 20.1675 20.8990 20.8990 k = 0.1296 0.2245 0.3086 ( 1440 PWs) bands (ev): -41.1368 -41.1368 -41.1368 -41.1368 -16.9827 -16.9827 -16.9813 -16.9813 -14.6576 -14.6576 -14.6568 -14.6568 -14.2833 -14.2833 -14.2804 -14.2804 11.7065 11.7065 11.7213 11.7213 17.2605 17.2605 17.2688 17.2688 18.1335 18.1335 18.1671 18.1671 19.7072 19.7072 19.7108 19.7108 20.1720 20.1720 20.1890 20.1890 20.8189 20.8189 k = 0.1250 0.2165 0.3086 ( 1436 PWs) bands (ev): -41.1392 -41.1392 -41.1392 -41.1392 -16.9779 -16.9779 -16.9767 -16.9767 -14.6525 -14.6525 -14.6518 -14.6518 -14.2727 -14.2727 -14.2700 -14.2700 11.6767 11.6767 11.6900 11.6900 17.2997 17.2997 17.3111 17.3111 18.1228 18.1228 18.1583 18.1583 19.6777 19.6777 19.6796 19.6796 20.1941 20.1941 20.2105 20.2105 20.7480 20.7480 k = 0.1204 0.2085 0.3086 ( 1428 PWs) bands (ev): -41.1415 -41.1415 -41.1415 -41.1415 -16.9732 -16.9732 -16.9721 -16.9721 -14.6475 -14.6475 -14.6468 -14.6468 -14.2621 -14.2621 -14.2597 -14.2597 11.6464 11.6464 11.6583 11.6583 17.3377 17.3377 17.3520 17.3520 18.1159 18.1159 18.1530 18.1530 19.6431 19.6431 19.6435 19.6435 20.2158 20.2158 20.2316 20.2316 20.6867 20.6867 k = 0.1157 0.2005 0.3086 ( 1430 PWs) bands (ev): -41.1439 -41.1439 -41.1439 -41.1439 -16.9686 -16.9686 -16.9677 -16.9677 -14.6426 -14.6426 -14.6420 -14.6420 -14.2516 -14.2516 -14.2494 -14.2494 11.6157 11.6157 11.6263 11.6263 17.3740 17.3740 17.3908 17.3908 18.1130 18.1130 18.1515 18.1515 19.6026 19.6026 19.6036 19.6036 20.2368 20.2368 20.2522 20.2522 20.6349 20.6349 k = 0.1111 0.1925 0.3086 ( 1430 PWs) bands (ev): -41.1463 -41.1463 -41.1463 -41.1463 -16.9642 -16.9642 -16.9633 -16.9633 -14.6379 -14.6379 -14.6373 -14.6373 -14.2412 -14.2412 -14.2392 -14.2392 11.5847 11.5847 11.5941 11.5941 17.4082 17.4082 17.4271 17.4271 18.1145 18.1145 18.1540 18.1540 19.5574 19.5574 19.5597 19.5597 20.2569 20.2569 20.2720 20.2720 20.5924 20.5924 k = 0.1065 0.1844 0.3086 ( 1430 PWs) bands (ev): -41.1487 -41.1487 -41.1487 -41.1487 -16.9599 -16.9599 -16.9591 -16.9591 -14.6332 -14.6332 -14.6327 -14.6327 -14.2309 -14.2309 -14.2291 -14.2291 11.5536 11.5536 11.5618 11.5618 17.4399 17.4399 17.4603 17.4603 18.1207 18.1207 18.1606 18.1606 19.5087 19.5087 19.5120 19.5120 20.2759 20.2759 20.2907 20.2907 20.5589 20.5589 k = 0.1019 0.1764 0.3086 ( 1426 PWs) bands (ev): -41.1509 -41.1509 -41.1509 -41.1509 -16.9557 -16.9557 -16.9550 -16.9550 -14.6287 -14.6287 -14.6282 -14.6282 -14.2207 -14.2207 -14.2191 -14.2191 11.5225 11.5225 11.5297 11.5297 17.4687 17.4687 17.4899 17.4899 18.1318 18.1318 18.1716 18.1716 19.4573 19.4573 19.4614 19.4614 20.2936 20.2936 20.3082 20.3082 20.5335 20.5335 k = 0.0972 0.1684 0.3086 ( 1430 PWs) bands (ev): -41.1532 -41.1532 -41.1532 -41.1532 -16.9517 -16.9517 -16.9511 -16.9511 -14.6244 -14.6244 -14.6239 -14.6239 -14.2107 -14.2107 -14.2093 -14.2093 11.4914 11.4914 11.4977 11.4977 17.4943 17.4943 17.5157 17.5157 18.1477 18.1477 18.1867 18.1867 19.4040 19.4040 19.4090 19.4090 20.3101 20.3101 20.3243 20.3243 20.5155 20.5155 k = 0.0926 0.1604 0.3086 ( 1436 PWs) bands (ev): -41.1555 -41.1555 -41.1555 -41.1555 -16.9479 -16.9479 -16.9474 -16.9474 -14.6202 -14.6202 -14.6198 -14.6198 -14.2009 -14.2009 -14.1997 -14.1997 11.4606 11.4606 11.4660 11.4660 17.5166 17.5166 17.5375 17.5375 18.1685 18.1685 18.2061 18.2061 19.3499 19.3499 19.3554 19.3554 20.3253 20.3253 20.3389 20.3389 20.5040 20.5040 k = 0.0880 0.1524 0.3086 ( 1434 PWs) bands (ev): -41.1575 -41.1575 -41.1575 -41.1575 -16.9442 -16.9442 -16.9437 -16.9437 -14.6162 -14.6162 -14.6159 -14.6159 -14.1912 -14.1912 -14.1902 -14.1902 11.4302 11.4302 11.4348 11.4348 17.5356 17.5356 17.5554 17.5554 18.1937 18.1937 18.2292 18.2292 19.2957 19.2957 19.3018 19.3018 20.3392 20.3392 20.3520 20.3520 20.4980 20.4980 k = 0.0833 0.1443 0.3086 ( 1434 PWs) bands (ev): -41.1595 -41.1595 -41.1595 -41.1595 -16.9407 -16.9407 -16.9403 -16.9403 -14.6124 -14.6124 -14.6121 -14.6121 -14.1818 -14.1818 -14.1809 -14.1809 11.4002 11.4002 11.4042 11.4042 17.5514 17.5514 17.5696 17.5696 18.2228 18.2228 18.2558 18.2558 19.2422 19.2422 19.2487 19.2487 20.3520 20.3520 20.3637 20.3637 20.4967 20.4967 k = 0.0787 0.1363 0.3086 ( 1434 PWs) bands (ev): -41.1615 -41.1615 -41.1615 -41.1615 -16.9373 -16.9373 -16.9370 -16.9370 -14.6088 -14.6088 -14.6085 -14.6085 -14.1727 -14.1727 -14.1719 -14.1719 11.3710 11.3710 11.3743 11.3743 17.5643 17.5643 17.5805 17.5805 18.2550 18.2550 18.2853 18.2853 19.1900 19.1900 19.1968 19.1968 20.3638 20.3638 20.3743 20.3743 20.4991 20.4991 k = 0.0741 0.1283 0.3086 ( 1436 PWs) bands (ev): -41.1634 -41.1634 -41.1634 -41.1634 -16.9341 -16.9341 -16.9338 -16.9338 -14.6053 -14.6053 -14.6051 -14.6051 -14.1639 -14.1639 -14.1632 -14.1632 11.3425 11.3425 11.3452 11.3452 17.5744 17.5744 17.5886 17.5886 18.2896 18.2896 18.3170 18.3170 19.1397 19.1397 19.1467 19.1467 20.3750 20.3750 20.3842 20.3842 20.5041 20.5041 k = 0.0694 0.1203 0.3086 ( 1434 PWs) bands (ev): -41.1651 -41.1651 -41.1651 -41.1651 -16.9311 -16.9311 -16.9308 -16.9308 -14.6021 -14.6021 -14.6019 -14.6019 -14.1554 -14.1554 -14.1549 -14.1549 11.3149 11.3149 11.3172 11.3172 17.5822 17.5822 17.5944 17.5944 18.3258 18.3258 18.3502 18.3502 19.0917 19.0917 19.0988 19.0988 20.3857 20.3857 20.3935 20.3935 20.5109 20.5109 k = 0.0648 0.1123 0.3086 ( 1438 PWs) bands (ev): -41.1668 -41.1668 -41.1668 -41.1668 -16.9283 -16.9283 -16.9281 -16.9281 -14.5990 -14.5990 -14.5989 -14.5989 -14.1473 -14.1473 -14.1469 -14.1469 11.2884 11.2884 11.2902 11.2902 17.5880 17.5880 17.5982 17.5982 18.3628 18.3628 18.3844 18.3844 19.0465 19.0465 19.0536 19.0536 20.3960 20.3960 20.4025 20.4025 20.5189 20.5189 k = 0.0602 0.1042 0.3086 ( 1438 PWs) bands (ev): -41.1684 -41.1684 -41.1684 -41.1684 -16.9256 -16.9256 -16.9255 -16.9255 -14.5962 -14.5962 -14.5960 -14.5960 -14.1397 -14.1397 -14.1393 -14.1393 11.2631 11.2631 11.2645 11.2645 17.5921 17.5921 17.6004 17.6004 18.3999 18.3999 18.4187 18.4187 19.0043 19.0043 19.0113 19.0113 20.4060 20.4060 20.4114 20.4114 20.5275 20.5275 k = 0.0556 0.0962 0.3086 ( 1442 PWs) bands (ev): -41.1700 -41.1700 -41.1700 -41.1700 -16.9232 -16.9232 -16.9231 -16.9231 -14.5935 -14.5935 -14.5935 -14.5935 -14.1324 -14.1324 -14.1321 -14.1321 11.2390 11.2390 11.2402 11.2402 17.5948 17.5948 17.6014 17.6014 18.4363 18.4363 18.4525 18.4525 18.9654 18.9654 18.9721 18.9721 20.4157 20.4157 20.4201 20.4201 20.5362 20.5362 k = 0.0509 0.0882 0.3086 ( 1446 PWs) bands (ev): -41.1714 -41.1714 -41.1714 -41.1714 -16.9209 -16.9209 -16.9208 -16.9208 -14.5911 -14.5911 -14.5911 -14.5911 -14.1256 -14.1256 -14.1254 -14.1254 11.2165 11.2165 11.2173 11.2173 17.5964 17.5964 17.6016 17.6016 18.4713 18.4713 18.4851 18.4851 18.9301 18.9301 18.9365 18.9365 20.4251 20.4251 20.4285 20.4286 20.5452 20.5468 k = 0.0463 0.0802 0.3086 ( 1454 PWs) bands (ev): -41.1729 -41.1729 -41.1729 -41.1729 -16.9189 -16.9189 -16.9188 -16.9188 -14.5890 -14.5890 -14.5889 -14.5889 -14.1194 -14.1194 -14.1193 -14.1193 11.1954 11.1954 11.1961 11.1961 17.5971 17.5971 17.6010 17.6010 18.5043 18.5043 18.5159 18.5159 18.8987 18.8987 18.9046 18.9046 20.4341 20.4341 20.4367 20.4367 20.5535 20.5541 k = 0.0417 0.0722 0.3086 ( 1446 PWs) bands (ev): -41.1739 -41.1739 -41.1739 -41.1739 -16.9170 -16.9170 -16.9169 -16.9169 -14.5869 -14.5869 -14.5868 -14.5868 -14.1136 -14.1136 -14.1134 -14.1134 11.1761 11.1761 11.1766 11.1766 17.5971 17.5971 17.6000 17.6000 18.5346 18.5346 18.5441 18.5441 18.8714 18.8714 18.8767 18.8767 20.4426 20.4426 20.4446 20.4446 20.5613 20.5613 k = 0.0370 0.0642 0.3086 ( 1446 PWs) bands (ev): -41.1749 -41.1749 -41.1749 -41.1749 -16.9153 -16.9153 -16.9152 -16.9152 -14.5851 -14.5851 -14.5850 -14.5850 -14.1083 -14.1083 -14.1082 -14.1082 11.1585 11.1585 11.1588 11.1588 17.5967 17.5967 17.5987 17.5987 18.5615 18.5615 18.5690 18.5690 18.8485 18.8485 18.8530 18.8530 20.4504 20.4505 20.4519 20.4519 20.5694 20.5699 k = 0.0324 0.0561 0.3086 ( 1450 PWs) bands (ev): -41.1759 -41.1759 -41.1759 -41.1759 -16.9138 -16.9138 -16.9138 -16.9138 -14.5835 -14.5835 -14.5835 -14.5835 -14.1037 -14.1037 -14.1036 -14.1036 11.1427 11.1427 11.1429 11.1429 17.5959 17.5959 17.5973 17.5973 18.5844 18.5844 18.5900 18.5900 18.8303 18.8303 18.8340 18.8340 20.4576 20.4576 20.4586 20.4586 20.5755 20.5755 k = 0.0278 0.0481 0.3086 ( 1442 PWs) bands (ev): -41.1765 -41.1765 -41.1765 -41.1765 -16.9124 -16.9124 -16.9124 -16.9124 -14.5821 -14.5821 -14.5820 -14.5820 -14.0995 -14.0995 -14.0995 -14.0995 11.1289 11.1289 11.1290 11.1290 17.5949 17.5949 17.5958 17.5958 18.6027 18.6027 18.6066 18.6066 18.8171 18.8171 18.8198 18.8198 20.4640 20.4640 20.4646 20.4646 20.5815 20.5815 k = 0.0231 0.0401 0.3086 ( 1440 PWs) bands (ev): -41.1772 -41.1772 -41.1772 -41.1772 -16.9113 -16.9113 -16.9113 -16.9113 -14.5809 -14.5809 -14.5809 -14.5809 -14.0960 -14.0960 -14.0959 -14.0959 11.1170 11.1170 11.1171 11.1171 17.5939 17.5939 17.5944 17.5944 18.6161 18.6161 18.6186 18.6186 18.8085 18.8085 18.8103 18.8103 20.4695 20.4695 20.4699 20.4699 20.5867 20.5869 k = 0.0185 0.0321 0.3086 ( 1444 PWs) bands (ev): -41.1778 -41.1778 -41.1778 -41.1778 -16.9105 -16.9105 -16.9105 -16.9105 -14.5799 -14.5799 -14.5799 -14.5799 -14.0931 -14.0931 -14.0931 -14.0931 11.1073 11.1073 11.1073 11.1073 17.5929 17.5929 17.5931 17.5931 18.6250 18.6250 18.6263 18.6263 18.8040 18.8040 18.8050 18.8050 20.4741 20.4741 20.4743 20.4743 20.5910 20.5911 k = 0.0139 0.0241 0.3086 ( 1448 PWs) bands (ev): -41.1784 -41.1784 -41.1784 -41.1784 -16.9098 -16.9098 -16.9098 -16.9098 -14.5792 -14.5792 -14.5792 -14.5792 -14.0909 -14.0909 -14.0909 -14.0909 11.0996 11.0996 11.0996 11.0996 17.5920 17.5920 17.5921 17.5921 18.6301 18.6301 18.6307 18.6307 18.8025 18.8025 18.8029 18.8029 20.4777 20.4777 20.4778 20.4778 20.5944 20.5945 k = 0.0093 0.0160 0.3086 ( 1448 PWs) bands (ev): -41.1787 -41.1787 -41.1787 -41.1787 -16.9093 -16.9093 -16.9093 -16.9093 -14.5787 -14.5787 -14.5787 -14.5787 -14.0892 -14.0892 -14.0892 -14.0892 11.0941 11.0941 11.0941 11.0941 17.5913 17.5913 17.5913 17.5913 18.6326 18.6326 18.6328 18.6328 18.8025 18.8025 18.8026 18.8026 20.4803 20.4803 20.4803 20.4803 20.5969 20.5969 k = 0.0046 0.0080 0.3086 ( 1448 PWs) bands (ev): -41.1789 -41.1789 -41.1789 -41.1789 -16.9090 -16.9090 -16.9090 -16.9090 -14.5784 -14.5784 -14.5784 -14.5784 -14.0883 -14.0883 -14.0883 -14.0883 11.0908 11.0908 11.0908 11.0908 17.5908 17.5908 17.5909 17.5909 18.6336 18.6336 18.6337 18.6337 18.8030 18.8030 18.8030 18.8030 20.4819 20.4819 20.4819 20.4819 20.5984 20.5984 k = 0.0000 0.0000 0.3086 ( 1448 PWs) bands (ev): -41.1789 -41.1789 -41.1789 -41.1789 -16.9089 -16.9089 -16.9089 -16.9089 -14.5783 -14.5783 -14.5783 -14.5783 -14.0879 -14.0879 -14.0879 -14.0879 11.0897 11.0897 11.0897 11.0897 17.5907 17.5907 17.5907 17.5907 18.6339 18.6339 18.6339 18.6339 18.8033 18.8033 18.8033 18.8033 20.4824 20.4824 20.4824 20.4824 20.5989 20.5989 k = 0.5000 0.2887 0.3086 ( 1448 PWs) bands (ev): -41.0787 -41.0787 -41.0787 -41.0787 -17.1095 -17.1095 -17.1095 -17.1095 -14.8297 -14.8297 -14.8297 -14.8297 -14.4341 -14.4341 -14.4341 -14.4341 12.1091 12.1091 12.1091 12.1091 15.7107 15.7107 15.7107 15.7107 19.4952 19.4952 19.4952 19.4952 19.5845 19.5845 19.5845 19.5845 22.6092 22.6092 22.6092 22.6092 22.8345 22.8345 k = 0.5000 0.2887 0.2996 ( 1444 PWs) bands (ev): -41.0898 -41.0898 -41.0674 -41.0674 -17.1258 -17.1258 -17.0940 -17.0940 -14.8564 -14.8564 -14.8046 -14.8046 -14.4370 -14.4370 -14.4281 -14.4281 12.0315 12.0315 12.1877 12.1877 15.6406 15.6406 15.7810 15.7810 19.3497 19.3497 19.3964 19.3964 19.6583 19.6583 19.7568 19.7568 22.5534 22.5534 22.6678 22.6678 22.8174 22.8174 k = 0.5000 0.2887 0.2905 ( 1444 PWs) bands (ev): -41.1010 -41.1010 -41.0561 -41.0561 -17.1431 -17.1431 -17.0796 -17.0796 -14.8841 -14.8841 -14.7818 -14.7818 -14.4375 -14.4375 -14.4187 -14.4187 11.9550 11.9550 12.2672 12.2672 15.5708 15.5708 15.8512 15.8512 19.1556 19.1556 19.2759 19.2759 19.7854 19.7854 19.9497 19.9497 22.5021 22.5021 22.7239 22.7239 22.8061 22.8061 k = 0.5000 0.2887 0.2814 ( 1440 PWs) bands (ev): -41.1120 -41.1120 -41.0449 -41.0449 -17.1613 -17.1613 -17.0660 -17.0660 -14.9122 -14.9122 -14.7620 -14.7620 -14.4361 -14.4361 -14.4051 -14.4051 11.8798 11.8798 12.3475 12.3475 15.5014 15.5014 15.9210 15.9210 18.9599 18.9599 19.1571 19.1571 19.9168 19.9168 20.1412 20.1412 22.4567 22.4567 22.7529 22.7529 22.8220 22.8220 k = 0.5000 0.2887 0.2723 ( 1440 PWs) bands (ev): -41.1230 -41.1230 -41.0337 -41.0337 -17.1804 -17.1804 -17.0535 -17.0535 -14.9402 -14.9402 -14.7456 -14.7456 -14.4333 -14.4333 -14.3870 -14.3870 11.8059 11.8059 12.4284 12.4284 15.4328 15.4328 15.9903 15.9903 18.7654 18.7654 19.0408 19.0408 20.0507 20.0507 20.3285 20.3285 22.4183 22.4183 22.7461 22.7461 22.8659 22.8659 k = 0.5000 0.2887 0.2633 ( 1440 PWs) bands (ev): -41.1339 -41.1339 -41.0225 -41.0225 -17.2002 -17.2002 -17.0419 -17.0419 -14.9678 -14.9678 -14.7329 -14.7329 -14.4293 -14.4293 -14.3644 -14.3644 11.7333 11.7333 12.5099 12.5099 15.3649 15.3649 16.0588 16.0588 18.5729 18.5729 18.9273 18.9273 20.1867 20.1867 20.5094 20.5094 22.3884 22.3884 22.7314 22.7314 22.9008 22.9008 k = 0.5000 0.2887 0.2542 ( 1436 PWs) bands (ev): -41.1447 -41.1447 -41.0113 -41.0113 -17.2208 -17.2208 -17.0313 -17.0313 -14.9946 -14.9946 -14.7236 -14.7236 -14.4244 -14.4244 -14.3376 -14.3376 11.6623 11.6623 12.5918 12.5918 15.2981 15.2981 16.1263 16.1263 18.3831 18.3831 18.8169 18.8169 20.3246 20.3246 20.6815 20.6815 22.3691 22.3691 22.7152 22.7152 22.9260 22.9260 k = 0.5000 0.2887 0.2451 ( 1436 PWs) bands (ev): -41.1553 -41.1553 -41.0003 -41.0003 -17.2421 -17.2421 -17.0215 -17.0215 -15.0206 -15.0206 -14.7175 -14.7175 -14.4190 -14.4190 -14.3069 -14.3069 11.5929 11.5929 12.6740 12.6740 15.2324 15.2324 16.1924 16.1924 18.1965 18.1965 18.7095 18.7095 20.4642 20.4642 20.8418 20.8418 22.3624 22.3624 22.6987 22.6987 22.9473 22.9473 k = 0.5000 0.2887 0.2360 ( 1430 PWs) bands (ev): -41.1657 -41.1657 -40.9894 -40.9894 -17.2639 -17.2639 -17.0125 -17.0125 -15.0454 -15.0454 -14.7139 -14.7139 -14.4129 -14.4129 -14.2731 -14.2731 11.5252 11.5252 12.7563 12.7563 15.1680 15.1680 16.2569 16.2569 18.0136 18.0136 18.6054 18.6054 20.6051 20.6051 20.9871 20.9871 22.3709 22.3709 22.6825 22.6825 22.9670 22.9670 k = 0.5000 0.2887 0.2269 ( 1434 PWs) bands (ev): -41.1761 -41.1761 -40.9788 -40.9788 -17.2863 -17.2863 -17.0044 -17.0044 -15.0692 -15.0692 -14.7126 -14.7126 -14.4066 -14.4066 -14.2369 -14.2369 11.4592 11.4592 12.8385 12.8385 15.1049 15.1049 16.3195 16.3195 17.8348 17.8348 18.5047 18.5047 20.7473 20.7473 21.1140 21.1140 22.3970 22.3970 22.6667 22.6667 22.9858 22.9858 k = 0.5000 0.2887 0.2179 ( 1434 PWs) bands (ev): -41.1861 -41.1861 -40.9683 -40.9683 -17.3091 -17.3091 -16.9970 -16.9970 -15.0917 -15.0917 -14.7128 -14.7128 -14.4000 -14.4000 -14.1987 -14.1987 11.3951 11.3951 12.9207 12.9207 15.0433 15.0433 16.3801 16.3801 17.6605 17.6605 18.4073 18.4073 20.8903 20.8903 21.2203 21.2203 22.4419 22.4419 22.6517 22.6517 23.0041 23.0041 k = 0.5000 0.2887 0.2088 ( 1430 PWs) bands (ev): -41.1958 -41.1958 -40.9579 -40.9579 -17.3322 -17.3322 -16.9903 -16.9903 -15.1130 -15.1130 -14.7144 -14.7144 -14.3931 -14.3931 -14.1592 -14.1592 11.3330 11.3330 13.0025 13.0025 14.9833 14.9833 16.4382 16.4382 17.4911 17.4911 18.3134 18.3134 21.0338 21.0338 21.3054 21.3054 22.5044 22.5044 22.6384 22.6384 23.0218 23.0218 k = 0.5000 0.2887 0.1997 ( 1426 PWs) bands (ev): -41.2053 -41.2053 -40.9478 -40.9478 -17.3553 -17.3553 -16.9843 -16.9843 -15.1328 -15.1328 -14.7169 -14.7169 -14.3863 -14.3863 -14.1189 -14.1189 11.2728 11.2728 13.0837 13.0837 14.9250 14.9250 16.4936 16.4936 17.3268 17.3268 18.2230 18.2230 21.1772 21.1772 21.3712 21.3712 22.5741 22.5741 22.6343 22.6343 23.0390 23.0390 k = 0.5000 0.2887 0.1906 ( 1426 PWs) bands (ev): -41.2145 -41.2145 -40.9381 -40.9381 -17.3787 -17.3787 -16.9790 -16.9790 -15.1515 -15.1515 -14.7201 -14.7201 -14.3795 -14.3795 -14.0781 -14.0781 11.2148 11.2148 13.1643 13.1643 14.8685 14.8685 16.5461 16.5461 17.1682 17.1682 18.1363 18.1363 21.3186 21.3186 21.4228 21.4228 22.5952 22.5952 22.6906 22.6906 23.0558 23.0558 k = 0.5000 0.2887 0.1816 ( 1430 PWs) bands (ev): -41.2236 -41.2236 -40.9287 -40.9287 -17.4019 -17.4019 -16.9743 -16.9743 -15.1688 -15.1688 -14.7239 -14.7239 -14.3727 -14.3727 -14.0372 -14.0372 11.1588 11.1588 13.2439 13.2439 14.8138 14.8138 16.5954 16.5954 17.0154 17.0154 18.0532 18.0532 21.4347 21.4347 21.4872 21.4872 22.5859 22.5859 22.7832 22.7832 23.0722 23.0722 k = 0.5000 0.2887 0.1725 ( 1424 PWs) bands (ev): -41.2319 -41.2319 -40.9195 -40.9195 -17.4250 -17.4250 -16.9699 -16.9699 -15.1849 -15.1849 -14.7279 -14.7279 -14.3660 -14.3660 -13.9965 -13.9965 11.1052 11.1052 13.3225 13.3225 14.7611 14.7611 16.6411 16.6411 16.8691 16.8691 17.9739 17.9739 21.4763 21.4763 21.6173 21.6173 22.5740 22.5740 22.8790 22.8790 23.0880 23.0880 k = 0.5000 0.2887 0.1634 ( 1422 PWs) bands (ev): -41.2401 -41.2401 -40.9107 -40.9107 -17.4477 -17.4477 -16.9662 -16.9662 -15.1998 -15.1998 -14.7322 -14.7322 -14.3594 -14.3594 -13.9563 -13.9563 11.0538 11.0538 13.3997 13.3997 14.7103 14.7103 16.6796 16.6796 16.7328 16.7328 17.8984 17.8984 21.5015 21.5015 21.7577 21.7577 22.5622 22.5622 22.9704 22.9704 23.1034 23.1034 k = 0.5000 0.2887 0.1543 ( 1430 PWs) bands (ev): -41.2481 -41.2481 -40.9025 -40.9025 -17.4702 -17.4702 -16.9630 -16.9630 -15.2135 -15.2135 -14.7366 -14.7366 -14.3530 -14.3530 -13.9171 -13.9171 11.0048 11.0048 13.4753 13.4753 14.6616 14.6616 16.5915 16.5915 16.7261 16.7261 17.8267 17.8267 21.5229 21.5229 21.8976 21.8976 22.5510 22.5510 23.0527 23.0527 23.1183 23.1183 k = 0.5000 0.2887 0.1452 ( 1434 PWs) bands (ev): -41.2557 -41.2557 -40.8946 -40.8946 -17.4920 -17.4920 -16.9601 -16.9601 -15.2261 -15.2261 -14.7411 -14.7411 -14.3469 -14.3469 -13.8789 -13.8789 10.9582 10.9582 13.5491 13.5491 14.6151 14.6151 16.4654 16.4654 16.7605 16.7605 17.7588 17.7588 21.5432 21.5432 22.0354 22.0354 22.5410 22.5410 23.1223 23.1223 23.1330 23.1330 k = 0.5000 0.2887 0.1362 ( 1422 PWs) bands (ev): -41.2626 -41.2626 -40.8865 -40.8865 -17.5130 -17.5130 -16.9575 -16.9575 -15.2374 -15.2374 -14.7454 -14.7454 -14.3408 -14.3408 -13.8418 -13.8418 10.9141 10.9141 13.6209 13.6209 14.5708 14.5708 16.3455 16.3455 16.7920 16.7920 17.6950 17.6950 21.5638 21.5638 22.1695 22.1695 22.5328 22.5328 23.1462 23.1462 23.1782 23.1782 k = 0.5000 0.2887 0.1271 ( 1426 PWs) bands (ev): -41.2695 -41.2695 -40.8793 -40.8793 -17.5333 -17.5333 -16.9554 -16.9554 -15.2479 -15.2479 -14.7497 -14.7497 -14.3351 -14.3351 -13.8063 -13.8063 10.8726 10.8726 13.6902 13.6902 14.5287 14.5287 16.2326 16.2326 16.8200 16.8200 17.6351 17.6351 21.5856 21.5856 22.2970 22.2970 22.5289 22.5289 23.1597 23.1597 23.2176 23.2176 k = 0.5000 0.2887 0.1180 ( 1426 PWs) bands (ev): -41.2759 -41.2759 -40.8724 -40.8724 -17.5527 -17.5527 -16.9536 -16.9536 -15.2573 -15.2573 -14.7539 -14.7539 -14.3297 -14.3297 -13.7723 -13.7723 10.8337 10.8337 13.7569 13.7569 14.4890 14.4890 16.1270 16.1270 16.8444 16.8444 17.5793 17.5793 21.6092 21.6092 22.4061 22.4061 22.5403 22.5403 23.1726 23.1726 23.2411 23.2411 k = 0.5000 0.2887 0.1089 ( 1430 PWs) bands (ev): -41.2820 -41.2820 -40.8660 -40.8660 -17.5711 -17.5711 -16.9521 -16.9521 -15.2658 -15.2658 -14.7580 -14.7580 -14.3246 -14.3246 -13.7402 -13.7402 10.7974 10.7974 13.8205 13.8205 14.4517 14.4517 16.0288 16.0288 16.8653 16.8653 17.5275 17.5275 21.6348 21.6348 22.4594 22.4594 22.6034 22.6034 23.1851 23.1851 23.2500 23.2500 k = 0.5000 0.2887 0.0999 ( 1434 PWs) bands (ev): -41.2875 -41.2875 -40.8602 -40.8602 -17.5885 -17.5885 -16.9508 -16.9508 -15.2735 -15.2735 -14.7618 -14.7618 -14.3199 -14.3199 -13.7100 -13.7100 10.7638 10.7638 13.8809 13.8809 14.4169 14.4169 15.9383 15.9383 16.8830 16.8830 17.4799 17.4799 21.6624 21.6624 22.4675 22.4675 22.7066 22.7066 23.1974 23.1974 23.2459 23.2459 k = 0.5000 0.2887 0.0908 ( 1434 PWs) bands (ev): -41.2925 -41.2925 -40.8547 -40.8547 -17.6046 -17.6046 -16.9496 -16.9496 -15.2802 -15.2802 -14.7653 -14.7653 -14.3155 -14.3155 -13.6820 -13.6820 10.7330 10.7330 13.9376 13.9376 14.3847 14.3847 15.8554 15.8554 16.8976 16.8976 17.4363 17.4363 21.6918 21.6918 22.4654 22.4654 22.8139 22.8139 23.2084 23.2084 23.2326 23.2326 k = 0.5000 0.2887 0.0817 ( 1434 PWs) bands (ev): -41.2971 -41.2971 -40.8497 -40.8497 -17.6194 -17.6194 -16.9487 -16.9487 -15.2862 -15.2862 -14.7685 -14.7685 -14.3115 -14.3115 -13.6562 -13.6562 10.7050 10.7050 13.9903 13.9903 14.3552 14.3552 15.7802 15.7802 16.9093 16.9093 17.3970 17.3970 21.7228 21.7228 22.4610 22.4610 22.9154 22.9154 23.2021 23.2021 23.2294 23.2294 k = 0.5000 0.2887 0.0726 ( 1428 PWs) bands (ev): -41.3012 -41.3012 -40.8449 -40.8449 -17.6328 -17.6328 -16.9479 -16.9479 -15.2914 -15.2914 -14.7714 -14.7714 -14.3078 -14.3078 -13.6328 -13.6328 10.6799 10.6799 14.0387 14.0387 14.3284 14.3284 15.7130 15.7130 16.9185 16.9185 17.3618 17.3618 21.7547 21.7547 22.4562 22.4562 23.0063 23.0063 23.1742 23.1742 23.2448 23.2448 k = 0.5000 0.2887 0.0635 ( 1428 PWs) bands (ev): -41.3049 -41.3049 -40.8409 -40.8409 -17.6448 -17.6448 -16.9472 -16.9472 -15.2959 -15.2959 -14.7741 -14.7741 -14.3045 -14.3045 -13.6119 -13.6119 10.6576 10.6576 14.0823 14.0823 14.3045 14.3045 15.6536 15.6536 16.9256 16.9256 17.3308 17.3308 21.7870 21.7870 22.4517 22.4517 23.0814 23.0814 23.1415 23.1415 23.2682 23.2682 k = 0.5000 0.2887 0.0545 ( 1428 PWs) bands (ev): -41.3081 -41.3081 -40.8374 -40.8374 -17.6554 -17.6554 -16.9467 -16.9467 -15.2998 -15.2998 -14.7764 -14.7764 -14.3017 -14.3017 -13.5936 -13.5936 10.6382 10.6382 14.1210 14.1210 14.2835 14.2835 15.6021 15.6021 16.9307 16.9307 17.3039 17.3039 21.8187 21.8187 22.4477 22.4477 23.1040 23.1040 23.1386 23.1386 23.3024 23.3024 k = 0.5000 0.2887 0.0454 ( 1430 PWs) bands (ev): -41.3109 -41.3109 -40.8344 -40.8344 -17.6644 -17.6644 -16.9463 -16.9463 -15.3030 -15.3030 -14.7784 -14.7784 -14.2993 -14.2993 -13.5780 -13.5780 10.6217 10.6217 14.1543 14.1543 14.2656 14.2656 15.5585 15.5585 16.9344 16.9344 17.2813 17.2813 21.8489 21.8489 22.4442 22.4442 23.0703 23.0703 23.1712 23.1712 23.3465 23.3465 k = 0.5000 0.2887 0.0363 ( 1432 PWs) bands (ev): -41.3132 -41.3132 -40.8319 -40.8319 -17.6719 -17.6719 -16.9460 -16.9460 -15.3056 -15.3056 -14.7800 -14.7800 -14.2973 -14.2973 -13.5651 -13.5651 10.6082 10.6082 14.1821 14.1821 14.2508 14.2508 15.5228 15.5228 16.9368 16.9368 17.2628 17.2628 21.8762 21.8762 22.4414 22.4414 23.0383 23.0383 23.1903 23.1903 23.3925 23.3925 k = 0.5000 0.2887 0.0272 ( 1436 PWs) bands (ev): -41.3151 -41.3151 -40.8300 -40.8300 -17.6777 -17.6777 -16.9458 -16.9458 -15.3076 -15.3076 -14.7813 -14.7813 -14.2957 -14.2957 -13.5551 -13.5551 10.5977 10.5977 14.2039 14.2039 14.2393 14.2393 15.4951 15.4951 16.9384 16.9384 17.2485 17.2485 21.8995 21.8995 22.4393 22.4393 23.0107 23.0107 23.2015 23.2015 23.4330 23.4330 k = 0.5000 0.2887 0.0182 ( 1436 PWs) bands (ev): -41.3163 -41.3163 -40.8287 -40.8287 -17.6819 -17.6819 -16.9457 -16.9457 -15.3090 -15.3090 -14.7822 -14.7822 -14.2946 -14.2946 -13.5479 -13.5479 10.5902 10.5902 14.2195 14.2195 14.2310 14.2310 15.4753 15.4753 16.9393 16.9393 17.2383 17.2383 21.9173 21.9173 22.4379 22.4379 22.9893 22.9893 23.2082 23.2082 23.4640 23.4640 k = 0.5000 0.2887 0.0091 ( 1434 PWs) bands (ev): -41.3171 -41.3171 -40.8278 -40.8278 -17.6844 -17.6844 -16.9456 -16.9456 -15.3098 -15.3098 -14.7828 -14.7828 -14.2940 -14.2940 -13.5435 -13.5435 10.5857 10.5857 14.2255 14.2255 14.2296 14.2296 15.4635 15.4635 16.9397 16.9397 17.2322 17.2322 21.9286 21.9286 22.4370 22.4370 22.9759 22.9759 23.2118 23.2118 23.4832 23.4832 k = 0.5000 0.2887-0.0000 ( 1436 PWs) bands (ev): -41.3172 -41.3172 -40.8277 -40.8277 -17.6853 -17.6853 -16.9455 -16.9455 -15.3102 -15.3102 -14.7830 -14.7830 -14.2938 -14.2938 -13.5420 -13.5420 10.5842 10.5842 14.2240 14.2240 14.2326 14.2326 15.4595 15.4595 16.9399 16.9399 17.2301 17.2301 21.9324 21.9324 22.4368 22.4368 22.9712 22.9712 23.2129 23.2129 23.4897 23.4897 k = 0.3333 0.5774-0.0000 ( 1428 PWs) bands (ev): -41.3033 -41.3033 -40.8161 -40.8161 -17.6811 -17.6811 -16.9590 -16.9590 -15.2900 -15.2900 -14.8781 -14.8781 -14.4109 -14.4109 -13.5623 -13.5623 11.9910 11.9910 12.0619 12.0619 15.4890 15.4890 15.8261 15.8261 15.9221 15.9221 19.4077 19.4077 19.4706 19.4706 22.4617 22.4617 22.5711 22.5711 24.0258 24.0258 24.1141 24.1141 k = 0.3333 0.5774 0.0091 ( 1428 PWs) bands (ev): -41.3031 -41.3031 -40.8164 -40.8164 -17.6803 -17.6803 -16.9591 -16.9591 -15.2896 -15.2896 -14.8779 -14.8779 -14.4112 -14.4112 -13.5637 -13.5637 11.9916 11.9916 12.0626 12.0626 15.4934 15.4934 15.8269 15.8269 15.9229 15.9229 19.4069 19.4069 19.4698 19.4698 22.4516 22.4516 22.5595 22.5595 24.0360 24.0360 24.1228 24.1228 k = 0.3333 0.5774 0.0182 ( 1428 PWs) bands (ev): -41.3023 -41.3023 -40.8172 -40.8172 -17.6778 -17.6778 -16.9592 -16.9592 -15.2887 -15.2887 -14.8772 -14.8772 -14.4120 -14.4120 -13.5682 -13.5682 11.9936 11.9936 12.0647 12.0647 15.5066 15.5066 15.8292 15.8292 15.9252 15.9252 19.4045 19.4045 19.4673 19.4673 22.4221 22.4221 22.5258 22.5258 24.0654 24.0654 24.1483 24.1483 k = 0.3333 0.5774 0.0272 ( 1434 PWs) bands (ev): -41.3011 -41.3011 -40.8188 -40.8188 -17.6739 -17.6739 -16.9593 -16.9593 -15.2872 -15.2872 -14.8760 -14.8760 -14.4133 -14.4133 -13.5756 -13.5756 11.9967 11.9967 12.0682 12.0682 15.5285 15.5285 15.8332 15.8332 15.9292 15.9292 19.4005 19.4005 19.4632 19.4632 22.3749 22.3749 22.4724 22.4724 24.1117 24.1117 24.1888 24.1888 k = 0.3333 0.5774 0.0363 ( 1434 PWs) bands (ev): -41.2994 -41.2994 -40.8207 -40.8207 -17.6681 -17.6681 -16.9596 -16.9596 -15.2849 -15.2849 -14.8743 -14.8743 -14.4151 -14.4151 -13.5859 -13.5859 12.0012 12.0012 12.0731 12.0731 15.5591 15.5591 15.8387 15.8387 15.9346 15.9346 19.3950 19.3950 19.4574 19.4574 22.3125 22.3125 22.4027 22.4027 24.1714 24.1714 24.2417 24.2417 k = 0.3333 0.5774 0.0454 ( 1431 PWs) bands (ev): -41.2970 -41.2970 -40.8232 -40.8232 -17.6608 -17.6608 -16.9599 -16.9599 -15.2820 -15.2820 -14.8722 -14.8722 -14.4174 -14.4174 -13.5990 -13.5990 12.0068 12.0068 12.0793 12.0793 15.5983 15.5983 15.8458 15.8458 15.9416 15.9416 19.3881 19.3881 19.4502 19.4502 22.2375 22.2375 22.3200 22.3200 24.2414 24.2414 24.3045 24.3045 k = 0.3333 0.5774 0.0545 ( 1437 PWs) bands (ev): -41.2943 -41.2943 -40.8264 -40.8264 -17.6521 -17.6521 -16.9603 -16.9603 -15.2785 -15.2785 -14.8696 -14.8696 -14.4204 -14.4204 -13.6150 -13.6150 12.0136 12.0136 12.0868 12.0868 15.6460 15.6460 15.8545 15.8545 15.9501 15.9501 19.3798 19.3798 19.4416 19.4416 22.1525 22.1525 22.2273 22.2273 24.3188 24.3188 24.3744 24.3744 k = 0.3333 0.5774 0.0635 ( 1437 PWs) bands (ev): -41.2912 -41.2912 -40.8299 -40.8299 -17.6417 -17.6417 -16.9609 -16.9609 -15.2741 -15.2741 -14.8665 -14.8665 -14.4237 -14.4237 -13.6338 -13.6338 12.0216 12.0216 12.0956 12.0956 15.7020 15.7020 15.8650 15.8650 15.9601 15.9601 19.3702 19.3702 19.4316 19.4316 22.0595 22.0595 22.1270 22.1270 24.4012 24.4012 24.4483 24.4483 k = 0.3333 0.5774 0.0726 ( 1440 PWs) bands (ev): -41.2876 -41.2876 -40.8339 -40.8339 -17.6299 -17.6299 -16.9616 -16.9616 -15.2690 -15.2690 -14.8630 -14.8630 -14.4275 -14.4275 -13.6554 -13.6554 12.0306 12.0306 12.1055 12.1055 15.7657 15.7657 15.8776 15.8776 15.9716 15.9716 19.3596 19.3596 19.4205 19.4205 21.9604 21.9604 22.0210 22.0210 24.4869 24.4869 24.5194 24.5194 k = 0.3333 0.5774 0.0817 ( 1440 PWs) bands (ev): -41.2835 -41.2835 -40.8384 -40.8384 -17.6168 -17.6168 -16.9624 -16.9624 -15.2631 -15.2631 -14.8591 -14.8591 -14.4318 -14.4318 -13.6794 -13.6794 12.0406 12.0406 12.1165 12.1165 15.8344 15.8344 15.8950 15.8950 15.9844 15.9844 19.3479 19.3479 19.4084 19.4084 21.8567 21.8567 21.9107 21.9107 24.5340 24.5340 24.5745 24.5745 k = 0.3333 0.5774 0.0908 ( 1434 PWs) bands (ev): -41.2787 -41.2787 -40.8434 -40.8434 -17.6023 -17.6023 -16.9633 -16.9633 -15.2564 -15.2564 -14.8546 -14.8546 -14.4366 -14.4366 -13.7058 -13.7058 12.0515 12.0515 12.1285 12.1285 15.8873 15.8873 15.9378 15.9378 15.9986 15.9986 19.3355 19.3355 19.3955 19.3955 21.7495 21.7495 21.7974 21.7974 24.4553 24.4553 24.6629 24.6629 k = 0.3333 0.5774 0.0999 ( 1425 PWs) bands (ev): -41.2734 -41.2734 -40.8487 -40.8487 -17.5864 -17.5864 -16.9643 -16.9643 -15.2487 -15.2487 -14.8497 -14.8497 -14.4418 -14.4418 -13.7346 -13.7346 12.0632 12.0632 12.1414 12.1414 15.9104 15.9104 16.0140 16.0140 16.0198 16.0198 19.3224 19.3224 19.3818 19.3818 21.6398 21.6398 21.6820 21.6820 24.3532 24.3532 24.7514 24.7514 k = 0.3333 0.5774 0.1089 ( 1425 PWs) bands (ev): -41.2679 -41.2679 -40.8547 -40.8547 -17.5695 -17.5695 -16.9657 -16.9657 -15.2402 -15.2402 -14.8444 -14.8444 -14.4474 -14.4474 -13.7658 -13.7658 12.0757 12.0757 12.1552 12.1552 15.9286 15.9286 16.0307 16.0307 16.1158 16.1158 19.3088 19.3088 19.3677 19.3677 21.5286 21.5286 21.5653 21.5653 24.2384 24.2384 24.8392 24.8392 k = 0.3333 0.5774 0.1180 ( 1425 PWs) bands (ev): -41.2620 -41.2620 -40.8611 -40.8611 -17.5516 -17.5516 -16.9673 -16.9673 -15.2307 -15.2307 -14.8388 -14.8388 -14.4535 -14.4535 -13.7991 -13.7991 12.0888 12.0888 12.1697 12.1697 15.9469 15.9469 16.0485 16.0485 16.2208 16.2208 19.2950 19.2950 19.3532 19.3532 21.4164 21.4164 21.4479 21.4479 24.1125 24.1125 24.9258 24.9258 k = 0.3333 0.5774 0.1271 ( 1419 PWs) bands (ev): -41.2557 -41.2557 -40.8677 -40.8677 -17.5325 -17.5325 -16.9691 -16.9691 -15.2200 -15.2200 -14.8327 -14.8327 -14.4599 -14.4599 -13.8344 -13.8344 12.1025 12.1025 12.1848 12.1848 15.9657 15.9657 16.0674 16.0674 16.3339 16.3339 19.2811 19.2811 19.3388 19.3388 21.3040 21.3040 21.3306 21.3306 23.9760 23.9760 25.0105 25.0109 k = 0.3333 0.5774 0.1362 ( 1419 PWs) bands (ev): -41.2490 -41.2490 -40.8749 -40.8749 -17.5127 -17.5127 -16.9713 -16.9713 -15.2084 -15.2084 -14.8262 -14.8262 -14.4669 -14.4669 -13.8716 -13.8716 12.1166 12.1166 12.2004 12.2004 15.9853 15.9853 16.0873 16.0873 16.4548 16.4548 19.2674 19.2674 19.3244 19.3244 21.1920 21.1920 21.2137 21.2137 23.8294 23.8294 25.0451 25.0451 k = 0.3333 0.5774 0.1452 ( 1413 PWs) bands (ev): -41.2418 -41.2418 -40.8823 -40.8823 -17.4920 -17.4920 -16.9738 -16.9738 -15.1955 -15.1955 -14.8194 -14.8194 -14.4741 -14.4741 -13.9105 -13.9105 12.1311 12.1311 12.2163 12.2163 16.0056 16.0056 16.1079 16.1079 16.5831 16.5831 19.2541 19.2541 19.3104 19.3104 21.0807 21.0807 21.0978 21.0978 23.6730 23.6730 25.0785 25.0785 k = 0.3333 0.5774 0.1543 ( 1413 PWs) bands (ev): -41.2343 -41.2343 -40.8904 -40.8904 -17.4708 -17.4708 -16.9767 -16.9767 -15.1815 -15.1815 -14.8122 -14.8122 -14.4818 -14.4818 -13.9509 -13.9509 12.1457 12.1457 12.2325 12.2325 16.0265 16.0265 16.1293 16.1293 16.7186 16.7186 19.2414 19.2414 19.2970 19.2970 20.9707 20.9707 20.9833 20.9833 23.5073 23.5073 25.1132 25.1132 k = 0.3333 0.5774 0.1634 ( 1413 PWs) bands (ev): -41.2265 -41.2265 -40.8988 -40.8988 -17.4490 -17.4490 -16.9799 -16.9799 -15.1662 -15.1662 -14.8046 -14.8046 -14.4898 -14.4898 -13.9927 -13.9927 12.1604 12.1604 12.2487 12.2487 16.0479 16.0479 16.1512 16.1512 16.8612 16.8612 19.2296 19.2296 19.2845 19.2845 20.8624 20.8624 20.8706 20.8706 23.3329 23.3329 25.1497 25.1497 k = 0.3333 0.5774 0.1725 ( 1419 PWs) bands (ev): -41.2182 -41.2182 -40.9078 -40.9078 -17.4270 -17.4270 -16.9836 -16.9836 -15.1496 -15.1496 -14.7968 -14.7968 -14.4982 -14.4982 -14.0358 -14.0358 12.1750 12.1750 12.2649 12.2649 16.0695 16.0695 16.1735 16.1735 17.0106 17.0106 19.2189 19.2189 19.2730 19.2730 20.7562 20.7562 20.7601 20.7601 23.1503 23.1503 25.1881 25.1881 k = 0.3333 0.5774 0.1816 ( 1431 PWs) bands (ev): -41.2102 -41.2102 -40.9169 -40.9169 -17.4045 -17.4045 -16.9880 -16.9880 -15.1316 -15.1316 -14.7887 -14.7887 -14.5069 -14.5069 -14.0802 -14.0802 12.1895 12.1895 12.2809 12.2809 16.0914 16.0914 16.1960 16.1960 17.1665 17.1665 19.2095 19.2095 19.2628 19.2628 20.6523 20.6523 20.6526 20.6526 22.9603 22.9603 25.2285 25.2285 k = 0.3333 0.5774 0.1906 ( 1437 PWs) bands (ev): -41.2016 -41.2016 -40.9263 -40.9263 -17.3819 -17.3819 -16.9928 -16.9928 -15.1121 -15.1121 -14.7802 -14.7802 -14.5158 -14.5158 -14.1253 -14.1253 12.2036 12.2036 12.2965 12.2965 16.1131 16.1131 16.2185 16.2185 17.3288 17.3288 19.2016 19.2016 19.2541 19.2541 20.5475 20.5475 20.5519 20.5519 22.7635 22.7635 25.2709 25.2709 k = 0.3333 0.5774 0.1997 ( 1437 PWs) bands (ev): -41.1924 -41.1924 -40.9360 -40.9360 -17.3592 -17.3592 -16.9981 -16.9981 -15.0911 -15.0911 -14.7714 -14.7714 -14.5251 -14.5251 -14.1710 -14.1710 12.2174 12.2174 12.3117 12.3117 16.1347 16.1347 16.2409 16.2409 17.4972 17.4972 19.1955 19.1955 19.2471 19.2471 20.4461 20.4461 20.4546 20.4546 22.5608 22.5608 25.3153 25.3153 k = 0.3333 0.5774 0.2088 ( 1437 PWs) bands (ev): -41.1830 -41.1830 -40.9459 -40.9459 -17.3366 -17.3366 -17.0040 -17.0040 -15.0685 -15.0685 -14.7624 -14.7624 -14.5345 -14.5345 -14.2173 -14.2173 12.2305 12.2305 12.3263 12.3263 16.1558 16.1558 16.2628 16.2628 17.6715 17.6715 19.1914 19.1914 19.2421 19.2421 20.3485 20.3485 20.3611 20.3611 22.3527 22.3527 25.3617 25.3617 k = 0.3333 0.5774 0.2179 ( 1425 PWs) bands (ev): -41.1730 -41.1730 -40.9558 -40.9558 -17.3140 -17.3140 -17.0104 -17.0104 -15.0442 -15.0442 -14.7530 -14.7530 -14.5442 -14.5442 -14.2638 -14.2638 12.2430 12.2430 12.3402 12.3402 16.1762 16.1762 16.2840 16.2840 17.8513 17.8513 19.1895 19.1895 19.2392 19.2392 20.2552 20.2552 20.2718 20.2718 22.1402 22.1402 25.4101 25.4101 k = 0.3333 0.5774 0.2269 ( 1425 PWs) bands (ev): -41.1630 -41.1630 -40.9662 -40.9662 -17.2918 -17.2918 -17.0176 -17.0176 -15.0185 -15.0185 -14.7435 -14.7435 -14.5541 -14.5541 -14.3106 -14.3106 12.2547 12.2547 12.3532 12.3532 16.1956 16.1956 16.3043 16.3043 18.0363 18.0363 19.1898 19.1898 19.2385 19.2385 20.1665 20.1665 20.1871 20.1871 21.9239 21.9239 25.4605 25.4605 k = 0.3333 0.5774 0.2360 ( 1425 PWs) bands (ev): -41.1528 -41.1528 -40.9768 -40.9768 -17.2701 -17.2701 -17.0256 -17.0256 -14.9910 -14.9910 -14.7338 -14.7338 -14.5642 -14.5642 -14.3575 -14.3575 12.2655 12.2655 12.3651 12.3651 16.2139 16.2139 16.3234 16.3234 18.2263 18.2263 19.1925 19.1925 19.2401 19.2401 20.0830 20.0830 20.1076 20.1076 21.7045 21.7045 25.5130 25.5130 k = 0.3333 0.5774 0.2451 ( 1425 PWs) bands (ev): -41.1424 -41.1424 -40.9876 -40.9876 -17.2488 -17.2488 -17.0343 -17.0343 -14.9619 -14.9619 -14.7239 -14.7239 -14.5744 -14.5744 -14.4041 -14.4041 12.2753 12.2753 12.3760 12.3760 16.2308 16.2308 16.3411 16.3411 18.4208 18.4208 19.1975 19.1975 19.2440 19.2440 20.0052 20.0052 20.0338 20.0338 21.4829 21.4829 25.5674 25.5675 k = 0.3333 0.5774 0.2542 ( 1431 PWs) bands (ev): -41.1321 -41.1321 -40.9985 -40.9985 -17.2282 -17.2282 -17.0440 -17.0440 -14.9312 -14.9312 -14.7139 -14.7139 -14.5847 -14.5847 -14.4506 -14.4506 12.2840 12.2840 12.3856 12.3856 16.2460 16.2460 16.3571 16.3571 18.6191 18.6191 19.2046 19.2046 19.2503 19.2503 19.9339 19.9339 19.9664 19.9664 21.2597 21.2597 25.6240 25.6240 k = 0.3333 0.5774 0.2633 ( 1431 PWs) bands (ev): -41.1214 -41.1214 -41.0095 -41.0095 -17.2082 -17.2082 -17.0544 -17.0544 -14.8987 -14.8987 -14.7037 -14.7037 -14.5951 -14.5951 -14.4965 -14.4965 12.2915 12.2915 12.3939 12.3939 16.2593 16.2593 16.3711 16.3711 18.8205 18.8205 19.2136 19.2136 19.2591 19.2591 19.8697 19.8697 19.9064 19.9064 21.0355 21.0355 25.6826 25.6826 k = 0.3333 0.5774 0.2723 ( 1431 PWs) bands (ev): -41.1105 -41.1105 -41.0206 -41.0206 -17.1889 -17.1889 -17.0657 -17.0657 -14.8647 -14.8647 -14.6935 -14.6935 -14.6056 -14.6056 -14.5417 -14.5417 12.2977 12.2977 12.4009 12.4009 16.2705 16.2705 16.3829 16.3829 19.0220 19.0220 19.2238 19.2238 19.2719 19.2719 19.8138 19.8138 19.8549 19.8549 20.8112 20.8112 25.7434 25.7434 k = 0.3333 0.5774 0.2814 ( 1434 PWs) bands (ev): -41.0995 -41.0995 -41.0319 -41.0319 -17.1705 -17.1705 -17.0778 -17.0778 -14.8292 -14.8292 -14.6833 -14.6833 -14.6160 -14.6160 -14.5861 -14.5861 12.3026 12.3026 12.4063 12.4063 16.2795 16.2795 16.3923 16.3923 19.2025 19.2025 19.2341 19.2341 19.3076 19.3076 19.7675 19.7675 19.8139 19.8139 20.5876 20.5876 25.8062 25.8062 k = 0.3333 0.5774 0.2905 ( 1428 PWs) bands (ev): -41.0881 -41.0881 -41.0432 -41.0432 -17.1529 -17.1529 -17.0907 -17.0907 -14.7920 -14.7920 -14.6732 -14.6732 -14.6295 -14.6295 -14.6261 -14.6261 12.3062 12.3062 12.4103 12.4103 16.2860 16.2860 16.3991 16.3991 19.2433 19.2433 19.2626 19.2626 19.4603 19.4603 19.7324 19.7324 19.7880 19.7880 20.3657 20.3657 25.8712 25.8712 k = 0.3333 0.5774 0.2996 ( 1428 PWs) bands (ev): -41.0769 -41.0769 -41.0544 -41.0544 -17.1364 -17.1364 -17.1044 -17.1044 -14.7535 -14.7535 -14.6719 -14.6719 -14.6641 -14.6641 -14.6353 -14.6353 12.3083 12.3083 12.4127 12.4127 16.2899 16.2899 16.4033 16.4033 19.2497 19.2497 19.2742 19.2742 19.6320 19.6320 19.7103 19.7103 19.8013 19.8013 20.1481 20.1481 25.9384 25.9384 k = 0.3333 0.5774 0.3086 ( 1428 PWs) bands (ev): -41.0657 -41.0657 -41.0657 -41.0657 -17.1242 -17.1242 -17.1157 -17.1157 -14.7167 -14.7167 -14.7100 -14.7100 -14.6592 -14.6592 -14.6401 -14.6401 12.3091 12.3091 12.4135 12.4135 16.2912 16.2912 16.4047 16.4047 19.2521 19.2521 19.2772 19.2772 19.6888 19.6888 19.7028 19.7028 19.9234 19.9234 19.9592 19.9592 25.9776 25.9776 Writing output data file MoH.save init_run : 0.11s CPU 0.22s WALL ( 1 calls) electrons : 75.56s CPU 77.45s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.02s WALL ( 1 calls) Called by electrons: c_bands : 75.55s CPU 77.45s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.02s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.02s WALL ( 451 calls) cegterg : 69.40s CPU 70.90s WALL ( 545 calls) Called by sum_band: Called by *egterg: h_psi : 32.68s CPU 33.61s WALL ( 8858 calls) s_psi : 1.39s CPU 1.56s WALL ( 8858 calls) g_psi : 0.06s CPU 0.07s WALL ( 7862 calls) cdiaghg : 34.54s CPU 34.91s WALL ( 8313 calls) cegterg:over : 2.09s CPU 2.21s WALL ( 7862 calls) cegterg:upda : 1.27s CPU 1.42s WALL ( 7862 calls) cegterg:last : 0.73s CPU 0.89s WALL ( 1435 calls) cdiaghg:chol : 1.58s CPU 1.72s WALL ( 8313 calls) cdiaghg:inve : 0.78s CPU 0.89s WALL ( 8313 calls) cdiaghg:para : 1.96s CPU 2.01s WALL ( 16626 calls) Called by h_psi: h_psi:vloc : 29.09s CPU 29.96s WALL ( 8858 calls) h_psi:vnl : 3.54s CPU 3.61s WALL ( 8858 calls) add_vuspsi : 2.00s CPU 1.99s WALL ( 8858 calls) General routines calbec : 1.50s CPU 1.60s WALL ( 8858 calls) fft : 0.00s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 27.58s CPU 28.34s WALL ( 660984 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.10s CPU 0.13s WALL ( 902 calls) Parallel routines fft_scatter : 12.75s CPU 12.99s WALL ( 661007 calls) PWSCF : 1m25.98s CPU 1m38.11s WALL This run was terminated on: 19:56:10 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=