Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 18:35:56 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: ./AlAuO2.save/ file Au.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 23 10 3 2443 712 121 Max 24 11 4 2472 749 142 Sum 859 379 121 88635 26183 4605 bravais-lattice index = 14 lattice parameter (alat) = 5.4554 a.u. unit-cell volume = 602.1441 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 424.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.455450 celldm(2)= 1.000000 celldm(3)= 4.282310 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 4.282310 ) 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 0.233519 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Au read from file: /users/gautes/Pseudo/Au.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d39daeb1f194fdf5670f47ad6d8ea3dd Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1279 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 O 6.00 15.99940 O( 1.00) Al 3.00 26.98150 Al( 1.00) Au 11.00 196.96660 Au( 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 ) ( -2.1411549 ) 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 ) ( 2.1411549 ) 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 ) ( -2.1411549 ) 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 ) ( -2.1411549 ) 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 ) ( 2.1411549 ) 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 ) ( 2.1411549 ) 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 ) ( 2.1411549 ) 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 ) ( -2.1411549 ) 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 ) ( 2.1411549 ) 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 ) ( 2.1411549 ) 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 ) ( -2.1411549 ) 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 ) ( -2.1411549 ) 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= 394 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 2) = ( 0.0079365 0.0045821 -0.0000000), wk = 0.0025381 k( 3) = ( 0.0158730 0.0091643 -0.0000000), wk = 0.0025381 k( 4) = ( 0.0238095 0.0137464 -0.0000000), wk = 0.0025381 k( 5) = ( 0.0317460 0.0183286 -0.0000000), wk = 0.0025381 k( 6) = ( 0.0396825 0.0229107 -0.0000000), wk = 0.0025381 k( 7) = ( 0.0476191 0.0274929 -0.0000000), wk = 0.0025381 k( 8) = ( 0.0555556 0.0320750 -0.0000000), wk = 0.0025381 k( 9) = ( 0.0634921 0.0366572 -0.0000000), wk = 0.0025381 k( 10) = ( 0.0714286 0.0412393 -0.0000000), wk = 0.0025381 k( 11) = ( 0.0793651 0.0458215 -0.0000000), wk = 0.0025381 k( 12) = ( 0.0873016 0.0504036 -0.0000000), wk = 0.0025381 k( 13) = ( 0.0952381 0.0549857 -0.0000000), wk = 0.0025381 k( 14) = ( 0.1031746 0.0595679 -0.0000000), wk = 0.0025381 k( 15) = ( 0.1111111 0.0641500 -0.0000000), wk = 0.0025381 k( 16) = ( 0.1190476 0.0687322 -0.0000000), wk = 0.0025381 k( 17) = ( 0.1269841 0.0733143 -0.0000000), wk = 0.0025381 k( 18) = ( 0.1349206 0.0778965 -0.0000000), wk = 0.0025381 k( 19) = ( 0.1428571 0.0824786 -0.0000000), wk = 0.0025381 k( 20) = ( 0.1507937 0.0870608 -0.0000000), wk = 0.0025381 k( 21) = ( 0.1587302 0.0916429 -0.0000000), wk = 0.0025381 k( 22) = ( 0.1666667 0.0962250 -0.0000000), wk = 0.0025381 k( 23) = ( 0.1746032 0.1008072 -0.0000000), wk = 0.0025381 k( 24) = ( 0.1825397 0.1053893 -0.0000000), wk = 0.0025381 k( 25) = ( 0.1904762 0.1099715 -0.0000000), wk = 0.0025381 k( 26) = ( 0.1984127 0.1145536 -0.0000000), wk = 0.0025381 k( 27) = ( 0.2063492 0.1191358 -0.0000000), wk = 0.0025381 k( 28) = ( 0.2142857 0.1237179 -0.0000000), wk = 0.0025381 k( 29) = ( 0.2222222 0.1283001 -0.0000000), wk = 0.0025381 k( 30) = ( 0.2301587 0.1328822 -0.0000000), wk = 0.0025381 k( 31) = ( 0.2380952 0.1374644 -0.0000000), wk = 0.0025381 k( 32) = ( 0.2460317 0.1420465 -0.0000000), wk = 0.0025381 k( 33) = ( 0.2539683 0.1466286 -0.0000000), wk = 0.0025381 k( 34) = ( 0.2619048 0.1512108 -0.0000000), wk = 0.0025381 k( 35) = ( 0.2698413 0.1557929 -0.0000000), wk = 0.0025381 k( 36) = ( 0.2777778 0.1603751 -0.0000000), wk = 0.0025381 k( 37) = ( 0.2857143 0.1649572 -0.0000000), wk = 0.0025381 k( 38) = ( 0.2936508 0.1695394 -0.0000000), wk = 0.0025381 k( 39) = ( 0.3015873 0.1741215 -0.0000000), wk = 0.0025381 k( 40) = ( 0.3095238 0.1787037 -0.0000000), wk = 0.0025381 k( 41) = ( 0.3174603 0.1832858 -0.0000000), wk = 0.0025381 k( 42) = ( 0.3253968 0.1878679 -0.0000000), wk = 0.0025381 k( 43) = ( 0.3333333 0.1924501 -0.0000000), wk = 0.0025381 k( 44) = ( 0.3412698 0.1970322 -0.0000000), wk = 0.0025381 k( 45) = ( 0.3492063 0.2016144 -0.0000000), wk = 0.0025381 k( 46) = ( 0.3571429 0.2061965 -0.0000000), wk = 0.0025381 k( 47) = ( 0.3650794 0.2107787 -0.0000000), wk = 0.0025381 k( 48) = ( 0.3730159 0.2153608 -0.0000000), wk = 0.0025381 k( 49) = ( 0.3809524 0.2199430 -0.0000000), wk = 0.0025381 k( 50) = ( 0.3888889 0.2245251 -0.0000000), wk = 0.0025381 k( 51) = ( 0.3968254 0.2291073 -0.0000000), wk = 0.0025381 k( 52) = ( 0.4047619 0.2336894 -0.0000000), wk = 0.0025381 k( 53) = ( 0.4126984 0.2382715 -0.0000000), wk = 0.0025381 k( 54) = ( 0.4206349 0.2428537 -0.0000000), wk = 0.0025381 k( 55) = ( 0.4285714 0.2474358 -0.0000000), wk = 0.0025381 k( 56) = ( 0.4365079 0.2520180 -0.0000000), wk = 0.0025381 k( 57) = ( 0.4444444 0.2566001 -0.0000000), wk = 0.0025381 k( 58) = ( 0.4523810 0.2611823 -0.0000000), wk = 0.0025381 k( 59) = ( 0.4603175 0.2657644 -0.0000000), wk = 0.0025381 k( 60) = ( 0.4682540 0.2703466 -0.0000000), wk = 0.0025381 k( 61) = ( 0.4761905 0.2749287 -0.0000000), wk = 0.0025381 k( 62) = ( 0.4841270 0.2795108 -0.0000000), wk = 0.0025381 k( 63) = ( 0.4920635 0.2840930 -0.0000000), wk = 0.0025381 k( 64) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0025381 k( 65) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0025381 k( 66) = ( 0.4954955 0.2964772 -0.0000000), wk = 0.0025381 k( 67) = ( 0.4909910 0.3042792 -0.0000000), wk = 0.0025381 k( 68) = ( 0.4864865 0.3120812 -0.0000000), wk = 0.0025381 k( 69) = ( 0.4819820 0.3198833 -0.0000000), wk = 0.0025381 k( 70) = ( 0.4774775 0.3276853 -0.0000000), wk = 0.0025381 k( 71) = ( 0.4729730 0.3354873 -0.0000000), wk = 0.0025381 k( 72) = ( 0.4684685 0.3432893 -0.0000000), wk = 0.0025381 k( 73) = ( 0.4639640 0.3510914 -0.0000000), wk = 0.0025381 k( 74) = ( 0.4594595 0.3588934 -0.0000000), wk = 0.0025381 k( 75) = ( 0.4549550 0.3666954 -0.0000000), wk = 0.0025381 k( 76) = ( 0.4504505 0.3744975 -0.0000000), wk = 0.0025381 k( 77) = ( 0.4459459 0.3822995 -0.0000000), wk = 0.0025381 k( 78) = ( 0.4414414 0.3901015 -0.0000000), wk = 0.0025381 k( 79) = ( 0.4369369 0.3979036 -0.0000000), wk = 0.0025381 k( 80) = ( 0.4324324 0.4057056 -0.0000000), wk = 0.0025381 k( 81) = ( 0.4279279 0.4135076 -0.0000000), wk = 0.0025381 k( 82) = ( 0.4234234 0.4213097 -0.0000000), wk = 0.0025381 k( 83) = ( 0.4189189 0.4291117 -0.0000000), wk = 0.0025381 k( 84) = ( 0.4144144 0.4369137 -0.0000000), wk = 0.0025381 k( 85) = ( 0.4099099 0.4447157 -0.0000000), wk = 0.0025381 k( 86) = ( 0.4054054 0.4525178 -0.0000000), wk = 0.0025381 k( 87) = ( 0.4009009 0.4603198 -0.0000000), wk = 0.0025381 k( 88) = ( 0.3963964 0.4681218 -0.0000000), wk = 0.0025381 k( 89) = ( 0.3918919 0.4759239 -0.0000000), wk = 0.0025381 k( 90) = ( 0.3873874 0.4837259 -0.0000000), wk = 0.0025381 k( 91) = ( 0.3828829 0.4915279 -0.0000000), wk = 0.0025381 k( 92) = ( 0.3783784 0.4993300 -0.0000000), wk = 0.0025381 k( 93) = ( 0.3738739 0.5071320 -0.0000000), wk = 0.0025381 k( 94) = ( 0.3693694 0.5149340 -0.0000000), wk = 0.0025381 k( 95) = ( 0.3648649 0.5227361 -0.0000000), wk = 0.0025381 k( 96) = ( 0.3603604 0.5305381 -0.0000000), wk = 0.0025381 k( 97) = ( 0.3558559 0.5383401 -0.0000000), wk = 0.0025381 k( 98) = ( 0.3513514 0.5461421 -0.0000000), wk = 0.0025381 k( 99) = ( 0.3468468 0.5539442 -0.0000000), wk = 0.0025381 k( 100) = ( 0.3423423 0.5617462 -0.0000000), wk = 0.0025381 k( 101) = ( 0.3378378 0.5695482 -0.0000000), wk = 0.0025381 k( 102) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0025381 k( 103) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0025381 k( 104) = ( 0.3287671 0.5694414 -0.0000000), wk = 0.0025381 k( 105) = ( 0.3242009 0.5615324 -0.0000000), wk = 0.0025381 k( 106) = ( 0.3196347 0.5536235 -0.0000000), wk = 0.0025381 k( 107) = ( 0.3150685 0.5457146 -0.0000000), wk = 0.0025381 k( 108) = ( 0.3105023 0.5378057 -0.0000000), wk = 0.0025381 k( 109) = ( 0.3059361 0.5298968 -0.0000000), wk = 0.0025381 k( 110) = ( 0.3013699 0.5219879 -0.0000000), wk = 0.0025381 k( 111) = ( 0.2968036 0.5140790 -0.0000000), wk = 0.0025381 k( 112) = ( 0.2922374 0.5061701 -0.0000000), wk = 0.0025381 k( 113) = ( 0.2876712 0.4982612 -0.0000000), wk = 0.0025381 k( 114) = ( 0.2831050 0.4903523 -0.0000000), wk = 0.0025381 k( 115) = ( 0.2785388 0.4824434 -0.0000000), wk = 0.0025381 k( 116) = ( 0.2739726 0.4745345 -0.0000000), wk = 0.0025381 k( 117) = ( 0.2694064 0.4666256 -0.0000000), wk = 0.0025381 k( 118) = ( 0.2648402 0.4587166 -0.0000000), wk = 0.0025381 k( 119) = ( 0.2602740 0.4508077 -0.0000000), wk = 0.0025381 k( 120) = ( 0.2557078 0.4428988 -0.0000000), wk = 0.0025381 k( 121) = ( 0.2511415 0.4349899 -0.0000000), wk = 0.0025381 k( 122) = ( 0.2465753 0.4270810 -0.0000000), wk = 0.0025381 k( 123) = ( 0.2420091 0.4191721 -0.0000000), wk = 0.0025381 k( 124) = ( 0.2374429 0.4112632 -0.0000000), wk = 0.0025381 k( 125) = ( 0.2328767 0.4033543 -0.0000000), wk = 0.0025381 k( 126) = ( 0.2283105 0.3954454 -0.0000000), wk = 0.0025381 k( 127) = ( 0.2237443 0.3875365 -0.0000000), wk = 0.0025381 k( 128) = ( 0.2191781 0.3796276 -0.0000000), wk = 0.0025381 k( 129) = ( 0.2146119 0.3717187 -0.0000000), wk = 0.0025381 k( 130) = ( 0.2100457 0.3638098 -0.0000000), wk = 0.0025381 k( 131) = ( 0.2054795 0.3559008 -0.0000000), wk = 0.0025381 k( 132) = ( 0.2009132 0.3479919 -0.0000000), wk = 0.0025381 k( 133) = ( 0.1963470 0.3400830 -0.0000000), wk = 0.0025381 k( 134) = ( 0.1917808 0.3321741 -0.0000000), wk = 0.0025381 k( 135) = ( 0.1872146 0.3242652 -0.0000000), wk = 0.0025381 k( 136) = ( 0.1826484 0.3163563 -0.0000000), wk = 0.0025381 k( 137) = ( 0.1780822 0.3084474 -0.0000000), wk = 0.0025381 k( 138) = ( 0.1735160 0.3005385 -0.0000000), wk = 0.0025381 k( 139) = ( 0.1689498 0.2926296 -0.0000000), wk = 0.0025381 k( 140) = ( 0.1643836 0.2847207 -0.0000000), wk = 0.0025381 k( 141) = ( 0.1598173 0.2768118 -0.0000000), wk = 0.0025381 k( 142) = ( 0.1552511 0.2689029 -0.0000000), wk = 0.0025381 k( 143) = ( 0.1506849 0.2609940 -0.0000000), wk = 0.0025381 k( 144) = ( 0.1461187 0.2530850 -0.0000000), wk = 0.0025381 k( 145) = ( 0.1415525 0.2451761 -0.0000000), wk = 0.0025381 k( 146) = ( 0.1369863 0.2372672 -0.0000000), wk = 0.0025381 k( 147) = ( 0.1324201 0.2293583 -0.0000000), wk = 0.0025381 k( 148) = ( 0.1278539 0.2214494 -0.0000000), wk = 0.0025381 k( 149) = ( 0.1232877 0.2135405 -0.0000000), wk = 0.0025381 k( 150) = ( 0.1187215 0.2056316 -0.0000000), wk = 0.0025381 k( 151) = ( 0.1141552 0.1977227 -0.0000000), wk = 0.0025381 k( 152) = ( 0.1095890 0.1898138 -0.0000000), wk = 0.0025381 k( 153) = ( 0.1050228 0.1819049 -0.0000000), wk = 0.0025381 k( 154) = ( 0.1004566 0.1739960 -0.0000000), wk = 0.0025381 k( 155) = ( 0.0958904 0.1660871 -0.0000000), wk = 0.0025381 k( 156) = ( 0.0913242 0.1581782 -0.0000000), wk = 0.0025381 k( 157) = ( 0.0867580 0.1502692 -0.0000000), wk = 0.0025381 k( 158) = ( 0.0821918 0.1423603 -0.0000000), wk = 0.0025381 k( 159) = ( 0.0776256 0.1344514 -0.0000000), wk = 0.0025381 k( 160) = ( 0.0730594 0.1265425 -0.0000000), wk = 0.0025381 k( 161) = ( 0.0684932 0.1186336 -0.0000000), wk = 0.0025381 k( 162) = ( 0.0639269 0.1107247 -0.0000000), wk = 0.0025381 k( 163) = ( 0.0593607 0.1028158 -0.0000000), wk = 0.0025381 k( 164) = ( 0.0547945 0.0949069 -0.0000000), wk = 0.0025381 k( 165) = ( 0.0502283 0.0869980 -0.0000000), wk = 0.0025381 k( 166) = ( 0.0456621 0.0790891 -0.0000000), wk = 0.0025381 k( 167) = ( 0.0410959 0.0711802 -0.0000000), wk = 0.0025381 k( 168) = ( 0.0365297 0.0632713 -0.0000000), wk = 0.0025381 k( 169) = ( 0.0319635 0.0553624 -0.0000000), wk = 0.0025381 k( 170) = ( 0.0273973 0.0474534 -0.0000000), wk = 0.0025381 k( 171) = ( 0.0228310 0.0395445 -0.0000000), wk = 0.0025381 k( 172) = ( 0.0182648 0.0316356 -0.0000000), wk = 0.0025381 k( 173) = ( 0.0136986 0.0237267 -0.0000000), wk = 0.0025381 k( 174) = ( 0.0091324 0.0158178 -0.0000000), wk = 0.0025381 k( 175) = ( 0.0045662 0.0079089 -0.0000000), wk = 0.0025381 k( 176) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 177) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 178) = ( 0.0000000 0.0000000 0.0089815), wk = 0.0025381 k( 179) = ( 0.0000000 0.0000000 0.0179630), wk = 0.0025381 k( 180) = ( 0.0000000 0.0000000 0.0269445), wk = 0.0025381 k( 181) = ( 0.0000000 0.0000000 0.0359260), wk = 0.0025381 k( 182) = ( 0.0000000 0.0000000 0.0449075), wk = 0.0025381 k( 183) = ( 0.0000000 0.0000000 0.0538890), wk = 0.0025381 k( 184) = ( 0.0000000 0.0000000 0.0628705), wk = 0.0025381 k( 185) = ( 0.0000000 0.0000000 0.0718520), wk = 0.0025381 k( 186) = ( 0.0000000 0.0000000 0.0808334), wk = 0.0025381 k( 187) = ( 0.0000000 0.0000000 0.0898149), wk = 0.0025381 k( 188) = ( 0.0000000 0.0000000 0.0987964), wk = 0.0025381 k( 189) = ( 0.0000000 0.0000000 0.1077779), wk = 0.0025381 k( 190) = ( 0.0000000 0.0000000 0.1167594), wk = 0.0025381 k( 191) = ( 0.0000000 0.0000000 0.1167594), wk = 0.0025381 k( 192) = ( 0.0079365 0.0045821 0.1167594), wk = 0.0025381 k( 193) = ( 0.0158730 0.0091643 0.1167594), wk = 0.0025381 k( 194) = ( 0.0238095 0.0137464 0.1167594), wk = 0.0025381 k( 195) = ( 0.0317460 0.0183286 0.1167594), wk = 0.0025381 k( 196) = ( 0.0396825 0.0229107 0.1167594), wk = 0.0025381 k( 197) = ( 0.0476191 0.0274929 0.1167594), wk = 0.0025381 k( 198) = ( 0.0555556 0.0320750 0.1167594), wk = 0.0025381 k( 199) = ( 0.0634921 0.0366572 0.1167594), wk = 0.0025381 k( 200) = ( 0.0714286 0.0412393 0.1167594), wk = 0.0025381 k( 201) = ( 0.0793651 0.0458215 0.1167594), wk = 0.0025381 k( 202) = ( 0.0873016 0.0504036 0.1167594), wk = 0.0025381 k( 203) = ( 0.0952381 0.0549857 0.1167594), wk = 0.0025381 k( 204) = ( 0.1031746 0.0595679 0.1167594), wk = 0.0025381 k( 205) = ( 0.1111111 0.0641500 0.1167594), wk = 0.0025381 k( 206) = ( 0.1190476 0.0687322 0.1167594), wk = 0.0025381 k( 207) = ( 0.1269841 0.0733143 0.1167594), wk = 0.0025381 k( 208) = ( 0.1349206 0.0778965 0.1167594), wk = 0.0025381 k( 209) = ( 0.1428571 0.0824786 0.1167594), wk = 0.0025381 k( 210) = ( 0.1507937 0.0870608 0.1167594), wk = 0.0025381 k( 211) = ( 0.1587302 0.0916429 0.1167594), wk = 0.0025381 k( 212) = ( 0.1666667 0.0962250 0.1167594), wk = 0.0025381 k( 213) = ( 0.1746032 0.1008072 0.1167594), wk = 0.0025381 k( 214) = ( 0.1825397 0.1053893 0.1167594), wk = 0.0025381 k( 215) = ( 0.1904762 0.1099715 0.1167594), wk = 0.0025381 k( 216) = ( 0.1984127 0.1145536 0.1167594), wk = 0.0025381 k( 217) = ( 0.2063492 0.1191358 0.1167594), wk = 0.0025381 k( 218) = ( 0.2142857 0.1237179 0.1167594), wk = 0.0025381 k( 219) = ( 0.2222222 0.1283001 0.1167594), wk = 0.0025381 k( 220) = ( 0.2301587 0.1328822 0.1167594), wk = 0.0025381 k( 221) = ( 0.2380952 0.1374644 0.1167594), wk = 0.0025381 k( 222) = ( 0.2460317 0.1420465 0.1167594), wk = 0.0025381 k( 223) = ( 0.2539683 0.1466286 0.1167594), wk = 0.0025381 k( 224) = ( 0.2619048 0.1512108 0.1167594), wk = 0.0025381 k( 225) = ( 0.2698413 0.1557929 0.1167594), wk = 0.0025381 k( 226) = ( 0.2777778 0.1603751 0.1167594), wk = 0.0025381 k( 227) = ( 0.2857143 0.1649572 0.1167594), wk = 0.0025381 k( 228) = ( 0.2936508 0.1695394 0.1167594), wk = 0.0025381 k( 229) = ( 0.3015873 0.1741215 0.1167594), wk = 0.0025381 k( 230) = ( 0.3095238 0.1787037 0.1167594), wk = 0.0025381 k( 231) = ( 0.3174603 0.1832858 0.1167594), wk = 0.0025381 k( 232) = ( 0.3253968 0.1878679 0.1167594), wk = 0.0025381 k( 233) = ( 0.3333333 0.1924501 0.1167594), wk = 0.0025381 k( 234) = ( 0.3412698 0.1970322 0.1167594), wk = 0.0025381 k( 235) = ( 0.3492063 0.2016144 0.1167594), wk = 0.0025381 k( 236) = ( 0.3571429 0.2061965 0.1167594), wk = 0.0025381 k( 237) = ( 0.3650794 0.2107787 0.1167594), wk = 0.0025381 k( 238) = ( 0.3730159 0.2153608 0.1167594), wk = 0.0025381 k( 239) = ( 0.3809524 0.2199430 0.1167594), wk = 0.0025381 k( 240) = ( 0.3888889 0.2245251 0.1167594), wk = 0.0025381 k( 241) = ( 0.3968254 0.2291073 0.1167594), wk = 0.0025381 k( 242) = ( 0.4047619 0.2336894 0.1167594), wk = 0.0025381 k( 243) = ( 0.4126984 0.2382715 0.1167594), wk = 0.0025381 k( 244) = ( 0.4206349 0.2428537 0.1167594), wk = 0.0025381 k( 245) = ( 0.4285714 0.2474358 0.1167594), wk = 0.0025381 k( 246) = ( 0.4365079 0.2520180 0.1167594), wk = 0.0025381 k( 247) = ( 0.4444444 0.2566001 0.1167594), wk = 0.0025381 k( 248) = ( 0.4523810 0.2611823 0.1167594), wk = 0.0025381 k( 249) = ( 0.4603175 0.2657644 0.1167594), wk = 0.0025381 k( 250) = ( 0.4682540 0.2703466 0.1167594), wk = 0.0025381 k( 251) = ( 0.4761905 0.2749287 0.1167594), wk = 0.0025381 k( 252) = ( 0.4841270 0.2795108 0.1167594), wk = 0.0025381 k( 253) = ( 0.4920635 0.2840930 0.1167594), wk = 0.0025381 k( 254) = ( 0.5000000 0.2886751 0.1167594), wk = 0.0025381 k( 255) = ( 0.5000000 0.2886751 0.1167594), wk = 0.0025381 k( 256) = ( 0.4954955 0.2964772 0.1167594), wk = 0.0025381 k( 257) = ( 0.4909910 0.3042792 0.1167594), wk = 0.0025381 k( 258) = ( 0.4864865 0.3120812 0.1167594), wk = 0.0025381 k( 259) = ( 0.4819820 0.3198833 0.1167594), wk = 0.0025381 k( 260) = ( 0.4774775 0.3276853 0.1167594), wk = 0.0025381 k( 261) = ( 0.4729730 0.3354873 0.1167594), wk = 0.0025381 k( 262) = ( 0.4684685 0.3432893 0.1167594), wk = 0.0025381 k( 263) = ( 0.4639640 0.3510914 0.1167594), wk = 0.0025381 k( 264) = ( 0.4594595 0.3588934 0.1167594), wk = 0.0025381 k( 265) = ( 0.4549550 0.3666954 0.1167594), wk = 0.0025381 k( 266) = ( 0.4504505 0.3744975 0.1167594), wk = 0.0025381 k( 267) = ( 0.4459459 0.3822995 0.1167594), wk = 0.0025381 k( 268) = ( 0.4414414 0.3901015 0.1167594), wk = 0.0025381 k( 269) = ( 0.4369369 0.3979036 0.1167594), wk = 0.0025381 k( 270) = ( 0.4324324 0.4057056 0.1167594), wk = 0.0025381 k( 271) = ( 0.4279279 0.4135076 0.1167594), wk = 0.0025381 k( 272) = ( 0.4234234 0.4213097 0.1167594), wk = 0.0025381 k( 273) = ( 0.4189189 0.4291117 0.1167594), wk = 0.0025381 k( 274) = ( 0.4144144 0.4369137 0.1167594), wk = 0.0025381 k( 275) = ( 0.4099099 0.4447157 0.1167594), wk = 0.0025381 k( 276) = ( 0.4054054 0.4525178 0.1167594), wk = 0.0025381 k( 277) = ( 0.4009009 0.4603198 0.1167594), wk = 0.0025381 k( 278) = ( 0.3963964 0.4681218 0.1167594), wk = 0.0025381 k( 279) = ( 0.3918919 0.4759239 0.1167594), wk = 0.0025381 k( 280) = ( 0.3873874 0.4837259 0.1167594), wk = 0.0025381 k( 281) = ( 0.3828829 0.4915279 0.1167594), wk = 0.0025381 k( 282) = ( 0.3783784 0.4993300 0.1167594), wk = 0.0025381 k( 283) = ( 0.3738739 0.5071320 0.1167594), wk = 0.0025381 k( 284) = ( 0.3693694 0.5149340 0.1167594), wk = 0.0025381 k( 285) = ( 0.3648649 0.5227361 0.1167594), wk = 0.0025381 k( 286) = ( 0.3603604 0.5305381 0.1167594), wk = 0.0025381 k( 287) = ( 0.3558559 0.5383401 0.1167594), wk = 0.0025381 k( 288) = ( 0.3513514 0.5461421 0.1167594), wk = 0.0025381 k( 289) = ( 0.3468468 0.5539442 0.1167594), wk = 0.0025381 k( 290) = ( 0.3423423 0.5617462 0.1167594), wk = 0.0025381 k( 291) = ( 0.3378378 0.5695482 0.1167594), wk = 0.0025381 k( 292) = ( 0.3333333 0.5773503 0.1167594), wk = 0.0025381 k( 293) = ( 0.3333333 0.5773503 0.1167594), wk = 0.0025381 k( 294) = ( 0.3287671 0.5694414 0.1167594), wk = 0.0025381 k( 295) = ( 0.3242009 0.5615324 0.1167594), wk = 0.0025381 k( 296) = ( 0.3196347 0.5536235 0.1167594), wk = 0.0025381 k( 297) = ( 0.3150685 0.5457146 0.1167594), wk = 0.0025381 k( 298) = ( 0.3105023 0.5378057 0.1167594), wk = 0.0025381 k( 299) = ( 0.3059361 0.5298968 0.1167594), wk = 0.0025381 k( 300) = ( 0.3013699 0.5219879 0.1167594), wk = 0.0025381 k( 301) = ( 0.2968036 0.5140790 0.1167594), wk = 0.0025381 k( 302) = ( 0.2922374 0.5061701 0.1167594), wk = 0.0025381 k( 303) = ( 0.2876712 0.4982612 0.1167594), wk = 0.0025381 k( 304) = ( 0.2831050 0.4903523 0.1167594), wk = 0.0025381 k( 305) = ( 0.2785388 0.4824434 0.1167594), wk = 0.0025381 k( 306) = ( 0.2739726 0.4745345 0.1167594), wk = 0.0025381 k( 307) = ( 0.2694064 0.4666256 0.1167594), wk = 0.0025381 k( 308) = ( 0.2648402 0.4587166 0.1167594), wk = 0.0025381 k( 309) = ( 0.2602740 0.4508077 0.1167594), wk = 0.0025381 k( 310) = ( 0.2557078 0.4428988 0.1167594), wk = 0.0025381 k( 311) = ( 0.2511415 0.4349899 0.1167594), wk = 0.0025381 k( 312) = ( 0.2465753 0.4270810 0.1167594), wk = 0.0025381 k( 313) = ( 0.2420091 0.4191721 0.1167594), wk = 0.0025381 k( 314) = ( 0.2374429 0.4112632 0.1167594), wk = 0.0025381 k( 315) = ( 0.2328767 0.4033543 0.1167594), wk = 0.0025381 k( 316) = ( 0.2283105 0.3954454 0.1167594), wk = 0.0025381 k( 317) = ( 0.2237443 0.3875365 0.1167594), wk = 0.0025381 k( 318) = ( 0.2191781 0.3796276 0.1167594), wk = 0.0025381 k( 319) = ( 0.2146119 0.3717187 0.1167594), wk = 0.0025381 k( 320) = ( 0.2100457 0.3638098 0.1167594), wk = 0.0025381 k( 321) = ( 0.2054795 0.3559008 0.1167594), wk = 0.0025381 k( 322) = ( 0.2009132 0.3479919 0.1167594), wk = 0.0025381 k( 323) = ( 0.1963470 0.3400830 0.1167594), wk = 0.0025381 k( 324) = ( 0.1917808 0.3321741 0.1167594), wk = 0.0025381 k( 325) = ( 0.1872146 0.3242652 0.1167594), wk = 0.0025381 k( 326) = ( 0.1826484 0.3163563 0.1167594), wk = 0.0025381 k( 327) = ( 0.1780822 0.3084474 0.1167594), wk = 0.0025381 k( 328) = ( 0.1735160 0.3005385 0.1167594), wk = 0.0025381 k( 329) = ( 0.1689498 0.2926296 0.1167594), wk = 0.0025381 k( 330) = ( 0.1643836 0.2847207 0.1167594), wk = 0.0025381 k( 331) = ( 0.1598173 0.2768118 0.1167594), wk = 0.0025381 k( 332) = ( 0.1552511 0.2689029 0.1167594), wk = 0.0025381 k( 333) = ( 0.1506849 0.2609940 0.1167594), wk = 0.0025381 k( 334) = ( 0.1461187 0.2530850 0.1167594), wk = 0.0025381 k( 335) = ( 0.1415525 0.2451761 0.1167594), wk = 0.0025381 k( 336) = ( 0.1369863 0.2372672 0.1167594), wk = 0.0025381 k( 337) = ( 0.1324201 0.2293583 0.1167594), wk = 0.0025381 k( 338) = ( 0.1278539 0.2214494 0.1167594), wk = 0.0025381 k( 339) = ( 0.1232877 0.2135405 0.1167594), wk = 0.0025381 k( 340) = ( 0.1187215 0.2056316 0.1167594), wk = 0.0025381 k( 341) = ( 0.1141552 0.1977227 0.1167594), wk = 0.0025381 k( 342) = ( 0.1095890 0.1898138 0.1167594), wk = 0.0025381 k( 343) = ( 0.1050228 0.1819049 0.1167594), wk = 0.0025381 k( 344) = ( 0.1004566 0.1739960 0.1167594), wk = 0.0025381 k( 345) = ( 0.0958904 0.1660871 0.1167594), wk = 0.0025381 k( 346) = ( 0.0913242 0.1581782 0.1167594), wk = 0.0025381 k( 347) = ( 0.0867580 0.1502692 0.1167594), wk = 0.0025381 k( 348) = ( 0.0821918 0.1423603 0.1167594), wk = 0.0025381 k( 349) = ( 0.0776256 0.1344514 0.1167594), wk = 0.0025381 k( 350) = ( 0.0730594 0.1265425 0.1167594), wk = 0.0025381 k( 351) = ( 0.0684932 0.1186336 0.1167594), wk = 0.0025381 k( 352) = ( 0.0639269 0.1107247 0.1167594), wk = 0.0025381 k( 353) = ( 0.0593607 0.1028158 0.1167594), wk = 0.0025381 k( 354) = ( 0.0547945 0.0949069 0.1167594), wk = 0.0025381 k( 355) = ( 0.0502283 0.0869980 0.1167594), wk = 0.0025381 k( 356) = ( 0.0456621 0.0790891 0.1167594), wk = 0.0025381 k( 357) = ( 0.0410959 0.0711802 0.1167594), wk = 0.0025381 k( 358) = ( 0.0365297 0.0632713 0.1167594), wk = 0.0025381 k( 359) = ( 0.0319635 0.0553624 0.1167594), wk = 0.0025381 k( 360) = ( 0.0273973 0.0474534 0.1167594), wk = 0.0025381 k( 361) = ( 0.0228310 0.0395445 0.1167594), wk = 0.0025381 k( 362) = ( 0.0182648 0.0316356 0.1167594), wk = 0.0025381 k( 363) = ( 0.0136986 0.0237267 0.1167594), wk = 0.0025381 k( 364) = ( 0.0091324 0.0158178 0.1167594), wk = 0.0025381 k( 365) = ( 0.0045662 0.0079089 0.1167594), wk = 0.0025381 k( 366) = ( 0.0000000 0.0000000 0.1167594), wk = 0.0025381 k( 367) = ( 0.5000000 0.2886751 0.1167594), wk = 0.0025381 k( 368) = ( 0.5000000 0.2886751 0.1077779), wk = 0.0025381 k( 369) = ( 0.5000000 0.2886751 0.0987964), wk = 0.0025381 k( 370) = ( 0.5000000 0.2886751 0.0898149), wk = 0.0025381 k( 371) = ( 0.5000000 0.2886751 0.0808334), wk = 0.0025381 k( 372) = ( 0.5000000 0.2886751 0.0718520), wk = 0.0025381 k( 373) = ( 0.5000000 0.2886751 0.0628705), wk = 0.0025381 k( 374) = ( 0.5000000 0.2886751 0.0538890), wk = 0.0025381 k( 375) = ( 0.5000000 0.2886751 0.0449075), wk = 0.0025381 k( 376) = ( 0.5000000 0.2886751 0.0359260), wk = 0.0025381 k( 377) = ( 0.5000000 0.2886751 0.0269445), wk = 0.0025381 k( 378) = ( 0.5000000 0.2886751 0.0179630), wk = 0.0025381 k( 379) = ( 0.5000000 0.2886751 0.0089815), wk = 0.0025381 k( 380) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0025381 k( 381) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0025381 k( 382) = ( 0.3333333 0.5773503 0.0089815), wk = 0.0025381 k( 383) = ( 0.3333333 0.5773503 0.0179630), wk = 0.0025381 k( 384) = ( 0.3333333 0.5773503 0.0269445), wk = 0.0025381 k( 385) = ( 0.3333333 0.5773503 0.0359260), wk = 0.0025381 k( 386) = ( 0.3333333 0.5773503 0.0449075), wk = 0.0025381 k( 387) = ( 0.3333333 0.5773503 0.0538890), wk = 0.0025381 k( 388) = ( 0.3333333 0.5773503 0.0628705), wk = 0.0025381 k( 389) = ( 0.3333333 0.5773503 0.0718520), wk = 0.0025381 k( 390) = ( 0.3333333 0.5773503 0.0808334), wk = 0.0025381 k( 391) = ( 0.3333333 0.5773503 0.0898149), wk = 0.0025381 k( 392) = ( 0.3333333 0.5773503 0.0987964), wk = 0.0025381 k( 393) = ( 0.3333333 0.5773503 0.1077779), wk = 0.0025381 k( 394) = ( 0.3333333 0.5773503 0.1167594), wk = 0.0025381 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 2) = ( 0.0079365 -0.0000000 -0.0000000), wk = 0.0025381 k( 3) = ( 0.0158730 -0.0000000 -0.0000000), wk = 0.0025381 k( 4) = ( 0.0238095 -0.0000000 0.0000000), wk = 0.0025381 k( 5) = ( 0.0317460 -0.0000000 0.0000000), wk = 0.0025381 k( 6) = ( 0.0396825 -0.0000000 -0.0000000), wk = 0.0025381 k( 7) = ( 0.0476191 -0.0000000 0.0000000), wk = 0.0025381 k( 8) = ( 0.0555556 -0.0000000 -0.0000000), wk = 0.0025381 k( 9) = ( 0.0634921 -0.0000000 0.0000000), wk = 0.0025381 k( 10) = ( 0.0714286 -0.0000000 -0.0000000), wk = 0.0025381 k( 11) = ( 0.0793651 -0.0000000 -0.0000000), wk = 0.0025381 k( 12) = ( 0.0873016 0.0000000 -0.0000000), wk = 0.0025381 k( 13) = ( 0.0952381 -0.0000000 0.0000000), wk = 0.0025381 k( 14) = ( 0.1031746 -0.0000000 -0.0000000), wk = 0.0025381 k( 15) = ( 0.1111111 -0.0000000 -0.0000000), wk = 0.0025381 k( 16) = ( 0.1190476 -0.0000000 0.0000000), wk = 0.0025381 k( 17) = ( 0.1269841 -0.0000000 0.0000000), wk = 0.0025381 k( 18) = ( 0.1349206 -0.0000000 0.0000000), wk = 0.0025381 k( 19) = ( 0.1428571 -0.0000000 -0.0000000), wk = 0.0025381 k( 20) = ( 0.1507937 -0.0000000 0.0000000), wk = 0.0025381 k( 21) = ( 0.1587302 -0.0000000 -0.0000000), wk = 0.0025381 k( 22) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0025381 k( 23) = ( 0.1746032 0.0000000 -0.0000000), wk = 0.0025381 k( 24) = ( 0.1825397 -0.0000000 -0.0000000), wk = 0.0025381 k( 25) = ( 0.1904762 -0.0000000 -0.0000000), wk = 0.0025381 k( 26) = ( 0.1984127 -0.0000000 0.0000000), wk = 0.0025381 k( 27) = ( 0.2063492 -0.0000000 0.0000000), wk = 0.0025381 k( 28) = ( 0.2142857 -0.0000000 -0.0000000), wk = 0.0025381 k( 29) = ( 0.2222222 -0.0000000 -0.0000000), wk = 0.0025381 k( 30) = ( 0.2301587 -0.0000000 0.0000000), wk = 0.0025381 k( 31) = ( 0.2380952 -0.0000000 0.0000000), wk = 0.0025381 k( 32) = ( 0.2460317 -0.0000000 -0.0000000), wk = 0.0025381 k( 33) = ( 0.2539683 -0.0000000 -0.0000000), wk = 0.0025381 k( 34) = ( 0.2619048 -0.0000000 0.0000000), wk = 0.0025381 k( 35) = ( 0.2698413 -0.0000000 -0.0000000), wk = 0.0025381 k( 36) = ( 0.2777778 -0.0000000 -0.0000000), wk = 0.0025381 k( 37) = ( 0.2857143 -0.0000000 0.0000000), wk = 0.0025381 k( 38) = ( 0.2936508 -0.0000000 0.0000000), wk = 0.0025381 k( 39) = ( 0.3015873 -0.0000000 0.0000000), wk = 0.0025381 k( 40) = ( 0.3095238 -0.0000000 -0.0000000), wk = 0.0025381 k( 41) = ( 0.3174603 -0.0000000 -0.0000000), wk = 0.0025381 k( 42) = ( 0.3253968 -0.0000000 -0.0000000), wk = 0.0025381 k( 43) = ( 0.3333333 -0.0000000 -0.0000000), wk = 0.0025381 k( 44) = ( 0.3412698 -0.0000000 -0.0000000), wk = 0.0025381 k( 45) = ( 0.3492063 -0.0000000 0.0000000), wk = 0.0025381 k( 46) = ( 0.3571429 -0.0000000 -0.0000000), wk = 0.0025381 k( 47) = ( 0.3650794 0.0000000 0.0000000), wk = 0.0025381 k( 48) = ( 0.3730159 -0.0000000 -0.0000000), wk = 0.0025381 k( 49) = ( 0.3809524 -0.0000000 -0.0000000), wk = 0.0025381 k( 50) = ( 0.3888889 -0.0000000 0.0000000), wk = 0.0025381 k( 51) = ( 0.3968254 -0.0000000 0.0000000), wk = 0.0025381 k( 52) = ( 0.4047619 -0.0000000 0.0000000), wk = 0.0025381 k( 53) = ( 0.4126984 -0.0000000 0.0000000), wk = 0.0025381 k( 54) = ( 0.4206349 -0.0000000 -0.0000000), wk = 0.0025381 k( 55) = ( 0.4285714 -0.0000000 -0.0000000), wk = 0.0025381 k( 56) = ( 0.4365079 -0.0000000 -0.0000000), wk = 0.0025381 k( 57) = ( 0.4444444 -0.0000000 -0.0000000), wk = 0.0025381 k( 58) = ( 0.4523810 -0.0000000 0.0000000), wk = 0.0025381 k( 59) = ( 0.4603175 -0.0000000 0.0000000), wk = 0.0025381 k( 60) = ( 0.4682540 -0.0000000 -0.0000000), wk = 0.0025381 k( 61) = ( 0.4761905 -0.0000000 0.0000000), wk = 0.0025381 k( 62) = ( 0.4841270 -0.0000000 -0.0000000), wk = 0.0025381 k( 63) = ( 0.4920635 -0.0000000 -0.0000000), wk = 0.0025381 k( 64) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0025381 k( 65) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0025381 k( 66) = ( 0.4954955 0.0090090 0.0000000), wk = 0.0025381 k( 67) = ( 0.4909910 0.0180180 -0.0000000), wk = 0.0025381 k( 68) = ( 0.4864865 0.0270270 -0.0000000), wk = 0.0025381 k( 69) = ( 0.4819820 0.0360360 -0.0000000), wk = 0.0025381 k( 70) = ( 0.4774775 0.0450450 0.0000000), wk = 0.0025381 k( 71) = ( 0.4729730 0.0540541 -0.0000000), wk = 0.0025381 k( 72) = ( 0.4684685 0.0630631 -0.0000000), wk = 0.0025381 k( 73) = ( 0.4639640 0.0720721 -0.0000000), wk = 0.0025381 k( 74) = ( 0.4594595 0.0810811 -0.0000000), wk = 0.0025381 k( 75) = ( 0.4549550 0.0900901 -0.0000000), wk = 0.0025381 k( 76) = ( 0.4504505 0.0990991 -0.0000000), wk = 0.0025381 k( 77) = ( 0.4459459 0.1081081 0.0000000), wk = 0.0025381 k( 78) = ( 0.4414414 0.1171171 -0.0000000), wk = 0.0025381 k( 79) = ( 0.4369369 0.1261261 0.0000000), wk = 0.0025381 k( 80) = ( 0.4324324 0.1351351 0.0000000), wk = 0.0025381 k( 81) = ( 0.4279279 0.1441441 -0.0000000), wk = 0.0025381 k( 82) = ( 0.4234234 0.1531531 0.0000000), wk = 0.0025381 k( 83) = ( 0.4189189 0.1621622 -0.0000000), wk = 0.0025381 k( 84) = ( 0.4144144 0.1711712 -0.0000000), wk = 0.0025381 k( 85) = ( 0.4099099 0.1801802 -0.0000000), wk = 0.0025381 k( 86) = ( 0.4054054 0.1891892 0.0000000), wk = 0.0025381 k( 87) = ( 0.4009009 0.1981982 -0.0000000), wk = 0.0025381 k( 88) = ( 0.3963964 0.2072072 0.0000000), wk = 0.0025381 k( 89) = ( 0.3918919 0.2162162 -0.0000000), wk = 0.0025381 k( 90) = ( 0.3873874 0.2252252 -0.0000000), wk = 0.0025381 k( 91) = ( 0.3828829 0.2342342 -0.0000000), wk = 0.0025381 k( 92) = ( 0.3783784 0.2432432 -0.0000000), wk = 0.0025381 k( 93) = ( 0.3738739 0.2522523 0.0000000), wk = 0.0025381 k( 94) = ( 0.3693694 0.2612613 0.0000000), wk = 0.0025381 k( 95) = ( 0.3648649 0.2702703 0.0000000), wk = 0.0025381 k( 96) = ( 0.3603604 0.2792793 -0.0000000), wk = 0.0025381 k( 97) = ( 0.3558559 0.2882883 0.0000000), wk = 0.0025381 k( 98) = ( 0.3513514 0.2972973 -0.0000000), wk = 0.0025381 k( 99) = ( 0.3468468 0.3063063 -0.0000000), wk = 0.0025381 k( 100) = ( 0.3423423 0.3153153 0.0000000), wk = 0.0025381 k( 101) = ( 0.3378378 0.3243243 -0.0000000), wk = 0.0025381 k( 102) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0025381 k( 103) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0025381 k( 104) = ( 0.3287671 0.3287671 0.0000000), wk = 0.0025381 k( 105) = ( 0.3242009 0.3242009 0.0000000), wk = 0.0025381 k( 106) = ( 0.3196347 0.3196347 -0.0000000), wk = 0.0025381 k( 107) = ( 0.3150685 0.3150685 0.0000000), wk = 0.0025381 k( 108) = ( 0.3105023 0.3105023 -0.0000000), wk = 0.0025381 k( 109) = ( 0.3059361 0.3059361 0.0000000), wk = 0.0025381 k( 110) = ( 0.3013699 0.3013699 -0.0000000), wk = 0.0025381 k( 111) = ( 0.2968036 0.2968037 0.0000000), wk = 0.0025381 k( 112) = ( 0.2922374 0.2922374 -0.0000000), wk = 0.0025381 k( 113) = ( 0.2876712 0.2876712 -0.0000000), wk = 0.0025381 k( 114) = ( 0.2831050 0.2831050 -0.0000000), wk = 0.0025381 k( 115) = ( 0.2785388 0.2785388 -0.0000000), wk = 0.0025381 k( 116) = ( 0.2739726 0.2739726 0.0000000), wk = 0.0025381 k( 117) = ( 0.2694064 0.2694064 0.0000000), wk = 0.0025381 k( 118) = ( 0.2648402 0.2648402 -0.0000000), wk = 0.0025381 k( 119) = ( 0.2602740 0.2602740 -0.0000000), wk = 0.0025381 k( 120) = ( 0.2557078 0.2557078 -0.0000000), wk = 0.0025381 k( 121) = ( 0.2511415 0.2511415 0.0000000), wk = 0.0025381 k( 122) = ( 0.2465753 0.2465753 0.0000000), wk = 0.0025381 k( 123) = ( 0.2420091 0.2420091 -0.0000000), wk = 0.0025381 k( 124) = ( 0.2374429 0.2374429 -0.0000000), wk = 0.0025381 k( 125) = ( 0.2328767 0.2328767 -0.0000000), wk = 0.0025381 k( 126) = ( 0.2283105 0.2283105 -0.0000000), wk = 0.0025381 k( 127) = ( 0.2237443 0.2237443 -0.0000000), wk = 0.0025381 k( 128) = ( 0.2191781 0.2191781 -0.0000000), wk = 0.0025381 k( 129) = ( 0.2146119 0.2146119 -0.0000000), wk = 0.0025381 k( 130) = ( 0.2100457 0.2100457 -0.0000000), wk = 0.0025381 k( 131) = ( 0.2054795 0.2054794 -0.0000000), wk = 0.0025381 k( 132) = ( 0.2009132 0.2009132 -0.0000000), wk = 0.0025381 k( 133) = ( 0.1963470 0.1963470 -0.0000000), wk = 0.0025381 k( 134) = ( 0.1917808 0.1917808 0.0000000), wk = 0.0025381 k( 135) = ( 0.1872146 0.1872146 0.0000000), wk = 0.0025381 k( 136) = ( 0.1826484 0.1826484 0.0000000), wk = 0.0025381 k( 137) = ( 0.1780822 0.1780822 -0.0000000), wk = 0.0025381 k( 138) = ( 0.1735160 0.1735160 -0.0000000), wk = 0.0025381 k( 139) = ( 0.1689498 0.1689498 -0.0000000), wk = 0.0025381 k( 140) = ( 0.1643836 0.1643836 0.0000000), wk = 0.0025381 k( 141) = ( 0.1598173 0.1598173 -0.0000000), wk = 0.0025381 k( 142) = ( 0.1552511 0.1552511 -0.0000000), wk = 0.0025381 k( 143) = ( 0.1506849 0.1506849 -0.0000000), wk = 0.0025381 k( 144) = ( 0.1461187 0.1461187 -0.0000000), wk = 0.0025381 k( 145) = ( 0.1415525 0.1415525 -0.0000000), wk = 0.0025381 k( 146) = ( 0.1369863 0.1369863 0.0000000), wk = 0.0025381 k( 147) = ( 0.1324201 0.1324201 -0.0000000), wk = 0.0025381 k( 148) = ( 0.1278539 0.1278539 -0.0000000), wk = 0.0025381 k( 149) = ( 0.1232877 0.1232877 0.0000000), wk = 0.0025381 k( 150) = ( 0.1187215 0.1187215 -0.0000000), wk = 0.0025381 k( 151) = ( 0.1141552 0.1141552 -0.0000000), wk = 0.0025381 k( 152) = ( 0.1095890 0.1095890 -0.0000000), wk = 0.0025381 k( 153) = ( 0.1050228 0.1050228 -0.0000000), wk = 0.0025381 k( 154) = ( 0.1004566 0.1004566 -0.0000000), wk = 0.0025381 k( 155) = ( 0.0958904 0.0958904 0.0000000), wk = 0.0025381 k( 156) = ( 0.0913242 0.0913242 0.0000000), wk = 0.0025381 k( 157) = ( 0.0867580 0.0867580 -0.0000000), wk = 0.0025381 k( 158) = ( 0.0821918 0.0821918 0.0000000), wk = 0.0025381 k( 159) = ( 0.0776256 0.0776256 -0.0000000), wk = 0.0025381 k( 160) = ( 0.0730594 0.0730594 -0.0000000), wk = 0.0025381 k( 161) = ( 0.0684932 0.0684932 0.0000000), wk = 0.0025381 k( 162) = ( 0.0639269 0.0639269 -0.0000000), wk = 0.0025381 k( 163) = ( 0.0593607 0.0593607 -0.0000000), wk = 0.0025381 k( 164) = ( 0.0547945 0.0547945 -0.0000000), wk = 0.0025381 k( 165) = ( 0.0502283 0.0502283 -0.0000000), wk = 0.0025381 k( 166) = ( 0.0456621 0.0456621 0.0000000), wk = 0.0025381 k( 167) = ( 0.0410959 0.0410959 0.0000000), wk = 0.0025381 k( 168) = ( 0.0365297 0.0365297 -0.0000000), wk = 0.0025381 k( 169) = ( 0.0319635 0.0319635 -0.0000000), wk = 0.0025381 k( 170) = ( 0.0273973 0.0273973 -0.0000000), wk = 0.0025381 k( 171) = ( 0.0228310 0.0228310 0.0000000), wk = 0.0025381 k( 172) = ( 0.0182648 0.0182648 -0.0000000), wk = 0.0025381 k( 173) = ( 0.0136986 0.0136986 -0.0000000), wk = 0.0025381 k( 174) = ( 0.0091324 0.0091324 -0.0000000), wk = 0.0025381 k( 175) = ( 0.0045662 0.0045662 -0.0000000), wk = 0.0025381 k( 176) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 177) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 178) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0025381 k( 179) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0025381 k( 180) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0025381 k( 181) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0025381 k( 182) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0025381 k( 183) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0025381 k( 184) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0025381 k( 185) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0025381 k( 186) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0025381 k( 187) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0025381 k( 188) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0025381 k( 189) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0025381 k( 190) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025381 k( 191) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025381 k( 192) = ( 0.0079365 -0.0000000 0.5000000), wk = 0.0025381 k( 193) = ( 0.0158730 -0.0000000 0.5000000), wk = 0.0025381 k( 194) = ( 0.0238095 -0.0000000 0.5000000), wk = 0.0025381 k( 195) = ( 0.0317460 -0.0000000 0.5000000), wk = 0.0025381 k( 196) = ( 0.0396825 -0.0000000 0.5000000), wk = 0.0025381 k( 197) = ( 0.0476191 -0.0000000 0.5000000), wk = 0.0025381 k( 198) = ( 0.0555556 -0.0000000 0.5000000), wk = 0.0025381 k( 199) = ( 0.0634921 -0.0000000 0.5000000), wk = 0.0025381 k( 200) = ( 0.0714286 -0.0000000 0.5000000), wk = 0.0025381 k( 201) = ( 0.0793651 -0.0000000 0.5000000), wk = 0.0025381 k( 202) = ( 0.0873016 0.0000000 0.5000000), wk = 0.0025381 k( 203) = ( 0.0952381 -0.0000000 0.5000000), wk = 0.0025381 k( 204) = ( 0.1031746 -0.0000000 0.5000000), wk = 0.0025381 k( 205) = ( 0.1111111 -0.0000000 0.5000000), wk = 0.0025381 k( 206) = ( 0.1190476 -0.0000000 0.5000000), wk = 0.0025381 k( 207) = ( 0.1269841 -0.0000000 0.5000000), wk = 0.0025381 k( 208) = ( 0.1349206 -0.0000000 0.5000000), wk = 0.0025381 k( 209) = ( 0.1428571 -0.0000000 0.5000000), wk = 0.0025381 k( 210) = ( 0.1507937 -0.0000000 0.5000000), wk = 0.0025381 k( 211) = ( 0.1587302 -0.0000000 0.5000000), wk = 0.0025381 k( 212) = ( 0.1666667 -0.0000000 0.5000000), wk = 0.0025381 k( 213) = ( 0.1746032 0.0000000 0.5000000), wk = 0.0025381 k( 214) = ( 0.1825397 -0.0000000 0.5000000), wk = 0.0025381 k( 215) = ( 0.1904762 -0.0000000 0.5000000), wk = 0.0025381 k( 216) = ( 0.1984127 -0.0000000 0.5000000), wk = 0.0025381 k( 217) = ( 0.2063492 -0.0000000 0.5000000), wk = 0.0025381 k( 218) = ( 0.2142857 -0.0000000 0.5000000), wk = 0.0025381 k( 219) = ( 0.2222222 -0.0000000 0.5000000), wk = 0.0025381 k( 220) = ( 0.2301587 -0.0000000 0.5000000), wk = 0.0025381 k( 221) = ( 0.2380952 -0.0000000 0.5000000), wk = 0.0025381 k( 222) = ( 0.2460317 -0.0000000 0.5000000), wk = 0.0025381 k( 223) = ( 0.2539683 -0.0000000 0.5000000), wk = 0.0025381 k( 224) = ( 0.2619048 -0.0000000 0.5000000), wk = 0.0025381 k( 225) = ( 0.2698413 -0.0000000 0.5000000), wk = 0.0025381 k( 226) = ( 0.2777778 -0.0000000 0.5000000), wk = 0.0025381 k( 227) = ( 0.2857143 -0.0000000 0.5000000), wk = 0.0025381 k( 228) = ( 0.2936508 -0.0000000 0.5000000), wk = 0.0025381 k( 229) = ( 0.3015873 -0.0000000 0.5000000), wk = 0.0025381 k( 230) = ( 0.3095238 -0.0000000 0.5000000), wk = 0.0025381 k( 231) = ( 0.3174603 -0.0000000 0.5000000), wk = 0.0025381 k( 232) = ( 0.3253968 -0.0000000 0.5000000), wk = 0.0025381 k( 233) = ( 0.3333333 -0.0000000 0.5000000), wk = 0.0025381 k( 234) = ( 0.3412698 -0.0000000 0.5000000), wk = 0.0025381 k( 235) = ( 0.3492063 -0.0000000 0.5000000), wk = 0.0025381 k( 236) = ( 0.3571429 -0.0000000 0.5000000), wk = 0.0025381 k( 237) = ( 0.3650794 0.0000000 0.5000000), wk = 0.0025381 k( 238) = ( 0.3730159 -0.0000000 0.5000000), wk = 0.0025381 k( 239) = ( 0.3809524 -0.0000000 0.5000000), wk = 0.0025381 k( 240) = ( 0.3888889 -0.0000000 0.5000000), wk = 0.0025381 k( 241) = ( 0.3968254 -0.0000000 0.5000000), wk = 0.0025381 k( 242) = ( 0.4047619 -0.0000000 0.5000000), wk = 0.0025381 k( 243) = ( 0.4126984 -0.0000000 0.5000000), wk = 0.0025381 k( 244) = ( 0.4206349 -0.0000000 0.5000000), wk = 0.0025381 k( 245) = ( 0.4285714 -0.0000000 0.5000000), wk = 0.0025381 k( 246) = ( 0.4365079 -0.0000000 0.5000000), wk = 0.0025381 k( 247) = ( 0.4444444 -0.0000000 0.5000000), wk = 0.0025381 k( 248) = ( 0.4523810 -0.0000000 0.5000000), wk = 0.0025381 k( 249) = ( 0.4603175 -0.0000000 0.5000000), wk = 0.0025381 k( 250) = ( 0.4682540 -0.0000000 0.5000000), wk = 0.0025381 k( 251) = ( 0.4761905 -0.0000000 0.5000000), wk = 0.0025381 k( 252) = ( 0.4841270 -0.0000000 0.5000000), wk = 0.0025381 k( 253) = ( 0.4920635 -0.0000000 0.5000000), wk = 0.0025381 k( 254) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0025381 k( 255) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0025381 k( 256) = ( 0.4954955 0.0090090 0.5000000), wk = 0.0025381 k( 257) = ( 0.4909910 0.0180180 0.5000000), wk = 0.0025381 k( 258) = ( 0.4864865 0.0270270 0.5000000), wk = 0.0025381 k( 259) = ( 0.4819820 0.0360360 0.5000000), wk = 0.0025381 k( 260) = ( 0.4774775 0.0450450 0.5000000), wk = 0.0025381 k( 261) = ( 0.4729730 0.0540541 0.5000000), wk = 0.0025381 k( 262) = ( 0.4684685 0.0630631 0.5000000), wk = 0.0025381 k( 263) = ( 0.4639640 0.0720721 0.5000000), wk = 0.0025381 k( 264) = ( 0.4594595 0.0810811 0.5000000), wk = 0.0025381 k( 265) = ( 0.4549550 0.0900901 0.5000000), wk = 0.0025381 k( 266) = ( 0.4504505 0.0990991 0.5000000), wk = 0.0025381 k( 267) = ( 0.4459459 0.1081081 0.5000000), wk = 0.0025381 k( 268) = ( 0.4414414 0.1171171 0.5000000), wk = 0.0025381 k( 269) = ( 0.4369369 0.1261261 0.5000000), wk = 0.0025381 k( 270) = ( 0.4324324 0.1351351 0.5000000), wk = 0.0025381 k( 271) = ( 0.4279279 0.1441441 0.5000000), wk = 0.0025381 k( 272) = ( 0.4234234 0.1531531 0.5000000), wk = 0.0025381 k( 273) = ( 0.4189189 0.1621622 0.5000000), wk = 0.0025381 k( 274) = ( 0.4144144 0.1711712 0.5000000), wk = 0.0025381 k( 275) = ( 0.4099099 0.1801802 0.5000000), wk = 0.0025381 k( 276) = ( 0.4054054 0.1891892 0.5000000), wk = 0.0025381 k( 277) = ( 0.4009009 0.1981982 0.5000000), wk = 0.0025381 k( 278) = ( 0.3963964 0.2072072 0.5000000), wk = 0.0025381 k( 279) = ( 0.3918919 0.2162162 0.5000000), wk = 0.0025381 k( 280) = ( 0.3873874 0.2252252 0.5000000), wk = 0.0025381 k( 281) = ( 0.3828829 0.2342342 0.5000000), wk = 0.0025381 k( 282) = ( 0.3783784 0.2432432 0.5000000), wk = 0.0025381 k( 283) = ( 0.3738739 0.2522523 0.5000000), wk = 0.0025381 k( 284) = ( 0.3693694 0.2612613 0.5000000), wk = 0.0025381 k( 285) = ( 0.3648649 0.2702703 0.5000000), wk = 0.0025381 k( 286) = ( 0.3603604 0.2792793 0.5000000), wk = 0.0025381 k( 287) = ( 0.3558559 0.2882883 0.5000000), wk = 0.0025381 k( 288) = ( 0.3513514 0.2972973 0.5000000), wk = 0.0025381 k( 289) = ( 0.3468468 0.3063063 0.5000000), wk = 0.0025381 k( 290) = ( 0.3423423 0.3153153 0.5000000), wk = 0.0025381 k( 291) = ( 0.3378378 0.3243243 0.5000000), wk = 0.0025381 k( 292) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0025381 k( 293) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0025381 k( 294) = ( 0.3287671 0.3287671 0.5000000), wk = 0.0025381 k( 295) = ( 0.3242009 0.3242009 0.5000000), wk = 0.0025381 k( 296) = ( 0.3196347 0.3196347 0.5000000), wk = 0.0025381 k( 297) = ( 0.3150685 0.3150685 0.5000000), wk = 0.0025381 k( 298) = ( 0.3105023 0.3105023 0.5000000), wk = 0.0025381 k( 299) = ( 0.3059361 0.3059361 0.5000000), wk = 0.0025381 k( 300) = ( 0.3013699 0.3013699 0.5000000), wk = 0.0025381 k( 301) = ( 0.2968036 0.2968037 0.5000000), wk = 0.0025381 k( 302) = ( 0.2922374 0.2922374 0.5000000), wk = 0.0025381 k( 303) = ( 0.2876712 0.2876712 0.5000000), wk = 0.0025381 k( 304) = ( 0.2831050 0.2831050 0.5000000), wk = 0.0025381 k( 305) = ( 0.2785388 0.2785388 0.5000000), wk = 0.0025381 k( 306) = ( 0.2739726 0.2739726 0.5000000), wk = 0.0025381 k( 307) = ( 0.2694064 0.2694064 0.5000000), wk = 0.0025381 k( 308) = ( 0.2648402 0.2648402 0.5000000), wk = 0.0025381 k( 309) = ( 0.2602740 0.2602740 0.5000000), wk = 0.0025381 k( 310) = ( 0.2557078 0.2557078 0.5000000), wk = 0.0025381 k( 311) = ( 0.2511415 0.2511415 0.5000000), wk = 0.0025381 k( 312) = ( 0.2465753 0.2465753 0.5000000), wk = 0.0025381 k( 313) = ( 0.2420091 0.2420091 0.5000000), wk = 0.0025381 k( 314) = ( 0.2374429 0.2374429 0.5000000), wk = 0.0025381 k( 315) = ( 0.2328767 0.2328767 0.5000000), wk = 0.0025381 k( 316) = ( 0.2283105 0.2283105 0.5000000), wk = 0.0025381 k( 317) = ( 0.2237443 0.2237443 0.5000000), wk = 0.0025381 k( 318) = ( 0.2191781 0.2191781 0.5000000), wk = 0.0025381 k( 319) = ( 0.2146119 0.2146119 0.5000000), wk = 0.0025381 k( 320) = ( 0.2100457 0.2100457 0.5000000), wk = 0.0025381 k( 321) = ( 0.2054795 0.2054794 0.5000000), wk = 0.0025381 k( 322) = ( 0.2009132 0.2009132 0.5000000), wk = 0.0025381 k( 323) = ( 0.1963470 0.1963470 0.5000000), wk = 0.0025381 k( 324) = ( 0.1917808 0.1917808 0.5000000), wk = 0.0025381 k( 325) = ( 0.1872146 0.1872146 0.5000000), wk = 0.0025381 k( 326) = ( 0.1826484 0.1826484 0.5000000), wk = 0.0025381 k( 327) = ( 0.1780822 0.1780822 0.5000000), wk = 0.0025381 k( 328) = ( 0.1735160 0.1735160 0.5000000), wk = 0.0025381 k( 329) = ( 0.1689498 0.1689498 0.5000000), wk = 0.0025381 k( 330) = ( 0.1643836 0.1643836 0.5000000), wk = 0.0025381 k( 331) = ( 0.1598173 0.1598173 0.5000000), wk = 0.0025381 k( 332) = ( 0.1552511 0.1552511 0.5000000), wk = 0.0025381 k( 333) = ( 0.1506849 0.1506849 0.5000000), wk = 0.0025381 k( 334) = ( 0.1461187 0.1461187 0.5000000), wk = 0.0025381 k( 335) = ( 0.1415525 0.1415525 0.5000000), wk = 0.0025381 k( 336) = ( 0.1369863 0.1369863 0.5000000), wk = 0.0025381 k( 337) = ( 0.1324201 0.1324201 0.5000000), wk = 0.0025381 k( 338) = ( 0.1278539 0.1278539 0.5000000), wk = 0.0025381 k( 339) = ( 0.1232877 0.1232877 0.5000000), wk = 0.0025381 k( 340) = ( 0.1187215 0.1187215 0.5000000), wk = 0.0025381 k( 341) = ( 0.1141552 0.1141552 0.5000000), wk = 0.0025381 k( 342) = ( 0.1095890 0.1095890 0.5000000), wk = 0.0025381 k( 343) = ( 0.1050228 0.1050228 0.5000000), wk = 0.0025381 k( 344) = ( 0.1004566 0.1004566 0.5000000), wk = 0.0025381 k( 345) = ( 0.0958904 0.0958904 0.5000000), wk = 0.0025381 k( 346) = ( 0.0913242 0.0913242 0.5000000), wk = 0.0025381 k( 347) = ( 0.0867580 0.0867580 0.5000000), wk = 0.0025381 k( 348) = ( 0.0821918 0.0821918 0.5000000), wk = 0.0025381 k( 349) = ( 0.0776256 0.0776256 0.5000000), wk = 0.0025381 k( 350) = ( 0.0730594 0.0730594 0.5000000), wk = 0.0025381 k( 351) = ( 0.0684932 0.0684932 0.5000000), wk = 0.0025381 k( 352) = ( 0.0639269 0.0639269 0.5000000), wk = 0.0025381 k( 353) = ( 0.0593607 0.0593607 0.5000000), wk = 0.0025381 k( 354) = ( 0.0547945 0.0547945 0.5000000), wk = 0.0025381 k( 355) = ( 0.0502283 0.0502283 0.5000000), wk = 0.0025381 k( 356) = ( 0.0456621 0.0456621 0.5000000), wk = 0.0025381 k( 357) = ( 0.0410959 0.0410959 0.5000000), wk = 0.0025381 k( 358) = ( 0.0365297 0.0365297 0.5000000), wk = 0.0025381 k( 359) = ( 0.0319635 0.0319635 0.5000000), wk = 0.0025381 k( 360) = ( 0.0273973 0.0273973 0.5000000), wk = 0.0025381 k( 361) = ( 0.0228310 0.0228310 0.5000000), wk = 0.0025381 k( 362) = ( 0.0182648 0.0182648 0.5000000), wk = 0.0025381 k( 363) = ( 0.0136986 0.0136986 0.5000000), wk = 0.0025381 k( 364) = ( 0.0091324 0.0091324 0.5000000), wk = 0.0025381 k( 365) = ( 0.0045662 0.0045662 0.5000000), wk = 0.0025381 k( 366) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025381 k( 367) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0025381 k( 368) = ( 0.5000000 -0.0000000 0.4615385), wk = 0.0025381 k( 369) = ( 0.5000000 -0.0000000 0.4230769), wk = 0.0025381 k( 370) = ( 0.5000000 -0.0000000 0.3846154), wk = 0.0025381 k( 371) = ( 0.5000000 -0.0000000 0.3461538), wk = 0.0025381 k( 372) = ( 0.5000000 -0.0000000 0.3076923), wk = 0.0025381 k( 373) = ( 0.5000000 -0.0000000 0.2692308), wk = 0.0025381 k( 374) = ( 0.5000000 -0.0000000 0.2307692), wk = 0.0025381 k( 375) = ( 0.5000000 -0.0000000 0.1923077), wk = 0.0025381 k( 376) = ( 0.5000000 -0.0000000 0.1538461), wk = 0.0025381 k( 377) = ( 0.5000000 -0.0000000 0.1153846), wk = 0.0025381 k( 378) = ( 0.5000000 -0.0000000 0.0769231), wk = 0.0025381 k( 379) = ( 0.5000000 -0.0000000 0.0384615), wk = 0.0025381 k( 380) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0025381 k( 381) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0025381 k( 382) = ( 0.3333333 0.3333333 0.0384615), wk = 0.0025381 k( 383) = ( 0.3333333 0.3333333 0.0769231), wk = 0.0025381 k( 384) = ( 0.3333333 0.3333333 0.1153846), wk = 0.0025381 k( 385) = ( 0.3333333 0.3333333 0.1538461), wk = 0.0025381 k( 386) = ( 0.3333333 0.3333333 0.1923077), wk = 0.0025381 k( 387) = ( 0.3333333 0.3333333 0.2307692), wk = 0.0025381 k( 388) = ( 0.3333333 0.3333333 0.2692308), wk = 0.0025381 k( 389) = ( 0.3333333 0.3333333 0.3076923), wk = 0.0025381 k( 390) = ( 0.3333333 0.3333333 0.3461539), wk = 0.0025381 k( 391) = ( 0.3333333 0.3333333 0.3846154), wk = 0.0025381 k( 392) = ( 0.3333333 0.3333333 0.4230769), wk = 0.0025381 k( 393) = ( 0.3333333 0.3333333 0.4615385), wk = 0.0025381 k( 394) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0025381 Dense grid: 88635 G-vectors FFT dimensions: ( 36, 36, 160) Smooth grid: 26183 G-vectors FFT dimensions: ( 24, 24, 108) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.20 Mb ( 210, 62) NL pseudopotentials 0.31 Mb ( 105, 192) Each V/rho on FFT grid 0.10 Mb ( 6480) Each G-vector array 0.02 Mb ( 2460) G-vector shells 0.01 Mb ( 1131) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.79 Mb ( 210, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.36 Mb ( 192, 2, 62) The potential is recalculated from file : ./AlAuO2.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.5 secs Computing kpt #: 2 total cpu time spent up to now is 5.2 secs Computing kpt #: 3 total cpu time spent up to now is 5.7 secs Computing kpt #: 4 total cpu time spent up to now is 6.4 secs Computing kpt #: 5 total cpu time spent up to now is 7.0 secs Computing kpt #: 6 total cpu time spent up to now is 7.7 secs Computing kpt #: 7 total cpu time spent up to now is 8.4 secs Computing kpt #: 8 total cpu time spent up to now is 9.1 secs Computing kpt #: 9 total cpu time spent up to now is 10.0 secs Computing kpt #: 10 total cpu time spent up to now is 10.8 secs Computing kpt #: 11 total cpu time spent up to now is 11.6 secs Computing kpt #: 12 total cpu time spent up to now is 12.2 secs Computing kpt #: 13 total cpu time spent up to now is 12.8 secs Computing kpt #: 14 total cpu time spent up to now is 13.4 secs Computing kpt #: 15 total cpu time spent up to now is 14.1 secs Computing kpt #: 16 total cpu time spent up to now is 14.7 secs Computing kpt #: 17 total cpu time spent up to now is 15.3 secs Computing kpt #: 18 total cpu time spent up to now is 16.0 secs Computing kpt #: 19 total cpu time spent up to now is 16.6 secs Computing kpt #: 20 total cpu time spent up to now is 17.3 secs Computing kpt #: 21 total cpu time spent up to now is 17.9 secs Computing kpt #: 22 total cpu time spent up to now is 18.6 secs Computing kpt #: 23 total cpu time spent up to now is 19.3 secs Computing kpt #: 24 total cpu time spent up to now is 20.0 secs Computing kpt #: 25 total cpu time spent up to now is 20.6 secs Computing kpt #: 26 total cpu time spent up to now is 21.3 secs Computing kpt #: 27 total cpu time spent up to now is 22.0 secs Computing kpt #: 28 total cpu time spent up to now is 22.7 secs Computing kpt #: 29 total cpu time spent up to now is 23.4 secs Computing kpt #: 30 total cpu time spent up to now is 24.1 secs Computing kpt #: 31 total cpu time spent up to now is 24.8 secs Computing kpt #: 32 total cpu time spent up to now is 25.5 secs Computing kpt #: 33 total cpu time spent up to now is 26.2 secs Computing kpt #: 34 total cpu time spent up to now is 26.9 secs Computing kpt #: 35 total cpu time spent up to now is 27.6 secs Computing kpt #: 36 total cpu time spent up to now is 28.3 secs Computing kpt #: 37 total cpu time spent up to now is 29.0 secs Computing kpt #: 38 total cpu time spent up to now is 29.7 secs Computing kpt #: 39 total cpu time spent up to now is 30.4 secs Computing kpt #: 40 total cpu time spent up to now is 31.1 secs Computing kpt #: 41 total cpu time spent up to now is 31.8 secs Computing kpt #: 42 total cpu time spent up to now is 32.5 secs Computing kpt #: 43 total cpu time spent up to now is 33.2 secs Computing kpt #: 44 total cpu time spent up to now is 33.9 secs Computing kpt #: 45 total cpu time spent up to now is 34.7 secs Computing kpt #: 46 total cpu time spent up to now is 35.5 secs Computing kpt #: 47 total cpu time spent up to now is 36.3 secs Computing kpt #: 48 total cpu time spent up to now is 37.0 secs Computing kpt #: 49 total cpu time spent up to now is 37.8 secs Computing kpt #: 50 total cpu time spent up to now is 38.6 secs Computing kpt #: 51 total cpu time spent up to now is 39.4 secs Computing kpt #: 52 total cpu time spent up to now is 40.1 secs Computing kpt #: 53 total cpu time spent up to now is 40.9 secs Computing kpt #: 54 total cpu time spent up to now is 41.6 secs Computing kpt #: 55 total cpu time spent up to now is 42.5 secs Computing kpt #: 56 total cpu time spent up to now is 43.2 secs Computing kpt #: 57 total cpu time spent up to now is 44.1 secs Computing kpt #: 58 total cpu time spent up to now is 45.0 secs Computing kpt #: 59 total cpu time spent up to now is 45.9 secs Computing kpt #: 60 total cpu time spent up to now is 46.8 secs Computing kpt #: 61 total cpu time spent up to now is 47.6 secs Computing kpt #: 62 total cpu time spent up to now is 48.4 secs Computing kpt #: 63 total cpu time spent up to now is 49.3 secs Computing kpt #: 64 total cpu time spent up to now is 50.0 secs Computing kpt #: 65 total cpu time spent up to now is 50.7 secs Computing kpt #: 66 total cpu time spent up to now is 51.5 secs Computing kpt #: 67 total cpu time spent up to now is 52.3 secs Computing kpt #: 68 total cpu time spent up to now is 53.1 secs Computing kpt #: 69 total cpu time spent up to now is 53.9 secs Computing kpt #: 70 total cpu time spent up to now is 54.7 secs Computing kpt #: 71 total cpu time spent up to now is 55.5 secs Computing kpt #: 72 total cpu time spent up to now is 56.2 secs Computing kpt #: 73 total cpu time spent up to now is 57.0 secs Computing kpt #: 74 total cpu time spent up to now is 57.8 secs Computing kpt #: 75 total cpu time spent up to now is 58.6 secs Computing kpt #: 76 total cpu time spent up to now is 59.4 secs Computing kpt #: 77 total cpu time spent up to now is 60.1 secs Computing kpt #: 78 total cpu time spent up to now is 61.0 secs Computing kpt #: 79 total cpu time spent up to now is 61.8 secs Computing kpt #: 80 total cpu time spent up to now is 62.6 secs Computing kpt #: 81 total cpu time spent up to now is 63.5 secs Computing kpt #: 82 total cpu time spent up to now is 64.4 secs Computing kpt #: 83 total cpu time spent up to now is 65.5 secs Computing kpt #: 84 total cpu time spent up to now is 66.5 secs Computing kpt #: 85 total cpu time spent up to now is 67.8 secs Computing kpt #: 86 total cpu time spent up to now is 69.0 secs Computing kpt #: 87 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 70.8 secs Computing kpt #: 88 total cpu time spent up to now is 72.0 secs Computing kpt #: 89 total cpu time spent up to now is 73.2 secs Computing kpt #: 90 total cpu time spent up to now is 74.4 secs Computing kpt #: 91 total cpu time spent up to now is 75.6 secs Computing kpt #: 92 total cpu time spent up to now is 76.5 secs Computing kpt #: 93 total cpu time spent up to now is 77.4 secs Computing kpt #: 94 total cpu time spent up to now is 78.2 secs Computing kpt #: 95 total cpu time spent up to now is 79.0 secs Computing kpt #: 96 total cpu time spent up to now is 79.7 secs Computing kpt #: 97 total cpu time spent up to now is 80.5 secs Computing kpt #: 98 total cpu time spent up to now is 81.3 secs Computing kpt #: 99 total cpu time spent up to now is 82.0 secs Computing kpt #: 100 total cpu time spent up to now is 82.7 secs Computing kpt #: 101 total cpu time spent up to now is 83.4 secs Computing kpt #: 102 total cpu time spent up to now is 84.1 secs Computing kpt #: 103 total cpu time spent up to now is 84.7 secs Computing kpt #: 104 total cpu time spent up to now is 85.4 secs Computing kpt #: 105 total cpu time spent up to now is 86.1 secs Computing kpt #: 106 total cpu time spent up to now is 86.8 secs Computing kpt #: 107 total cpu time spent up to now is 87.6 secs Computing kpt #: 108 total cpu time spent up to now is 88.4 secs Computing kpt #: 109 total cpu time spent up to now is 89.2 secs Computing kpt #: 110 total cpu time spent up to now is 89.9 secs Computing kpt #: 111 total cpu time spent up to now is 90.7 secs Computing kpt #: 112 total cpu time spent up to now is 91.5 secs Computing kpt #: 113 total cpu time spent up to now is 92.3 secs Computing kpt #: 114 total cpu time spent up to now is 93.4 secs Computing kpt #: 115 total cpu time spent up to now is 94.3 secs Computing kpt #: 116 total cpu time spent up to now is 95.5 secs Computing kpt #: 117 total cpu time spent up to now is 96.7 secs Computing kpt #: 118 total cpu time spent up to now is 97.9 secs Computing kpt #: 119 total cpu time spent up to now is 99.1 secs Computing kpt #: 120 total cpu time spent up to now is 100.2 secs Computing kpt #: 121 total cpu time spent up to now is 101.9 secs Computing kpt #: 122 total cpu time spent up to now is 103.1 secs Computing kpt #: 123 total cpu time spent up to now is 104.2 secs Computing kpt #: 124 total cpu time spent up to now is 105.0 secs Computing kpt #: 125 total cpu time spent up to now is 106.0 secs Computing kpt #: 126 total cpu time spent up to now is 107.0 secs Computing kpt #: 127 total cpu time spent up to now is 108.1 secs Computing kpt #: 128 total cpu time spent up to now is 109.3 secs Computing kpt #: 129 total cpu time spent up to now is 110.1 secs Computing kpt #: 130 total cpu time spent up to now is 110.9 secs Computing kpt #: 131 total cpu time spent up to now is 111.6 secs Computing kpt #: 132 total cpu time spent up to now is 112.3 secs Computing kpt #: 133 total cpu time spent up to now is 113.0 secs Computing kpt #: 134 total cpu time spent up to now is 113.7 secs Computing kpt #: 135 total cpu time spent up to now is 114.4 secs Computing kpt #: 136 total cpu time spent up to now is 115.1 secs Computing kpt #: 137 total cpu time spent up to now is 115.8 secs Computing kpt #: 138 total cpu time spent up to now is 116.5 secs Computing kpt #: 139 total cpu time spent up to now is 117.2 secs Computing kpt #: 140 total cpu time spent up to now is 117.8 secs Computing kpt #: 141 total cpu time spent up to now is 118.5 secs Computing kpt #: 142 total cpu time spent up to now is 119.2 secs Computing kpt #: 143 total cpu time spent up to now is 119.9 secs Computing kpt #: 144 total cpu time spent up to now is 120.5 secs Computing kpt #: 145 total cpu time spent up to now is 121.2 secs Computing kpt #: 146 total cpu time spent up to now is 121.8 secs Computing kpt #: 147 total cpu time spent up to now is 122.5 secs Computing kpt #: 148 total cpu time spent up to now is 123.1 secs Computing kpt #: 149 total cpu time spent up to now is 123.8 secs Computing kpt #: 150 total cpu time spent up to now is 124.4 secs Computing kpt #: 151 total cpu time spent up to now is 125.1 secs Computing kpt #: 152 total cpu time spent up to now is 125.7 secs Computing kpt #: 153 total cpu time spent up to now is 126.3 secs Computing kpt #: 154 total cpu time spent up to now is 127.0 secs Computing kpt #: 155 total cpu time spent up to now is 127.6 secs Computing kpt #: 156 total cpu time spent up to now is 128.2 secs Computing kpt #: 157 total cpu time spent up to now is 128.8 secs Computing kpt #: 158 total cpu time spent up to now is 129.4 secs Computing kpt #: 159 total cpu time spent up to now is 130.0 secs Computing kpt #: 160 total cpu time spent up to now is 130.6 secs Computing kpt #: 161 total cpu time spent up to now is 131.2 secs Computing kpt #: 162 total cpu time spent up to now is 131.9 secs Computing kpt #: 163 total cpu time spent up to now is 132.5 secs Computing kpt #: 164 total cpu time spent up to now is 133.1 secs Computing kpt #: 165 total cpu time spent up to now is 133.7 secs Computing kpt #: 166 total cpu time spent up to now is 134.4 secs Computing kpt #: 167 total cpu time spent up to now is 135.1 secs Computing kpt #: 168 total cpu time spent up to now is 135.8 secs Computing kpt #: 169 total cpu time spent up to now is 136.5 secs Computing kpt #: 170 total cpu time spent up to now is 137.2 secs Computing kpt #: 171 total cpu time spent up to now is 138.0 secs Computing kpt #: 172 total cpu time spent up to now is 138.5 secs Computing kpt #: 173 total cpu time spent up to now is 139.2 secs Computing kpt #: 174 total cpu time spent up to now is 139.9 secs Computing kpt #: 175 total cpu time spent up to now is 140.4 secs Computing kpt #: 176 total cpu time spent up to now is 140.9 secs Computing kpt #: 177 total cpu time spent up to now is 141.4 secs Computing kpt #: 178 total cpu time spent up to now is 142.1 secs Computing kpt #: 179 total cpu time spent up to now is 142.6 secs Computing kpt #: 180 total cpu time spent up to now is 143.1 secs Computing kpt #: 181 total cpu time spent up to now is 143.8 secs Computing kpt #: 182 total cpu time spent up to now is 144.4 secs Computing kpt #: 183 total cpu time spent up to now is 145.2 secs Computing kpt #: 184 total cpu time spent up to now is 146.0 secs Computing kpt #: 185 total cpu time spent up to now is 146.8 secs Computing kpt #: 186 total cpu time spent up to now is 147.5 secs Computing kpt #: 187 total cpu time spent up to now is 148.3 secs Computing kpt #: 188 total cpu time spent up to now is 149.2 secs Computing kpt #: 189 total cpu time spent up to now is 150.1 secs Computing kpt #: 190 total cpu time spent up to now is 150.5 secs Computing kpt #: 191 total cpu time spent up to now is 151.0 secs Computing kpt #: 192 total cpu time spent up to now is 151.5 secs Computing kpt #: 193 total cpu time spent up to now is 152.0 secs Computing kpt #: 194 total cpu time spent up to now is 152.5 secs Computing kpt #: 195 total cpu time spent up to now is 153.0 secs Computing kpt #: 196 total cpu time spent up to now is 153.4 secs Computing kpt #: 197 total cpu time spent up to now is 153.9 secs Computing kpt #: 198 total cpu time spent up to now is 154.4 secs Computing kpt #: 199 total cpu time spent up to now is 154.9 secs Computing kpt #: 200 total cpu time spent up to now is 155.4 secs Computing kpt #: 201 total cpu time spent up to now is 156.0 secs Computing kpt #: 202 total cpu time spent up to now is 156.4 secs Computing kpt #: 203 total cpu time spent up to now is 157.0 secs Computing kpt #: 204 total cpu time spent up to now is 157.5 secs Computing kpt #: 205 total cpu time spent up to now is 158.1 secs Computing kpt #: 206 total cpu time spent up to now is 158.6 secs Computing kpt #: 207 total cpu time spent up to now is 159.2 secs Computing kpt #: 208 total cpu time spent up to now is 159.7 secs Computing kpt #: 209 total cpu time spent up to now is 160.3 secs Computing kpt #: 210 total cpu time spent up to now is 160.8 secs Computing kpt #: 211 total cpu time spent up to now is 161.4 secs Computing kpt #: 212 total cpu time spent up to now is 162.0 secs Computing kpt #: 213 total cpu time spent up to now is 162.5 secs Computing kpt #: 214 total cpu time spent up to now is 163.1 secs Computing kpt #: 215 total cpu time spent up to now is 163.7 secs Computing kpt #: 216 total cpu time spent up to now is 164.3 secs Computing kpt #: 217 total cpu time spent up to now is 164.9 secs Computing kpt #: 218 total cpu time spent up to now is 165.6 secs Computing kpt #: 219 total cpu time spent up to now is 166.3 secs Computing kpt #: 220 total cpu time spent up to now is 166.9 secs Computing kpt #: 221 total cpu time spent up to now is 167.6 secs Computing kpt #: 222 total cpu time spent up to now is 168.3 secs Computing kpt #: 223 total cpu time spent up to now is 168.9 secs Computing kpt #: 224 total cpu time spent up to now is 169.6 secs Computing kpt #: 225 total cpu time spent up to now is 170.2 secs Computing kpt #: 226 total cpu time spent up to now is 170.9 secs Computing kpt #: 227 total cpu time spent up to now is 171.6 secs Computing kpt #: 228 total cpu time spent up to now is 172.3 secs Computing kpt #: 229 total cpu time spent up to now is 173.0 secs Computing kpt #: 230 total cpu time spent up to now is 173.7 secs Computing kpt #: 231 total cpu time spent up to now is 174.4 secs Computing kpt #: 232 total cpu time spent up to now is 175.1 secs Computing kpt #: 233 total cpu time spent up to now is 175.9 secs Computing kpt #: 234 total cpu time spent up to now is 176.6 secs Computing kpt #: 235 total cpu time spent up to now is 177.4 secs Computing kpt #: 236 total cpu time spent up to now is 178.1 secs Computing kpt #: 237 total cpu time spent up to now is 178.9 secs Computing kpt #: 238 total cpu time spent up to now is 179.6 secs Computing kpt #: 239 total cpu time spent up to now is 180.4 secs Computing kpt #: 240 total cpu time spent up to now is 181.1 secs Computing kpt #: 241 total cpu time spent up to now is 181.8 secs Computing kpt #: 242 total cpu time spent up to now is 182.5 secs Computing kpt #: 243 total cpu time spent up to now is 183.2 secs Computing kpt #: 244 total cpu time spent up to now is 183.9 secs Computing kpt #: 245 total cpu time spent up to now is 184.6 secs Computing kpt #: 246 total cpu time spent up to now is 185.2 secs Computing kpt #: 247 total cpu time spent up to now is 185.9 secs Computing kpt #: 248 total cpu time spent up to now is 186.6 secs Computing kpt #: 249 total cpu time spent up to now is 187.2 secs Computing kpt #: 250 total cpu time spent up to now is 187.9 secs Computing kpt #: 251 total cpu time spent up to now is 188.5 secs Computing kpt #: 252 total cpu time spent up to now is 189.2 secs Computing kpt #: 253 total cpu time spent up to now is 189.8 secs Computing kpt #: 254 total cpu time spent up to now is 190.5 secs Computing kpt #: 255 total cpu time spent up to now is 191.1 secs Computing kpt #: 256 total cpu time spent up to now is 191.8 secs Computing kpt #: 257 total cpu time spent up to now is 192.5 secs Computing kpt #: 258 total cpu time spent up to now is 193.1 secs Computing kpt #: 259 total cpu time spent up to now is 193.8 secs Computing kpt #: 260 total cpu time spent up to now is 194.5 secs Computing kpt #: 261 total cpu time spent up to now is 195.2 secs Computing kpt #: 262 total cpu time spent up to now is 195.9 secs Computing kpt #: 263 total cpu time spent up to now is 196.6 secs Computing kpt #: 264 total cpu time spent up to now is 197.6 secs Computing kpt #: 265 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 199.4 secs Computing kpt #: 266 total cpu time spent up to now is 200.1 secs Computing kpt #: 267 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 201.7 secs Computing kpt #: 268 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 203.5 secs Computing kpt #: 269 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 205.2 secs Computing kpt #: 270 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 206.8 secs Computing kpt #: 271 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 208.5 secs Computing kpt #: 272 total cpu time spent up to now is 209.5 secs Computing kpt #: 273 total cpu time spent up to now is 210.2 secs Computing kpt #: 274 total cpu time spent up to now is 210.9 secs Computing kpt #: 275 total cpu time spent up to now is 211.6 secs Computing kpt #: 276 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 213.3 secs Computing kpt #: 277 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 215.1 secs Computing kpt #: 278 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 216.9 secs Computing kpt #: 279 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 218.7 secs Computing kpt #: 280 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 220.5 secs Computing kpt #: 281 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 222.2 secs Computing kpt #: 282 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 223.9 secs Computing kpt #: 283 total cpu time spent up to now is 225.1 secs Computing kpt #: 284 total cpu time spent up to now is 226.1 secs Computing kpt #: 285 total cpu time spent up to now is 226.9 secs Computing kpt #: 286 total cpu time spent up to now is 227.7 secs Computing kpt #: 287 total cpu time spent up to now is 228.4 secs Computing kpt #: 288 total cpu time spent up to now is 229.1 secs Computing kpt #: 289 total cpu time spent up to now is 229.8 secs Computing kpt #: 290 total cpu time spent up to now is 230.4 secs Computing kpt #: 291 total cpu time spent up to now is 231.1 secs Computing kpt #: 292 total cpu time spent up to now is 231.7 secs Computing kpt #: 293 total cpu time spent up to now is 232.4 secs Computing kpt #: 294 total cpu time spent up to now is 233.1 secs Computing kpt #: 295 total cpu time spent up to now is 233.8 secs Computing kpt #: 296 total cpu time spent up to now is 234.5 secs Computing kpt #: 297 total cpu time spent up to now is 235.2 secs Computing kpt #: 298 total cpu time spent up to now is 235.9 secs Computing kpt #: 299 total cpu time spent up to now is 236.6 secs Computing kpt #: 300 total cpu time spent up to now is 237.4 secs Computing kpt #: 301 total cpu time spent up to now is 238.2 secs Computing kpt #: 302 total cpu time spent up to now is 239.0 secs Computing kpt #: 303 total cpu time spent up to now is 240.6 secs Computing kpt #: 304 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 242.3 secs Computing kpt #: 305 total cpu time spent up to now is 243.6 secs Computing kpt #: 306 total cpu time spent up to now is 245.2 secs Computing kpt #: 307 total cpu time spent up to now is 246.9 secs Computing kpt #: 308 total cpu time spent up to now is 248.6 secs Computing kpt #: 309 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 250.4 secs Computing kpt #: 310 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 252.2 secs Computing kpt #: 311 total cpu time spent up to now is 253.1 secs Computing kpt #: 312 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 254.8 secs Computing kpt #: 313 total cpu time spent up to now is 256.2 secs Computing kpt #: 314 total cpu time spent up to now is 257.5 secs Computing kpt #: 315 total cpu time spent up to now is 258.7 secs Computing kpt #: 316 total cpu time spent up to now is 259.6 secs Computing kpt #: 317 total cpu time spent up to now is 260.8 secs Computing kpt #: 318 total cpu time spent up to now is 261.8 secs Computing kpt #: 319 total cpu time spent up to now is 263.1 secs Computing kpt #: 320 total cpu time spent up to now is 264.5 secs Computing kpt #: 321 total cpu time spent up to now is 266.0 secs Computing kpt #: 322 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 267.7 secs Computing kpt #: 323 total cpu time spent up to now is 269.5 secs Computing kpt #: 324 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 271.2 secs Computing kpt #: 325 total cpu time spent up to now is 272.1 secs Computing kpt #: 326 total cpu time spent up to now is 273.1 secs Computing kpt #: 327 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 274.8 secs Computing kpt #: 328 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 276.6 secs Computing kpt #: 329 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 278.2 secs Computing kpt #: 330 total cpu time spent up to now is 279.0 secs Computing kpt #: 331 total cpu time spent up to now is 279.7 secs Computing kpt #: 332 total cpu time spent up to now is 280.5 secs Computing kpt #: 333 total cpu time spent up to now is 281.2 secs Computing kpt #: 334 total cpu time spent up to now is 281.9 secs Computing kpt #: 335 total cpu time spent up to now is 282.6 secs Computing kpt #: 336 total cpu time spent up to now is 283.4 secs Computing kpt #: 337 total cpu time spent up to now is 284.0 secs Computing kpt #: 338 total cpu time spent up to now is 284.7 secs Computing kpt #: 339 total cpu time spent up to now is 285.3 secs Computing kpt #: 340 total cpu time spent up to now is 285.9 secs Computing kpt #: 341 total cpu time spent up to now is 286.6 secs Computing kpt #: 342 total cpu time spent up to now is 287.2 secs Computing kpt #: 343 total cpu time spent up to now is 287.9 secs Computing kpt #: 344 total cpu time spent up to now is 288.5 secs Computing kpt #: 345 total cpu time spent up to now is 289.1 secs Computing kpt #: 346 total cpu time spent up to now is 289.7 secs Computing kpt #: 347 total cpu time spent up to now is 290.2 secs Computing kpt #: 348 total cpu time spent up to now is 290.8 secs Computing kpt #: 349 total cpu time spent up to now is 291.4 secs Computing kpt #: 350 total cpu time spent up to now is 291.9 secs Computing kpt #: 351 total cpu time spent up to now is 292.4 secs Computing kpt #: 352 total cpu time spent up to now is 293.0 secs Computing kpt #: 353 total cpu time spent up to now is 293.5 secs Computing kpt #: 354 total cpu time spent up to now is 294.0 secs Computing kpt #: 355 total cpu time spent up to now is 294.6 secs Computing kpt #: 356 total cpu time spent up to now is 295.1 secs Computing kpt #: 357 total cpu time spent up to now is 295.6 secs Computing kpt #: 358 total cpu time spent up to now is 296.0 secs Computing kpt #: 359 total cpu time spent up to now is 296.5 secs Computing kpt #: 360 total cpu time spent up to now is 297.0 secs Computing kpt #: 361 total cpu time spent up to now is 297.5 secs Computing kpt #: 362 total cpu time spent up to now is 298.0 secs Computing kpt #: 363 total cpu time spent up to now is 298.5 secs Computing kpt #: 364 total cpu time spent up to now is 299.0 secs Computing kpt #: 365 total cpu time spent up to now is 299.5 secs Computing kpt #: 366 total cpu time spent up to now is 300.0 secs Computing kpt #: 367 total cpu time spent up to now is 300.6 secs Computing kpt #: 368 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 302.4 secs Computing kpt #: 369 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 304.0 secs Computing kpt #: 370 total cpu time spent up to now is 305.6 secs Computing kpt #: 371 total cpu time spent up to now is 307.2 secs Computing kpt #: 372 total cpu time spent up to now is 308.6 secs Computing kpt #: 373 total cpu time spent up to now is 312.3 secs Computing kpt #: 374 total cpu time spent up to now is 318.6 secs Computing kpt #: 375 total cpu time spent up to now is 320.1 secs Computing kpt #: 376 total cpu time spent up to now is 321.0 secs Computing kpt #: 377 total cpu time spent up to now is 322.5 secs Computing kpt #: 378 total cpu time spent up to now is 323.3 secs Computing kpt #: 379 total cpu time spent up to now is 324.2 secs Computing kpt #: 380 total cpu time spent up to now is 325.1 secs Computing kpt #: 381 total cpu time spent up to now is 325.7 secs Computing kpt #: 382 total cpu time spent up to now is 326.4 secs Computing kpt #: 383 total cpu time spent up to now is 327.1 secs Computing kpt #: 384 total cpu time spent up to now is 327.8 secs Computing kpt #: 385 total cpu time spent up to now is 328.4 secs Computing kpt #: 386 total cpu time spent up to now is 329.1 secs Computing kpt #: 387 total cpu time spent up to now is 329.8 secs Computing kpt #: 388 total cpu time spent up to now is 330.4 secs Computing kpt #: 389 total cpu time spent up to now is 331.1 secs Computing kpt #: 390 total cpu time spent up to now is 331.8 secs Computing kpt #: 391 total cpu time spent up to now is 332.4 secs Computing kpt #: 392 total cpu time spent up to now is 333.1 secs Computing kpt #: 393 total cpu time spent up to now is 333.8 secs Computing kpt #: 394 total cpu time spent up to now is 334.5 secs ethr = 1.92E-08, avg # of iterations = 38.1 total cpu time spent up to now is 334.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3237 PWs) bands (ev): -10.0103 -10.0103 -9.9256 -9.9256 -7.8897 -7.8897 -7.7211 -7.7211 2.6367 2.6367 3.9503 3.9503 4.2185 4.2185 4.2437 4.2437 5.1988 5.1988 6.4076 6.4076 6.4320 6.4320 6.9037 6.9037 7.1384 7.1384 7.2881 7.2881 7.3415 7.3415 7.3674 7.3674 7.4776 7.4776 7.8363 7.8363 7.8642 7.8642 7.8652 7.8652 8.3117 8.3117 8.3428 8.3428 8.6607 8.6607 9.1758 9.1758 9.4114 9.4114 9.6837 9.6837 11.6059 11.6059 13.2251 13.2251 14.4583 14.4583 16.1160 16.1160 17.4304 17.4304 k = 0.0079 0.0046-0.0000 ( 3231 PWs) bands (ev): -10.0095 -10.0095 -9.9249 -9.9249 -7.8895 -7.8895 -7.7209 -7.7209 2.6376 2.6376 3.9520 3.9520 4.2200 4.2200 4.2442 4.2442 5.1984 5.1984 6.4074 6.4074 6.4320 6.4320 6.8977 6.8977 7.1276 7.1276 7.3024 7.3024 7.3401 7.3401 7.3659 7.3659 7.4763 7.4763 7.8344 7.8344 7.8645 7.8645 7.8654 7.8654 8.3098 8.3098 8.3411 8.3411 8.6603 8.6603 9.1748 9.1748 9.4107 9.4107 9.6830 9.6830 11.6072 11.6072 13.2250 13.2250 14.4626 14.4626 16.1186 16.1186 17.4331 17.4331 k = 0.0159 0.0092-0.0000 ( 3223 PWs) bands (ev): -10.0073 -10.0073 -9.9226 -9.9226 -7.8887 -7.8887 -7.7201 -7.7201 2.6403 2.6403 3.9569 3.9569 4.2243 4.2243 4.2457 4.2457 5.1973 5.1973 6.4067 6.4067 6.4322 6.4322 6.8793 6.8793 7.1044 7.1044 7.3354 7.3354 7.3360 7.3360 7.3616 7.3616 7.4725 7.4725 7.8289 7.8289 7.8654 7.8654 7.8659 7.8659 8.3033 8.3033 8.3371 8.3371 8.6593 8.6593 9.1717 9.1717 9.4088 9.4088 9.6809 9.6809 11.6110 11.6110 13.2245 13.2245 14.4753 14.4753 16.1263 16.1263 17.4410 17.4410 k = 0.0238 0.0137-0.0000 ( 3219 PWs) bands (ev): -10.0036 -10.0036 -9.9189 -9.9189 -7.8873 -7.8873 -7.7189 -7.7189 2.6448 2.6448 3.9652 3.9652 4.2315 4.2315 4.2483 4.2483 5.1955 5.1955 6.4053 6.4053 6.4325 6.4325 6.8487 6.8487 7.0805 7.0805 7.3281 7.3281 7.3550 7.3550 7.3759 7.3759 7.4666 7.4666 7.8199 7.8199 7.8667 7.8667 7.8670 7.8670 8.2903 8.2903 8.3329 8.3329 8.6576 8.6576 9.1666 9.1666 9.4055 9.4055 9.6773 9.6773 11.6172 11.6172 13.2237 13.2237 14.4964 14.4964 16.1391 16.1391 17.4542 17.4542 k = 0.0317 0.0183-0.0000 ( 3215 PWs) bands (ev): -9.9985 -9.9985 -9.9137 -9.9137 -7.8854 -7.8854 -7.7172 -7.7172 2.6510 2.6510 3.9767 3.9767 4.2415 4.2415 4.2518 4.2518 5.1930 5.1930 6.4029 6.4029 6.4328 6.4328 6.8076 6.8076 7.0599 7.0599 7.3165 7.3165 7.3468 7.3468 7.4142 7.4142 7.4619 7.4619 7.8079 7.8079 7.8680 7.8680 7.8694 7.8694 8.2700 8.2700 8.3297 8.3297 8.6548 8.6548 9.1596 9.1596 9.4011 9.4011 9.6725 9.6725 11.6258 11.6258 13.2225 13.2225 14.5257 14.5257 16.1570 16.1570 17.4725 17.4725 k = 0.0397 0.0229-0.0000 ( 3223 PWs) bands (ev): -9.9918 -9.9918 -9.9071 -9.9071 -7.8830 -7.8830 -7.7150 -7.7150 2.6590 2.6590 3.9913 3.9913 4.2544 4.2544 4.2564 4.2564 5.1898 5.1898 6.3990 6.3990 6.4331 6.4331 6.7587 6.7587 7.0425 7.0425 7.3007 7.3007 7.3374 7.3374 7.4268 7.4268 7.4796 7.4796 7.7932 7.7932 7.8697 7.8697 7.8726 7.8726 8.2429 8.2429 8.3271 8.3271 8.6510 8.6510 9.1505 9.1505 9.3954 9.3954 9.6663 9.6663 11.6366 11.6366 13.2209 13.2209 14.5629 14.5629 16.1798 16.1798 17.4959 17.4959 k = 0.0476 0.0275-0.0000 ( 3227 PWs) bands (ev): -9.9838 -9.9838 -9.8990 -9.8990 -7.8801 -7.8801 -7.7123 -7.7123 2.6686 2.6686 4.0089 4.0089 4.2620 4.2620 4.2701 4.2701 5.1859 5.1859 6.3926 6.3926 6.4332 6.4332 6.7055 6.7055 7.0273 7.0273 7.2808 7.2808 7.3271 7.3271 7.4131 7.4131 7.5186 7.5186 7.7767 7.7767 7.8719 7.8719 7.8767 7.8767 8.2101 8.2101 8.3248 8.3248 8.6458 8.6458 9.1396 9.1396 9.3885 9.3885 9.6590 9.6590 11.6495 11.6495 13.2190 13.2190 14.6079 14.6079 16.2077 16.2077 17.5243 17.5243 k = 0.0556 0.0321-0.0000 ( 3233 PWs) bands (ev): -9.9742 -9.9742 -9.8894 -9.8894 -7.8767 -7.8767 -7.7091 -7.7091 2.6798 2.6798 4.0295 4.0295 4.2686 4.2686 4.2887 4.2887 5.1813 5.1813 6.3820 6.3820 6.4331 6.4331 6.6513 6.6513 7.0129 7.0129 7.2570 7.2570 7.3156 7.3156 7.3912 7.3912 7.5600 7.5600 7.7590 7.7590 7.8747 7.8747 7.8818 7.8818 8.1724 8.1724 8.3225 8.3225 8.6393 8.6393 9.1268 9.1268 9.3806 9.3806 9.6506 9.6506 11.6643 11.6643 13.2166 13.2166 14.6603 14.6603 16.2403 16.2403 17.5574 17.5574 k = 0.0635 0.0367-0.0000 ( 3241 PWs) bands (ev): -9.9632 -9.9632 -9.8784 -9.8784 -7.8728 -7.8728 -7.7055 -7.7055 2.6926 2.6926 4.0528 4.0528 4.2762 4.2762 4.3101 4.3101 5.1761 5.1761 6.3640 6.3640 6.4326 6.4326 6.6004 6.6004 6.9987 6.9987 7.2299 7.2299 7.3029 7.3029 7.3636 7.3636 7.6003 7.6003 7.7407 7.7407 7.8779 7.8779 7.8881 7.8881 8.1306 8.1306 8.3202 8.3202 8.6312 8.6312 9.1122 9.1122 9.3716 9.3716 9.6412 9.6412 11.6808 11.6808 13.2138 13.2138 14.7197 14.7197 16.2777 16.2777 17.5951 17.5951 k = 0.0714 0.0412-0.0000 ( 3241 PWs) bands (ev): -9.9508 -9.9508 -9.8659 -9.8659 -7.8684 -7.8684 -7.7015 -7.7015 2.7069 2.7069 4.0785 4.0785 4.2848 4.2848 4.3342 4.3342 5.1702 5.1702 6.3348 6.3348 6.4315 6.4315 6.5577 6.5577 6.9840 6.9840 7.1998 7.1998 7.2887 7.2887 7.3310 7.3310 7.6386 7.6386 7.7227 7.7227 7.8815 7.8815 7.8956 7.8956 8.0855 8.0855 8.3176 8.3176 8.6216 8.6216 9.0960 9.0960 9.3616 9.3616 9.6310 9.6310 11.6989 11.6989 13.2105 13.2105 14.7857 14.7857 16.3197 16.3197 17.6373 17.6373 k = 0.0794 0.0458-0.0000 ( 3243 PWs) bands (ev): -9.9370 -9.9370 -9.8521 -9.8521 -7.8635 -7.8635 -7.6970 -7.6970 2.7226 2.7226 4.1065 4.1065 4.2944 4.2944 4.3610 4.3610 5.1639 5.1639 6.2914 6.2914 6.4297 6.4297 6.5264 6.5264 6.9686 6.9686 7.1671 7.1671 7.2719 7.2719 7.2947 7.2947 7.6728 7.6728 7.7069 7.7069 7.8848 7.8848 7.9045 7.9045 8.0386 8.0386 8.3148 8.3148 8.6105 8.6105 9.0781 9.0781 9.3507 9.3507 9.6201 9.6201 11.7183 11.7183 13.2068 13.2068 14.8580 14.8580 16.3662 16.3662 17.6836 17.6836 k = 0.0873 0.0504-0.0000 ( 3239 PWs) bands (ev): -9.9218 -9.9218 -9.8368 -9.8368 -7.8583 -7.8583 -7.6921 -7.6921 2.7396 2.7396 4.1363 4.1363 4.3052 4.3052 4.3906 4.3906 5.1570 5.1570 6.2347 6.2347 6.4270 6.4270 6.5061 6.5061 6.9522 6.9522 7.1321 7.1321 7.2435 7.2435 7.2640 7.2640 7.6811 7.6811 7.7150 7.7150 7.8855 7.8855 7.9148 7.9148 7.9931 7.9931 8.3117 8.3117 8.5977 8.5977 9.0587 9.0587 9.3390 9.3390 9.6086 9.6086 11.7389 11.7389 13.2025 13.2025 14.9362 14.9362 16.4170 16.4170 17.7338 17.7338 k = 0.0952 0.0550-0.0000 ( 3241 PWs) bands (ev): -9.9052 -9.9052 -9.8201 -9.8201 -7.8525 -7.8525 -7.6869 -7.6869 2.7579 2.7579 4.1676 4.1676 4.3171 4.3171 4.4227 4.4227 5.1499 5.1499 6.1684 6.1684 6.4230 6.4230 6.4933 6.4933 6.9344 6.9344 7.0954 7.0954 7.1991 7.1991 7.2442 7.2442 7.6662 7.6662 7.7430 7.7430 7.8765 7.8765 7.9267 7.9267 7.9579 7.9579 8.3084 8.3084 8.5833 8.5833 9.0379 9.0379 9.3264 9.3264 9.5967 9.5967 11.7606 11.7606 13.1977 13.1977 15.0198 15.0198 16.4720 16.4720 17.7877 17.7877 k = 0.1032 0.0596-0.0000 ( 3237 PWs) bands (ev): -9.8872 -9.8872 -9.8021 -9.8021 -7.8464 -7.8464 -7.6813 -7.6813 2.7772 2.7772 4.1995 4.1995 4.3304 4.3304 4.4573 4.4573 5.1426 5.1426 6.0955 6.0955 6.4175 6.4175 6.4850 6.4850 6.9151 6.9151 7.0575 7.0575 7.1492 7.1492 7.2254 7.2254 7.6500 7.6500 7.7649 7.7649 7.8502 7.8502 7.9391 7.9391 7.9465 7.9465 8.3049 8.3049 8.5674 8.5674 9.0158 9.0158 9.3132 9.3132 9.5844 9.5844 11.7831 11.7831 13.1923 13.1923 15.1084 15.1084 16.5309 16.5309 17.8449 17.8449 k = 0.1111 0.0642-0.0000 ( 3239 PWs) bands (ev): -9.8679 -9.8679 -9.7827 -9.7827 -7.8399 -7.8399 -7.6753 -7.6753 2.7976 2.7976 4.2315 4.2315 4.3451 4.3451 4.4942 4.4942 5.1354 5.1354 6.0183 6.0183 6.4100 6.4100 6.4793 6.4793 6.8939 6.8939 7.0189 7.0189 7.0965 7.0965 7.2061 7.2061 7.6339 7.6339 7.7587 7.7587 7.8341 7.8341 7.9470 7.9470 7.9576 7.9576 8.3011 8.3011 8.5499 8.5499 8.9926 8.9926 9.2993 9.2993 9.5719 9.5719 11.8063 11.8063 13.1864 13.1864 15.2016 15.2016 16.5937 16.5937 17.9051 17.9051 k = 0.1190 0.0687-0.0000 ( 3239 PWs) bands (ev): -9.8473 -9.8473 -9.7620 -9.7620 -7.8331 -7.8331 -7.6690 -7.6690 2.8189 2.8189 4.2625 4.2625 4.3617 4.3617 4.5334 4.5334 5.1286 5.1286 5.9381 5.9381 6.3999 6.3999 6.4750 6.4750 6.8703 6.8703 6.9800 6.9800 7.0430 7.0430 7.1860 7.1860 7.6178 7.6178 7.7152 7.7152 7.8474 7.8474 7.9573 7.9573 7.9748 7.9748 8.2971 8.2971 8.5310 8.5310 8.9683 8.9683 9.2849 9.2849 9.5594 9.5594 11.8301 11.8301 13.1798 13.1798 15.2989 15.2989 16.6601 16.6601 17.9680 17.9680 k = 0.1270 0.0733-0.0000 ( 3241 PWs) bands (ev): -9.8254 -9.8254 -9.7399 -9.7399 -7.8259 -7.8259 -7.6625 -7.6625 2.8410 2.8410 4.2913 4.2913 4.3804 4.3804 4.5746 4.5746 5.1226 5.1226 5.8557 5.8557 6.3866 6.3866 6.4713 6.4713 6.8437 6.8437 6.9405 6.9405 6.9914 6.9914 7.1651 7.1651 7.6012 7.6012 7.6607 7.6607 7.8677 7.8677 7.9708 7.9708 7.9943 7.9943 8.2930 8.2930 8.5108 8.5108 8.9431 8.9431 9.2701 9.2701 9.5469 9.5469 11.8543 11.8543 13.1726 13.1726 15.4000 15.4000 16.7298 16.7298 18.0332 18.0332 k = 0.1349 0.0779-0.0000 ( 3237 PWs) bands (ev): -9.8021 -9.8021 -9.7166 -9.7166 -7.8185 -7.8185 -7.6556 -7.6556 2.8638 2.8638 4.3171 4.3171 4.4011 4.4011 4.6177 4.6177 5.1180 5.1180 5.7717 5.7717 6.3691 6.3691 6.4679 6.4679 6.8135 6.8135 6.8984 6.8984 6.9461 6.9461 7.1436 7.1436 7.5807 7.5807 7.6074 7.6074 7.8881 7.8881 7.9867 7.9867 8.0160 8.0160 8.2889 8.2889 8.4893 8.4893 8.9171 8.9171 9.2549 9.2549 9.5345 9.5345 11.8790 11.8790 13.1648 13.1648 15.5045 15.5045 16.8027 16.8027 18.1003 18.1003 k = 0.1429 0.0825-0.0000 ( 3235 PWs) bands (ev): -9.7777 -9.7777 -9.6921 -9.6921 -7.8108 -7.8108 -7.6486 -7.6486 2.8872 2.8872 4.3395 4.3395 4.4229 4.4229 4.6623 4.6623 5.1153 5.1153 5.6864 5.6864 6.3467 6.3467 6.4645 6.4645 6.7785 6.7785 6.8538 6.8538 6.9103 6.9103 7.1214 7.1214 7.5367 7.5367 7.5770 7.5770 7.9070 7.9070 8.0043 8.0043 8.0398 8.0398 8.2849 8.2849 8.4667 8.4667 8.8905 8.8905 9.2394 9.2394 9.5223 9.5223 11.9039 11.9039 13.1563 13.1563 15.6119 15.6119 16.8785 16.8785 18.1689 18.1689 k = 0.1508 0.0871-0.0000 ( 3237 PWs) bands (ev): -9.7520 -9.7520 -9.6663 -9.6663 -7.8028 -7.8028 -7.6413 -7.6413 2.9111 2.9111 4.3588 4.3588 4.4445 4.4445 4.7081 4.7081 5.1153 5.1153 5.6002 5.6002 6.3186 6.3186 6.4607 6.4607 6.7373 6.7373 6.8117 6.8117 6.8824 6.8824 7.0987 7.0987 7.4805 7.4805 7.5596 7.5596 7.9240 7.9240 8.0235 8.0235 8.0656 8.0656 8.2812 8.2812 8.4432 8.4432 8.8634 8.8634 9.2239 9.2239 9.5104 9.5104 11.9291 11.9291 13.1471 13.1471 15.7218 15.7218 16.9570 16.9570 18.2385 18.2385 k = 0.1587 0.0916-0.0000 ( 3238 PWs) bands (ev): -9.7252 -9.7252 -9.6393 -9.6393 -7.7947 -7.7947 -7.6339 -7.6339 2.9353 2.9353 4.3753 4.3753 4.4638 4.4638 4.7548 4.7548 5.1186 5.1186 5.5134 5.5134 6.2841 6.2841 6.4560 6.4560 6.6901 6.6901 6.7762 6.7762 6.8601 6.8601 7.0755 7.0755 7.4245 7.4245 7.5435 7.5435 7.9391 7.9391 8.0436 8.0436 8.0934 8.0934 8.2782 8.2782 8.4192 8.4192 8.8360 8.8360 9.2085 9.2085 9.4987 9.4987 11.9544 11.9544 13.1373 13.1373 15.8340 15.8340 17.0379 17.0379 18.3086 18.3086 k = 0.1667 0.0962-0.0000 ( 3248 PWs) bands (ev): -9.6971 -9.6971 -9.6111 -9.6111 -7.7864 -7.7864 -7.6264 -7.6264 2.9598 2.9598 4.3892 4.3892 4.4796 4.4796 4.8018 4.8018 5.1257 5.1257 5.4264 5.4264 6.2434 6.2434 6.4494 6.4494 6.6399 6.6399 6.7470 6.7470 6.8425 6.8425 7.0518 7.0518 7.3707 7.3707 7.5278 7.5278 7.9521 7.9521 8.0642 8.0642 8.1230 8.1230 8.2763 8.2763 8.3949 8.3949 8.8083 8.8083 9.1932 9.1932 9.4874 9.4874 11.9799 11.9799 13.1268 13.1268 15.9480 15.9480 17.1210 17.1210 18.3788 18.3788 k = 0.1746 0.1008-0.0000 ( 3250 PWs) bands (ev): -9.6680 -9.6680 -9.5818 -9.5818 -7.7780 -7.7780 -7.6187 -7.6187 2.9844 2.9844 4.4002 4.4002 4.4911 4.4911 4.8487 4.8487 5.1367 5.1367 5.3398 5.3398 6.1969 6.1969 6.4390 6.4390 6.5914 6.5914 6.7218 6.7218 6.8299 6.8299 7.0279 7.0279 7.3203 7.3203 7.5121 7.5121 7.9630 7.9630 8.0842 8.0842 8.1541 8.1541 8.2763 8.2763 8.3710 8.3710 8.7807 8.7807 9.1784 9.1784 9.4766 9.4766 12.0054 12.0054 13.1157 13.1157 16.0634 16.0634 17.2058 17.2058 18.4485 18.4485 k = 0.1825 0.1054-0.0000 ( 3250 PWs) bands (ev): -9.6378 -9.6378 -9.5514 -9.5514 -7.7696 -7.7696 -7.6110 -7.6110 3.0090 3.0090 4.4073 4.4073 4.4985 4.4985 4.8944 4.8944 5.1498 5.1498 5.2558 5.2558 6.1455 6.1455 6.4210 6.4210 6.5496 6.5496 6.6989 6.6989 6.8225 6.8225 7.0036 7.0036 7.2747 7.2747 7.4964 7.4964 7.9717 7.9717 8.1025 8.1025 8.1856 8.1856 8.2792 8.2792 8.3487 8.3487 8.7532 8.7532 9.1641 9.1641 9.4661 9.4661 12.0310 12.0310 13.1040 13.1040 16.1799 16.1799 17.2922 17.2922 18.5172 18.5172 k = 0.1905 0.1100-0.0000 ( 3258 PWs) bands (ev): -9.6065 -9.6065 -9.5200 -9.5200 -7.7611 -7.7611 -7.6033 -7.6033 3.0336 3.0336 4.4090 4.4090 4.5029 4.5029 4.9374 4.9374 5.1457 5.1457 5.1946 5.1946 6.0905 6.0905 6.3909 6.3909 6.5195 6.5195 6.6768 6.6768 6.8205 6.8205 6.9792 6.9792 7.2353 7.2353 7.4808 7.4808 7.9782 7.9782 8.1176 8.1176 8.2152 8.2152 8.2862 8.2862 8.3307 8.3307 8.7260 8.7260 9.1507 9.1507 9.4561 9.4561 12.0566 12.0566 13.0916 13.0916 16.2972 16.2972 17.3798 17.3798 18.5842 18.5842 k = 0.1984 0.1146-0.0000 ( 3252 PWs) bands (ev): -9.5743 -9.5743 -9.4875 -9.4875 -7.7526 -7.7526 -7.5957 -7.5957 3.0580 3.0580 4.4035 4.4035 4.5060 4.5060 4.9704 4.9704 5.0840 5.0840 5.2025 5.2025 6.0329 6.0329 6.3492 6.3492 6.5007 6.5007 6.6548 6.6548 6.8237 6.8237 6.9545 6.9545 7.2038 7.2038 7.4651 7.4651 7.9825 7.9825 8.1283 8.1283 8.2353 8.2353 8.2990 8.2990 8.3241 8.3241 8.6994 8.6994 9.1382 9.1382 9.4467 9.4467 12.0823 12.0823 13.0787 13.0787 16.4148 16.4148 17.4682 17.4682 18.6491 18.6491 k = 0.2063 0.1191-0.0000 ( 3252 PWs) bands (ev): -9.5411 -9.5411 -9.4541 -9.4541 -7.7441 -7.7441 -7.5881 -7.5881 3.0820 3.0820 4.3898 4.3898 4.5090 4.5090 4.9532 4.9532 5.0587 5.0587 5.2244 5.2244 5.9740 5.9740 6.3008 6.3008 6.4880 6.4880 6.6324 6.6324 6.8313 6.8313 6.9297 6.9297 7.1823 7.1823 7.4496 7.4496 7.9846 7.9846 8.1341 8.1341 8.2361 8.2361 8.3184 8.3184 8.3380 8.3380 8.6739 8.6739 9.1271 9.1271 9.4378 9.4378 12.1079 12.1079 13.0652 13.0652 16.5324 16.5324 17.5570 17.5570 18.7112 18.7112 k = 0.2143 0.1237-0.0000 ( 3256 PWs) bands (ev): -9.5069 -9.5069 -9.4197 -9.4197 -7.7358 -7.7358 -7.5806 -7.5806 3.1056 3.1056 4.3683 4.3683 4.5114 4.5114 4.8820 4.8820 5.0847 5.0847 5.2480 5.2480 5.9149 5.9149 6.2496 6.2496 6.4770 6.4770 6.6097 6.6097 6.8422 6.8422 6.9054 6.9054 7.1727 7.1727 7.4342 7.4342 7.9845 7.9845 8.1355 8.1355 8.2239 8.2239 8.3413 8.3413 8.3686 8.3686 8.6500 8.6500 9.1176 9.1176 9.4295 9.4295 12.1335 12.1335 13.0512 13.0512 16.6497 16.6497 17.6458 17.6458 18.7697 18.7697 k = 0.2222 0.1283-0.0000 ( 3264 PWs) bands (ev): -9.4719 -9.4719 -9.3845 -9.3845 -7.7276 -7.7276 -7.5733 -7.5733 3.1286 3.1286 4.3399 4.3399 4.5115 4.5115 4.8025 4.8025 5.1176 5.1176 5.2714 5.2714 5.8567 5.8567 6.1975 6.1975 6.4651 6.4651 6.5865 6.5865 6.8523 6.8523 6.8848 6.8848 7.1764 7.1764 7.4191 7.4191 7.9825 7.9825 8.1333 8.1333 8.2084 8.2084 8.3662 8.3662 8.4060 8.4060 8.6287 8.6287 9.1100 9.1100 9.4219 9.4219 12.1591 12.1591 13.0367 13.0367 16.7662 16.7662 17.7342 17.7342 18.8243 18.8243 k = 0.2302 0.1329-0.0000 ( 3262 PWs) bands (ev): -9.4361 -9.4361 -9.3484 -9.3484 -7.7196 -7.7196 -7.5662 -7.5662 3.1509 3.1509 4.3058 4.3058 4.5065 4.5065 4.7253 4.7253 5.1489 5.1489 5.2935 5.2935 5.8004 5.8004 6.1458 6.1458 6.4507 6.4507 6.5629 6.5629 6.8444 6.8444 6.8851 6.8851 7.1939 7.1939 7.4044 7.4044 7.9789 7.9789 8.1287 8.1287 8.1932 8.1932 8.3914 8.3914 8.4449 8.4449 8.6119 8.6119 9.1048 9.1048 9.4151 9.4151 12.1847 12.1847 13.0217 13.0217 16.8817 16.8817 17.8217 17.8217 18.8742 18.8742 k = 0.2381 0.1375-0.0000 ( 3258 PWs) bands (ev): -9.3995 -9.3995 -9.3115 -9.3115 -7.7118 -7.7118 -7.5593 -7.5593 3.1725 3.1725 4.2671 4.2671 4.4904 4.4904 4.6571 4.6571 5.1768 5.1768 5.3134 5.3134 5.7468 5.7468 6.0949 6.0949 6.4333 6.4333 6.5391 6.5391 6.8220 6.8220 6.9029 6.9029 7.2247 7.2247 7.3905 7.3905 7.9743 7.9743 8.1223 8.1223 8.1799 8.1799 8.4145 8.4145 8.4818 8.4818 8.6036 8.6036 9.1024 9.1024 9.4092 9.4092 12.2102 12.2102 13.0064 13.0064 16.9958 16.9958 17.9077 17.9077 18.9190 18.9190 k = 0.2460 0.1420-0.0000 ( 3254 PWs) bands (ev): -9.3622 -9.3622 -9.2740 -9.2740 -7.7044 -7.7044 -7.5528 -7.5528 3.1931 3.1931 4.2246 4.2246 4.4538 4.4538 4.6071 4.6071 5.2006 5.2006 5.3307 5.3307 5.6968 5.6968 6.0453 6.0453 6.4127 6.4127 6.5150 6.5150 6.7975 6.7975 6.9255 6.9255 7.2666 7.2666 7.3781 7.3781 7.9696 7.9696 8.1148 8.1148 8.1691 8.1691 8.4316 8.4316 8.5125 8.5125 8.6104 8.6104 9.1033 9.1033 9.4043 9.4043 12.2356 12.2356 12.9908 12.9908 17.1081 17.1081 17.9916 17.9916 18.9581 18.9581 k = 0.2540 0.1466-0.0000 ( 3262 PWs) bands (ev): -9.3243 -9.3243 -9.2357 -9.2357 -7.6972 -7.6972 -7.5466 -7.5466 3.2126 3.2126 4.1789 4.1789 4.3946 4.3946 4.5770 4.5770 5.2202 5.2202 5.3452 5.3452 5.6511 5.6511 5.9972 5.9972 6.3893 6.3893 6.4909 6.4909 6.7728 6.7728 6.9505 6.9505 7.3149 7.3149 7.3704 7.3704 7.9658 7.9658 8.1065 8.1065 8.1612 8.1612 8.4393 8.4393 8.5362 8.5362 8.6355 8.6355 9.1081 9.1081 9.4007 9.4007 12.2609 12.2609 12.9749 12.9749 17.2183 17.2183 18.0730 18.0730 18.9911 18.9911 k = 0.2619 0.1512-0.0000 ( 3264 PWs) bands (ev): -9.2857 -9.2857 -9.1968 -9.1968 -7.6905 -7.6905 -7.5408 -7.5408 3.2309 3.2309 4.1308 4.1308 4.3225 4.3225 4.5569 4.5569 5.2356 5.2356 5.3567 5.3567 5.6103 5.6103 5.9509 5.9509 6.3636 6.3636 6.4669 6.4669 6.7483 6.7483 6.9762 6.9762 7.3407 7.3407 7.3944 7.3944 7.9640 7.9640 8.0978 8.0978 8.1568 8.1568 8.4382 8.4382 8.5575 8.5575 8.6731 8.6731 9.1173 9.1173 9.3986 9.3986 12.2861 12.2861 12.9590 12.9590 17.3260 17.3260 18.1510 18.1510 19.0177 19.0177 k = 0.2698 0.1558-0.0000 ( 3266 PWs) bands (ev): -9.2466 -9.2466 -9.1574 -9.1574 -7.6842 -7.6842 -7.5354 -7.5354 3.2478 3.2478 4.0807 4.0807 4.2454 4.2454 4.5386 4.5386 5.2468 5.2468 5.3656 5.3656 5.5747 5.5747 5.9066 5.9066 6.3364 6.3364 6.4431 6.4431 6.7242 6.7242 7.0005 7.0005 7.3367 7.3367 7.4554 7.4554 7.9652 7.9652 8.0888 8.0888 8.1571 8.1571 8.4326 8.4326 8.5789 8.5789 8.7163 8.7163 9.1314 9.1314 9.3983 9.3983 12.3110 12.3110 12.9430 12.9430 17.4309 17.4309 18.2251 18.2251 19.0375 19.0375 k = 0.2778 0.1604-0.0000 ( 3266 PWs) bands (ev): -9.2071 -9.2071 -9.1175 -9.1175 -7.6783 -7.6783 -7.5305 -7.5305 3.2632 3.2632 4.0292 4.0292 4.1668 4.1668 4.5186 4.5186 5.2544 5.2544 5.3719 5.3719 5.5445 5.5445 5.8644 5.8644 6.3083 6.3083 6.4196 6.4196 6.7004 6.7004 7.0210 7.0210 7.3303 7.3303 7.5238 7.5238 7.9694 7.9694 8.0797 8.0797 8.1637 8.1637 8.4268 8.4268 8.5997 8.5997 8.7615 8.7615 9.1507 9.1507 9.4002 9.4002 12.3356 12.3356 12.9273 12.9273 17.5326 17.5326 18.2945 18.2945 19.0504 19.0504 k = 0.2857 0.1650-0.0000 ( 3274 PWs) bands (ev): -9.1672 -9.1672 -9.0771 -9.0771 -7.6730 -7.6730 -7.5262 -7.5262 3.2768 3.2768 3.9768 3.9768 4.0881 4.0881 4.4955 4.4955 5.2586 5.2586 5.3761 5.3761 5.5198 5.5198 5.8244 5.8244 6.2797 6.2797 6.3966 6.3966 6.6771 6.6771 7.0357 7.0357 7.3247 7.3247 7.5934 7.5934 7.9759 7.9759 8.0705 8.0705 8.1791 8.1791 8.4242 8.4242 8.6193 8.6193 8.8071 8.8071 9.1754 9.1754 9.4049 9.4049 12.3598 12.3598 12.9119 12.9119 17.6309 17.6309 18.3588 18.3588 19.0560 19.0560 k = 0.2937 0.1695-0.0000 ( 3266 PWs) bands (ev): -9.1269 -9.1269 -9.0364 -9.0364 -7.6683 -7.6683 -7.5225 -7.5225 3.2884 3.2884 3.9242 3.9242 4.0101 4.0101 4.4688 4.4688 5.2601 5.2601 5.3783 5.3783 5.5002 5.5002 5.7868 5.7868 6.2512 6.2512 6.3740 6.3740 6.6544 6.6544 7.0436 7.0436 7.3199 7.3199 7.6606 7.6606 7.9828 7.9828 8.0613 8.0613 8.2058 8.2058 8.4276 8.4276 8.6381 8.6381 8.8520 8.8520 9.2053 9.2053 9.4129 9.4129 12.3833 12.3833 12.8972 12.8972 17.7254 17.7254 18.4173 18.4173 19.0543 19.0543 k = 0.3016 0.1741-0.0000 ( 3268 PWs) bands (ev): -9.0864 -9.0864 -8.9955 -8.9955 -7.6642 -7.6642 -7.5194 -7.5194 3.2979 3.2979 3.8717 3.8717 3.9333 3.9333 4.4386 4.4386 5.2593 5.2593 5.3785 5.3785 5.4857 5.4857 5.7516 5.7516 6.2231 6.2231 6.3519 6.3519 6.6321 6.6321 7.0443 7.0443 7.3153 7.3153 7.7217 7.7217 7.9887 7.9887 8.0522 8.0522 8.2450 8.2450 8.4395 8.4395 8.6570 8.6570 8.8955 8.8955 9.2403 9.2403 9.4249 9.4249 12.4059 12.4059 12.8835 12.8835 17.8158 17.8158 18.4696 18.4696 19.0448 19.0448 k = 0.3095 0.1787-0.0000 ( 3266 PWs) bands (ev): -9.0457 -9.0457 -8.9543 -8.9543 -7.6608 -7.6608 -7.5169 -7.5169 3.3048 3.3048 3.8200 3.8200 3.8580 3.8580 4.4053 4.4053 5.2568 5.2568 5.3764 5.3764 5.4760 5.4760 5.7192 5.7192 6.1956 6.1956 6.3304 6.3304 6.6104 6.6104 7.0387 7.0387 7.3098 7.3098 7.7733 7.7733 7.9926 7.9926 8.0433 8.0433 8.2960 8.2960 8.4615 8.4615 8.6785 8.6785 8.9369 8.9369 9.2798 9.2798 9.4419 9.4419 12.4272 12.4272 12.8712 12.8712 17.9018 17.9018 18.5153 18.5153 19.0270 19.0270 k = 0.3175 0.1833-0.0000 ( 3262 PWs) bands (ev): -9.0049 -9.0049 -8.9130 -8.9130 -7.6581 -7.6581 -7.5152 -7.5152 3.3088 3.3088 3.7697 3.7697 3.7845 3.7845 4.3694 4.3694 5.2530 5.2530 5.3717 5.3717 5.4711 5.4711 5.6897 5.6897 6.1689 6.1689 6.3095 6.3095 6.5894 6.5894 7.0276 7.0276 7.3030 7.3030 7.8129 7.8129 7.9943 7.9943 8.0348 8.0348 8.3565 8.3565 8.4926 8.4926 8.7064 8.7064 8.9761 8.9761 9.3235 9.3235 9.4647 9.4647 12.4468 12.4468 12.8609 12.8609 17.9832 17.9832 18.5543 18.5543 19.0001 19.0001 k = 0.3254 0.1879-0.0000 ( 3262 PWs) bands (ev): -8.9640 -8.9640 -8.8717 -8.8717 -7.6561 -7.6561 -7.5142 -7.5142 3.3094 3.3094 3.7128 3.7128 3.7217 3.7217 4.3314 4.3314 5.2484 5.2484 5.3645 5.3645 5.4699 5.4699 5.6636 5.6636 6.1432 6.1432 6.2893 6.2893 6.5689 6.5689 7.0121 7.0121 7.2945 7.2945 7.8397 7.8397 7.9938 7.9938 8.0268 8.0268 8.4233 8.4233 8.5292 8.5292 8.7452 8.7452 9.0136 9.0136 9.3710 9.3710 9.4942 9.4942 12.4641 12.4641 12.8533 12.8533 18.0595 18.0595 18.5863 18.5863 18.9627 18.9627 k = 0.3333 0.1925-0.0000 ( 3262 PWs) bands (ev): -8.9233 -8.9233 -8.8305 -8.8305 -7.6549 -7.6549 -7.5140 -7.5140 3.3060 3.3060 3.6433 3.6433 3.6768 3.6768 4.2919 4.2919 5.2432 5.2432 5.3551 5.3551 5.4712 5.4712 5.6415 5.6415 6.1187 6.1187 6.2698 6.2698 6.5492 6.5492 6.9932 6.9932 7.2846 7.2846 7.8552 7.8552 7.9909 7.9909 8.0190 8.0190 8.4873 8.4873 8.5724 8.5724 8.7968 8.7968 9.0510 9.0510 9.4219 9.4219 9.5310 9.5310 12.4786 12.4786 12.8490 12.8490 18.1305 18.1305 18.6109 18.6109 18.9130 18.9130 k = 0.3413 0.1970-0.0000 ( 3266 PWs) bands (ev): -8.8827 -8.8827 -8.7894 -8.7894 -7.6544 -7.6544 -7.5146 -7.5146 3.2981 3.2981 3.5761 3.5761 3.6357 3.6357 4.2517 4.2517 5.2378 5.2378 5.3442 5.3442 5.4731 5.4731 5.6243 5.6243 6.0954 6.0954 6.2509 6.2509 6.5301 6.5301 6.9714 6.9714 7.2735 7.2735 7.8622 7.8622 7.9858 7.9858 8.0110 8.0110 8.5297 8.5297 8.6374 8.6374 8.8563 8.8563 9.0918 9.0918 9.4759 9.4759 9.5762 9.5762 12.4895 12.4895 12.8489 12.8489 18.1957 18.1957 18.6261 18.6261 18.8498 18.8498 k = 0.3492 0.2016-0.0000 ( 3266 PWs) bands (ev): -8.8424 -8.8424 -8.7485 -8.7485 -7.6548 -7.6548 -7.5159 -7.5159 3.2850 3.2850 3.5114 3.5114 3.5995 3.5995 4.2110 4.2110 5.2323 5.2323 5.3321 5.3321 5.4736 5.4736 5.6132 5.6132 6.0735 6.0735 6.2329 6.2329 6.5118 6.5118 6.9475 6.9475 7.2617 7.2617 7.8633 7.8633 7.9793 7.9793 8.0023 8.0023 8.5497 8.5497 8.7244 8.7244 8.9135 8.9135 9.1412 9.1412 9.5327 9.5327 9.6309 9.6309 12.4965 12.4965 12.8534 12.8534 18.2548 18.2548 18.6231 18.6231 18.7785 18.7785 k = 0.3571 0.2062-0.0000 ( 3266 PWs) bands (ev): -8.8025 -8.8025 -8.7080 -8.7080 -7.6561 -7.6561 -7.5182 -7.5182 3.2665 3.2665 3.4492 3.4492 3.5686 3.5686 4.1706 4.1706 5.2269 5.2269 5.3195 5.3195 5.4711 5.4711 5.6088 5.6088 6.0532 6.0532 6.2157 6.2157 6.4943 6.4943 6.9216 6.9216 7.2494 7.2494 7.8606 7.8606 7.9719 7.9719 7.9926 7.9926 8.5592 8.5592 8.8212 8.8212 8.9595 8.9595 9.2023 9.2023 9.5917 9.5917 9.6966 9.6966 12.4993 12.4993 12.8629 12.8629 18.3069 18.3069 18.5692 18.5692 18.7294 18.7294 k = 0.3651 0.2108-0.0000 ( 3262 PWs) bands (ev): -8.7631 -8.7631 -8.6680 -8.6680 -7.6581 -7.6581 -7.5212 -7.5212 3.2429 3.2429 3.3898 3.3898 3.5431 3.5431 4.1307 4.1307 5.2217 5.2217 5.3065 5.3065 5.4654 5.4654 5.6109 5.6109 6.0346 6.0346 6.1993 6.1993 6.4776 6.4776 6.8944 6.8944 7.2371 7.2371 7.8555 7.8555 7.9641 7.9641 7.9821 7.9821 8.5635 8.5635 8.9194 8.9194 8.9948 8.9948 9.2725 9.2725 9.6526 9.6526 9.7747 9.7747 12.4985 12.4985 12.8772 12.8772 18.3507 18.3507 18.4508 18.4508 18.7176 18.7176 k = 0.3730 0.2154-0.0000 ( 3262 PWs) bands (ev): -8.7243 -8.7243 -8.6286 -8.6286 -7.6610 -7.6610 -7.5251 -7.5251 3.2148 3.2148 3.3334 3.3334 3.5225 3.5225 4.0917 4.0917 5.2168 5.2168 5.2933 5.2933 5.4575 5.4575 5.6178 5.6178 6.0179 6.0179 6.1839 6.1839 6.4616 6.4616 6.8659 6.8659 7.2249 7.2249 7.8489 7.8489 7.9560 7.9560 7.9711 7.9711 8.5649 8.5649 8.9917 8.9917 9.0469 9.0469 9.3451 9.3451 9.7158 9.7158 9.8657 9.8657 12.4945 12.4945 12.8958 12.8958 18.2916 18.2916 18.3901 18.3901 18.7171 18.7171 k = 0.3810 0.2199-0.0000 ( 3270 PWs) bands (ev): -8.6862 -8.6862 -8.5899 -8.5899 -7.6647 -7.6647 -7.5298 -7.5298 3.1835 3.1835 3.2800 3.2800 3.5058 3.5058 4.0539 4.0539 5.2121 5.2121 5.2803 5.2803 5.4487 5.4487 5.6275 5.6275 6.0036 6.0036 6.1694 6.1694 6.4466 6.4466 6.8365 6.8365 7.2131 7.2131 7.8414 7.8414 7.9477 7.9477 7.9600 7.9600 8.5646 8.5646 9.0146 9.0146 9.1401 9.1401 9.4150 9.4150 9.7818 9.7818 9.9688 9.9688 12.4883 12.4883 12.9180 12.9180 18.1176 18.1176 18.4135 18.4135 18.7105 18.7105 k = 0.3889 0.2245-0.0000 ( 3270 PWs) bands (ev): -8.6489 -8.6489 -8.5520 -8.5520 -7.6692 -7.6692 -7.5352 -7.5352 3.1503 3.1503 3.2298 3.2298 3.4922 3.4922 4.0177 4.0177 5.2077 5.2077 5.2675 5.2675 5.4402 5.4402 5.6383 5.6383 5.9918 5.9918 6.1559 6.1559 6.4323 6.4323 6.8064 6.8064 7.2017 7.2017 7.8335 7.8335 7.9388 7.9388 7.9496 7.9496 8.5632 8.5632 9.0255 9.0255 9.2375 9.2375 9.4795 9.4795 9.8516 9.8516 10.0819 10.0819 12.4809 12.4809 12.9430 12.9430 17.9320 17.9320 18.4179 18.4179 18.6545 18.6546 k = 0.3968 0.2291-0.0000 ( 3268 PWs) bands (ev): -8.6127 -8.6127 -8.5152 -8.5152 -7.6745 -7.6745 -7.5414 -7.5414 3.1161 3.1161 3.1829 3.1829 3.4807 3.4807 3.9831 3.9831 5.2034 5.2034 5.2550 5.2550 5.4326 5.4326 5.6488 5.6488 5.9830 5.9830 6.1435 6.1435 6.4190 6.4190 6.7759 6.7759 7.1909 7.1909 7.8255 7.8255 7.9291 7.9291 7.9404 7.9404 8.5612 8.5612 9.0323 9.0323 9.3305 9.3305 9.5380 9.5380 9.9259 9.9259 10.2021 10.2021 12.4736 12.4736 12.9700 12.9700 17.7413 17.7413 18.3630 18.3630 18.5572 18.5572 k = 0.4048 0.2337-0.0000 ( 3268 PWs) bands (ev): -8.5776 -8.5776 -8.4795 -8.4795 -7.6804 -7.6804 -7.5483 -7.5483 3.0818 3.0818 3.1395 3.1395 3.4708 3.4708 3.9505 3.9505 5.1992 5.1992 5.2431 5.2431 5.4265 5.4265 5.6579 5.6579 5.9776 5.9776 6.1324 6.1324 6.4066 6.4066 6.7450 6.7450 7.1807 7.1807 7.8177 7.8177 7.9187 7.9187 7.9325 7.9325 8.5587 8.5587 9.0366 9.0366 9.4165 9.4165 9.5906 9.5906 10.0053 10.0053 10.3259 10.3259 12.4674 12.4674 12.9980 12.9980 17.5501 17.5501 18.2133 18.2133 18.5225 18.5225 k = 0.4127 0.2383-0.0000 ( 3268 PWs) bands (ev): -8.5440 -8.5440 -8.4452 -8.4452 -7.6869 -7.6869 -7.5557 -7.5557 3.0483 3.0483 3.0997 3.0997 3.4621 3.4621 3.9201 3.9201 5.1950 5.1950 5.2318 5.2318 5.4221 5.4221 5.6646 5.6646 5.9758 5.9758 6.1225 6.1225 6.3951 6.3951 6.7142 6.7142 7.1712 7.1712 7.8101 7.8101 7.9080 7.9080 7.9256 7.9256 8.5560 8.5560 9.0393 9.0393 9.4943 9.4943 9.6379 9.6379 10.0898 10.0898 10.4502 10.4502 12.4638 12.4638 13.0261 13.0261 17.3617 17.3617 18.0286 18.0286 18.5144 18.5144 k = 0.4206 0.2429-0.0000 ( 3262 PWs) bands (ev): -8.5118 -8.5118 -8.4124 -8.4124 -7.6940 -7.6940 -7.5636 -7.5636 3.0162 3.0162 3.0635 3.0635 3.4543 3.4543 3.8918 3.8918 5.1908 5.1908 5.2212 5.2212 5.4195 5.4195 5.6686 5.6686 5.9775 5.9775 6.1142 6.1142 6.3846 6.3846 6.6834 6.6834 7.1625 7.1625 7.8031 7.8031 7.8976 7.8976 7.9194 7.9194 8.5533 8.5533 9.0410 9.0410 9.5632 9.5632 9.6803 9.6803 10.1785 10.1785 10.5716 10.5716 12.4642 12.4642 13.0532 13.0532 17.1791 17.1791 17.8389 17.8389 18.5103 18.5103 k = 0.4286 0.2474-0.0000 ( 3274 PWs) bands (ev): -8.4814 -8.4814 -8.3814 -8.3814 -7.7013 -7.7013 -7.5718 -7.5718 2.9858 2.9858 3.0308 3.0308 3.4472 3.4472 3.8659 3.8659 5.1867 5.1867 5.2114 5.2114 5.4186 5.4186 5.6698 5.6698 5.9823 5.9823 6.1078 6.1078 6.3750 6.3750 6.6530 6.6530 7.1546 7.1546 7.7966 7.7966 7.8876 7.8876 7.9139 7.9139 8.5506 8.5506 9.0420 9.0420 9.6233 9.6233 9.7182 9.7182 10.2702 10.2702 10.6866 10.6866 12.4703 12.4703 13.0780 13.0780 17.0048 17.0048 17.6525 17.6525 18.5062 18.5062 k = 0.4365 0.2520-0.0000 ( 3268 PWs) bands (ev): -8.4531 -8.4531 -8.3525 -8.3525 -7.7089 -7.7089 -7.5802 -7.5802 2.9577 2.9577 3.0016 3.0016 3.4408 3.4408 3.8425 3.8425 5.1826 5.1826 5.2024 5.2024 5.4194 5.4194 5.6682 5.6682 5.9892 5.9892 6.1036 6.1036 6.3664 6.3664 6.6233 6.6233 7.1474 7.1474 7.7907 7.7907 7.8782 7.8782 7.9090 7.9090 8.5480 8.5480 9.0424 9.0424 9.6752 9.6752 9.7517 9.7517 10.3632 10.3632 10.7920 10.7920 12.4840 12.4840 13.0992 13.0992 16.8415 16.8415 17.4734 17.4734 18.5015 18.5015 k = 0.4444 0.2566-0.0000 ( 3278 PWs) bands (ev): -8.4270 -8.4270 -8.3259 -8.3259 -7.7165 -7.7165 -7.5885 -7.5885 2.9323 2.9323 2.9759 2.9759 3.4350 3.4350 3.8217 3.8217 5.1787 5.1787 5.1943 5.1943 5.4215 5.4215 5.6646 5.6646 5.9969 5.9969 6.1021 6.1021 6.3588 6.3588 6.5946 6.5946 7.1411 7.1411 7.7854 7.7854 7.8696 7.8696 7.9046 7.9046 8.5456 8.5456 9.0425 9.0425 9.7195 9.7195 9.7810 9.7810 10.4554 10.4554 10.8844 10.8844 12.5067 12.5067 13.1151 13.1151 16.6918 16.6918 17.3044 17.3044 18.4964 18.4964 k = 0.4524 0.2612-0.0000 ( 3280 PWs) bands (ev): -8.4034 -8.4034 -8.3018 -8.3018 -7.7239 -7.7239 -7.5965 -7.5965 2.9098 2.9098 2.9536 2.9536 3.4299 3.4299 3.8035 3.8035 5.1750 5.1750 5.1873 5.1873 5.4247 5.4247 5.6594 5.6594 6.0042 6.0042 6.1039 6.1039 6.3521 6.3521 6.5672 6.5672 7.1355 7.1355 7.7809 7.7809 7.8619 7.8619 7.9008 7.9008 8.5434 8.5434 9.0424 9.0424 9.7570 9.7570 9.8061 9.8061 10.5450 10.5450 10.9611 10.9611 12.5396 12.5396 13.1242 13.1242 16.5581 16.5581 17.1481 17.1481 18.4913 18.4913 k = 0.4603 0.2658-0.0000 ( 3284 PWs) bands (ev): -8.3828 -8.3828 -8.2807 -8.2807 -7.7308 -7.7308 -7.6040 -7.6040 2.8905 2.8905 2.9347 2.9347 3.4255 3.4255 3.7880 3.7880 5.1717 5.1717 5.1812 5.1812 5.4286 5.4286 5.6535 5.6535 6.0099 6.0099 6.1089 6.1089 6.3465 6.3465 6.5418 6.5418 7.1309 7.1309 7.7771 7.7771 7.8552 7.8552 7.8976 7.8976 8.5415 8.5415 9.0422 9.0422 9.7883 9.7883 9.8271 9.8271 10.6299 10.6299 11.0202 11.0202 12.5829 12.5829 13.1247 13.1247 16.4428 16.4428 17.0071 17.0071 18.4865 18.4865 k = 0.4683 0.2703-0.0000 ( 3280 PWs) bands (ev): -8.3653 -8.3653 -8.2628 -8.2628 -7.7369 -7.7369 -7.6106 -7.6106 2.8745 2.8745 2.9192 2.9192 3.4219 3.4219 3.7753 3.7753 5.1689 5.1689 5.1761 5.1761 5.4327 5.4327 5.6474 5.6474 6.0137 6.0137 6.1165 6.1165 6.3419 6.3419 6.5188 6.5188 7.1270 7.1270 7.7740 7.7740 7.8495 7.8495 7.8949 7.8949 8.5400 8.5400 9.0420 9.0420 9.8137 9.8137 9.8440 9.8440 10.7079 10.7079 11.0611 11.0611 12.6352 12.6352 13.1155 13.1155 16.3478 16.3478 16.8844 16.8844 18.4822 18.4822 k = 0.4762 0.2749-0.0000 ( 3280 PWs) bands (ev): -8.3512 -8.3512 -8.2484 -8.2484 -7.7421 -7.7421 -7.6162 -7.6162 2.8620 2.8620 2.9072 2.9072 3.4190 3.4190 3.7653 3.7653 5.1666 5.1666 5.1722 5.1722 5.4366 5.4366 5.6418 5.6418 6.0159 6.0159 6.1252 6.1252 6.3383 6.3383 6.4993 6.4993 7.1240 7.1240 7.7716 7.7716 7.8450 7.8450 7.8929 7.8929 8.5387 8.5387 9.0417 9.0417 9.8337 9.8337 9.8566 9.8566 10.7767 10.7767 11.0850 11.0850 12.6934 12.6934 13.0965 13.0965 16.2742 16.2742 16.7833 16.7833 18.4787 18.4787 k = 0.4841 0.2795-0.0000 ( 3280 PWs) bands (ev): -8.3410 -8.3410 -8.2379 -8.2379 -7.7460 -7.7460 -7.6204 -7.6204 2.8529 2.8529 2.8985 2.8985 3.4168 3.4168 3.7582 3.7582 5.1649 5.1649 5.1693 5.1693 5.4398 5.4398 5.6373 5.6373 6.0169 6.0169 6.1332 6.1332 6.3358 6.3358 6.4842 6.4842 7.1219 7.1219 7.7700 7.7700 7.8418 7.8418 7.8914 7.8914 8.5378 8.5378 9.0415 9.0415 9.8483 9.8483 9.8652 9.8652 10.8327 10.8327 11.0948 11.0948 12.7516 12.7516 13.0696 13.0696 16.2223 16.2223 16.7074 16.7074 18.4761 18.4761 k = 0.4921 0.2841-0.0000 ( 3280 PWs) bands (ev): -8.3347 -8.3347 -8.2315 -8.2315 -7.7484 -7.7484 -7.6230 -7.6230 2.8475 2.8475 2.8933 2.8933 3.4156 3.4156 3.7539 3.7539 5.1639 5.1639 5.1675 5.1675 5.4419 5.4419 5.6343 5.6343 6.0174 6.0174 6.1388 6.1388 6.3343 6.3343 6.4746 6.4746 7.1206 7.1206 7.7690 7.7690 7.8398 7.8398 7.8905 7.8905 8.5372 8.5372 9.0414 9.0414 9.8574 9.8574 9.8699 9.8699 10.8708 10.8708 11.0960 11.0960 12.7998 12.7998 13.0417 13.0417 16.1918 16.1918 16.6600 16.6600 18.4744 18.4744 k = 0.5000 0.2887-0.0000 ( 3284 PWs) bands (ev): -8.3326 -8.3326 -8.2294 -8.2294 -7.7492 -7.7492 -7.6239 -7.6239 2.8457 2.8457 2.8916 2.8916 3.4151 3.4151 3.7525 3.7525 5.1636 5.1636 5.1669 5.1669 5.4426 5.4426 5.6333 5.6333 6.0175 6.0175 6.1408 6.1408 6.3338 6.3338 6.4713 6.4713 7.1201 7.1201 7.7686 7.7686 7.8391 7.8391 7.8902 7.8902 8.5371 8.5371 9.0413 9.0413 9.8606 9.8606 9.8713 9.8713 10.8847 10.8847 11.0952 11.0952 12.8203 12.8203 13.0282 13.0282 16.1817 16.1817 16.6439 16.6439 18.4739 18.4739 k = 0.5000 0.2887-0.0000 ( 3284 PWs) bands (ev): -8.3326 -8.3326 -8.2294 -8.2294 -7.7492 -7.7492 -7.6239 -7.6239 2.8457 2.8457 2.8916 2.8916 3.4151 3.4151 3.7525 3.7525 5.1636 5.1636 5.1669 5.1669 5.4426 5.4426 5.6333 5.6333 6.0175 6.0175 6.1408 6.1408 6.3338 6.3338 6.4713 6.4713 7.1201 7.1201 7.7686 7.7686 7.8391 7.8391 7.8902 7.8902 8.5371 8.5371 9.0413 9.0413 9.8606 9.8606 9.8713 9.8713 10.8847 10.8847 11.0952 11.0952 12.8203 12.8203 13.0282 13.0282 16.1817 16.1817 16.6439 16.6439 18.4739 18.4739 k = 0.4955 0.2965-0.0000 ( 3278 PWs) bands (ev): -8.3322 -8.3322 -8.2290 -8.2290 -7.7492 -7.7492 -7.6239 -7.6239 2.8465 2.8465 2.8924 2.8924 3.4156 3.4156 3.7532 3.7532 5.1648 5.1648 5.1685 5.1685 5.4411 5.4411 5.6336 5.6336 6.0150 6.0150 6.1393 6.1393 6.3320 6.3320 6.4736 6.4736 7.1185 7.1185 7.7690 7.7690 7.8394 7.8394 7.8883 7.8883 8.5362 8.5362 9.0402 9.0402 9.8559 9.8559 9.8670 9.8670 10.8845 10.8845 11.0948 11.0948 12.8271 12.8271 13.0347 13.0347 16.1824 16.1824 16.6438 16.6438 18.4778 18.4778 k = 0.4910 0.3043-0.0000 ( 3282 PWs) bands (ev): -8.3311 -8.3311 -8.2278 -8.2278 -7.7492 -7.7492 -7.6239 -7.6239 2.8488 2.8488 2.8947 2.8947 3.4171 3.4171 3.7551 3.7551 5.1685 5.1685 5.1731 5.1731 5.4367 5.4367 5.6344 5.6344 6.0071 6.0071 6.1353 6.1353 6.3272 6.3272 6.4803 6.4803 7.1134 7.1134 7.7701 7.7701 7.8400 7.8400 7.8830 7.8830 8.5337 8.5337 9.0367 9.0367 9.8417 9.8417 9.8540 9.8540 10.8838 10.8838 11.0936 11.0936 12.8473 12.8473 13.0540 13.0540 16.1844 16.1844 16.6433 16.6433 18.4896 18.4896 k = 0.4865 0.3121-0.0000 ( 3284 PWs) bands (ev): -8.3291 -8.3291 -8.2258 -8.2258 -7.7491 -7.7491 -7.6239 -7.6239 2.8527 2.8527 2.8985 2.8985 3.4196 3.4196 3.7585 3.7585 5.1744 5.1744 5.1807 5.1807 5.4295 5.4295 5.6357 5.6357 5.9933 5.9933 6.1299 6.1299 6.3200 6.3200 6.4902 6.4902 7.1050 7.1050 7.7715 7.7715 7.8397 7.8397 7.8756 7.8756 8.5295 8.5295 9.0309 9.0309 9.8186 9.8186 9.8327 9.8327 10.8828 10.8828 11.0917 11.0917 12.8804 12.8804 13.0857 13.0857 16.1878 16.1878 16.6424 16.6424 18.5092 18.5092 k = 0.4820 0.3199-0.0000 ( 3288 PWs) bands (ev): -8.3264 -8.3264 -8.2230 -8.2230 -7.7491 -7.7491 -7.6239 -7.6239 2.8581 2.8581 2.9039 2.9039 3.4230 3.4230 3.7631 3.7631 5.1821 5.1821 5.1912 5.1912 5.4197 5.4197 5.6375 5.6375 5.9727 5.9727 6.1245 6.1245 6.3115 6.3115 6.5023 6.5023 7.0934 7.0934 7.7728 7.7728 7.8353 7.8353 7.8700 7.8700 8.5236 8.5236 9.0228 9.0228 9.7872 9.7872 9.8038 9.8038 10.8814 10.8814 11.0891 11.0891 12.9259 12.9259 13.1293 13.1293 16.1926 16.1926 16.6413 16.6413 18.5365 18.5365 k = 0.4775 0.3277-0.0000 ( 3288 PWs) bands (ev): -8.3229 -8.3229 -8.2195 -8.2195 -7.7490 -7.7490 -7.6239 -7.6239 2.8650 2.8650 2.9108 2.9108 3.4274 3.4274 3.7690 3.7690 5.1910 5.1910 5.2045 5.2045 5.4082 5.4082 5.6397 5.6397 5.9455 5.9455 6.1199 6.1199 6.3021 6.3021 6.5155 6.5155 7.0787 7.0787 7.7729 7.7729 7.8235 7.8235 7.8701 7.8701 8.5162 8.5162 9.0124 9.0124 9.7481 9.7481 9.7679 9.7679 10.8798 10.8798 11.0858 11.0858 12.9829 12.9829 13.1841 13.1841 16.1986 16.1986 16.6399 16.6399 18.5713 18.5713 k = 0.4730 0.3355-0.0000 ( 3284 PWs) bands (ev): -8.3186 -8.3186 -8.2151 -8.2151 -7.7489 -7.7489 -7.6239 -7.6239 2.8734 2.8734 2.9192 2.9192 3.4327 3.4327 3.7763 3.7763 5.1997 5.1997 5.2204 5.2204 5.3959 5.3959 5.6421 5.6421 5.9121 5.9121 6.1166 6.1166 6.2926 6.2926 6.5293 6.5293 7.0611 7.0611 7.7688 7.7688 7.8082 7.8082 7.8752 7.8752 8.5072 8.5072 8.9996 8.9996 9.7022 9.7022 9.7259 9.7259 10.8779 10.8779 11.0818 11.0818 13.0505 13.0505 13.2492 13.2492 16.2058 16.2058 16.6382 16.6382 18.6134 18.6134 k = 0.4685 0.3433-0.0000 ( 3288 PWs) bands (ev): -8.3136 -8.3136 -8.2100 -8.2100 -7.7489 -7.7489 -7.6240 -7.6240 2.8834 2.8834 2.9292 2.9292 3.4389 3.4389 3.7848 3.7848 5.2061 5.2061 5.2386 5.2386 5.3849 5.3849 5.6444 5.6444 5.8740 5.8740 6.1143 6.1143 6.2831 6.2831 6.5431 6.5431 7.0410 7.0410 7.7541 7.7541 7.7976 7.7976 7.8832 7.8832 8.4967 8.4967 8.9845 8.9845 9.6506 9.6506 9.6786 9.6786 10.8758 10.8758 11.0773 11.0773 13.1276 13.1276 13.3237 13.3237 16.2143 16.2143 16.6362 16.6362 18.6627 18.6627 k = 0.4640 0.3511-0.0000 ( 3284 PWs) bands (ev): -8.3078 -8.3078 -8.2042 -8.2042 -7.7489 -7.7489 -7.6241 -7.6241 2.8948 2.8948 2.9406 2.9406 3.4459 3.4459 3.7945 3.7945 5.2069 5.2069 5.2587 5.2587 5.3785 5.3785 5.6461 5.6461 5.8327 5.8327 6.1128 6.1128 6.2741 6.2741 6.5566 6.5566 7.0187 7.0187 7.7277 7.7277 7.7940 7.7940 7.8929 7.8929 8.4848 8.4848 8.9671 8.9671 9.5941 9.5941 9.6271 9.6271 10.8735 10.8735 11.0722 11.0722 13.2135 13.2135 13.4069 13.4069 16.2239 16.2239 16.6340 16.6340 18.7189 18.7189 k = 0.4595 0.3589-0.0000 ( 3294 PWs) bands (ev): -8.3013 -8.3013 -8.1976 -8.1976 -7.7490 -7.7490 -7.6243 -7.6243 2.9078 2.9078 2.9535 2.9535 3.4539 3.4539 3.8055 3.8055 5.1987 5.1987 5.2799 5.2799 5.3798 5.3798 5.6459 5.6459 5.7911 5.7911 6.1116 6.1116 6.2657 6.2657 6.5695 6.5695 6.9947 6.9947 7.6943 7.6943 7.7928 7.7928 7.9038 7.9038 8.4716 8.4716 8.9472 8.9472 9.5336 9.5336 9.5721 9.5721 10.8710 10.8710 11.0665 11.0665 13.3071 13.3071 13.4979 13.4979 16.2345 16.2345 16.6316 16.6316 18.7817 18.7817 k = 0.4550 0.3667-0.0000 ( 3290 PWs) bands (ev): -8.2941 -8.2941 -8.1902 -8.1902 -7.7491 -7.7491 -7.6246 -7.6246 2.9221 2.9221 2.9678 2.9678 3.4626 3.4626 3.8177 3.8177 5.1800 5.1800 5.3011 5.3011 5.3903 5.3903 5.6405 5.6405 5.7541 5.7541 6.1105 6.1105 6.2584 6.2584 6.5815 6.5815 6.9696 6.9696 7.6564 7.6564 7.7922 7.7922 7.9154 7.9154 8.4573 8.4573 8.9248 8.9248 9.4701 9.4701 9.5147 9.5147 10.8682 10.8682 11.0603 11.0603 13.4077 13.4077 13.5959 13.5959 16.2462 16.2462 16.6290 16.6290 18.8507 18.8507 k = 0.4505 0.3745-0.0000 ( 3294 PWs) bands (ev): -8.2862 -8.2862 -8.1822 -8.1822 -7.7494 -7.7494 -7.6251 -7.6251 2.9379 2.9379 2.9836 2.9836 3.4721 3.4721 3.8311 3.8311 5.1520 5.1520 5.3201 5.3201 5.4084 5.4084 5.6251 5.6251 5.7291 5.7291 6.1092 6.1092 6.2522 6.2522 6.5923 6.5923 6.9442 6.9442 7.6150 7.6150 7.7912 7.7912 7.9274 7.9274 8.4418 8.4418 8.8999 8.8999 9.4043 9.4043 9.4557 9.4557 10.8652 10.8652 11.0536 11.0536 13.5146 13.5146 13.7002 13.7002 16.2589 16.2589 16.6263 16.6263 18.9255 18.9255 k = 0.4459 0.3823-0.0000 ( 3294 PWs) bands (ev): -8.2775 -8.2775 -8.1734 -8.1734 -7.7498 -7.7498 -7.6256 -7.6256 2.9551 2.9551 3.0008 3.0008 3.4823 3.4823 3.8456 3.8456 5.1169 5.1169 5.3329 5.3329 5.4320 5.4320 5.6008 5.6008 5.7195 5.7195 6.1074 6.1074 6.2475 6.2475 6.6014 6.6014 6.9195 6.9195 7.5707 7.5707 7.7897 7.7897 7.9394 7.9394 8.4254 8.4254 8.8723 8.8723 9.3371 9.3371 9.3961 9.3961 10.8620 10.8620 11.0463 11.0463 13.6270 13.6270 13.8101 13.8101 16.2726 16.2726 16.6235 16.6235 19.0058 19.0058 k = 0.4414 0.3901-0.0000 ( 3290 PWs) bands (ev): -8.2682 -8.2682 -8.1639 -8.1639 -7.7503 -7.7503 -7.6264 -7.6264 2.9737 2.9737 3.0195 3.0195 3.4931 3.4931 3.8613 3.8613 5.0762 5.0762 5.3326 5.3326 5.4591 5.4591 5.5797 5.5797 5.7202 5.7202 6.1048 6.1048 6.2443 6.2443 6.6083 6.6083 6.8967 6.8967 7.5240 7.5240 7.7873 7.7873 7.9513 7.9513 8.4081 8.4081 8.8418 8.8418 9.2690 9.2690 9.3366 9.3366 10.8585 10.8585 11.0385 11.0385 13.7443 13.7443 13.9252 13.9252 16.2871 16.2871 16.6208 16.6208 19.0911 19.0911 k = 0.4369 0.3979-0.0000 ( 3288 PWs) bands (ev): -8.2583 -8.2583 -8.1538 -8.1538 -7.7510 -7.7510 -7.6274 -7.6274 2.9936 2.9936 3.0394 3.0394 3.5046 3.5046 3.8780 3.8780 5.0311 5.0311 5.3130 5.3130 5.4883 5.4883 5.5731 5.5731 5.7266 5.7266 6.1015 6.1015 6.2429 6.2429 6.6124 6.6124 6.8771 6.8771 7.4752 7.4752 7.7841 7.7841 7.9628 7.9628 8.3902 8.3902 8.8084 8.8084 9.2008 9.2008 9.2780 9.2780 10.8548 10.8548 11.0302 11.0302 13.8661 13.8661 14.0449 14.0449 16.3025 16.3025 16.6180 16.6180 19.1809 19.1809 k = 0.4324 0.4057-0.0000 ( 3288 PWs) bands (ev): -8.2477 -8.2477 -8.1430 -8.1430 -7.7520 -7.7520 -7.6286 -7.6286 3.0148 3.0148 3.0608 3.0608 3.5166 3.5166 3.8956 3.8956 4.9824 4.9824 5.2742 5.2742 5.5184 5.5184 5.5828 5.5828 5.7366 5.7366 6.0972 6.0972 6.2433 6.2433 6.6130 6.6130 6.8620 6.8620 7.4248 7.4248 7.7797 7.7797 7.9736 7.9736 8.3717 8.3717 8.7720 8.7720 9.1330 9.1330 9.2210 9.2210 10.8507 10.8507 11.0213 11.0213 13.9919 13.9919 14.1686 14.1686 16.3188 16.3188 16.6155 16.6155 19.2746 19.2746 k = 0.4279 0.4135-0.0000 ( 3288 PWs) bands (ev): -8.2365 -8.2365 -8.1316 -8.1316 -7.7532 -7.7532 -7.6301 -7.6301 3.0373 3.0373 3.0834 3.0834 3.5291 3.5291 3.9142 3.9142 4.9308 4.9308 5.2224 5.2224 5.5479 5.5479 5.6033 5.6033 5.7499 5.7499 6.0922 6.0922 6.2456 6.2456 6.6099 6.6099 6.8525 6.8525 7.3731 7.3731 7.7741 7.7741 7.9836 7.9836 8.3527 8.3527 8.7324 8.7324 9.0664 9.0664 9.1664 9.1664 10.8464 10.8464 11.0119 11.0119 14.1213 14.1213 14.2961 14.2961 16.3359 16.3359 16.6131 16.6131 19.3717 19.3717 k = 0.4234 0.4213-0.0000 ( 3300 PWs) bands (ev): -8.2247 -8.2247 -8.1196 -8.1196 -7.7547 -7.7547 -7.6319 -7.6319 3.0609 3.0609 3.1073 3.1073 3.5421 3.5421 3.9337 3.9337 4.8766 4.8766 5.1630 5.1630 5.5754 5.5754 5.6292 5.6292 5.7668 5.7668 6.0868 6.0868 6.2499 6.2499 6.6036 6.6036 6.8488 6.8488 7.3205 7.3205 7.7672 7.7672 7.9928 7.9928 8.3331 8.3331 8.6899 8.6899 9.0013 9.0013 9.1145 9.1145 10.8418 10.8418 11.0019 11.0019 14.2539 14.2539 14.4270 14.4270 16.3539 16.3539 16.6111 16.6111 19.4716 19.4716 k = 0.4189 0.4291-0.0000 ( 3304 PWs) bands (ev): -8.2123 -8.2123 -8.1070 -8.1070 -7.7566 -7.7566 -7.6340 -7.6340 3.0858 3.0858 3.1324 3.1324 3.5553 3.5553 3.9540 3.9540 4.8204 4.8204 5.0994 5.0994 5.5991 5.5991 5.6568 5.6568 5.7877 5.7877 6.0816 6.0816 6.2564 6.2564 6.5951 6.5951 6.8507 6.8507 7.2675 7.2675 7.7589 7.7589 8.0009 8.0009 8.3132 8.3132 8.6446 8.6446 8.9384 8.9384 9.0656 9.0656 10.8369 10.8369 10.9914 10.9914 14.3894 14.3894 14.5609 14.5609 16.3727 16.3727 16.6095 16.6095 19.5736 19.5736 k = 0.4144 0.4369-0.0000 ( 3308 PWs) bands (ev): -8.1994 -8.1994 -8.0938 -8.0938 -7.7588 -7.7588 -7.6366 -7.6366 3.1117 3.1117 3.1587 3.1587 3.5689 3.5689 3.9749 3.9749 4.7625 4.7625 5.0335 5.0335 5.6172 5.6172 5.6840 5.6840 5.8127 5.8127 6.0774 6.0774 6.2652 6.2652 6.5859 6.5859 6.8573 6.8573 7.2145 7.2145 7.7491 7.7491 8.0079 8.0079 8.2927 8.2927 8.5971 8.5971 8.8783 8.8783 9.0200 9.0200 10.8318 10.8318 10.9804 10.9804 14.5276 14.5276 14.6975 14.6975 16.3925 16.3925 16.6085 16.6085 19.6769 19.6769 k = 0.4099 0.4447-0.0000 ( 3308 PWs) bands (ev): -8.1860 -8.1860 -8.0801 -8.0801 -7.7615 -7.7615 -7.6396 -7.6396 3.1386 3.1386 3.1861 3.1861 3.5826 3.5826 3.9964 3.9964 4.7032 4.7032 4.9665 4.9665 5.6284 5.6284 5.7094 5.7094 5.8413 5.8413 6.0754 6.0754 6.2765 6.2765 6.5773 6.5773 6.8678 6.8678 7.1619 7.1619 7.7379 7.7379 8.0134 8.0134 8.2717 8.2717 8.5478 8.5478 8.8215 8.8215 8.9775 8.9775 10.8264 10.8264 10.9690 10.9690 14.6682 14.6682 14.8366 14.8366 16.4133 16.4133 16.6081 16.6081 19.7807 19.7807 k = 0.4054 0.4525-0.0000 ( 3314 PWs) bands (ev): -8.1721 -8.1721 -8.0659 -8.0659 -7.7646 -7.7646 -7.6430 -7.6430 3.1666 3.1666 3.2146 3.2146 3.5964 3.5964 4.0184 4.0184 4.6430 4.6430 4.8993 4.8993 5.6321 5.6321 5.7324 5.7324 5.8721 5.8721 6.0765 6.0765 6.2906 6.2906 6.5703 6.5703 6.8814 6.8814 7.1103 7.1103 7.7253 7.7253 8.0174 8.0174 8.2501 8.2501 8.4977 8.4977 8.7684 8.7684 8.9380 8.9380 10.8209 10.8209 10.9572 10.9572 14.8109 14.8109 14.9778 14.9778 16.4352 16.4352 16.6085 16.6085 19.8842 19.8842 k = 0.4009 0.4603-0.0000 ( 3318 PWs) bands (ev): -8.1577 -8.1577 -8.0513 -8.0513 -7.7682 -7.7682 -7.6470 -7.6470 3.1953 3.1953 3.2441 3.2441 3.6102 3.6102 4.0407 4.0407 4.5822 4.5822 4.8325 4.8325 5.6278 5.6278 5.7528 5.7528 5.9035 5.9035 6.0814 6.0814 6.3076 6.3076 6.5656 6.5656 6.8974 6.8974 7.0602 7.0602 7.7116 7.7116 8.0192 8.0192 8.2280 8.2280 8.4474 8.4474 8.7196 8.7196 8.9013 8.9013 10.8153 10.8153 10.9449 10.9449 14.9556 14.9556 15.1210 15.1210 16.4583 16.4583 16.6099 16.6099 19.9328 19.9853 k = 0.3964 0.4681-0.0000 ( 3318 PWs) bands (ev): -8.1429 -8.1429 -8.0362 -8.0362 -7.7724 -7.7724 -7.6516 -7.6516 3.2249 3.2249 3.2745 3.2745 3.6239 3.6239 4.0632 4.0632 4.5210 4.5210 4.7667 4.7667 5.6159 5.6159 5.7709 5.7709 5.9339 5.9339 6.0902 6.0902 6.3276 6.3276 6.5636 6.5636 6.9150 6.9150 7.0127 7.0127 7.6968 7.6968 8.0184 8.0184 8.2056 8.2056 8.3982 8.3982 8.6754 8.6754 8.8673 8.8673 10.8096 10.8096 10.9324 10.9324 15.1020 15.1020 15.2659 15.2659 16.4826 16.4826 16.6124 16.6124 19.8911 19.8911 k = 0.3919 0.4759-0.0000 ( 3318 PWs) bands (ev): -8.1278 -8.1278 -8.0206 -8.0206 -7.7771 -7.7771 -7.6567 -7.6567 3.2550 3.2550 3.3057 3.3057 3.6375 3.6375 4.0856 4.0856 4.4597 4.4597 4.7022 4.7022 5.5972 5.5972 5.7873 5.7873 5.9619 5.9619 6.1020 6.1020 6.3505 6.3505 6.5642 6.5642 6.9307 6.9307 6.9714 6.9714 7.6814 7.6814 8.0140 8.0140 8.1830 8.1830 8.3514 8.3514 8.6358 8.6358 8.8357 8.8357 10.8040 10.8040 10.9197 10.9197 15.2499 15.2499 15.4121 15.4121 16.5083 16.5083 16.6162 16.6162 19.8099 19.8099 k = 0.3874 0.4837-0.0000 ( 3318 PWs) bands (ev): -8.1122 -8.1122 -8.0047 -8.0047 -7.7825 -7.7825 -7.6625 -7.6625 3.2857 3.2857 3.3377 3.3377 3.6508 3.6508 4.1077 4.1077 4.3986 4.3986 4.6397 4.6397 5.5728 5.5728 5.8025 5.8025 5.9866 5.9866 6.1158 6.1158 6.3758 6.3758 6.5675 6.5675 6.9150 6.9150 6.9664 6.9664 7.6656 7.6656 8.0054 8.0054 8.1600 8.1600 8.3087 8.3087 8.6008 8.6008 8.8065 8.8065 10.7984 10.7984 10.9068 10.9068 15.3992 15.3992 15.5594 15.5594 16.5356 16.5356 16.6216 16.6216 19.6921 19.6921 k = 0.3829 0.4915-0.0000 ( 3314 PWs) bands (ev): -8.0964 -8.0964 -7.9885 -7.9885 -7.7885 -7.7885 -7.6690 -7.6690 3.3166 3.3166 3.3704 3.3704 3.6638 3.6638 4.1293 4.1293 4.3380 4.3380 4.5796 4.5796 5.5442 5.5442 5.8168 5.8168 6.0075 6.0075 6.1300 6.1300 6.4029 6.4029 6.5731 6.5731 6.8785 6.8785 6.9874 6.9874 7.6498 7.6498 7.9919 7.9919 8.1359 8.1359 8.2727 8.2727 8.5701 8.5701 8.7796 8.7796 10.7930 10.7930 10.8939 10.8939 15.5494 15.5494 15.7074 15.7074 16.5646 16.5646 16.6288 16.6288 19.5461 19.5461 k = 0.3784 0.4993-0.0000 ( 3310 PWs) bands (ev): -8.0802 -8.0802 -7.9719 -7.9719 -7.7953 -7.7953 -7.6763 -7.6763 3.3476 3.3476 3.4036 3.4036 3.6763 3.6763 4.1500 4.1500 4.2781 4.2781 4.5223 4.5223 5.5128 5.5128 5.8305 5.8305 6.0248 6.0248 6.1430 6.1430 6.4310 6.4310 6.5805 6.5805 6.8439 6.8439 7.0120 7.0120 7.6345 7.6345 7.9741 7.9741 8.1089 8.1089 8.2456 8.2456 8.5433 8.5433 8.7551 8.7551 10.7880 10.7880 10.8810 10.8810 15.7005 15.7005 15.8556 15.8556 16.5955 16.5955 16.6384 16.6384 19.3804 19.3805 k = 0.3739 0.5071-0.0000 ( 3312 PWs) bands (ev): -8.0639 -8.0639 -7.9551 -7.9551 -7.8029 -7.8029 -7.6843 -7.6843 3.3782 3.3782 3.4373 3.4373 3.6883 3.6883 4.1695 4.1695 4.2191 4.2191 4.4685 4.4685 5.4800 5.4800 5.8436 5.8436 6.0389 6.0389 6.1535 6.1535 6.4591 6.4591 6.5891 6.5891 6.8135 6.8135 7.0380 7.0380 7.6200 7.6200 7.9532 7.9532 8.0784 8.0784 8.2282 8.2282 8.5198 8.5198 8.7329 8.7329 10.7833 10.7833 10.8683 10.8683 15.8520 15.8520 16.0033 16.0033 16.6275 16.6275 16.6519 16.6519 19.2019 19.2019 k = 0.3694 0.5149-0.0000 ( 3316 PWs) bands (ev): -8.0473 -8.0473 -7.9381 -7.9381 -7.8112 -7.8112 -7.6931 -7.6931 3.4081 3.4081 3.4714 3.4714 3.6998 3.6998 4.1611 4.1611 4.1875 4.1875 4.4188 4.4188 5.4471 5.4471 5.8563 5.8563 6.0501 6.0501 6.1608 6.1608 6.4864 6.4864 6.5983 6.5983 6.7879 6.7879 7.0646 7.0646 7.6066 7.6066 7.9309 7.9309 8.0453 8.0453 8.2192 8.2192 8.4991 8.4991 8.7131 8.7131 10.7791 10.7791 10.8558 10.8558 16.0034 16.0034 16.1492 16.1492 16.6548 16.6548 16.6762 16.6762 19.0148 19.0148 k = 0.3649 0.5227-0.0000 ( 3304 PWs) bands (ev): -8.0305 -8.0305 -7.9209 -7.9209 -7.8204 -7.8204 -7.7028 -7.7028 3.4367 3.4367 3.5060 3.5060 3.7106 3.7106 4.1047 4.1047 4.2031 4.2031 4.3739 4.3739 5.4152 5.4152 5.8684 5.8684 6.0590 6.0590 6.1644 6.1644 6.5120 6.5120 6.6075 6.6075 6.7671 6.7671 7.0912 7.0912 7.5947 7.5947 7.9091 7.9091 8.0118 8.0118 8.2161 8.2161 8.4806 8.4806 8.6957 8.6957 10.7756 10.7756 10.8438 10.8438 16.1540 16.1540 16.2912 16.2912 16.6755 16.6755 16.7156 16.7156 18.8227 18.8227 k = 0.3604 0.5305-0.0000 ( 3304 PWs) bands (ev): -8.0136 -8.0136 -7.9035 -7.9035 -7.8305 -7.8305 -7.7135 -7.7135 3.4633 3.4633 3.5409 3.5409 3.7208 3.7208 4.0497 4.0497 4.2159 4.2159 4.3349 4.3349 5.3852 5.3852 5.8798 5.8798 6.0659 6.0659 6.1647 6.1647 6.5351 6.5351 6.6162 6.6162 6.7510 6.7510 7.1168 7.1168 7.5844 7.5844 7.8892 7.8892 7.9795 7.9795 8.2167 8.2167 8.4642 8.4642 8.6809 8.6809 10.7728 10.7728 10.8322 10.8322 16.3027 16.3027 16.4254 16.4254 16.6981 16.6981 16.7655 16.7655 18.6277 18.6277 k = 0.3559 0.5383-0.0000 ( 3308 PWs) bands (ev): -7.9966 -7.9966 -7.8860 -7.8860 -7.8415 -7.8415 -7.7250 -7.7250 3.4872 3.4872 3.5762 3.5762 3.7303 3.7303 3.9964 3.9964 4.2247 4.2247 4.3030 4.3030 5.3583 5.3583 5.8902 5.8902 6.0709 6.0709 6.1625 6.1625 6.5550 6.5550 6.6242 6.6242 6.7387 6.7387 7.1404 7.1404 7.5758 7.5758 7.8728 7.8728 7.9496 7.9496 8.2196 8.2196 8.4495 8.4495 8.6686 8.6686 10.7710 10.7710 10.8213 10.8213 16.4469 16.4469 16.5441 16.5441 16.7267 16.7267 16.8294 16.8294 18.4320 18.4320 k = 0.3514 0.5461-0.0000 ( 3308 PWs) bands (ev): -7.9796 -7.9796 -7.8684 -7.8684 -7.8535 -7.8535 -7.7376 -7.7376 3.5075 3.5075 3.6118 3.6118 3.7391 3.7391 3.9451 3.9451 4.2278 4.2278 4.2805 4.2805 5.3352 5.3352 5.8994 5.8994 6.0743 6.0743 6.1587 6.1587 6.5713 6.5713 6.6316 6.6316 6.7295 6.7295 7.1611 7.1611 7.5690 7.5690 7.8607 7.8607 7.9230 7.9230 8.2239 8.2239 8.4367 8.4367 8.6587 8.6587 10.7702 10.7702 10.8112 10.8112 16.5802 16.5802 16.6390 16.6390 16.7658 16.7658 16.9135 16.9135 18.2381 18.2381 k = 0.3468 0.5539-0.0000 ( 3310 PWs) bands (ev): -7.9625 -7.9625 -7.8665 -7.8665 -7.8508 -7.8508 -7.7512 -7.7512 3.5236 3.5236 3.6478 3.6478 3.7471 3.7471 3.8958 3.8958 4.2242 4.2242 4.2686 4.2686 5.3166 5.3166 5.9071 5.9071 6.0763 6.0763 6.1546 6.1546 6.5837 6.5837 6.6384 6.6384 6.7225 6.7225 7.1777 7.1777 7.5640 7.5640 7.8533 7.8533 7.9004 7.9004 8.2284 8.2284 8.4259 8.4259 8.6512 8.6512 10.7706 10.7706 10.8020 10.8020 16.6798 16.6798 16.7187 16.7187 16.8230 16.8230 17.0160 17.0160 18.0502 18.0502 k = 0.3423 0.5617-0.0000 ( 3310 PWs) bands (ev): -7.9455 -7.9455 -7.8805 -7.8805 -7.8332 -7.8332 -7.7658 -7.7658 3.5350 3.5350 3.6841 3.6841 3.7542 3.7542 3.8489 3.8489 4.2183 4.2183 4.2634 4.2634 5.3030 5.3030 5.9128 5.9128 6.0770 6.0770 6.1511 6.1511 6.5923 6.5923 6.6440 6.6440 6.7173 6.7173 7.1896 7.1896 7.5608 7.5608 7.8507 7.8507 7.8822 7.8822 8.2325 8.2325 8.4176 8.4176 8.6460 8.6460 10.7724 10.7724 10.7938 10.7938 16.7336 16.7336 16.7863 16.7863 16.9036 16.9036 17.1220 17.1220 17.8772 17.8772 k = 0.3378 0.5695-0.0000 ( 3314 PWs) bands (ev): -7.9286 -7.9286 -7.8956 -7.8956 -7.8157 -7.8157 -7.7815 -7.7815 3.5415 3.5415 3.7201 3.7201 3.7599 3.7599 3.8051 3.8051 4.2149 4.2149 4.2601 4.2601 5.2947 5.2947 5.9162 5.9162 6.0770 6.0770 6.1490 6.1490 6.5974 6.5974 6.6477 6.6477 6.7139 6.7139 7.1965 7.1965 7.5591 7.5591 7.8521 7.8521 7.8690 7.8690 8.2355 8.2355 8.4123 8.4123 8.6430 8.6430 10.7755 10.7755 10.7866 10.7866 16.7720 16.7720 16.8231 16.8231 16.9800 16.9800 17.2060 17.2060 17.7414 17.7414 k = 0.3333 0.5774-0.0000 ( 3318 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7991 -7.7991 -7.7975 -7.7975 3.5436 3.5436 3.7532 3.7532 3.7536 3.7536 3.7777 3.7777 4.2145 4.2145 4.2584 4.2584 5.2920 5.2920 5.9174 5.9174 6.0768 6.0768 6.1483 6.1483 6.5992 6.5992 6.6489 6.6489 6.7128 6.7128 7.1987 7.1987 7.5586 7.5586 7.8545 7.8545 7.8629 7.8629 8.2365 8.2365 8.4105 8.4105 8.6421 8.6421 10.7791 10.7791 10.7817 10.7817 16.7946 16.7946 16.8307 16.8307 17.0120 17.0120 17.2351 17.2351 17.6877 17.6877 k = 0.3333 0.5774-0.0000 ( 3318 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7991 -7.7991 -7.7975 -7.7975 3.5436 3.5436 3.7532 3.7532 3.7536 3.7536 3.7777 3.7777 4.2145 4.2145 4.2584 4.2584 5.2920 5.2920 5.9174 5.9174 6.0768 6.0768 6.1483 6.1483 6.5992 6.5992 6.6489 6.6489 6.7128 6.7128 7.1987 7.1987 7.5586 7.5586 7.8545 7.8545 7.8629 7.8629 8.2365 8.2365 8.4105 8.4105 8.6421 8.6421 10.7791 10.7791 10.7817 10.7817 16.7946 16.7946 16.8307 16.8307 17.0120 17.0120 17.2351 17.2351 17.6877 17.6877 k = 0.3288 0.5694-0.0000 ( 3314 PWs) bands (ev): -7.9294 -7.9294 -7.8949 -7.8949 -7.8165 -7.8165 -7.7808 -7.7808 3.5418 3.5418 3.7172 3.7172 3.7679 3.7679 3.8000 3.8000 4.2129 4.2129 4.2621 4.2621 5.2947 5.2947 5.9163 5.9163 6.0771 6.0771 6.1489 6.1489 6.5973 6.5973 6.6479 6.6479 6.7138 6.7138 7.1968 7.1968 7.5589 7.5589 7.8525 7.8525 7.8682 7.8682 8.2354 8.2354 8.4124 8.4124 8.6430 8.6430 10.7752 10.7752 10.7870 10.7870 16.7480 16.7480 16.8294 16.8294 16.9838 16.9838 17.2300 17.2300 17.7339 17.7339 k = 0.3242 0.5615-0.0000 ( 3314 PWs) bands (ev): -7.9480 -7.9480 -7.8783 -7.8783 -7.8358 -7.8358 -7.7635 -7.7635 3.5369 3.5369 3.6797 3.6797 3.7715 3.7715 3.8358 3.8358 4.2053 4.2053 4.2758 4.2758 5.3028 5.3028 5.9134 5.9134 6.0779 6.0779 6.1507 6.1507 6.5914 6.5914 6.6460 6.6460 6.7167 6.7167 7.1918 7.1918 7.5597 7.5597 7.8517 7.8517 7.8775 7.8775 8.2319 8.2319 8.4180 8.4180 8.6458 8.6458 10.7714 10.7714 10.7950 10.7950 16.6295 16.6295 16.7540 16.7540 16.9706 16.9706 17.2496 17.2496 17.8390 17.8390 k = 0.3196 0.5536-0.0000 ( 3306 PWs) bands (ev): -7.9679 -7.9679 -7.8619 -7.8619 -7.8563 -7.8563 -7.7464 -7.7464 3.5300 3.5300 3.6444 3.6444 3.7731 3.7731 3.8726 3.8726 4.1925 4.1925 4.2983 4.2983 5.3157 5.3157 5.9093 5.9093 6.0792 6.0792 6.1534 6.1534 6.5818 6.5818 6.6439 6.6439 6.7207 6.7207 7.1849 7.1849 7.5608 7.5608 7.8532 7.8532 7.8879 7.8879 8.2265 8.2265 8.4268 8.4268 8.6502 8.6502 10.7686 10.7686 10.8048 10.8048 16.4695 16.4695 16.6008 16.6008 17.0059 17.0059 17.2960 17.2960 17.9711 17.9711 k = 0.3151 0.5457-0.0000 ( 3306 PWs) bands (ev): -7.9889 -7.9889 -7.8780 -7.8780 -7.8459 -7.8459 -7.7296 -7.7296 3.5221 3.5221 3.6117 3.6117 3.7736 3.7736 3.9090 3.9090 4.1767 4.1767 4.3272 4.3272 5.3330 5.3330 5.9046 5.9046 6.0806 6.0806 6.1567 6.1567 6.5693 6.5693 6.6417 6.6417 6.7258 6.7258 7.1772 7.1772 7.5621 7.5621 7.8562 7.8562 7.8980 7.8980 8.2197 8.2197 8.4381 8.4381 8.6562 8.6562 10.7667 10.7667 10.8162 10.8162 16.2876 16.2876 16.4223 16.4223 17.0582 17.0582 17.3584 17.3584 18.1166 18.1166 k = 0.3105 0.5378-0.0000 ( 3306 PWs) bands (ev): -8.0111 -8.0111 -7.9010 -7.9010 -7.8301 -7.8301 -7.7131 -7.7131 3.5138 3.5138 3.5818 3.5818 3.7732 3.7732 3.9443 3.9443 4.1596 4.1596 4.3608 4.3608 5.3540 5.3540 5.9000 5.9000 6.0817 6.0817 6.1606 6.1606 6.5549 6.5549 6.6392 6.6392 6.7318 6.7318 7.1693 7.1693 7.5636 7.5636 7.8599 7.8599 7.9073 7.9073 8.2119 8.2119 8.4512 8.4512 8.6635 8.6635 10.7656 10.7656 10.8291 10.8291 16.0949 16.0949 16.2350 16.2350 17.1194 17.1194 17.4315 17.4315 18.2693 18.2693 k = 0.3059 0.5299-0.0000 ( 3302 PWs) bands (ev): -8.0345 -8.0345 -7.9251 -7.9251 -7.8148 -7.8148 -7.6970 -7.6970 3.5057 3.5057 3.5550 3.5550 3.7721 3.7721 3.9776 3.9776 4.1432 4.1432 4.3980 4.3980 5.3782 5.3782 5.8960 5.8960 6.0821 6.0821 6.1649 6.1649 6.5393 6.5393 6.6359 6.6359 6.7392 6.7392 7.1621 7.1621 7.5655 7.5655 7.8633 7.8633 7.9151 7.9151 8.2036 8.2036 8.4655 8.4655 8.6721 8.6721 10.7650 10.7650 10.8433 10.8433 15.8972 15.8972 16.0447 16.0447 17.1876 17.1876 17.5128 17.5128 18.4259 18.4259 k = 0.3014 0.5220-0.0000 ( 3302 PWs) bands (ev): -8.0591 -8.0591 -7.9504 -7.9504 -7.7999 -7.7999 -7.6814 -7.6814 3.4977 3.4977 3.5320 3.5320 3.7705 3.7705 4.0062 4.0062 4.1306 4.1306 4.4379 4.4379 5.4049 5.4049 5.8929 5.8929 6.0817 6.0817 6.1695 6.1695 6.5233 6.5233 6.6318 6.6318 6.7481 6.7481 7.1559 7.1559 7.5678 7.5678 7.8659 7.8659 7.9209 7.9209 8.1952 8.1952 8.4805 8.4805 8.6817 8.6817 10.7646 10.7646 10.8585 10.8585 15.6978 15.6978 15.8538 15.8538 17.2626 17.2626 17.6012 17.6012 18.5845 18.5845 k = 0.2968 0.5141-0.0000 ( 3290 PWs) bands (ev): -8.0849 -8.0849 -7.9769 -7.9769 -7.7855 -7.7855 -7.6661 -7.6661 3.4884 3.4884 3.5148 3.5148 3.7686 3.7686 4.0247 4.0247 4.1278 4.1278 4.4798 4.4798 5.4336 5.4336 5.8911 5.8911 6.0802 6.0802 6.1743 6.1743 6.5074 6.5074 6.6269 6.6269 6.7590 6.7590 7.1510 7.1510 7.5705 7.5705 7.8671 7.8671 7.9245 7.9245 8.1869 8.1869 8.4957 8.4957 8.6924 8.6924 10.7640 10.7640 10.8743 10.8743 15.4986 15.4986 15.6638 15.6638 17.3441 17.3441 17.6964 17.6964 18.7441 18.7441 k = 0.2922 0.5062-0.0000 ( 3290 PWs) bands (ev): -8.1118 -8.1118 -8.0045 -8.0045 -7.7715 -7.7715 -7.6514 -7.6514 3.4755 3.4755 3.5056 3.5056 3.7667 3.7667 4.0278 4.0278 4.1405 4.1405 4.5232 4.5232 5.4635 5.4635 5.8907 5.8907 6.0775 6.0775 6.1794 6.1794 6.4918 6.4918 6.6214 6.6214 6.7718 6.7718 7.1473 7.1473 7.5735 7.5735 7.8668 7.8668 7.9256 7.9256 8.1789 8.1789 8.5109 8.5109 8.7038 8.7038 10.7628 10.7628 10.8903 10.8903 15.3010 15.3010 15.4757 15.4757 17.4323 17.4323 17.7978 17.7978 18.9033 18.9033 k = 0.2877 0.4983-0.0000 ( 3290 PWs) bands (ev): -8.1399 -8.1399 -8.0333 -8.0333 -7.7581 -7.7581 -7.6372 -7.6372 3.4610 3.4610 3.5032 3.5032 3.7649 3.7649 4.0193 4.0193 4.1654 4.1654 4.5677 4.5677 5.4942 5.4942 5.8919 5.8919 6.0735 6.0735 6.1849 6.1849 6.4769 6.4769 6.6158 6.6158 6.7868 6.7868 7.1449 7.1449 7.5766 7.5766 7.8647 7.8647 7.9242 7.9242 8.1714 8.1714 8.5258 8.5258 8.7160 8.7160 10.7606 10.7606 10.9059 10.9059 15.1062 15.1062 15.2902 15.2902 17.5271 17.5271 17.9055 17.9055 19.0615 19.0615 k = 0.2831 0.4904-0.0000 ( 3298 PWs) bands (ev): -8.1691 -8.1691 -8.0633 -8.0633 -7.7454 -7.7454 -7.6235 -7.6235 3.4471 3.4471 3.5050 3.5050 3.7634 3.7634 4.0061 4.0061 4.1959 4.1959 4.6129 4.6129 5.5249 5.5249 5.8950 5.8950 6.0682 6.0682 6.1907 6.1907 6.4628 6.4628 6.6103 6.6103 6.8039 6.8039 7.1436 7.1436 7.5795 7.5795 7.8608 7.8608 7.9205 7.9205 8.1645 8.1645 8.5405 8.5405 8.7287 8.7287 10.7567 10.7567 10.9206 10.9206 14.9150 14.9150 15.1080 15.1080 17.6288 17.6288 18.0193 18.0193 19.2174 19.2174 k = 0.2785 0.4824-0.0000 ( 3296 PWs) bands (ev): -8.1994 -8.1994 -8.0943 -8.0943 -7.7332 -7.7332 -7.6105 -7.6105 3.4349 3.4349 3.5103 3.5103 3.7624 3.7624 3.9920 3.9920 4.2286 4.2286 4.6584 4.6584 5.5551 5.5551 5.8999 5.8999 6.0619 6.0619 6.1970 6.1970 6.4496 6.4496 6.6055 6.6055 6.8230 6.8230 7.1432 7.1432 7.5820 7.5820 7.8552 7.8552 7.9147 7.9147 8.1582 8.1582 8.5548 8.5548 8.7420 8.7420 10.7508 10.7508 10.9336 10.9336 14.7283 14.7283 14.9295 14.9295 17.7372 17.7372 18.1391 18.1391 19.3699 19.3699 k = 0.2740 0.4745-0.0000 ( 3294 PWs) bands (ev): -8.2308 -8.2308 -8.1264 -8.1264 -7.7216 -7.7216 -7.5981 -7.5981 3.4245 3.4245 3.5188 3.5188 3.7621 3.7621 3.9785 3.9785 4.2622 4.2622 4.7038 4.7038 5.5840 5.5840 5.9068 5.9068 6.0546 6.0546 6.2042 6.2042 6.4375 6.4375 6.6018 6.6018 6.8442 6.8442 7.1435 7.1435 7.5837 7.5837 7.8477 7.8477 7.9073 7.9073 8.1528 8.1528 8.5687 8.5687 8.7556 8.7556 10.7421 10.7421 10.9441 10.9441 14.5469 14.5469 14.7553 14.7553 17.8524 17.8524 18.2647 18.2647 19.5173 19.5173 k = 0.2694 0.4666-0.0000 ( 3294 PWs) bands (ev): -8.2632 -8.2632 -8.1596 -8.1596 -7.7108 -7.7108 -7.5863 -7.5863 3.4159 3.4159 3.5305 3.5305 3.7626 3.7626 3.9664 3.9664 4.2961 4.2961 4.7490 4.7490 5.6112 5.6112 5.9158 5.9158 6.0467 6.0467 6.2123 6.2123 6.4264 6.4264 6.5996 6.5996 6.8670 6.8670 7.1441 7.1441 7.5842 7.5842 7.8381 7.8381 7.8992 7.8992 8.1482 8.1482 8.5823 8.5823 8.7697 8.7697 10.7303 10.7303 10.9513 10.9513 14.3718 14.3718 14.5858 14.5858 17.9742 17.9742 18.3960 18.3960 19.6575 19.6575 k = 0.2648 0.4587-0.0000 ( 3294 PWs) bands (ev): -8.2966 -8.2966 -8.1937 -8.1937 -7.7006 -7.7006 -7.5752 -7.5752 3.4091 3.4091 3.5453 3.5453 3.7642 3.7642 3.9563 3.9563 4.3303 4.3303 4.7936 4.7936 5.6360 5.6360 5.9265 5.9265 6.0384 6.0384 6.2218 6.2218 6.4163 6.4163 6.5992 6.5992 6.8913 6.8913 7.1448 7.1448 7.5831 7.5831 7.8259 7.8259 7.8917 7.8917 8.1444 8.1444 8.5957 8.5957 8.7841 8.7841 10.7147 10.7147 10.9542 10.9542 14.2037 14.2037 14.4217 14.4217 18.1026 18.1026 18.5327 18.5327 19.7876 19.7876 k = 0.2603 0.4508-0.0000 ( 3292 PWs) bands (ev): -8.3309 -8.3309 -8.2288 -8.2288 -7.6912 -7.6912 -7.5649 -7.5649 3.4039 3.4039 3.5633 3.5633 3.7670 3.7670 3.9483 3.9483 4.3646 4.3646 4.8373 4.8373 5.6580 5.6580 5.9388 5.9388 6.0303 6.0303 6.2330 6.2330 6.4073 6.4073 6.6009 6.6009 6.9168 6.9168 7.1454 7.1454 7.5802 7.5802 7.8107 7.8107 7.8858 7.8858 8.1415 8.1415 8.6089 8.6089 8.7987 8.7987 10.6948 10.6948 10.9519 10.9519 14.0438 14.0438 14.2633 14.2633 18.2373 18.2373 18.6744 18.6744 19.9038 19.9038 k = 0.2557 0.4429-0.0000 ( 3286 PWs) bands (ev): -8.3662 -8.3662 -8.2648 -8.2648 -7.6825 -7.6825 -7.5553 -7.5553 3.4000 3.4000 3.5843 3.5843 3.7712 3.7712 3.9428 3.9428 4.3990 4.3990 4.8797 4.8797 5.6770 5.6770 5.9518 5.9518 6.0230 6.0230 6.2463 6.2463 6.3994 6.3994 6.6048 6.6048 6.9427 6.9427 7.1457 7.1457 7.5752 7.5752 7.7926 7.7926 7.8825 7.8825 8.1394 8.1394 8.6221 8.6221 8.8137 8.8137 10.6702 10.6702 10.9433 10.9433 13.8928 13.8928 14.1110 14.1110 18.3780 18.3780 18.8204 18.8204 20.0015 20.0015 k = 0.2511 0.4350-0.0000 ( 3282 PWs) bands (ev): -8.4023 -8.4023 -8.3016 -8.3016 -7.6746 -7.6746 -7.5464 -7.5464 3.3974 3.3974 3.6083 3.6083 3.7769 3.7769 3.9400 3.9400 4.4337 4.4337 4.9205 4.9205 5.6930 5.6930 5.9641 5.9641 6.0177 6.0177 6.2620 6.2620 6.3925 6.3925 6.6110 6.6110 6.9684 6.9684 7.1459 7.1459 7.5682 7.5682 7.7719 7.7719 7.8823 7.8823 8.1381 8.1381 8.6351 8.6351 8.8289 8.8289 10.6404 10.6404 10.9275 10.9275 13.7518 13.7518 13.9653 13.9653 18.5242 18.5242 18.9697 18.9697 20.0693 20.0693 k = 0.2466 0.4271-0.0000 ( 3278 PWs) bands (ev): -8.4392 -8.4392 -8.3392 -8.3392 -7.6674 -7.6674 -7.5383 -7.5383 3.3957 3.3957 3.6351 3.6351 3.7842 3.7842 3.9399 3.9399 4.4687 4.4687 4.9595 4.9595 5.7062 5.7062 5.9733 5.9733 6.0165 6.0165 6.2805 6.2805 6.3869 6.3869 6.6194 6.6194 6.9924 6.9924 7.1468 7.1468 7.5589 7.5589 7.7495 7.7495 7.8849 7.8849 8.1376 8.1376 8.6482 8.6482 8.8444 8.8444 10.6051 10.6051 10.9034 10.9034 13.6217 13.6217 13.8266 13.8266 18.6754 18.6754 19.1206 19.1206 20.0507 20.0507 k = 0.2420 0.4192-0.0000 ( 3282 PWs) bands (ev): -8.4768 -8.4768 -8.3776 -8.3776 -7.6611 -7.6611 -7.5310 -7.5310 3.3947 3.3947 3.6646 3.6646 3.7935 3.7935 3.9426 3.9426 4.5042 4.5042 4.9961 4.9961 5.7170 5.7170 5.9770 5.9770 6.0214 6.0214 6.3019 6.3019 6.3825 6.3825 6.6299 6.6299 7.0123 7.0123 7.1502 7.1502 7.5474 7.5474 7.7266 7.7266 7.8904 7.8904 8.1379 8.1379 8.6613 8.6613 8.8601 8.8601 10.5640 10.5640 10.8705 10.8705 13.5033 13.5033 13.6951 13.6951 18.8307 18.8307 19.2697 19.2697 19.9810 19.9810 k = 0.2374 0.4113-0.0000 ( 3282 PWs) bands (ev): -8.5152 -8.5152 -8.4166 -8.4166 -7.6555 -7.6555 -7.5244 -7.5244 3.3942 3.3942 3.6965 3.6965 3.8050 3.8050 3.9483 3.9483 4.5404 4.5404 5.0302 5.0302 5.7257 5.7257 5.9766 5.9766 6.0309 6.0309 6.3263 6.3263 6.3794 6.3794 6.6425 6.6425 7.0247 7.0247 7.1587 7.1587 7.5332 7.5332 7.7047 7.7047 7.8983 7.8983 8.1388 8.1388 8.6745 8.6745 8.8760 8.8760 10.5171 10.5171 10.8279 10.8279 13.3971 13.3971 13.5710 13.5710 18.9888 18.9888 19.4083 19.4083 19.9123 19.9123 k = 0.2329 0.4034-0.0000 ( 3270 PWs) bands (ev): -8.5542 -8.5542 -8.4562 -8.4562 -7.6507 -7.6507 -7.5187 -7.5187 3.3939 3.3939 3.7303 3.7303 3.8191 3.8191 3.9569 3.9569 4.5774 4.5774 5.0614 5.0614 5.7328 5.7328 5.9749 5.9749 6.0420 6.0420 6.3531 6.3531 6.3777 6.3777 6.6568 6.6568 7.0273 7.0273 7.1746 7.1746 7.5157 7.5157 7.6856 7.6856 7.9083 7.9083 8.1403 8.1403 8.6879 8.6879 8.8920 8.8920 10.4642 10.4642 10.7756 10.7756 13.3035 13.3035 13.4545 13.4545 19.1477 19.1477 19.5108 19.5108 19.8731 19.8731 k = 0.2283 0.3954-0.0000 ( 3278 PWs) bands (ev): -8.5937 -8.5937 -8.4964 -8.4964 -7.6468 -7.6468 -7.5137 -7.5137 3.3936 3.3936 3.7649 3.7649 3.8368 3.8368 3.9686 3.9686 4.6154 4.6154 5.0893 5.0893 5.7385 5.7385 5.9736 5.9736 6.0533 6.0533 6.3758 6.3758 6.3837 6.3837 6.6728 6.6728 7.0203 7.0203 7.1971 7.1971 7.4942 7.4942 7.6709 7.6709 7.9203 7.9203 8.1425 8.1425 8.7013 8.7013 8.9083 8.9083 10.4054 10.4054 10.7136 10.7136 13.2226 13.2226 13.3456 13.3456 19.3039 19.3039 19.5279 19.5279 19.9101 19.9101 k = 0.2237 0.3875-0.0000 ( 3278 PWs) bands (ev): -8.6337 -8.6337 -8.5371 -8.5371 -7.6436 -7.6436 -7.5096 -7.5096 3.3931 3.3931 3.7986 3.7986 3.8596 3.8596 3.9834 3.9834 4.6545 4.6545 5.1138 5.1138 5.7433 5.7433 5.9734 5.9734 6.0641 6.0641 6.3776 6.3776 6.4135 6.4135 6.6901 6.6901 7.0064 7.0064 7.2240 7.2240 7.4687 7.4687 7.6618 7.6618 7.9338 7.9338 8.1452 8.1452 8.7148 8.7148 8.9246 8.9246 10.3411 10.3411 10.6423 10.6423 13.1539 13.1539 13.2442 13.2442 19.4510 19.4510 19.4674 19.4674 20.0091 20.0091 k = 0.2192 0.3796-0.0000 ( 3282 PWs) bands (ev): -8.6742 -8.6742 -8.5782 -8.5782 -7.6412 -7.6412 -7.5062 -7.5062 3.3921 3.3921 3.8291 3.8291 3.8898 3.8898 4.0012 4.0012 4.6949 4.6949 5.1347 5.1347 5.7474 5.7474 5.9745 5.9745 6.0745 6.0745 6.3800 6.3800 6.4447 6.4447 6.7085 6.7085 6.9881 6.9881 7.2522 7.2522 7.4403 7.4403 7.6582 7.6582 7.9487 7.9487 8.1485 8.1485 8.7283 8.7283 8.9411 8.9411 10.2716 10.2716 10.5625 10.5625 13.0968 13.0968 13.1502 13.1502 19.3743 19.3743 19.5771 19.5771 20.0740 20.0740 k = 0.2146 0.3717-0.0000 ( 3274 PWs) bands (ev): -8.7151 -8.7151 -8.6197 -8.6197 -7.6396 -7.6396 -7.5036 -7.5036 3.3905 3.3905 3.8559 3.8559 3.9274 3.9274 4.0220 4.0220 4.7366 4.7366 5.1521 5.1521 5.7507 5.7507 5.9770 5.9770 6.0844 6.0844 6.3837 6.3837 6.4756 6.4756 6.7276 6.7276 6.9677 6.9677 7.2783 7.2783 7.4124 7.4124 7.6599 7.6599 7.9647 7.9647 8.1523 8.1523 8.7420 8.7420 8.9575 8.9575 10.1973 10.1973 10.4754 10.4754 13.0504 13.0504 13.0632 13.0632 19.2679 19.2679 19.6611 19.6611 20.0044 20.0044 k = 0.2100 0.3638-0.0000 ( 3274 PWs) bands (ev): -8.7562 -8.7562 -8.6614 -8.6614 -7.6388 -7.6388 -7.5018 -7.5018 3.3880 3.3880 3.8810 3.8810 3.9704 3.9704 4.0460 4.0460 4.7798 4.7798 5.1662 5.1662 5.7532 5.7532 5.9809 5.9809 6.0941 6.0941 6.3887 6.3887 6.5050 6.5050 6.7470 6.7470 6.9476 6.9476 7.2934 7.2934 7.3939 7.3939 7.6659 7.6659 7.9817 7.9817 8.1566 8.1566 8.7556 8.7556 8.9739 8.9739 10.1190 10.1190 10.3820 10.3820 12.9827 12.9827 13.0137 13.0137 19.1542 19.1542 19.6771 19.6771 19.9465 19.9465 k = 0.2055 0.3559-0.0000 ( 3274 PWs) bands (ev): -8.7976 -8.7976 -8.7034 -8.7034 -7.6388 -7.6388 -7.5007 -7.5007 3.3845 3.3845 3.9058 3.9058 4.0168 4.0168 4.0730 4.0730 4.8244 4.8244 5.1773 5.1773 5.7547 5.7547 5.9859 5.9859 6.1037 6.1037 6.3948 6.3948 6.5310 6.5310 6.7666 6.7666 6.9301 6.9301 7.2840 7.2840 7.3990 7.3990 7.6756 7.6756 7.9993 7.9993 8.1616 8.1616 8.7691 8.7691 8.9901 8.9901 10.0371 10.0371 10.2839 10.2839 12.9086 12.9086 12.9855 12.9855 19.0358 19.0358 19.6245 19.6245 19.9161 19.9161 k = 0.2009 0.3480-0.0000 ( 3274 PWs) bands (ev): -8.8392 -8.8392 -8.7455 -8.7455 -7.6394 -7.6394 -7.5004 -7.5004 3.3798 3.3798 3.9313 3.9313 4.0653 4.0653 4.1030 4.1030 4.8703 4.8703 5.1859 5.1859 5.7549 5.7549 5.9917 5.9917 6.1134 6.1134 6.4017 6.4017 6.5520 6.5520 6.7863 6.7863 6.9178 6.9178 7.2555 7.2555 7.4229 7.4229 7.6884 7.6884 8.0174 8.0174 8.1672 8.1672 8.7825 8.7825 9.0060 9.0060 9.9525 9.9525 10.1823 10.1823 12.8402 12.8402 12.9647 12.9647 18.9141 18.9141 19.5356 19.5356 19.8931 19.8931 k = 0.1963 0.3401-0.0000 ( 3274 PWs) bands (ev): -8.8809 -8.8809 -8.7877 -8.7877 -7.6408 -7.6408 -7.5008 -7.5008 3.3739 3.3739 3.9578 3.9578 4.1150 4.1150 4.1360 4.1360 4.9175 4.9175 5.1928 5.1928 5.7534 5.7534 5.9979 5.9979 6.1235 6.1235 6.4091 6.4091 6.5662 6.5662 6.8068 6.8068 6.9123 6.9123 7.2206 7.2206 7.4538 7.4538 7.7037 7.7037 8.0356 8.0356 8.1736 8.1736 8.7956 8.7956 9.0214 9.0214 9.8660 9.8660 10.0787 10.0787 12.7769 12.7769 12.9502 12.9502 18.7897 18.7897 19.4326 19.4326 19.8653 19.8653 k = 0.1918 0.3322-0.0000 ( 3270 PWs) bands (ev): -8.9226 -8.9226 -8.8300 -8.8300 -7.6429 -7.6429 -7.5019 -7.5019 3.3666 3.3666 3.9855 3.9855 4.1651 4.1651 4.1721 4.1721 4.9655 4.9655 5.1986 5.1986 5.7500 5.7500 6.0038 6.0038 6.1341 6.1341 6.4163 6.4163 6.5732 6.5732 6.8293 6.8293 6.9133 6.9133 7.1849 7.1849 7.4871 7.4871 7.7211 7.7211 8.0537 8.0537 8.1812 8.1812 8.8084 8.8084 9.0361 9.0361 9.7783 9.7783 9.9744 9.9744 12.7185 12.7185 12.9411 12.9411 18.6633 18.6633 19.3240 19.3240 19.8309 19.8309 k = 0.1872 0.3243-0.0000 ( 3274 PWs) bands (ev): -8.9643 -8.9643 -8.8721 -8.8721 -7.6457 -7.6457 -7.5037 -7.5037 3.3580 3.3580 4.0143 4.0143 4.2107 4.2107 4.2153 4.2153 5.0142 5.0142 5.2042 5.2042 5.7444 5.7444 6.0086 6.0086 6.1454 6.1454 6.4225 6.4225 6.5748 6.5748 6.8547 6.8547 6.9185 6.9185 7.1515 7.1515 7.5212 7.5212 7.7404 7.7404 8.0711 8.0711 8.1901 8.1901 8.8206 8.8206 9.0496 9.0496 9.6904 9.6904 9.8709 9.8709 12.6642 12.6642 12.9364 12.9364 18.5352 18.5352 19.2128 19.2128 19.7905 19.7905 k = 0.1826 0.3164-0.0000 ( 3286 PWs) bands (ev): -9.0058 -9.0058 -8.9142 -8.9142 -7.6491 -7.6491 -7.5061 -7.5061 3.3479 3.3479 4.0441 4.0441 4.2526 4.2526 4.2640 4.2640 5.0628 5.0628 5.2107 5.2107 5.7363 5.7363 6.0118 6.0118 6.1577 6.1577 6.4266 6.4266 6.5747 6.5747 6.8834 6.8834 6.9236 6.9236 7.1235 7.1235 7.5556 7.5556 7.7611 7.7611 8.0874 8.0874 8.2008 8.2008 8.8319 8.8319 9.0615 9.0615 9.6031 9.6031 9.7695 9.7695 12.6137 12.6137 12.9355 12.9355 18.4059 18.4059 19.1004 19.1004 19.7447 19.7447 k = 0.1781 0.3084-0.0000 ( 3282 PWs) bands (ev): -9.0473 -9.0473 -8.9561 -8.9561 -7.6531 -7.6531 -7.5091 -7.5091 3.3364 3.3364 4.0749 4.0749 4.2973 4.2973 4.3108 4.3108 5.1105 5.1105 5.2191 5.2191 5.7255 5.7255 6.0129 6.0129 6.1711 6.1711 6.4279 6.4279 6.5767 6.5767 6.9147 6.9147 6.9242 6.9242 7.1048 7.1048 7.5898 7.5898 7.7830 7.7830 8.1021 8.1021 8.2136 8.2136 8.8420 8.8420 9.0708 9.0708 9.5175 9.5175 9.6721 9.6721 12.5666 12.5666 12.9376 12.9376 18.2755 18.2755 18.9877 18.9877 19.6944 19.6944 k = 0.1735 0.3005-0.0000 ( 3284 PWs) bands (ev): -9.0885 -9.0885 -8.9977 -8.9977 -7.6577 -7.6577 -7.5127 -7.5127 3.3235 3.3235 4.1065 4.1065 4.3447 4.3447 4.3547 4.3547 5.1560 5.1560 5.2305 5.2305 5.7121 5.7121 6.0120 6.0120 6.1854 6.1854 6.4268 6.4268 6.5828 6.5828 6.9160 6.9160 6.9482 6.9482 7.0983 7.0983 7.6238 7.6238 7.8058 7.8058 8.1149 8.1149 8.2287 8.2287 8.8502 8.8502 9.0759 9.0759 9.4348 9.4348 9.5808 9.5808 12.5223 12.5223 12.9422 12.9422 18.1444 18.1444 18.8750 18.8750 19.6400 19.6400 k = 0.1689 0.2926-0.0000 ( 3284 PWs) bands (ev): -9.1294 -9.1294 -9.0391 -9.0391 -7.6628 -7.6628 -7.5169 -7.5169 3.3092 3.3092 4.1387 4.1387 4.3946 4.3946 4.3949 4.3949 5.1976 5.1976 5.2463 5.2463 5.6961 5.6961 6.0100 6.0100 6.2008 6.2008 6.4245 6.4245 6.5937 6.5937 6.9002 6.9002 6.9825 6.9825 7.1036 7.1036 7.6572 7.6572 7.8292 7.8292 8.1258 8.1258 8.2461 8.2461 8.8556 8.8556 9.0742 9.0742 9.3567 9.3567 9.4986 9.4986 12.4806 12.4806 12.9488 12.9488 18.0126 18.0126 18.7626 18.7626 19.5819 19.5819 k = 0.1644 0.2847-0.0000 ( 3276 PWs) bands (ev): -9.1699 -9.1699 -9.0800 -9.0800 -7.6685 -7.6685 -7.5215 -7.5215 3.2936 3.2936 4.1713 4.1713 4.4302 4.4302 4.4473 4.4473 5.2324 5.2324 5.2680 5.2680 5.6778 5.6778 6.0086 6.0086 6.2169 6.2169 6.4228 6.4228 6.6086 6.6086 6.8796 6.8796 7.0173 7.0173 7.1174 7.1174 7.6900 7.6900 7.8531 7.8531 8.1349 8.1349 8.2653 8.2653 8.8567 8.8567 9.0620 9.0620 9.2853 9.2853 9.4300 9.4300 12.4412 12.4412 12.9570 12.9570 17.8805 17.8805 18.6508 18.6508 19.5205 19.5205 k = 0.1598 0.2768-0.0000 ( 3280 PWs) bands (ev): -9.2101 -9.2101 -9.1206 -9.1206 -7.6746 -7.6746 -7.5267 -7.5267 3.2768 3.2768 4.2039 4.2039 4.4602 4.4602 4.5025 4.5025 5.2589 5.2589 5.2950 5.2950 5.6578 5.6578 6.0100 6.0100 6.2337 6.2337 6.4228 6.4228 6.6266 6.6266 6.8576 6.8576 7.0522 7.0522 7.1364 7.1364 7.7220 7.7220 7.8772 7.8772 8.1427 8.1427 8.2857 8.2857 8.8511 8.8511 9.0351 9.0351 9.2231 9.2231 9.3795 9.3795 12.4036 12.4036 12.9665 12.9665 17.7481 17.7481 18.5396 18.5396 19.4561 19.4561 k = 0.1553 0.2689-0.0000 ( 3276 PWs) bands (ev): -9.2498 -9.2498 -9.1606 -9.1606 -7.6811 -7.6811 -7.5323 -7.5323 3.2588 3.2588 4.2364 4.2364 4.4844 4.4844 4.5600 4.5600 5.2777 5.2777 5.3236 5.3236 5.6377 5.6377 6.0171 6.0171 6.2508 6.2508 6.4253 6.4253 6.6467 6.6467 6.8367 6.8367 7.0870 7.0870 7.1586 7.1586 7.7530 7.7530 7.9012 7.9012 8.1494 8.1494 8.3067 8.3067 8.8359 8.8359 8.9932 8.9932 9.1730 9.1730 9.3490 9.3490 12.3678 12.3678 12.9770 12.9770 17.6156 17.6156 18.4293 18.4293 19.3890 19.3890 k = 0.1507 0.2610-0.0000 ( 3274 PWs) bands (ev): -9.2889 -9.2889 -9.2001 -9.2001 -7.6881 -7.6881 -7.5383 -7.5383 3.2396 3.2396 4.2683 4.2683 4.5028 4.5028 4.6198 4.6198 5.2873 5.2873 5.3511 5.3511 5.6201 5.6201 6.0322 6.0322 6.2681 6.2681 6.4304 6.4304 6.6684 6.6684 6.8181 6.8181 7.1212 7.1212 7.1827 7.1827 7.7829 7.7829 7.9248 7.9248 8.1557 8.1557 8.3273 8.3273 8.8090 8.8090 8.9406 8.9406 9.1371 9.1371 9.3351 9.3351 12.3334 12.3334 12.9883 12.9883 17.4833 17.4833 18.3200 18.3200 19.3195 19.3195 k = 0.1461 0.2531-0.0000 ( 3278 PWs) bands (ev): -9.3275 -9.3275 -9.2390 -9.2390 -7.6954 -7.6954 -7.5446 -7.5446 3.2195 3.2195 4.2992 4.2992 4.5156 4.5156 4.6816 4.6816 5.2852 5.2852 5.3738 5.3738 5.6106 5.6106 6.0567 6.0567 6.2855 6.2855 6.4381 6.4381 6.6908 6.6908 6.8030 6.8030 7.1549 7.1549 7.2080 7.2080 7.8114 7.8114 7.9479 7.9479 8.1617 8.1617 8.3464 8.3464 8.7705 8.7705 8.8839 8.8839 9.1155 9.1155 9.3325 9.3325 12.3002 12.3002 13.0001 13.0001 17.3511 17.3511 18.2117 18.2117 19.2479 19.2479 k = 0.1416 0.2452-0.0000 ( 3282 PWs) bands (ev): -9.3655 -9.3655 -9.2773 -9.2773 -7.7030 -7.7030 -7.5513 -7.5513 3.1984 3.1984 4.3287 4.3287 4.5235 4.5235 4.7454 4.7454 5.2715 5.2715 5.3843 5.3843 5.6168 5.6168 6.0906 6.0906 6.3028 6.3028 6.4484 6.4484 6.7132 6.7132 6.7921 6.7921 7.1878 7.1878 7.2340 7.2340 7.8382 7.8382 7.9700 7.9700 8.1678 8.1678 8.3626 8.3626 8.7238 8.7238 8.8285 8.8285 9.1056 9.1056 9.3368 9.3368 12.2682 12.2682 13.0123 13.0123 17.2193 17.2193 18.1046 18.1046 19.1744 19.1744 k = 0.1370 0.2373-0.0000 ( 3272 PWs) bands (ev): -9.4027 -9.4027 -9.3148 -9.3148 -7.7108 -7.7108 -7.5582 -7.5582 3.1765 3.1765 4.3560 4.3560 4.5274 4.5274 4.8108 4.8108 5.2476 5.2476 5.3778 5.3778 5.6434 5.6434 6.1327 6.1327 6.3199 6.3199 6.4612 6.4612 6.7341 6.7341 6.7871 6.7871 7.2199 7.2199 7.2607 7.2607 7.8629 7.8629 7.9911 7.9911 8.1743 8.1743 8.3736 8.3736 8.6731 8.6731 8.7791 8.7791 9.1040 9.1040 9.3452 9.3452 12.2371 12.2371 13.0248 13.0248 17.0881 17.0881 17.9989 17.9989 19.0994 19.0994 k = 0.1324 0.2294-0.0000 ( 3272 PWs) bands (ev): -9.4392 -9.4392 -9.3516 -9.3516 -7.7189 -7.7189 -7.5654 -7.5654 3.1539 3.1539 4.3803 4.3803 4.5282 4.5282 4.8773 4.8773 5.2158 5.2158 5.3571 5.3571 5.6874 5.6874 6.1810 6.1810 6.3369 6.3369 6.4767 6.4767 6.7499 6.7499 6.7913 6.7913 7.2511 7.2511 7.2877 7.2877 7.8850 7.8850 8.0109 8.0109 8.1813 8.1813 8.3766 8.3766 8.6217 8.6217 8.7399 8.7399 9.1078 9.1078 9.3561 9.3561 12.2067 12.2067 13.0373 13.0373 16.9575 16.9575 17.8946 17.8946 19.0231 19.0231 k = 0.1279 0.2214-0.0000 ( 3276 PWs) bands (ev): -9.4750 -9.4750 -9.3876 -9.3876 -7.7272 -7.7272 -7.5728 -7.5728 3.1307 3.1307 4.4009 4.4009 4.5269 4.5269 4.9436 4.9436 5.1795 5.1795 5.3282 5.3282 5.7427 5.7427 6.2330 6.2330 6.3537 6.3537 6.4954 6.4954 6.7587 6.7587 6.8065 6.8065 7.2815 7.2815 7.3150 7.3150 7.9040 7.9040 8.0292 8.0292 8.1887 8.1887 8.3689 8.3689 8.5725 8.5725 8.7143 8.7143 9.1151 9.1151 9.3685 9.3685 12.1771 12.1771 13.0498 13.0498 16.8277 16.8277 17.7919 17.7919 18.9457 18.9457 k = 0.1233 0.2135-0.0000 ( 3268 PWs) bands (ev): -9.5098 -9.5098 -9.4227 -9.4227 -7.7356 -7.7356 -7.5803 -7.5803 3.1069 3.1069 4.4163 4.4163 4.5248 4.5248 5.0044 5.0044 5.1452 5.1452 5.2956 5.2956 5.8048 5.8048 6.2856 6.2856 6.3708 6.3708 6.5180 6.5180 6.7650 6.7650 6.8280 6.8280 7.3110 7.3110 7.3426 7.3426 7.9193 7.9193 8.0461 8.0461 8.1961 8.1961 8.3496 8.3496 8.5277 8.5277 8.7034 8.7034 9.1246 9.1246 9.3820 9.3820 12.1480 12.1480 13.0622 13.0622 16.6988 16.6988 17.6908 17.6908 18.8676 18.8676 k = 0.1187 0.2056-0.0000 ( 3262 PWs) bands (ev): -9.5438 -9.5438 -9.4569 -9.4569 -7.7441 -7.7441 -7.5880 -7.5880 3.0827 3.0827 4.4258 4.4258 4.5226 4.5226 5.0336 5.0336 5.1404 5.1404 5.2626 5.2626 5.8707 5.8707 6.3341 6.3341 6.3899 6.3899 6.5460 6.5460 6.7727 6.7727 6.8517 6.8517 7.3397 7.3397 7.3705 7.3705 7.9306 7.9306 8.0613 8.0613 8.2026 8.2026 8.3208 8.3208 8.4893 8.4893 8.7056 8.7056 9.1357 9.1357 9.3960 9.3960 12.1195 12.1195 13.0744 13.0744 16.5711 16.5711 17.5916 17.5916 18.7890 18.7890 k = 0.1142 0.1977-0.0000 ( 3254 PWs) bands (ev): -9.5769 -9.5769 -9.4902 -9.4902 -7.7527 -7.7527 -7.5957 -7.5957 3.0582 3.0582 4.4286 4.4286 4.5204 4.5204 5.0074 5.0074 5.1874 5.1874 5.2336 5.2336 5.9383 5.9383 6.3710 6.3710 6.4160 6.4160 6.5810 6.5810 6.7831 6.7831 6.8762 6.8762 7.3675 7.3675 7.3989 7.3989 7.9377 7.9377 8.0741 8.0741 8.2073 8.2073 8.2860 8.2860 8.4592 8.4592 8.7174 8.7174 9.1479 9.1479 9.4105 9.4105 12.0914 12.0914 13.0863 13.0863 16.4446 16.4446 17.4942 17.4942 18.7102 18.7102 k = 0.1096 0.1898-0.0000 ( 3258 PWs) bands (ev): -9.6090 -9.6090 -9.5225 -9.5225 -7.7613 -7.7613 -7.6035 -7.6035 3.0335 3.0335 4.4257 4.4257 4.5172 4.5172 4.9623 4.9623 5.1956 5.1956 5.2650 5.2650 6.0061 6.0061 6.3931 6.3931 6.4500 6.4500 6.6240 6.6240 6.7965 6.7965 6.9012 6.9012 7.3944 7.3944 7.4281 7.4281 7.9407 7.9407 8.0835 8.0835 8.2093 8.2093 8.2487 8.2487 8.4394 8.4394 8.7355 8.7355 9.1609 9.1609 9.4252 9.4252 12.0638 12.0638 13.0979 13.0979 16.3196 16.3196 17.3990 17.3990 18.6314 18.6314 k = 0.1050 0.1819-0.0000 ( 3254 PWs) bands (ev): -9.6401 -9.6401 -9.5538 -9.5538 -7.7699 -7.7699 -7.6113 -7.6113 3.0086 3.0086 4.4181 4.4181 4.5114 4.5114 4.9127 4.9127 5.1719 5.1719 5.3373 5.3373 6.0724 6.0724 6.4080 6.4080 6.4848 6.4848 6.6742 6.6742 6.8130 6.8130 6.9265 6.9265 7.4202 7.4202 7.4584 7.4584 7.9399 7.9399 8.0876 8.0876 8.2054 8.2054 8.2153 8.2153 8.4303 8.4303 8.7577 8.7577 9.1744 9.1744 9.4400 9.4400 12.0364 12.0364 13.1091 13.1091 16.1963 16.1963 17.3059 17.3059 18.5529 18.5529 k = 0.1005 0.1740-0.0000 ( 3252 PWs) bands (ev): -9.6702 -9.6702 -9.5840 -9.5840 -7.7784 -7.7784 -7.6190 -7.6190 2.9837 2.9837 4.4073 4.4073 4.5017 4.5017 4.8620 4.8620 5.1517 5.1517 5.4131 5.4131 6.1356 6.1356 6.4198 6.4198 6.5183 6.5183 6.7291 6.7291 6.8324 6.8324 6.9520 6.9520 7.4450 7.4450 7.4901 7.4901 7.9357 7.9357 8.0846 8.0846 8.1721 8.1721 8.2130 8.2130 8.4307 8.4307 8.7823 8.7823 9.1883 9.1883 9.4549 9.4549 12.0095 12.0095 13.1199 13.1199 16.0748 16.0748 17.2152 17.2152 18.4750 18.4750 k = 0.0959 0.1661-0.0000 ( 3264 PWs) bands (ev): -9.6992 -9.6992 -9.6132 -9.6132 -7.7868 -7.7868 -7.6267 -7.6267 2.9589 2.9589 4.3940 4.3940 4.4875 4.4875 4.8112 4.8112 5.1366 5.1366 5.4906 5.4906 6.1940 6.1940 6.4298 6.4298 6.5519 6.5519 6.7858 6.7858 6.8549 6.8549 6.9780 6.9780 7.4687 7.4687 7.5235 7.5235 7.9286 7.9286 8.0743 8.0743 8.1370 8.1370 8.2172 8.2172 8.4384 8.4384 8.8084 8.8084 9.2025 9.2025 9.4697 9.4697 11.9828 11.9828 13.1301 13.1301 15.9553 15.9553 17.1269 17.1269 18.3979 18.3979 k = 0.0913 0.1582-0.0000 ( 3268 PWs) bands (ev): -9.7270 -9.7270 -9.6412 -9.6412 -7.7951 -7.7951 -7.6343 -7.6343 2.9343 2.9343 4.3787 4.3787 4.4691 4.4691 4.7611 4.7611 5.1265 5.1265 5.5689 5.5689 6.2459 6.2459 6.4384 6.4384 6.5873 6.5873 6.8413 6.8413 6.8808 6.8808 7.0047 7.0047 7.4913 7.4913 7.5588 7.5588 7.9187 7.9187 8.0585 8.0585 8.1040 8.1040 8.2246 8.2246 8.4509 8.4509 8.8353 8.8353 9.2168 9.2168 9.4845 9.4845 11.9564 11.9564 13.1399 13.1399 15.8382 15.8382 17.0413 17.0413 18.3219 18.3219 k = 0.0868 0.1503-0.0000 ( 3256 PWs) bands (ev): -9.7537 -9.7537 -9.6680 -9.6680 -7.8033 -7.8033 -7.6417 -7.6417 2.9100 2.9100 4.3612 4.3612 4.4475 4.4475 4.7121 4.7121 5.1211 5.1211 5.6477 5.6477 6.2902 6.2902 6.4460 6.4460 6.6257 6.6257 6.8901 6.8901 6.9140 6.9140 7.0322 7.0322 7.5131 7.5131 7.5962 7.5962 7.9065 7.9065 8.0397 8.0397 8.0734 8.0734 8.2338 8.2338 8.4665 8.4665 8.8626 8.8626 9.2313 9.2313 9.4992 9.4992 11.9303 11.9303 13.1492 13.1492 15.7236 15.7236 16.9585 16.9585 18.2473 18.2473 k = 0.0822 0.1424-0.0000 ( 3252 PWs) bands (ev): -9.7792 -9.7792 -9.6936 -9.6936 -7.8112 -7.8112 -7.6489 -7.6489 2.8861 2.8861 4.3413 4.3413 4.4243 4.4243 4.6645 4.6645 5.1196 5.1196 5.7267 5.7267 6.3263 6.3263 6.4527 6.4527 6.6671 6.6671 6.9259 6.9259 6.9591 6.9591 7.0608 7.0608 7.5340 7.5340 7.6359 7.6359 7.8921 7.8921 8.0198 8.0198 8.0455 8.0455 8.2440 8.2440 8.4837 8.4837 8.8897 8.8897 9.2457 9.2457 9.5137 9.5137 11.9045 11.9045 13.1579 13.1579 15.6118 15.6118 16.8786 16.8786 18.1743 18.1743 k = 0.0776 0.1345-0.0000 ( 3248 PWs) bands (ev): -9.8035 -9.8035 -9.7180 -9.7180 -7.8189 -7.8189 -7.6560 -7.6560 2.8627 2.8627 4.3182 4.3182 4.4013 4.4013 4.6187 4.6187 5.1211 5.1211 5.8055 5.8055 6.3548 6.3548 6.4587 6.4587 6.7107 6.7107 6.9572 6.9572 7.0068 7.0068 7.0907 7.0907 7.5542 7.5542 7.6774 7.6774 7.8757 7.8757 8.0005 8.0005 8.0202 8.0202 8.2543 8.2543 8.5017 8.5017 8.9165 8.9165 9.2601 9.2601 9.5281 9.5281 11.8792 11.8792 13.1660 13.1660 15.5031 15.5031 16.8018 16.8018 18.1033 18.1033 k = 0.0731 0.1265-0.0000 ( 3244 PWs) bands (ev): -9.8266 -9.8266 -9.7412 -9.7412 -7.8263 -7.8263 -7.6628 -7.6628 2.8400 2.8400 4.2918 4.2918 4.3801 4.3801 4.5748 4.5748 5.1249 5.1249 5.8838 5.8838 6.3766 6.3766 6.4642 6.4642 6.7547 6.7547 6.9883 6.9883 7.0523 7.0523 7.1218 7.1218 7.5738 7.5738 7.7203 7.7203 7.8576 7.8576 7.9827 7.9827 7.9976 7.9976 8.2642 8.2642 8.5197 8.5197 8.9428 8.9428 9.2743 9.2743 9.5423 9.5423 11.8542 11.8542 13.1736 13.1736 15.3978 15.3978 16.7283 16.7283 18.0344 18.0344 k = 0.0685 0.1186-0.0000 ( 3244 PWs) bands (ev): -9.8484 -9.8484 -9.7631 -9.7631 -7.8334 -7.8334 -7.6693 -7.6693 2.8179 2.8179 4.2624 4.2624 4.3612 4.3612 4.5330 4.5330 5.1303 5.1303 5.9611 5.9611 6.3932 6.3932 6.4697 6.4697 6.7973 6.7973 7.0199 7.0199 7.0950 7.0950 7.1534 7.1534 7.5928 7.5928 7.7622 7.7622 7.8391 7.8391 7.9670 7.9670 7.9780 7.9780 8.2737 8.2737 8.5375 8.5375 8.9682 8.9682 9.2883 9.2883 9.5562 9.5562 11.8297 11.8297 13.1805 13.1805 15.2962 15.2962 16.6582 16.6582 17.9680 17.9680 k = 0.0639 0.1107-0.0000 ( 3244 PWs) bands (ev): -9.8689 -9.8689 -9.7837 -9.7837 -7.8402 -7.8402 -7.6756 -7.6756 2.7967 2.7967 4.2310 4.2310 4.3446 4.3446 4.4934 4.4934 5.1366 5.1366 6.0368 6.0368 6.4055 6.4055 6.4755 6.4755 6.8370 6.8370 7.0518 7.0518 7.1350 7.1350 7.1853 7.1853 7.6112 7.6112 7.7894 7.7894 7.8323 7.8323 7.9533 7.9533 7.9633 7.9633 8.2824 8.2824 8.5545 8.5545 8.9927 8.9927 9.3019 9.3019 9.5699 9.5699 11.8057 11.8057 13.1869 13.1869 15.1986 15.1986 16.5917 16.5917 17.9044 17.9044 k = 0.0594 0.1028-0.0000 ( 3246 PWs) bands (ev): -9.8881 -9.8881 -9.8029 -9.8029 -7.8467 -7.8467 -7.6815 -7.6815 2.7764 2.7764 4.1988 4.1988 4.3298 4.3298 4.4563 4.4563 5.1435 5.1435 6.1101 6.1101 6.4146 6.4146 6.4824 6.4824 6.8728 6.8728 7.0840 7.0840 7.1722 7.1722 7.2173 7.2173 7.6288 7.6288 7.7773 7.7773 7.8575 7.8575 7.9394 7.9394 7.9594 7.9594 8.2903 8.2903 8.5706 8.5706 9.0161 9.0161 9.3151 9.3151 9.5831 9.5831 11.7824 11.7824 13.1927 13.1927 15.1054 15.1054 16.5289 16.5289 17.8437 17.8437 k = 0.0548 0.0949-0.0000 ( 3246 PWs) bands (ev): -9.9059 -9.9059 -9.8209 -9.8209 -7.8528 -7.8528 -7.6871 -7.6871 2.7571 2.7571 4.1667 4.1667 4.3167 4.3167 4.4217 4.4217 5.1505 5.1505 6.1794 6.1794 6.4213 6.4213 6.4918 6.4918 6.9042 6.9042 7.1161 7.1161 7.2057 7.2057 7.2495 7.2495 7.6448 7.6448 7.7534 7.7534 7.8792 7.8792 7.9261 7.9261 7.9736 7.9736 8.2973 8.2973 8.5855 8.5855 9.0383 9.0383 9.3279 9.3279 9.5960 9.5960 11.7599 11.7599 13.1980 13.1980 15.0169 15.0169 16.4701 16.4701 17.7863 17.7863 k = 0.0502 0.0870-0.0000 ( 3242 PWs) bands (ev): -9.9224 -9.9224 -9.8374 -9.8374 -7.8585 -7.8585 -7.6923 -7.6923 2.7390 2.7390 4.1354 4.1354 4.3048 4.3048 4.3896 4.3896 5.1575 5.1575 6.2427 6.2427 6.4260 6.4260 6.5057 6.5057 6.9315 6.9315 7.1477 7.1477 7.2347 7.2347 7.2821 7.2821 7.6559 7.6559 7.7304 7.7304 7.8858 7.8858 7.9143 7.9143 8.0067 8.0067 8.3036 8.3036 8.5992 8.5992 9.0592 9.0592 9.3400 9.3400 9.6083 9.6083 11.7383 11.7383 13.2028 13.2028 14.9335 14.9335 16.4153 16.4153 17.7324 17.7324 k = 0.0457 0.0791-0.0000 ( 3236 PWs) bands (ev): -9.9375 -9.9375 -9.8526 -9.8526 -7.8637 -7.8637 -7.6972 -7.6972 2.7221 2.7221 4.1056 4.1056 4.2941 4.2941 4.3602 4.3602 5.1642 5.1642 6.2966 6.2966 6.4292 6.4292 6.5272 6.5272 6.9551 6.9551 7.1784 7.1784 7.2592 7.2592 7.3144 7.3144 7.6519 7.6519 7.7199 7.7199 7.8846 7.8846 7.9040 7.9040 8.0485 8.0485 8.3090 8.3090 8.6115 8.6115 9.0786 9.0786 9.3515 9.3515 9.6201 9.6201 11.7177 11.7177 13.2070 13.2070 14.8557 14.8557 16.3647 16.3647 17.6822 17.6822 k = 0.0411 0.0712-0.0000 ( 3242 PWs) bands (ev): -9.9512 -9.9512 -9.8664 -9.8664 -7.8685 -7.8685 -7.7016 -7.7016 2.7065 2.7065 4.0778 4.0778 4.2845 4.2845 4.3335 4.3335 5.1705 5.1705 6.3377 6.3377 6.4312 6.4312 6.5593 6.5593 6.9757 6.9757 7.2077 7.2077 7.2800 7.2800 7.3450 7.3450 7.6277 7.6277 7.7274 7.7274 7.8814 7.8814 7.8952 7.8952 8.0923 8.0923 8.3137 8.3137 8.6223 8.6223 9.0964 9.0964 9.3621 9.3621 9.6311 9.6311 11.6983 11.6983 13.2107 13.2107 14.7837 14.7837 16.3184 16.3184 17.6361 17.6361 k = 0.0365 0.0633-0.0000 ( 3238 PWs) bands (ev): -9.9636 -9.9636 -9.8787 -9.8787 -7.8729 -7.8729 -7.7056 -7.7056 2.6923 2.6923 4.0521 4.0521 4.2759 4.2759 4.3095 4.3095 5.1763 5.1763 6.3654 6.3654 6.4324 6.4324 6.6024 6.6024 6.9938 6.9938 7.2352 7.2352 7.2976 7.2976 7.3730 7.3730 7.5936 7.5936 7.7426 7.7426 7.8778 7.8778 7.8878 7.8878 8.1350 8.1350 8.3176 8.3176 8.6317 8.6317 9.1126 9.1126 9.3720 9.3720 9.6414 9.6414 11.6803 11.6803 13.2139 13.2139 14.7180 14.7180 16.2767 16.2767 17.5941 17.5941 k = 0.0320 0.0554-0.0000 ( 3240 PWs) bands (ev): -9.9745 -9.9745 -9.8897 -9.8897 -7.8768 -7.8768 -7.7092 -7.7092 2.6795 2.6795 4.0290 4.0290 4.2684 4.2684 4.2882 4.2882 5.1814 5.1814 6.3826 6.3826 6.4330 6.4330 6.6532 6.6532 7.0103 7.0103 7.2603 7.2603 7.3127 7.3127 7.3973 7.3973 7.5553 7.5553 7.7599 7.7599 7.8746 7.8746 7.8816 7.8816 8.1752 8.1752 8.3210 8.3210 8.6395 8.6395 9.1271 9.1271 9.3808 9.3808 9.6507 9.6507 11.6639 11.6639 13.2167 13.2167 14.6589 14.6589 16.2395 16.2395 17.5566 17.5566 k = 0.0274 0.0475-0.0000 ( 3232 PWs) bands (ev): -9.9839 -9.9839 -9.8992 -9.8992 -7.8802 -7.8802 -7.7123 -7.7123 2.6684 2.6684 4.0085 4.0085 4.2619 4.2619 4.2698 4.2698 5.1860 5.1860 6.3929 6.3929 6.4332 6.4332 6.7070 6.7070 7.0261 7.0261 7.2826 7.2826 7.3257 7.3257 7.4171 7.4171 7.5151 7.5151 7.7772 7.7772 7.8719 7.8719 7.8765 7.8765 8.2118 8.2118 8.3240 8.3240 8.6460 8.6460 9.1398 9.1398 9.3887 9.3887 9.6591 9.6591 11.6492 11.6492 13.2190 13.2190 14.6069 14.6069 16.2070 16.2070 17.5236 17.5236 k = 0.0228 0.0395-0.0000 ( 3225 PWs) bands (ev): -9.9920 -9.9920 -9.9072 -9.9072 -7.8831 -7.8831 -7.7150 -7.7150 2.6588 2.6588 3.9910 3.9910 4.2541 4.2541 4.2563 4.2563 5.1899 5.1899 6.3992 6.3992 6.4330 6.4330 6.7598 6.7598 7.0422 7.0422 7.3016 7.3016 7.3369 7.3369 7.4294 7.4294 7.4769 7.4769 7.7936 7.7936 7.8697 7.8697 7.8725 7.8725 8.2439 8.2439 8.3267 8.3267 8.6510 8.6510 9.1507 9.1507 9.3955 9.3955 9.6664 9.6664 11.6364 11.6364 13.2210 13.2210 14.5622 14.5622 16.1794 16.1794 17.4955 17.4955 k = 0.0183 0.0316-0.0000 ( 3221 PWs) bands (ev): -9.9986 -9.9986 -9.9138 -9.9138 -7.8855 -7.8855 -7.7172 -7.7172 2.6509 2.6509 3.9765 3.9765 4.2413 4.2413 4.2518 4.2518 5.1931 5.1931 6.4030 6.4030 6.4328 6.4328 6.8083 6.8083 7.0599 7.0599 7.3169 7.3169 7.3467 7.3467 7.4146 7.4146 7.4612 7.4612 7.8081 7.8081 7.8680 7.8680 7.8693 7.8693 8.2705 8.2705 8.3295 8.3295 8.6549 8.6549 9.1597 9.1597 9.4011 9.4011 9.6725 9.6725 11.6256 11.6256 13.2225 13.2225 14.5252 14.5252 16.1567 16.1567 17.4722 17.4722 k = 0.0137 0.0237-0.0000 ( 3219 PWs) bands (ev): -10.0037 -10.0037 -9.9190 -9.9190 -7.8873 -7.8873 -7.7189 -7.7189 2.6447 2.6447 3.9651 3.9651 4.2314 4.2314 4.2483 4.2483 5.1956 5.1956 6.4053 6.4053 6.4325 6.4325 6.8491 6.8491 7.0807 7.0807 7.3283 7.3283 7.3550 7.3550 7.3756 7.3756 7.4666 7.4666 7.8201 7.8201 7.8667 7.8667 7.8670 7.8670 8.2905 8.2905 8.3329 8.3329 8.6576 8.6576 9.1667 9.1667 9.4056 9.4056 9.6774 9.6774 11.6171 11.6171 13.2237 13.2237 14.4961 14.4961 16.1389 16.1389 17.4540 17.4540 k = 0.0091 0.0158-0.0000 ( 3219 PWs) bands (ev): -10.0073 -10.0073 -9.9227 -9.9227 -7.8887 -7.8887 -7.7202 -7.7202 2.6402 2.6402 3.9569 3.9569 4.2243 4.2243 4.2457 4.2457 5.1973 5.1973 6.4067 6.4067 6.4322 6.4322 6.8794 6.8794 7.1046 7.1046 7.3353 7.3353 7.3359 7.3359 7.3617 7.3617 7.4725 7.4725 7.8290 7.8290 7.8654 7.8654 7.8659 7.8659 8.3034 8.3034 8.3372 8.3372 8.6594 8.6594 9.1718 9.1718 9.4088 9.4088 9.6809 9.6809 11.6109 11.6109 13.2245 13.2245 14.4752 14.4752 16.1262 16.1262 17.4409 17.4409 k = 0.0046 0.0079-0.0000 ( 3231 PWs) bands (ev): -10.0095 -10.0095 -9.9249 -9.9249 -7.8895 -7.8895 -7.7209 -7.7209 2.6376 2.6376 3.9520 3.9520 4.2200 4.2200 4.2442 4.2442 5.1984 5.1984 6.4074 6.4074 6.4320 6.4320 6.8977 6.8977 7.1276 7.1276 7.3023 7.3023 7.3401 7.3401 7.3660 7.3660 7.4763 7.4763 7.8345 7.8345 7.8645 7.8645 7.8654 7.8654 8.3098 8.3098 8.3412 8.3412 8.6603 8.6603 9.1748 9.1748 9.4107 9.4107 9.6830 9.6830 11.6072 11.6072 13.2250 13.2250 14.4625 14.4625 16.1185 16.1185 17.4330 17.4330 k = 0.0000 0.0000 0.0000 ( 3237 PWs) bands (ev): -10.0103 -10.0103 -9.9256 -9.9256 -7.8897 -7.8897 -7.7211 -7.7211 2.6367 2.6367 3.9503 3.9503 4.2185 4.2185 4.2437 4.2437 5.1988 5.1988 6.4076 6.4076 6.4320 6.4320 6.9037 6.9037 7.1384 7.1384 7.2881 7.2881 7.3415 7.3415 7.3674 7.3674 7.4776 7.4776 7.8363 7.8363 7.8642 7.8642 7.8652 7.8652 8.3117 8.3117 8.3428 8.3428 8.6607 8.6607 9.1758 9.1758 9.4114 9.4114 9.6837 9.6837 11.6059 11.6059 13.2251 13.2251 14.4583 14.4583 16.1160 16.1160 17.4304 17.4304 k = 0.0000 0.0000 0.0000 ( 3237 PWs) bands (ev): -10.0103 -10.0103 -9.9256 -9.9256 -7.8897 -7.8897 -7.7211 -7.7211 2.6367 2.6367 3.9503 3.9503 4.2185 4.2185 4.2437 4.2437 5.1988 5.1988 6.4076 6.4076 6.4320 6.4320 6.9037 6.9037 7.1384 7.1384 7.2881 7.2881 7.3415 7.3415 7.3674 7.3674 7.4776 7.4776 7.8363 7.8363 7.8642 7.8642 7.8652 7.8652 8.3117 8.3117 8.3428 8.3428 8.6607 8.6607 9.1758 9.1758 9.4114 9.4114 9.6837 9.6837 11.6059 11.6059 13.2251 13.2251 14.4583 14.4583 16.1160 16.1160 17.4304 17.4304 k = 0.0000 0.0000 0.0090 ( 3225 PWs) bands (ev): -10.0100 -10.0100 -9.9259 -9.9259 -7.8891 -7.8891 -7.7217 -7.7217 2.6397 2.6397 3.9402 3.9402 4.2186 4.2186 4.2423 4.2423 5.2122 5.2122 6.4077 6.4077 6.4319 6.4319 6.9041 6.9041 7.1389 7.1389 7.2817 7.2817 7.3339 7.3339 7.3659 7.3659 7.4861 7.4861 7.8387 7.8387 7.8642 7.8642 7.8652 7.8652 8.3067 8.3067 8.3410 8.3410 8.6657 8.6657 9.1747 9.1747 9.4127 9.4127 9.6829 9.6829 11.6111 11.6111 13.2148 13.2148 14.4689 14.4689 16.1107 16.1107 17.4319 17.4319 k = 0.0000 0.0000 0.0180 ( 3225 PWs) bands (ev): -10.0091 -10.0091 -9.9269 -9.9269 -7.8872 -7.8872 -7.7235 -7.7235 2.6487 2.6487 3.9107 3.9107 4.2186 4.2186 4.2389 4.2389 5.2510 5.2510 6.4080 6.4080 6.4316 6.4316 6.9051 6.9051 7.1405 7.1405 7.2627 7.2627 7.3150 7.3150 7.3613 7.3613 7.5078 7.5078 7.8457 7.8457 7.8642 7.8642 7.8652 7.8652 8.2924 8.2924 8.3355 8.3355 8.6799 8.6799 9.1714 9.1714 9.4165 9.4165 9.6805 9.6805 11.6264 11.6264 13.1847 13.1847 14.4994 14.4994 16.0951 16.0951 17.4363 17.4363 k = 0.0000 0.0000 0.0269 ( 3219 PWs) bands (ev): -10.0077 -10.0077 -9.9285 -9.9285 -7.8841 -7.8841 -7.7265 -7.7265 2.6637 2.6637 3.8643 3.8643 4.2186 4.2186 4.2347 4.2347 5.3114 5.3114 6.4084 6.4084 6.4312 6.4312 6.9064 6.9064 7.1431 7.1431 7.2318 7.2318 7.2908 7.2908 7.3540 7.3540 7.5366 7.5366 7.8571 7.8571 7.8642 7.8642 7.8652 7.8652 8.2708 8.2708 8.3264 8.3264 8.7014 8.7014 9.1660 9.1660 9.4228 9.4228 9.6766 9.6766 11.6516 11.6516 13.1377 13.1377 14.5473 14.5473 16.0693 16.0693 17.4436 17.4436 k = 0.0000 0.0000 0.0359 ( 3237 PWs) bands (ev): -10.0057 -10.0057 -9.9308 -9.9308 -7.8799 -7.8799 -7.7306 -7.7306 2.6847 2.6847 3.8046 3.8046 4.2186 4.2186 4.2309 4.2309 5.3885 5.3885 6.4091 6.4091 6.4306 6.4306 6.9073 6.9073 7.1468 7.1468 7.1905 7.1905 7.2647 7.2647 7.3444 7.3444 7.5691 7.5691 7.8642 7.8642 7.8652 7.8652 7.8723 7.8723 8.2438 8.2438 8.3141 8.3141 8.7277 8.7277 9.1584 9.1584 9.4314 9.4314 9.6710 9.6710 11.6862 11.6862 13.0769 13.0769 14.6091 14.6091 16.0339 16.0339 17.4537 17.4537 k = 0.0000 0.0000 0.0449 ( 3237 PWs) bands (ev): -10.0032 -10.0032 -9.9336 -9.9336 -7.8745 -7.8745 -7.7358 -7.7358 2.7114 2.7114 3.7353 3.7353 4.2186 4.2186 4.2278 4.2278 5.4782 5.4782 6.4099 6.4099 6.4299 6.4299 6.9061 6.9061 7.1414 7.1414 7.1515 7.1515 7.2381 7.2381 7.3330 7.3330 7.6039 7.6039 7.8642 7.8642 7.8653 7.8653 7.8908 7.8908 8.2132 8.2132 8.2986 8.2986 8.7571 8.7571 9.1486 9.1486 9.4419 9.4419 9.6640 9.6640 11.7296 11.7296 13.0059 13.0059 14.6815 14.6815 15.9894 15.9894 17.4664 17.4664 k = 0.0000 0.0000 0.0539 ( 3219 PWs) bands (ev): -10.0002 -10.0002 -9.9369 -9.9369 -7.8681 -7.8681 -7.7420 -7.7420 2.7440 2.7440 3.6598 3.6598 4.2186 4.2186 4.2255 4.2255 5.5769 5.5769 6.4108 6.4108 6.4291 6.4291 6.8989 6.8989 7.0895 7.0895 7.1572 7.1572 7.2119 7.2119 7.3203 7.3203 7.6402 7.6402 7.8642 7.8642 7.8653 7.8653 7.9121 7.9121 8.1799 8.1799 8.2804 8.2804 8.7882 8.7882 9.1368 9.1368 9.4542 9.4542 9.6556 9.6556 11.7813 11.7813 12.9273 12.9273 14.7617 14.7617 15.9366 15.9366 17.4816 17.4816 k = 0.0000 0.0000 0.0629 ( 3219 PWs) bands (ev): -9.9968 -9.9968 -9.9407 -9.9407 -7.8608 -7.8608 -7.7491 -7.7491 2.7821 2.7821 3.5808 3.5808 4.2187 4.2187 4.2237 4.2237 5.6821 5.6821 6.4119 6.4119 6.4281 6.4281 6.8761 6.8761 7.0452 7.0452 7.1639 7.1639 7.1863 7.1863 7.3067 7.3067 7.6776 7.6776 7.8642 7.8642 7.8654 7.8654 7.9357 7.9357 8.1448 8.1448 8.2597 8.2597 8.8201 8.8201 9.1229 9.1229 9.4680 9.4680 9.6457 9.6457 11.8403 11.8403 12.8435 12.8435 14.8474 14.8474 15.8762 15.8762 17.4989 17.4989 k = 0.0000 0.0000 0.0719 ( 3225 PWs) bands (ev): -9.9929 -9.9929 -9.9448 -9.9448 -7.8527 -7.8527 -7.7570 -7.7570 2.8256 2.8256 3.5003 3.5003 4.2187 4.2187 4.2224 4.2224 5.7916 5.7916 6.4131 6.4131 6.4269 6.4269 6.8270 6.8270 7.0206 7.0206 7.1617 7.1617 7.1716 7.1716 7.2926 7.2926 7.7157 7.7157 7.8641 7.8641 7.8655 7.8655 7.9611 7.9611 8.1083 8.1083 8.2369 8.2369 8.8519 8.8519 9.1069 9.1069 9.4828 9.4828 9.6346 9.6346 11.9059 11.9059 12.7561 12.7561 14.9369 14.9369 15.8090 15.8090 17.5183 17.5183 k = 0.0000 0.0000 0.0808 ( 3237 PWs) bands (ev): -9.9887 -9.9887 -9.9494 -9.9494 -7.8439 -7.8439 -7.7656 -7.7656 2.8745 2.8745 3.4198 3.4198 4.2188 4.2188 4.2215 4.2215 5.9039 5.9039 6.4144 6.4144 6.4257 6.4257 6.7536 6.7536 7.0145 7.0145 7.1382 7.1382 7.1803 7.1803 7.2783 7.2783 7.7543 7.7543 7.8641 7.8641 7.8657 7.8657 7.9879 7.9879 8.0707 8.0707 8.2122 8.2122 8.8834 8.8834 9.0889 9.0889 9.4984 9.4984 9.6223 9.6223 11.9773 11.9773 12.6664 12.6664 15.0287 15.0287 15.7358 15.7358 17.5395 17.5395 k = 0.0000 0.0000 0.0898 ( 3237 PWs) bands (ev): -9.9841 -9.9841 -9.9541 -9.9541 -7.8345 -7.8345 -7.7748 -7.7748 2.9284 2.9284 3.3405 3.3405 4.2189 4.2189 4.2207 4.2207 6.0175 6.0175 6.4158 6.4158 6.4244 6.4244 6.6652 6.6652 7.0189 7.0189 7.1159 7.1159 7.1899 7.1899 7.2641 7.2641 7.7931 7.7931 7.8640 7.8640 7.8662 7.8662 8.0158 8.0158 8.0324 8.0324 8.1861 8.1861 8.9140 8.9140 9.0691 9.0691 9.5146 9.5146 9.6089 9.6089 12.0537 12.0537 12.5757 12.5757 15.1218 15.1218 15.6574 15.6574 17.5621 17.5621 k = 0.0000 0.0000 0.0988 ( 3249 PWs) bands (ev): -9.9794 -9.9794 -9.9591 -9.9591 -7.8247 -7.8247 -7.7844 -7.7844 2.9870 2.9870 3.2633 3.2633 4.2190 4.2190 4.2202 4.2202 6.1314 6.1314 6.4172 6.4172 6.4230 6.4230 6.5676 6.5676 7.0288 7.0288 7.0949 7.0949 7.2004 7.2004 7.2502 7.2502 7.8310 7.8310 7.8638 7.8638 7.8678 7.8678 7.9936 7.9936 8.0443 8.0443 8.1588 8.1588 8.9435 8.9435 9.0473 9.0473 9.5310 9.5310 9.5946 9.5946 12.1344 12.1344 12.4848 12.4848 15.2151 15.2151 15.5747 15.5747 17.5859 17.5859 k = 0.0000 0.0000 0.1078 ( 3249 PWs) bands (ev): -9.9744 -9.9744 -9.9642 -9.9642 -7.8147 -7.8147 -7.7944 -7.7944 3.0502 3.0502 3.1888 3.1888 4.2192 4.2192 4.2198 4.2198 6.2445 6.2445 6.4186 6.4186 6.4216 6.4216 6.4638 6.4638 7.0420 7.0420 7.0755 7.0755 7.2118 7.2118 7.2368 7.2368 7.8581 7.8581 7.8635 7.8635 7.8805 7.8805 7.9545 7.9545 8.0731 8.0731 8.1307 8.1307 8.9718 8.9718 9.0238 9.0238 9.5475 9.5475 9.5794 9.5794 12.2185 12.2185 12.3944 12.3944 15.3078 15.3078 15.4883 15.4883 17.6106 17.6106 k = 0.0000 0.0000 0.1168 ( 3242 PWs) bands (ev): -9.9693 -9.9693 -9.9693 -9.9693 -7.8045 -7.8045 -7.8045 -7.8045 3.1176 3.1176 3.1176 3.1176 4.2195 4.2195 4.2195 4.2195 6.3556 6.3556 6.3556 6.3556 6.4201 6.4201 6.4201 6.4201 7.0578 7.0578 7.0578 7.0578 7.2239 7.2239 7.2239 7.2239 7.8626 7.8626 7.8626 7.8626 7.9157 7.9157 7.9157 7.9157 8.1020 8.1020 8.1020 8.1020 8.9986 8.9986 8.9986 8.9986 9.5637 9.5637 9.5637 9.5637 12.3055 12.3055 12.3055 12.3055 15.3991 15.3991 15.3991 15.3991 17.6358 17.6358 k = 0.0000 0.0000 0.1168 ( 3242 PWs) bands (ev): -9.9693 -9.9693 -9.9693 -9.9693 -7.8045 -7.8045 -7.8045 -7.8045 3.1176 3.1176 3.1176 3.1176 4.2195 4.2195 4.2195 4.2195 6.3556 6.3556 6.3556 6.3556 6.4201 6.4201 6.4201 6.4201 7.0578 7.0578 7.0578 7.0578 7.2239 7.2239 7.2239 7.2239 7.8626 7.8626 7.8626 7.8626 7.9157 7.9157 7.9157 7.9157 8.1020 8.1020 8.1020 8.1020 8.9986 8.9986 8.9986 8.9986 9.5637 9.5637 9.5637 9.5637 12.3055 12.3055 12.3055 12.3055 15.3991 15.3991 15.3991 15.3991 17.6358 17.6358 k = 0.0079 0.0046 0.1168 ( 3248 PWs) bands (ev): -9.9686 -9.9686 -9.9686 -9.9686 -7.8043 -7.8043 -7.8043 -7.8043 3.1185 3.1185 3.1185 3.1185 4.2208 4.2208 4.2208 4.2208 6.3524 6.3524 6.3524 6.3524 6.4210 6.4210 6.4210 6.4210 7.0572 7.0572 7.0572 7.0572 7.2236 7.2236 7.2236 7.2236 7.8628 7.8628 7.8628 7.8628 7.9144 7.9144 7.9144 7.9144 8.1005 8.1005 8.1005 8.1005 8.9978 8.9978 8.9978 8.9978 9.5629 9.5629 9.5629 9.5629 12.3066 12.3066 12.3066 12.3066 15.4019 15.4019 15.4019 15.4019 17.6387 17.6387 k = 0.0159 0.0092 0.1168 ( 3246 PWs) bands (ev): -9.9664 -9.9664 -9.9664 -9.9664 -7.8035 -7.8035 -7.8035 -7.8035 3.1212 3.1212 3.1212 3.1212 4.2249 4.2249 4.2249 4.2249 6.3430 6.3430 6.3430 6.3430 6.4231 6.4231 6.4231 6.4231 7.0556 7.0556 7.0556 7.0556 7.2227 7.2227 7.2227 7.2227 7.8632 7.8632 7.8632 7.8632 7.9104 7.9104 7.9104 7.9104 8.0961 8.0961 8.0961 8.0961 8.9954 8.9954 8.9954 8.9954 9.5606 9.5606 9.5606 9.5606 12.3099 12.3099 12.3099 12.3099 15.4104 15.4104 15.4104 15.4104 17.6473 17.6473 k = 0.0238 0.0137 0.1168 ( 3238 PWs) bands (ev): -9.9627 -9.9627 -9.9627 -9.9627 -7.8022 -7.8022 -7.8022 -7.8022 3.1257 3.1257 3.1257 3.1257 4.2317 4.2317 4.2317 4.2317 6.3282 6.3282 6.3282 6.3282 6.4258 6.4258 6.4258 6.4258 7.0529 7.0529 7.0529 7.0529 7.2210 7.2210 7.2210 7.2210 7.8639 7.8639 7.8639 7.8639 7.9035 7.9035 7.9035 7.9035 8.0891 8.0891 8.0891 8.0891 8.9914 8.9914 8.9914 8.9914 9.5567 9.5567 9.5567 9.5567 12.3152 12.3152 12.3152 12.3152 15.4245 15.4245 15.4245 15.4245 17.6615 17.6615 k = 0.0317 0.0183 0.1168 ( 3238 PWs) bands (ev): -9.9575 -9.9575 -9.9575 -9.9575 -7.8004 -7.8004 -7.8004 -7.8004 3.1319 3.1319 3.1319 3.1319 4.2412 4.2412 4.2412 4.2412 6.3086 6.3086 6.3086 6.3086 6.4287 6.4287 6.4287 6.4287 7.0489 7.0489 7.0489 7.0489 7.2187 7.2187 7.2187 7.2187 7.8645 7.8645 7.8645 7.8645 7.8938 7.8938 7.8938 7.8938 8.0801 8.0801 8.0801 8.0801 8.9858 8.9858 8.9858 8.9858 9.5514 9.5514 9.5514 9.5514 12.3226 12.3226 12.3226 12.3226 15.4443 15.4443 15.4443 15.4443 17.6814 17.6814 k = 0.0397 0.0229 0.1168 ( 3236 PWs) bands (ev): -9.9509 -9.9509 -9.9509 -9.9509 -7.7981 -7.7981 -7.7981 -7.7981 3.1398 3.1398 3.1398 3.1398 4.2535 4.2535 4.2535 4.2535 6.2846 6.2846 6.2846 6.2846 6.4314 6.4314 6.4314 6.4314 7.0436 7.0436 7.0436 7.0436 7.2156 7.2156 7.2156 7.2156 7.8638 7.8638 7.8638 7.8638 7.8822 7.8822 7.8822 7.8822 8.0698 8.0698 8.0698 8.0698 8.9786 8.9786 8.9786 8.9786 9.5447 9.5447 9.5447 9.5447 12.3318 12.3318 12.3318 12.3318 15.4695 15.4695 15.4695 15.4695 17.7068 17.7068 k = 0.0476 0.0275 0.1168 ( 3236 PWs) bands (ev): -9.9428 -9.9428 -9.9428 -9.9428 -7.7953 -7.7953 -7.7953 -7.7953 3.1493 3.1493 3.1493 3.1493 4.2684 4.2684 4.2684 4.2684 6.2563 6.2563 6.2563 6.2563 6.4338 6.4338 6.4338 6.4338 7.0369 7.0369 7.0369 7.0369 7.2116 7.2116 7.2116 7.2116 7.8550 7.8550 7.8550 7.8550 7.8752 7.8752 7.8752 7.8752 8.0588 8.0588 8.0588 8.0588 8.9699 8.9699 8.9699 8.9699 9.5367 9.5367 9.5367 9.5367 12.3426 12.3426 12.3426 12.3426 15.5003 15.5003 15.5003 15.5003 17.7376 17.7376 k = 0.0556 0.0321 0.1168 ( 3236 PWs) bands (ev): -9.9332 -9.9332 -9.9332 -9.9332 -7.7920 -7.7920 -7.7920 -7.7920 3.1604 3.1604 3.1604 3.1604 4.2861 4.2861 4.2861 4.2861 6.2240 6.2240 6.2240 6.2240 6.4359 6.4359 6.4359 6.4359 7.0287 7.0287 7.0287 7.0287 7.2065 7.2065 7.2065 7.2065 7.8353 7.8353 7.8353 7.8353 7.8756 7.8756 7.8756 7.8756 8.0480 8.0480 8.0480 8.0480 8.9596 8.9596 8.9596 8.9596 9.5275 9.5275 9.5275 9.5275 12.3548 12.3548 12.3548 12.3548 15.5364 15.5364 15.5364 15.5364 17.7736 17.7736 k = 0.0635 0.0367 0.1168 ( 3244 PWs) bands (ev): -9.9222 -9.9222 -9.9222 -9.9222 -7.7882 -7.7882 -7.7882 -7.7882 3.1729 3.1729 3.1729 3.1729 4.3064 4.3064 4.3064 4.3064 6.1879 6.1879 6.1879 6.1879 6.4378 6.4378 6.4378 6.4378 7.0189 7.0189 7.0189 7.0189 7.2002 7.2002 7.2002 7.2002 7.8099 7.8099 7.8099 7.8099 7.8782 7.8782 7.8782 7.8782 8.0379 8.0379 8.0379 8.0379 8.9478 8.9478 8.9478 8.9478 9.5173 9.5173 9.5173 9.5173 12.3682 12.3682 12.3682 12.3682 15.5779 15.5779 15.5779 15.5779 17.8147 17.8147 k = 0.0714 0.0412 0.1168 ( 3240 PWs) bands (ev): -9.9098 -9.9098 -9.9098 -9.9098 -7.7840 -7.7840 -7.7840 -7.7840 3.1868 3.1868 3.1868 3.1868 4.3294 4.3294 4.3294 4.3294 6.1481 6.1481 6.1481 6.1481 6.4392 6.4392 6.4392 6.4392 7.0074 7.0074 7.0074 7.0074 7.1924 7.1924 7.1924 7.1924 7.7806 7.7806 7.7806 7.7806 7.8816 7.8816 7.8816 7.8816 8.0289 8.0289 8.0289 8.0289 8.9345 8.9345 8.9345 8.9345 9.5061 9.5061 9.5061 9.5061 12.3825 12.3825 12.3825 12.3825 15.6245 15.6245 15.6245 15.6245 17.8606 17.8606 k = 0.0794 0.0458 0.1168 ( 3244 PWs) bands (ev): -9.8959 -9.8959 -9.8959 -9.8959 -7.7793 -7.7793 -7.7793 -7.7793 3.2020 3.2020 3.2020 3.2020 4.3550 4.3550 4.3550 4.3550 6.1048 6.1048 6.1048 6.1048 6.4402 6.4402 6.4402 6.4402 6.9940 6.9940 6.9940 6.9940 7.1829 7.1829 7.1829 7.1829 7.7485 7.7485 7.7485 7.7485 7.8855 7.8855 7.8855 7.8855 8.0214 8.0214 8.0214 8.0214 8.9197 8.9197 8.9197 8.9197 9.4941 9.4941 9.4941 9.4941 12.3975 12.3975 12.3975 12.3975 15.6762 15.6762 15.6762 15.6762 17.9111 17.9111 k = 0.0873 0.0504 0.1168 ( 3248 PWs) bands (ev): -9.8807 -9.8807 -9.8807 -9.8807 -7.7742 -7.7742 -7.7742 -7.7742 3.2183 3.2183 3.2183 3.2183 4.3831 4.3831 4.3831 4.3831 6.0582 6.0582 6.0582 6.0582 6.4406 6.4406 6.4406 6.4406 6.9788 6.9788 6.9788 6.9788 7.1712 7.1712 7.1712 7.1712 7.7146 7.7146 7.7146 7.7146 7.8894 7.8894 7.8894 7.8894 8.0156 8.0156 8.0156 8.0156 8.9035 8.9035 8.9035 8.9035 9.4814 9.4814 9.4814 9.4814 12.4130 12.4130 12.4130 12.4130 15.7328 15.7328 15.7328 15.7328 17.9659 17.9659 k = 0.0952 0.0550 0.1168 ( 3246 PWs) bands (ev): -9.8641 -9.8641 -9.8641 -9.8641 -7.7687 -7.7687 -7.7687 -7.7687 3.2356 3.2356 3.2356 3.2356 4.4136 4.4136 4.4136 4.4136 6.0087 6.0087 6.0087 6.0087 6.4405 6.4405 6.4405 6.4405 6.9615 6.9615 6.9615 6.9615 7.1569 7.1569 7.1569 7.1569 7.6799 7.6799 7.6799 7.6799 7.8929 7.8929 7.8929 7.8929 8.0121 8.0121 8.0121 8.0121 8.8858 8.8858 8.8858 8.8858 9.4682 9.4682 9.4682 9.4682 12.4287 12.4287 12.4287 12.4287 15.7941 15.7941 15.7941 15.7941 18.0248 18.0248 k = 0.1032 0.0596 0.1168 ( 3246 PWs) bands (ev): -9.8461 -9.8461 -9.8461 -9.8461 -7.7629 -7.7629 -7.7629 -7.7629 3.2538 3.2538 3.2538 3.2538 4.4464 4.4464 4.4464 4.4464 5.9564 5.9564 5.9564 5.9564 6.4396 6.4396 6.4396 6.4396 6.9421 6.9421 6.9421 6.9421 7.1399 7.1399 7.1399 7.1399 7.6458 7.6458 7.6458 7.6458 7.8953 7.8953 7.8953 7.8953 8.0115 8.0115 8.0115 8.0115 8.8667 8.8667 8.8667 8.8667 9.4546 9.4546 9.4546 9.4546 12.4444 12.4444 12.4444 12.4444 15.8600 15.8600 15.8600 15.8600 18.0875 18.0875 k = 0.1111 0.0642 0.1168 ( 3244 PWs) bands (ev): -9.8267 -9.8267 -9.8267 -9.8267 -7.7566 -7.7566 -7.7566 -7.7566 3.2729 3.2729 3.2729 3.2729 4.4814 4.4814 4.4814 4.4814 5.9016 5.9016 5.9016 5.9016 6.4378 6.4378 6.4378 6.4378 6.9204 6.9204 6.9204 6.9204 7.1197 7.1197 7.1197 7.1197 7.6132 7.6132 7.6132 7.6132 7.8961 7.8961 7.8961 7.8961 8.0144 8.0144 8.0144 8.0144 8.8462 8.8462 8.8462 8.8462 9.4407 9.4407 9.4407 9.4407 12.4600 12.4600 12.4600 12.4600 15.9301 15.9301 15.9301 15.9301 18.1536 18.1536 k = 0.1190 0.0687 0.1168 ( 3240 PWs) bands (ev): -9.8061 -9.8061 -9.8061 -9.8061 -7.7500 -7.7500 -7.7500 -7.7500 3.2925 3.2925 3.2925 3.2925 4.5182 4.5182 4.5182 4.5182 5.8447 5.8447 5.8447 5.8447 6.4350 6.4350 6.4350 6.4350 6.8963 6.8963 6.8963 6.8963 7.0964 7.0964 7.0964 7.0964 7.5832 7.5832 7.5832 7.5832 7.8947 7.8947 7.8947 7.8947 8.0213 8.0213 8.0213 8.0213 8.8243 8.8243 8.8243 8.8243 9.4267 9.4267 9.4267 9.4267 12.4753 12.4753 12.4753 12.4753 16.0044 16.0044 16.0044 16.0044 18.2228 18.2228 k = 0.1270 0.0733 0.1168 ( 3236 PWs) bands (ev): -9.7841 -9.7841 -9.7841 -9.7841 -7.7432 -7.7432 -7.7432 -7.7432 3.3127 3.3127 3.3127 3.3127 4.5566 4.5566 4.5566 4.5566 5.7859 5.7859 5.7859 5.7859 6.4308 6.4308 6.4308 6.4308 6.8698 6.8698 6.8698 6.8698 7.0703 7.0703 7.0703 7.0703 7.5565 7.5565 7.5565 7.5565 7.8911 7.8911 7.8911 7.8911 8.0323 8.0323 8.0323 8.0323 8.8012 8.8012 8.8012 8.8012 9.4126 9.4126 9.4126 9.4126 12.4902 12.4902 12.4902 12.4902 16.0824 16.0824 16.0824 16.0824 18.2947 18.2947 k = 0.1349 0.0779 0.1168 ( 3234 PWs) bands (ev): -9.7608 -9.7608 -9.7608 -9.7608 -7.7360 -7.7360 -7.7360 -7.7360 3.3332 3.3332 3.3332 3.3332 4.5961 4.5961 4.5961 4.5961 5.7257 5.7257 5.7257 5.7257 6.4249 6.4249 6.4249 6.4249 6.8409 6.8409 6.8409 6.8409 7.0418 7.0418 7.0418 7.0418 7.5335 7.5335 7.5335 7.5335 7.8855 7.8855 7.8855 7.8855 8.0471 8.0471 8.0471 8.0471 8.7769 8.7769 8.7769 8.7769 9.3987 9.3987 9.3987 9.3987 12.5046 12.5046 12.5046 12.5046 16.1641 16.1641 16.1641 16.1641 18.3689 18.3689 k = 0.1429 0.0825 0.1168 ( 3244 PWs) bands (ev): -9.7363 -9.7363 -9.7363 -9.7363 -7.7286 -7.7286 -7.7286 -7.7286 3.3540 3.3540 3.3540 3.3540 4.6363 4.6363 4.6363 4.6363 5.6645 5.6645 5.6645 5.6645 6.4167 6.4167 6.4167 6.4167 6.8099 6.8099 6.8099 6.8099 7.0118 7.0118 7.0118 7.0118 7.5143 7.5143 7.5143 7.5143 7.8784 7.8784 7.8784 7.8784 8.0654 8.0654 8.0654 8.0654 8.7515 8.7515 8.7515 8.7515 9.3848 9.3848 9.3848 9.3848 12.5183 12.5183 12.5183 12.5183 16.2490 16.2490 16.2490 16.2490 18.4449 18.4449 k = 0.1508 0.0871 0.1168 ( 3246 PWs) bands (ev): -9.7106 -9.7106 -9.7106 -9.7106 -7.7210 -7.7210 -7.7210 -7.7210 3.3749 3.3749 3.3749 3.3749 4.6764 4.6764 4.6764 4.6764 5.6030 5.6030 5.6030 5.6030 6.4057 6.4057 6.4057 6.4057 6.7777 6.7777 6.7777 6.7777 6.9810 6.9810 6.9810 6.9810 7.4987 7.4987 7.4987 7.4987 7.8699 7.8699 7.8699 7.8699 8.0869 8.0869 8.0869 8.0869 8.7251 8.7251 8.7251 8.7251 9.3713 9.3713 9.3713 9.3713 12.5314 12.5314 12.5314 12.5314 16.3369 16.3369 16.3369 16.3369 18.5224 18.5224 k = 0.1587 0.0916 0.1168 ( 3248 PWs) bands (ev): -9.6837 -9.6837 -9.6837 -9.6837 -7.7132 -7.7132 -7.7132 -7.7132 3.3958 3.3958 3.3958 3.3958 4.7156 4.7156 4.7156 4.7156 5.5418 5.5418 5.5418 5.5418 6.3906 6.3906 6.3906 6.3906 6.7455 6.7455 6.7455 6.7455 6.9502 6.9502 6.9502 6.9502 7.4867 7.4867 7.4867 7.4867 7.8604 7.8604 7.8604 7.8604 8.1112 8.1112 8.1112 8.1112 8.6980 8.6980 8.6980 8.6980 9.3580 9.3580 9.3580 9.3580 12.5438 12.5438 12.5438 12.5438 16.4276 16.4276 16.4276 16.4276 18.6008 18.6008 k = 0.1667 0.0962 0.1168 ( 3240 PWs) bands (ev): -9.6556 -9.6556 -9.6556 -9.6556 -7.7053 -7.7053 -7.7053 -7.7053 3.4165 3.4165 3.4165 3.4165 4.7524 4.7524 4.7524 4.7524 5.4821 5.4821 5.4821 5.4821 6.3705 6.3705 6.3705 6.3705 6.7153 6.7153 6.7153 6.7153 6.9199 6.9199 6.9199 6.9199 7.4778 7.4778 7.4778 7.4778 7.8501 7.8501 7.8501 7.8501 8.1381 8.1381 8.1381 8.1381 8.6702 8.6702 8.6702 8.6702 9.3452 9.3452 9.3452 9.3452 12.5555 12.5555 12.5555 12.5555 16.5206 16.5206 16.5206 16.5206 18.6797 18.6797 k = 0.1746 0.1008 0.1168 ( 3244 PWs) bands (ev): -9.6264 -9.6264 -9.6264 -9.6264 -7.6972 -7.6972 -7.6972 -7.6972 3.4369 3.4369 3.4369 3.4369 4.7852 4.7852 4.7852 4.7852 5.4253 5.4253 5.4253 5.4253 6.3439 6.3439 6.3439 6.3439 6.6889 6.6889 6.6889 6.6889 6.8903 6.8903 6.8903 6.8903 7.4717 7.4717 7.4717 7.4717 7.8391 7.8391 7.8391 7.8391 8.1673 8.1673 8.1673 8.1673 8.6420 8.6420 8.6420 8.6420 9.3328 9.3328 9.3328 9.3328 12.5664 12.5664 12.5664 12.5664 16.6156 16.6156 16.6156 16.6156 18.7583 18.7583 k = 0.1825 0.1054 0.1168 ( 3240 PWs) bands (ev): -9.5962 -9.5962 -9.5962 -9.5962 -7.6891 -7.6891 -7.6891 -7.6891 3.4568 3.4568 3.4568 3.4568 4.8115 4.8115 4.8115 4.8115 5.3736 5.3736 5.3736 5.3736 6.3103 6.3103 6.3103 6.3103 6.6681 6.6681 6.6681 6.6681 6.8618 6.8618 6.8618 6.8618 7.4683 7.4683 7.4683 7.4683 7.8277 7.8277 7.8277 7.8277 8.1984 8.1984 8.1984 8.1984 8.6138 8.6138 8.6138 8.6138 9.3209 9.3209 9.3209 9.3209 12.5765 12.5765 12.5765 12.5765 16.7124 16.7124 16.7124 16.7124 18.8363 18.8363 k = 0.1905 0.1100 0.1168 ( 3248 PWs) bands (ev): -9.5648 -9.5648 -9.5648 -9.5648 -7.6810 -7.6810 -7.6810 -7.6810 3.4761 3.4761 3.4761 3.4761 4.8279 4.8279 4.8279 4.8279 5.3298 5.3298 5.3298 5.3298 6.2697 6.2697 6.2697 6.2697 6.6538 6.6538 6.6538 6.6538 6.8343 6.8343 6.8343 6.8343 7.4674 7.4674 7.4674 7.4674 7.8157 7.8157 7.8157 7.8157 8.2312 8.2312 8.2312 8.2312 8.5859 8.5859 8.5859 8.5859 9.3097 9.3097 9.3097 9.3097 12.5860 12.5860 12.5860 12.5860 16.8106 16.8106 16.8106 16.8106 18.9129 18.9129 k = 0.1984 0.1146 0.1168 ( 3256 PWs) bands (ev): -9.5325 -9.5325 -9.5325 -9.5325 -7.6729 -7.6729 -7.6729 -7.6729 3.4946 3.4946 3.4946 3.4946 4.8311 4.8311 4.8311 4.8311 5.2970 5.2970 5.2970 5.2970 6.2230 6.2230 6.2230 6.2230 6.6457 6.6457 6.6457 6.6457 6.8082 6.8082 6.8082 6.8082 7.4689 7.4689 7.4689 7.4689 7.8035 7.8035 7.8035 7.8035 8.2650 8.2650 8.2650 8.2650 8.5590 8.5590 8.5590 8.5590 9.2992 9.2992 9.2992 9.2992 12.5947 12.5947 12.5947 12.5947 16.9097 16.9097 16.9097 16.9097 18.9876 18.9876 k = 0.2063 0.1191 0.1168 ( 3244 PWs) bands (ev): -9.4992 -9.4992 -9.4992 -9.4992 -7.6648 -7.6648 -7.6648 -7.6648 3.5121 3.5121 3.5121 3.5121 4.8184 4.8184 4.8184 4.8184 5.2775 5.2775 5.2775 5.2775 6.1716 6.1716 6.1716 6.1716 6.6429 6.6429 6.6429 6.6429 6.7841 6.7841 6.7841 6.7841 7.4729 7.4729 7.4729 7.4729 7.7910 7.7910 7.7910 7.7910 8.2987 8.2987 8.2987 8.2987 8.5342 8.5342 8.5342 8.5342 9.2894 9.2894 9.2894 9.2894 12.6027 12.6027 12.6027 12.6027 17.0095 17.0095 17.0095 17.0095 19.0596 19.0596 k = 0.2143 0.1237 0.1168 ( 3248 PWs) bands (ev): -9.4650 -9.4650 -9.4650 -9.4650 -7.6569 -7.6569 -7.6569 -7.6569 3.5285 3.5285 3.5285 3.5285 4.7900 4.7900 4.7900 4.7900 5.2705 5.2705 5.2705 5.2705 6.1168 6.1168 6.1168 6.1168 6.6434 6.6434 6.6434 6.6434 6.7631 6.7631 6.7631 6.7631 7.4794 7.4794 7.4794 7.4794 7.7782 7.7782 7.7782 7.7782 8.3303 8.3303 8.3303 8.3303 8.5136 8.5136 8.5136 8.5136 9.2806 9.2806 9.2806 9.2806 12.6101 12.6101 12.6101 12.6101 17.1095 17.1095 17.1095 17.1095 19.1282 19.1282 k = 0.2222 0.1283 0.1168 ( 3254 PWs) bands (ev): -9.4299 -9.4299 -9.4299 -9.4299 -7.6491 -7.6491 -7.6491 -7.6491 3.5434 3.5434 3.5434 3.5434 4.7488 4.7488 4.7488 4.7488 5.2729 5.2729 5.2729 5.2729 6.0601 6.0601 6.0601 6.0601 6.6439 6.6439 6.6439 6.6439 6.7477 6.7477 6.7477 6.7477 7.4886 7.4886 7.4886 7.4886 7.7654 7.7654 7.7654 7.7654 8.3556 8.3556 8.3556 8.3556 8.5017 8.5017 8.5017 8.5017 9.2728 9.2728 9.2728 9.2728 12.6168 12.6168 12.6168 12.6168 17.2094 17.2094 17.2094 17.2094 19.1929 19.1929 k = 0.2302 0.1329 0.1168 ( 3254 PWs) bands (ev): -9.3939 -9.3939 -9.3939 -9.3939 -7.6415 -7.6415 -7.6415 -7.6415 3.5567 3.5567 3.5567 3.5567 4.6986 4.6986 4.6986 4.6986 5.2807 5.2807 5.2807 5.2807 6.0025 6.0025 6.0025 6.0025 6.6398 6.6398 6.6398 6.6398 6.7419 6.7419 6.7419 6.7419 7.5004 7.5004 7.5004 7.5004 7.7527 7.7527 7.7527 7.7527 8.3678 8.3678 8.3678 8.3678 8.5052 8.5052 8.5052 8.5052 9.2663 9.2663 9.2663 9.2663 12.6230 12.6230 12.6230 12.6230 17.3087 17.3087 17.3087 17.3087 19.2529 19.2529 k = 0.2381 0.1375 0.1168 ( 3264 PWs) bands (ev): -9.3573 -9.3573 -9.3573 -9.3573 -7.6341 -7.6341 -7.6341 -7.6341 3.5680 3.5680 3.5680 3.5680 4.6427 4.6427 4.6427 4.6427 5.2904 5.2904 5.2904 5.2904 5.9449 5.9449 5.9449 5.9449 6.6283 6.6283 6.6283 6.6283 6.7476 6.7476 6.7476 6.7476 7.5150 7.5150 7.5150 7.5150 7.7402 7.7402 7.7402 7.7402 8.3653 8.3653 8.3653 8.3653 8.5262 8.5262 8.5262 8.5262 9.2612 9.2612 9.2612 9.2612 12.6287 12.6287 12.6287 12.6287 17.4069 17.4069 17.4069 17.4069 19.3077 19.3077 k = 0.2460 0.1420 0.1168 ( 3270 PWs) bands (ev): -9.3198 -9.3198 -9.3198 -9.3198 -7.6271 -7.6271 -7.6271 -7.6271 3.5770 3.5770 3.5770 3.5770 4.5836 4.5836 4.5836 4.5836 5.2996 5.2996 5.2996 5.2996 5.8882 5.8882 5.8882 5.8882 6.6110 6.6110 6.6110 6.6110 6.7625 6.7625 6.7625 6.7625 7.5322 7.5322 7.5322 7.5322 7.7281 7.7281 7.7281 7.7281 8.3545 8.3545 8.3545 8.3545 8.5583 8.5583 8.5583 8.5583 9.2578 9.2578 9.2578 9.2578 12.6339 12.6339 12.6339 12.6339 17.5037 17.5037 17.5037 17.5037 19.3567 19.3567 k = 0.2540 0.1466 0.1168 ( 3272 PWs) bands (ev): -9.2818 -9.2818 -9.2818 -9.2818 -7.6204 -7.6204 -7.6204 -7.6204 3.5833 3.5833 3.5833 3.5833 4.5233 4.5233 4.5233 4.5233 5.3067 5.3067 5.3067 5.3067 5.8330 5.8330 5.8330 5.8330 6.5904 6.5904 6.5904 6.5904 6.7827 6.7827 6.7827 6.7827 7.5514 7.5514 7.5514 7.5514 7.7171 7.7171 7.7171 7.7171 8.3421 8.3421 8.3421 8.3421 8.5957 8.5957 8.5957 8.5957 9.2565 9.2565 9.2565 9.2565 12.6387 12.6387 12.6387 12.6387 17.5985 17.5985 17.5985 17.5985 19.3996 19.3996 k = 0.2619 0.1512 0.1168 ( 3272 PWs) bands (ev): -9.2431 -9.2431 -9.2431 -9.2431 -7.6141 -7.6141 -7.6141 -7.6141 3.5866 3.5866 3.5866 3.5866 4.4631 4.4631 4.4631 4.4631 5.3108 5.3108 5.3108 5.3108 5.7799 5.7799 5.7799 5.7799 6.5685 6.5685 6.5685 6.5685 6.8057 6.8057 6.8057 6.8057 7.5711 7.5711 7.5711 7.5711 7.7081 7.7081 7.7081 7.7081 8.3319 8.3319 8.3319 8.3319 8.6350 8.6350 8.6350 8.6350 9.2577 9.2577 9.2577 9.2577 12.6431 12.6431 12.6431 12.6431 17.6908 17.6908 17.6908 17.6908 19.4361 19.4361 k = 0.2698 0.1558 0.1168 ( 3268 PWs) bands (ev): -9.2039 -9.2039 -9.2039 -9.2039 -7.6082 -7.6082 -7.6082 -7.6082 3.5864 3.5864 3.5864 3.5864 4.4040 4.4040 4.4040 4.4040 5.3114 5.3114 5.3114 5.3114 5.7293 5.7293 5.7293 5.7293 6.5460 6.5460 6.5460 6.5460 6.8295 6.8295 6.8295 6.8295 7.5887 7.5887 7.5887 7.5887 7.7027 7.7027 7.7027 7.7027 8.3269 8.3269 8.3269 8.3269 8.6744 8.6744 8.6744 8.6744 9.2620 9.2620 9.2620 9.2620 12.6472 12.6472 12.6472 12.6472 17.7800 17.7800 17.7800 17.7800 19.4660 19.4660 k = 0.2778 0.1604 0.1168 ( 3272 PWs) bands (ev): -9.1642 -9.1642 -9.1642 -9.1642 -7.6028 -7.6028 -7.6028 -7.6028 3.5822 3.5822 3.5822 3.5822 4.3471 4.3471 4.3471 4.3471 5.3084 5.3084 5.3084 5.3084 5.6818 5.6818 5.6818 5.6818 6.5233 6.5233 6.5233 6.5233 6.8528 6.8528 6.8528 6.8528 7.6004 7.6004 7.6004 7.6004 7.7034 7.7034 7.7034 7.7034 8.3293 8.3293 8.3293 8.3293 8.7128 8.7128 8.7128 8.7128 9.2699 9.2699 9.2699 9.2699 12.6511 12.6511 12.6511 12.6511 17.8656 17.8656 17.8656 17.8656 19.4894 19.4894 k = 0.2857 0.1650 0.1168 ( 3264 PWs) bands (ev): -9.1241 -9.1241 -9.1241 -9.1241 -7.5979 -7.5979 -7.5979 -7.5979 3.5736 3.5736 3.5736 3.5736 4.2929 4.2929 4.2929 4.2929 5.3018 5.3018 5.3018 5.3018 5.6375 5.6375 5.6375 5.6375 6.5008 6.5008 6.5008 6.5008 6.8748 6.8748 6.8748 6.8748 7.6033 7.6033 7.6033 7.6033 7.7109 7.7109 7.7109 7.7109 8.3417 8.3417 8.3417 8.3417 8.7491 8.7491 8.7491 8.7491 9.2822 9.2822 9.2822 9.2822 12.6548 12.6548 12.6548 12.6548 17.9471 17.9471 17.9471 17.9471 19.5063 19.5063 k = 0.2937 0.1695 0.1168 ( 3276 PWs) bands (ev): -9.0837 -9.0837 -9.0837 -9.0837 -7.5936 -7.5936 -7.5936 -7.5936 3.5602 3.5602 3.5602 3.5602 4.2422 4.2422 4.2422 4.2422 5.2919 5.2919 5.2919 5.2919 5.5967 5.5967 5.5967 5.5967 6.4786 6.4786 6.4786 6.4786 6.8949 6.8949 6.8949 6.8949 7.5988 7.5988 7.5988 7.5988 7.7217 7.7217 7.7217 7.7217 8.3662 8.3662 8.3662 8.3662 8.7826 8.7826 8.7826 8.7826 9.2996 9.2996 9.2996 9.2996 12.6584 12.6584 12.6584 12.6584 18.0236 18.0236 18.0236 18.0236 19.5167 19.5167 k = 0.3016 0.1741 0.1168 ( 3264 PWs) bands (ev): -9.0430 -9.0430 -9.0430 -9.0430 -7.5899 -7.5899 -7.5899 -7.5899 3.5418 3.5418 3.5418 3.5418 4.1954 4.1954 4.1954 4.1954 5.2792 5.2792 5.2792 5.2792 5.5594 5.5594 5.5594 5.5594 6.4568 6.4568 6.4568 6.4568 6.9127 6.9127 6.9127 6.9127 7.5897 7.5897 7.5897 7.5897 7.7313 7.7313 7.7313 7.7313 8.4040 8.4040 8.4040 8.4040 8.8129 8.8129 8.8129 8.8129 9.3225 9.3225 9.3225 9.3225 12.6619 12.6619 12.6619 12.6619 18.0947 18.0947 18.0947 18.0947 19.5203 19.5203 k = 0.3095 0.1787 0.1168 ( 3274 PWs) bands (ev): -9.0021 -9.0021 -9.0021 -9.0021 -7.5869 -7.5869 -7.5869 -7.5869 3.5184 3.5184 3.5184 3.5184 4.1527 4.1527 4.1527 4.1527 5.2644 5.2644 5.2644 5.2644 5.5255 5.5255 5.5255 5.5255 6.4355 6.4355 6.4355 6.4355 6.9282 6.9282 6.9282 6.9282 7.5780 7.5780 7.5780 7.5780 7.7367 7.7367 7.7367 7.7367 8.4550 8.4550 8.4550 8.4550 8.8400 8.8400 8.8400 8.8400 9.3515 9.3515 9.3515 9.3515 12.6655 12.6655 12.6655 12.6655 18.1596 18.1596 18.1596 18.1596 19.5167 19.5167 k = 0.3175 0.1833 0.1168 ( 3278 PWs) bands (ev): -8.9611 -8.9611 -8.9611 -8.9611 -7.5846 -7.5846 -7.5846 -7.5846 3.4902 3.4902 3.4902 3.4902 4.1141 4.1141 4.1141 4.1141 5.2481 5.2481 5.2481 5.2481 5.4947 5.4947 5.4947 5.4947 6.4148 6.4148 6.4148 6.4148 6.9414 6.9414 6.9414 6.9414 7.5649 7.5649 7.5649 7.5649 7.7370 7.7370 7.7370 7.7370 8.5174 8.5174 8.5174 8.5174 8.8643 8.8643 8.8643 8.8643 9.3865 9.3865 9.3865 9.3865 12.6691 12.6691 12.6691 12.6691 18.2176 18.2176 18.2176 18.2176 19.5043 19.5043 k = 0.3254 0.1879 0.1168 ( 3268 PWs) bands (ev): -8.9201 -8.9201 -8.9201 -8.9201 -7.5830 -7.5830 -7.5830 -7.5830 3.4576 3.4576 3.4576 3.4576 4.0792 4.0792 4.0792 4.0792 5.2311 5.2311 5.2311 5.2311 5.4667 5.4667 5.4667 5.4667 6.3947 6.3947 6.3947 6.3947 6.9527 6.9527 6.9527 6.9527 7.5508 7.5508 7.5508 7.5508 7.7327 7.7327 7.7327 7.7327 8.5881 8.5881 8.5881 8.5881 8.8877 8.8877 8.8877 8.8877 9.4276 9.4276 9.4276 9.4276 12.6729 12.6729 12.6729 12.6729 18.2679 18.2679 18.2679 18.2679 19.4806 19.4806 k = 0.3333 0.1925 0.1168 ( 3272 PWs) bands (ev): -8.8792 -8.8792 -8.8792 -8.8792 -7.5822 -7.5822 -7.5822 -7.5822 3.4214 3.4214 3.4214 3.4214 4.0477 4.0477 4.0477 4.0477 5.2142 5.2142 5.2142 5.2142 5.4409 5.4409 5.4409 5.4409 6.3753 6.3753 6.3753 6.3753 6.9621 6.9621 6.9621 6.9621 7.5360 7.5360 7.5360 7.5360 7.7246 7.7246 7.7246 7.7246 8.6618 8.6618 8.6618 8.6618 8.9133 8.9133 8.9133 8.9133 9.4746 9.4746 9.4746 9.4746 12.6770 12.6770 12.6770 12.6770 18.3097 18.3097 18.3097 18.3097 19.4414 19.4414 k = 0.3413 0.1970 0.1168 ( 3276 PWs) bands (ev): -8.8385 -8.8385 -8.8385 -8.8385 -7.5822 -7.5822 -7.5822 -7.5822 3.3822 3.3822 3.3822 3.3822 4.0190 4.0190 4.0190 4.0190 5.1979 5.1979 5.1979 5.1979 5.4172 5.4172 5.4172 5.4172 6.3565 6.3565 6.3565 6.3565 6.9700 6.9700 6.9700 6.9700 7.5208 7.5208 7.5208 7.5208 7.7137 7.7137 7.7137 7.7137 8.7302 8.7302 8.7302 8.7302 8.9474 8.9474 8.9474 8.9474 9.5274 9.5274 9.5274 9.5274 12.6814 12.6814 12.6814 12.6814 18.3416 18.3416 18.3416 18.3416 19.3811 19.3811 k = 0.3492 0.2016 0.1168 ( 3280 PWs) bands (ev): -8.7980 -8.7980 -8.7980 -8.7980 -7.5830 -7.5830 -7.5830 -7.5830 3.3410 3.3410 3.3410 3.3410 3.9925 3.9925 3.9925 3.9925 5.1828 5.1828 5.1828 5.1828 5.3950 5.3950 5.3950 5.3950 6.3385 6.3385 6.3385 6.3385 6.9766 6.9766 6.9766 6.9766 7.5051 7.5051 7.5051 7.5051 7.7009 7.7009 7.7009 7.7009 8.7832 8.7832 8.7832 8.7832 8.9983 8.9983 8.9983 8.9983 9.5859 9.5859 9.5859 9.5859 12.6862 12.6862 12.6862 12.6862 18.3621 18.3621 18.3621 18.3621 19.2952 19.2952 k = 0.3571 0.2062 0.1168 ( 3280 PWs) bands (ev): -8.7579 -8.7579 -8.7579 -8.7579 -7.5846 -7.5846 -7.5846 -7.5846 3.2986 3.2986 3.2986 3.2986 3.9678 3.9678 3.9678 3.9678 5.1691 5.1691 5.1691 5.1691 5.3743 5.3743 5.3743 5.3743 6.3212 6.3212 6.3212 6.3212 6.9822 6.9822 6.9822 6.9822 7.4892 7.4892 7.4892 7.4892 7.6871 7.6871 7.6871 7.6871 8.8164 8.8164 8.8164 8.8164 9.0681 9.0681 9.0681 9.0681 9.6506 9.6506 9.6506 9.6506 12.6916 12.6916 12.6916 12.6916 18.3682 18.3682 18.3682 18.3682 19.1849 19.1849 k = 0.3651 0.2108 0.1168 ( 3280 PWs) bands (ev): -8.7183 -8.7183 -8.7183 -8.7183 -7.5871 -7.5871 -7.5871 -7.5871 3.2556 3.2556 3.2556 3.2556 3.9445 3.9445 3.9445 3.9445 5.1571 5.1571 5.1571 5.1571 5.3548 5.3548 5.3548 5.3548 6.3048 6.3048 6.3048 6.3048 6.9869 6.9869 6.9869 6.9869 7.4729 7.4729 7.4729 7.4729 7.6729 7.6729 7.6729 7.6729 8.8350 8.8350 8.8350 8.8350 9.1496 9.1496 9.1496 9.1496 9.7218 9.7218 9.7218 9.7218 12.6977 12.6977 12.6977 12.6977 18.3547 18.3547 18.3547 18.3547 19.0603 19.0603 k = 0.3730 0.2154 0.1168 ( 3278 PWs) bands (ev): -8.6793 -8.6793 -8.6793 -8.6793 -7.5903 -7.5903 -7.5903 -7.5903 3.2128 3.2128 3.2128 3.2128 3.9223 3.9223 3.9223 3.9223 5.1468 5.1468 5.1468 5.1468 5.3365 5.3365 5.3365 5.3365 6.2891 6.2891 6.2891 6.2891 6.9910 6.9910 6.9910 6.9910 7.4564 7.4564 7.4564 7.4564 7.6585 7.6585 7.6585 7.6585 8.8454 8.8454 8.8454 8.8454 9.2345 9.2345 9.2345 9.2345 9.8003 9.8003 9.8003 9.8003 12.7046 12.7046 12.7046 12.7046 18.3133 18.3133 18.3133 18.3133 18.9384 18.9384 k = 0.3810 0.2199 0.1168 ( 3278 PWs) bands (ev): -8.6410 -8.6410 -8.6410 -8.6410 -7.5944 -7.5944 -7.5944 -7.5944 3.1706 3.1706 3.1706 3.1706 3.9009 3.9009 3.9009 3.9009 5.1383 5.1383 5.1383 5.1383 5.3192 5.3192 5.3192 5.3192 6.2743 6.2743 6.2743 6.2743 6.9945 6.9945 6.9945 6.9945 7.4399 7.4399 7.4399 7.4399 7.6445 7.6445 7.6445 7.6445 8.8510 8.8510 8.8510 8.8510 9.3173 9.3173 9.3173 9.3173 9.8863 9.8863 9.8863 9.8863 12.7123 12.7123 12.7123 12.7123 18.2344 18.2344 18.2344 18.2344 18.8369 18.8369 k = 0.3889 0.2245 0.1168 ( 3282 PWs) bands (ev): -8.6036 -8.6036 -8.6036 -8.6036 -7.5992 -7.5992 -7.5992 -7.5992 3.1296 3.1296 3.1296 3.1296 3.8805 3.8805 3.8805 3.8805 5.1314 5.1314 5.1314 5.1314 5.3030 5.3030 5.3030 5.3030 6.2604 6.2604 6.2604 6.2604 6.9977 6.9977 6.9977 6.9977 7.4232 7.4232 7.4232 7.4232 7.6311 7.6311 7.6311 7.6311 8.8540 8.8540 8.8540 8.8540 9.3949 9.3949 9.3949 9.3949 9.9796 9.9796 9.9796 9.9796 12.7212 12.7212 12.7212 12.7212 18.1154 18.1154 18.1154 18.1154 18.7650 18.7650 k = 0.3968 0.2291 0.1168 ( 3286 PWs) bands (ev): -8.5672 -8.5672 -8.5672 -8.5672 -7.6048 -7.6048 -7.6048 -7.6048 3.0901 3.0901 3.0901 3.0901 3.8608 3.8608 3.8608 3.8608 5.1260 5.1260 5.1260 5.1260 5.2878 5.2878 5.2878 5.2878 6.2474 6.2474 6.2474 6.2474 7.0007 7.0007 7.0007 7.0007 7.4067 7.4067 7.4067 7.4067 7.6183 7.6183 7.6183 7.6183 8.8553 8.8553 8.8553 8.8553 9.4657 9.4657 9.4657 9.4657 10.0793 10.0793 10.0793 10.0793 12.7312 12.7312 12.7312 12.7312 17.9654 17.9654 17.9654 17.9654 18.7185 18.7185 k = 0.4048 0.2337 0.1168 ( 3288 PWs) bands (ev): -8.5320 -8.5320 -8.5320 -8.5320 -7.6110 -7.6110 -7.6110 -7.6110 3.0525 3.0525 3.0525 3.0525 3.8420 3.8420 3.8420 3.8420 5.1219 5.1219 5.1219 5.1219 5.2736 5.2736 5.2736 5.2736 6.2352 6.2352 6.2352 6.2352 7.0036 7.0036 7.0036 7.0036 7.3903 7.3903 7.3903 7.3903 7.6064 7.6064 7.6064 7.6064 8.8555 8.8555 8.8555 8.8555 9.5295 9.5295 9.5295 9.5295 10.1839 10.1839 10.1839 10.1839 12.7426 12.7426 12.7426 12.7426 17.7974 17.7974 17.7974 17.7974 18.6883 18.6883 k = 0.4127 0.2383 0.1168 ( 3280 PWs) bands (ev): -8.4981 -8.4981 -8.4981 -8.4981 -7.6178 -7.6178 -7.6178 -7.6178 3.0171 3.0171 3.0171 3.0171 3.8241 3.8241 3.8241 3.8241 5.1190 5.1190 5.1190 5.1190 5.2606 5.2606 5.2606 5.2606 6.2240 6.2240 6.2240 6.2240 7.0063 7.0063 7.0063 7.0063 7.3743 7.3743 7.3743 7.3743 7.5954 7.5954 7.5954 7.5954 8.8550 8.8550 8.8550 8.8550 9.5863 9.5863 9.5863 9.5863 10.2911 10.2911 10.2911 10.2911 12.7554 12.7554 12.7554 12.7554 17.6218 17.6218 17.6218 17.6218 18.6672 18.6672 k = 0.4206 0.2429 0.1168 ( 3284 PWs) bands (ev): -8.4659 -8.4659 -8.4659 -8.4659 -7.6251 -7.6251 -7.6251 -7.6251 2.9840 2.9840 2.9840 2.9840 3.8073 3.8073 3.8073 3.8073 5.1170 5.1170 5.1170 5.1170 5.2486 5.2486 5.2486 5.2486 6.2137 6.2137 6.2137 6.2137 7.0091 7.0091 7.0091 7.0091 7.3588 7.3588 7.3588 7.3588 7.5854 7.5854 7.5854 7.5854 8.8540 8.8540 8.8540 8.8540 9.6367 9.6367 9.6367 9.6367 10.3987 10.3987 10.3987 10.3987 12.7697 12.7697 12.7697 12.7697 17.4452 17.4452 17.4452 17.4452 18.6512 18.6512 k = 0.4286 0.2474 0.1168 ( 3284 PWs) bands (ev): -8.4354 -8.4354 -8.4354 -8.4354 -7.6327 -7.6327 -7.6327 -7.6327 2.9536 2.9536 2.9536 2.9536 3.7916 3.7916 3.7916 3.7916 5.1157 5.1157 5.1157 5.1157 5.2378 5.2378 5.2378 5.2378 6.2044 6.2044 6.2044 6.2044 7.0118 7.0118 7.0118 7.0118 7.3439 7.3439 7.3439 7.3439 7.5763 7.5763 7.5763 7.5763 8.8528 8.8528 8.8528 8.8528 9.6813 9.6813 9.6813 9.6813 10.5044 10.5044 10.5044 10.5044 12.7855 12.7855 12.7855 12.7855 17.2724 17.2724 17.2724 17.2724 18.6381 18.6381 k = 0.4365 0.2520 0.1168 ( 3284 PWs) bands (ev): -8.4069 -8.4069 -8.4069 -8.4069 -7.6405 -7.6405 -7.6405 -7.6405 2.9260 2.9260 2.9260 2.9260 3.7772 3.7772 3.7772 3.7772 5.1151 5.1151 5.1151 5.1151 5.2281 5.2281 5.2281 5.2281 6.1960 6.1960 6.1960 6.1960 7.0145 7.0145 7.0145 7.0145 7.3298 7.3298 7.3298 7.3298 7.5682 7.5682 7.5682 7.5682 8.8515 8.8515 8.8515 8.8515 9.7204 9.7204 9.7204 9.7204 10.6058 10.6058 10.6058 10.6058 12.8028 12.8028 12.8028 12.8028 17.1067 17.1067 17.1067 17.1067 18.6271 18.6271 k = 0.4444 0.2566 0.1168 ( 3284 PWs) bands (ev): -8.3808 -8.3808 -8.3808 -8.3808 -7.6482 -7.6482 -7.6482 -7.6482 2.9013 2.9013 2.9013 2.9013 3.7642 3.7642 3.7642 3.7642 5.1147 5.1147 5.1147 5.1147 5.2196 5.2196 5.2196 5.2196 6.1886 6.1886 6.1886 6.1886 7.0172 7.0172 7.0172 7.0172 7.3167 7.3167 7.3167 7.3167 7.5611 7.5611 7.5611 7.5611 8.8502 8.8502 8.8502 8.8502 9.7544 9.7544 9.7544 9.7544 10.7010 10.7010 10.7010 10.7010 12.8211 12.8211 12.8211 12.8211 16.9513 16.9513 16.9513 16.9513 18.6176 18.6176 k = 0.4524 0.2612 0.1168 ( 3276 PWs) bands (ev): -8.3572 -8.3572 -8.3572 -8.3572 -7.6557 -7.6557 -7.6557 -7.6557 2.8797 2.8797 2.8797 2.8797 3.7527 3.7527 3.7527 3.7527 5.1147 5.1147 5.1147 5.1147 5.2123 5.2123 5.2123 5.2123 6.1821 6.1821 6.1821 6.1821 7.0199 7.0199 7.0199 7.0199 7.3048 7.3048 7.3048 7.3048 7.5550 7.5550 7.5550 7.5550 8.8489 8.8489 8.8489 8.8489 9.7836 9.7836 9.7836 9.7836 10.7878 10.7878 10.7878 10.7878 12.8402 12.8402 12.8402 12.8402 16.8089 16.8089 16.8089 16.8089 18.6093 18.6093 k = 0.4603 0.2658 0.1168 ( 3270 PWs) bands (ev): -8.3364 -8.3364 -8.3364 -8.3364 -7.6627 -7.6627 -7.6627 -7.6627 2.8612 2.8612 2.8612 2.8612 3.7428 3.7428 3.7428 3.7428 5.1148 5.1148 5.1148 5.1148 5.2062 5.2062 5.2062 5.2062 6.1767 6.1767 6.1767 6.1767 7.0223 7.0223 7.0223 7.0223 7.2943 7.2943 7.2943 7.2943 7.5498 7.5498 7.5498 7.5498 8.8477 8.8477 8.8477 8.8477 9.8082 9.8082 9.8082 9.8082 10.8646 10.8646 10.8646 10.8646 12.8591 12.8591 12.8591 12.8591 16.6821 16.6821 16.6821 16.6821 18.6023 18.6023 k = 0.4683 0.2703 0.1168 ( 3278 PWs) bands (ev): -8.3189 -8.3189 -8.3189 -8.3189 -7.6689 -7.6689 -7.6689 -7.6689 2.8460 2.8460 2.8460 2.8460 3.7346 3.7346 3.7346 3.7346 5.1149 5.1149 5.1149 5.1149 5.2013 5.2013 5.2013 5.2013 6.1722 6.1722 6.1722 6.1722 7.0246 7.0246 7.0246 7.0246 7.2853 7.2853 7.2853 7.2853 7.5456 7.5456 7.5456 7.5456 8.8467 8.8467 8.8467 8.8467 9.8281 9.8281 9.8281 9.8281 10.9296 10.9296 10.9296 10.9296 12.8771 12.8771 12.8771 12.8771 16.5737 16.5737 16.5737 16.5737 18.5965 18.5965 k = 0.4762 0.2749 0.1168 ( 3286 PWs) bands (ev): -8.3049 -8.3049 -8.3049 -8.3049 -7.6741 -7.6741 -7.6741 -7.6741 2.8341 2.8341 2.8341 2.8341 3.7281 3.7281 3.7281 3.7281 5.1150 5.1150 5.1150 5.1150 5.1975 5.1975 5.1975 5.1975 6.1687 6.1687 6.1687 6.1687 7.0265 7.0265 7.0265 7.0265 7.2781 7.2781 7.2781 7.2781 7.5423 7.5423 7.5423 7.5423 8.8459 8.8459 8.8459 8.8459 9.8436 9.8436 9.8436 9.8436 10.9815 10.9815 10.9815 10.9815 12.8929 12.8929 12.8929 12.8929 16.4861 16.4861 16.4861 16.4861 18.5919 18.5919 k = 0.4841 0.2795 0.1168 ( 3290 PWs) bands (ev): -8.2947 -8.2947 -8.2947 -8.2947 -7.6780 -7.6780 -7.6780 -7.6780 2.8255 2.8255 2.8255 2.8255 3.7235 3.7235 3.7235 3.7235 5.1151 5.1151 5.1151 5.1151 5.1949 5.1949 5.1949 5.1949 6.1662 6.1662 6.1662 6.1662 7.0279 7.0279 7.0279 7.0279 7.2728 7.2728 7.2728 7.2728 7.5400 7.5400 7.5400 7.5400 8.8453 8.8453 8.8453 8.8453 9.8547 9.8547 9.8547 9.8547 11.0193 11.0193 11.0193 11.0193 12.9053 12.9053 12.9053 12.9053 16.4216 16.4216 16.4216 16.4216 18.5886 18.5886 k = 0.4921 0.2841 0.1168 ( 3290 PWs) bands (ev): -8.2884 -8.2884 -8.2884 -8.2884 -7.6805 -7.6805 -7.6805 -7.6805 2.8204 2.8204 2.8204 2.8204 3.7207 3.7207 3.7207 3.7207 5.1151 5.1151 5.1151 5.1151 5.1933 5.1933 5.1933 5.1933 6.1647 6.1647 6.1647 6.1647 7.0288 7.0288 7.0288 7.0288 7.2696 7.2696 7.2696 7.2696 7.5386 7.5386 7.5386 7.5386 8.8449 8.8449 8.8449 8.8449 9.8613 9.8613 9.8613 9.8613 11.0423 11.0423 11.0423 11.0423 12.9132 12.9132 12.9132 12.9132 16.3821 16.3821 16.3821 16.3821 18.5866 18.5866 k = 0.5000 0.2887 0.1168 ( 3284 PWs) bands (ev): -8.2863 -8.2863 -8.2863 -8.2863 -7.6813 -7.6813 -7.6813 -7.6813 2.8187 2.8187 2.8187 2.8187 3.7197 3.7197 3.7197 3.7197 5.1152 5.1152 5.1152 5.1152 5.1928 5.1928 5.1928 5.1928 6.1642 6.1642 6.1642 6.1642 7.0291 7.0291 7.0291 7.0291 7.2685 7.2685 7.2685 7.2685 7.5381 7.5381 7.5381 7.5381 8.8448 8.8448 8.8448 8.8448 9.8635 9.8635 9.8635 9.8635 11.0501 11.0501 11.0501 11.0501 12.9160 12.9160 12.9160 12.9160 16.3688 16.3688 16.3688 16.3688 18.5859 18.5859 k = 0.5000 0.2887 0.1168 ( 3284 PWs) bands (ev): -8.2863 -8.2863 -8.2863 -8.2863 -7.6813 -7.6813 -7.6813 -7.6813 2.8187 2.8187 2.8187 2.8187 3.7197 3.7197 3.7197 3.7197 5.1152 5.1152 5.1152 5.1152 5.1928 5.1928 5.1928 5.1928 6.1642 6.1642 6.1642 6.1642 7.0291 7.0291 7.0291 7.0291 7.2685 7.2685 7.2685 7.2685 7.5381 7.5381 7.5381 7.5381 8.8448 8.8448 8.8448 8.8448 9.8635 9.8635 9.8635 9.8635 11.0501 11.0501 11.0501 11.0501 12.9160 12.9160 12.9160 12.9160 16.3688 16.3688 16.3688 16.3688 18.5859 18.5859 k = 0.4955 0.2965 0.1168 ( 3288 PWs) bands (ev): -8.2859 -8.2859 -8.2859 -8.2859 -7.6813 -7.6813 -7.6813 -7.6813 2.8194 2.8194 2.8195 2.8195 3.7202 3.7202 3.7203 3.7203 5.1146 5.1146 5.1162 5.1162 5.1915 5.1915 5.1964 5.1964 6.1556 6.1556 6.1661 6.1661 7.0231 7.0231 7.0356 7.0356 7.2688 7.2688 7.2692 7.2692 7.5341 7.5341 7.5404 7.5404 8.8435 8.8435 8.8436 8.8436 9.8586 9.8586 9.8596 9.8596 11.0489 11.0489 11.0500 11.0500 12.9225 12.9225 12.9230 12.9230 16.3692 16.3692 16.3692 16.3692 18.5897 18.5899 k = 0.4910 0.3043 0.1168 ( 3284 PWs) bands (ev): -8.2848 -8.2848 -8.2847 -8.2847 -7.6813 -7.6813 -7.6812 -7.6812 2.8217 2.8217 2.8218 2.8218 3.7218 3.7218 3.7220 3.7220 5.1146 5.1146 5.1175 5.1175 5.1927 5.1927 5.2024 5.2024 6.1406 6.1406 6.1614 6.1614 7.0177 7.0177 7.0421 7.0421 7.2699 7.2699 7.2710 7.2710 7.5285 7.5285 7.5411 7.5411 8.8396 8.8396 8.8399 8.8399 9.8450 9.8450 9.8468 9.8468 11.0468 11.0468 11.0489 11.0489 12.9423 12.9423 12.9434 12.9434 16.3703 16.3703 16.3705 16.3705 18.6010 18.6011 k = 0.4865 0.3121 0.1168 ( 3288 PWs) bands (ev): -8.2828 -8.2828 -8.2828 -8.2828 -7.6812 -7.6812 -7.6812 -7.6812 2.8254 2.8254 2.8256 2.8256 3.7245 3.7245 3.7247 3.7247 5.1150 5.1150 5.1185 5.1185 5.1968 5.1968 5.2107 5.2107 6.1196 6.1196 6.1504 6.1504 7.0125 7.0125 7.0480 7.0480 7.2717 7.2717 7.2740 7.2740 7.5214 7.5214 7.5404 7.5404 8.8332 8.8332 8.8337 8.8337 9.8230 9.8230 9.8257 9.8257 11.0436 11.0436 11.0467 11.0467 12.9751 12.9751 12.9768 12.9768 16.3722 16.3722 16.3725 16.3725 18.6199 18.6204 k = 0.4820 0.3199 0.1168 ( 3288 PWs) bands (ev): -8.2801 -8.2801 -8.2801 -8.2801 -7.6812 -7.6812 -7.6811 -7.6811 2.8307 2.8307 2.8310 2.8310 3.7282 3.7282 3.7285 3.7285 5.1156 5.1156 5.1189 5.1189 5.2040 5.2040 5.2215 5.2215 6.0932 6.0932 6.1335 6.1335 7.0073 7.0073 7.0525 7.0525 7.2741 7.2741 7.2786 7.2786 7.5131 7.5131 7.5386 7.5386 8.8243 8.8243 8.8249 8.8249 9.7931 9.7931 9.7966 9.7966 11.0397 11.0397 11.0436 11.0436 13.0203 13.0203 13.0224 13.0224 16.3749 16.3749 16.3752 16.3752 18.6463 18.6472 k = 0.4775 0.3277 0.1168 ( 3288 PWs) bands (ev): -8.2766 -8.2766 -8.2765 -8.2765 -7.6811 -7.6811 -7.6810 -7.6810 2.8376 2.8376 2.8379 2.8379 3.7330 3.7330 3.7334 3.7334 5.1161 5.1161 5.1182 5.1182 5.2146 5.2146 5.2348 5.2348 6.0620 6.0620 6.1115 6.1115 7.0015 7.0015 7.0545 7.0545 7.2769 7.2769 7.2848 7.2848 7.5041 7.5041 7.5361 7.5361 8.8130 8.8130 8.8137 8.8137 9.7561 9.7561 9.7602 9.7602 11.0352 11.0352 11.0396 11.0396 13.0769 13.0769 13.0794 13.0794 16.3783 16.3783 16.3787 16.3787 18.6801 18.6812 k = 0.4730 0.3355 0.1168 ( 3286 PWs) bands (ev): -8.2724 -8.2724 -8.2723 -8.2723 -7.6811 -7.6811 -7.6810 -7.6810 2.8459 2.8459 2.8463 2.8463 3.7388 3.7388 3.7393 3.7393 5.1162 5.1162 5.1162 5.1162 5.2283 5.2283 5.2508 5.2508 6.0270 6.0270 6.0853 6.0853 6.9942 6.9942 7.0532 7.0532 7.2801 7.2801 7.2927 7.2927 7.4947 7.4947 7.5335 7.5335 8.7994 8.7994 8.8001 8.8001 9.7127 9.7127 9.7174 9.7174 11.0302 11.0302 11.0351 11.0351 13.1441 13.1441 13.1469 13.1469 16.3824 16.3824 16.3828 16.3828 18.7214 18.7221 k = 0.4685 0.3433 0.1168 ( 3270 PWs) bands (ev): -8.2673 -8.2673 -8.2673 -8.2673 -7.6810 -7.6810 -7.6809 -7.6809 2.8557 2.8557 2.8561 2.8561 3.7455 3.7455 3.7462 3.7462 5.1128 5.1128 5.1156 5.1156 5.2448 5.2448 5.2695 5.2695 5.9889 5.9889 6.0558 6.0558 6.9848 6.9848 7.0478 7.0478 7.2835 7.2835 7.3024 7.3024 7.4857 7.4857 7.5312 7.5312 8.7834 8.7834 8.7841 8.7841 9.6638 9.6638 9.6689 9.6689 11.0248 11.0248 11.0300 11.0300 13.2210 13.2210 13.2240 13.2240 16.3872 16.3872 16.3876 16.3876 18.7690 18.7701 k = 0.4640 0.3511 0.1168 ( 3274 PWs) bands (ev): -8.2616 -8.2616 -8.2615 -8.2615 -7.6811 -7.6811 -7.6809 -7.6809 2.8669 2.8669 2.8675 2.8675 3.7532 3.7532 3.7540 3.7540 5.1078 5.1078 5.1140 5.1140 5.2639 5.2639 5.2905 5.2905 5.9488 5.9488 6.0243 6.0243 6.9727 6.9727 7.0376 7.0376 7.2869 7.2869 7.3137 7.3137 7.4774 7.4774 7.5298 7.5298 8.7652 8.7652 8.7657 8.7657 9.6102 9.6102 9.6156 9.6156 11.0191 11.0191 11.0245 11.0245 13.3066 13.3066 13.3097 13.3097 16.3925 16.3925 16.3929 16.3929 18.8236 18.8252 k = 0.4595 0.3589 0.1168 ( 3278 PWs) bands (ev): -8.2551 -8.2551 -8.2550 -8.2550 -7.6811 -7.6811 -7.6810 -7.6810 2.8797 2.8797 2.8803 2.8803 3.7618 3.7618 3.7628 3.7628 5.1009 5.1009 5.1110 5.1110 5.2849 5.2849 5.3137 5.3137 5.9076 5.9076 5.9918 5.9918 6.9573 6.9573 7.0224 7.0224 7.2903 7.2903 7.3262 7.3262 7.4706 7.4706 7.5297 7.5297 8.7448 8.7448 8.7452 8.7452 9.5527 9.5527 9.5584 9.5584 11.0132 11.0132 11.0187 11.0187 13.4000 13.4000 13.4032 13.4032 16.3983 16.3983 16.3988 16.3988 18.8842 18.8854 k = 0.4550 0.3667 0.1168 ( 3286 PWs) bands (ev): -8.2479 -8.2479 -8.2478 -8.2478 -7.6813 -7.6813 -7.6811 -7.6811 2.8938 2.8938 2.8945 2.8945 3.7713 3.7713 3.7724 3.7724 5.0919 5.0919 5.1062 5.1062 5.3074 5.3074 5.3385 5.3385 5.8667 5.8667 5.9598 5.9598 6.9382 6.9382 7.0020 7.0020 7.2935 7.2935 7.3395 7.3395 7.4655 7.4655 7.5311 7.5311 8.7223 8.7223 8.7223 8.7223 9.4921 9.4921 9.4981 9.4981 11.0071 11.0071 11.0125 11.0125 13.5003 13.5003 13.5037 13.5037 16.4046 16.4046 16.4052 16.4052 18.9508 18.9517 k = 0.4505 0.3745 0.1168 ( 3286 PWs) bands (ev): -8.2400 -8.2400 -8.2399 -8.2399 -7.6816 -7.6816 -7.6814 -7.6814 2.9094 2.9094 2.9102 2.9102 3.7815 3.7815 3.7828 3.7828 5.0804 5.0804 5.0992 5.0992 5.3306 5.3306 5.3644 5.3644 5.8275 5.8275 5.9297 5.9297 6.9152 6.9152 6.9767 6.9767 7.2966 7.2966 7.3533 7.3533 7.4625 7.4625 7.5342 7.5342 8.6974 8.6974 8.6979 8.6979 9.4293 9.4293 9.4356 9.4356 11.0007 11.0007 11.0061 11.0061 13.6070 13.6070 13.6103 13.6103 16.4115 16.4115 16.4120 16.4120 19.0224 19.0249 k = 0.4459 0.3823 0.1168 ( 3296 PWs) bands (ev): -8.2314 -8.2314 -8.2313 -8.2313 -7.6819 -7.6819 -7.6818 -7.6818 2.9264 2.9264 2.9273 2.9273 3.7924 3.7924 3.7939 3.7939 5.0660 5.0660 5.0893 5.0893 5.3536 5.3536 5.3903 5.3903 5.7919 5.7919 5.9032 5.9032 6.8884 6.8884 6.9468 6.9468 7.2997 7.2997 7.3671 7.3671 7.4618 7.4618 7.5391 7.5391 8.6704 8.6704 8.6715 8.6715 9.3650 9.3650 9.3714 9.3714 10.9941 10.9941 10.9994 10.9994 13.7192 13.7192 13.7226 13.7226 16.4187 16.4187 16.4193 16.4193 19.1006 19.1022 k = 0.4414 0.3901 0.1168 ( 3292 PWs) bands (ev): -8.2221 -8.2221 -8.2220 -8.2220 -7.6825 -7.6825 -7.6823 -7.6823 2.9447 2.9447 2.9457 2.9457 3.8039 3.8039 3.8057 3.8057 5.0483 5.0483 5.0759 5.0759 5.3754 5.3754 5.4147 5.4147 5.7621 5.7621 5.8819 5.8819 6.8579 6.8579 6.9129 6.9129 7.3027 7.3027 7.3805 7.3805 7.4633 7.4633 7.5454 7.5454 8.6414 8.6414 8.6434 8.6434 9.2997 9.2997 9.3064 9.3064 10.9872 10.9872 10.9924 10.9924 13.8364 13.8364 13.8398 13.8398 16.4264 16.4264 16.4269 16.4269 19.1816 19.1835 k = 0.4369 0.3979 0.1168 ( 3288 PWs) bands (ev): -8.2122 -8.2122 -8.2121 -8.2121 -7.6832 -7.6832 -7.6830 -7.6830 2.9644 2.9644 2.9655 2.9655 3.8159 3.8159 3.8180 3.8180 5.0268 5.0268 5.0583 5.0583 5.3951 5.3951 5.4356 5.4356 5.7410 5.7410 5.8676 5.8676 6.8240 6.8240 6.8755 6.8755 7.3057 7.3057 7.3933 7.3933 7.4671 7.4671 7.5532 7.5532 8.6104 8.6104 8.6135 8.6135 9.2340 9.2340 9.2411 9.2411 10.9801 10.9801 10.9852 10.9852 13.9582 13.9582 13.9615 13.9615 16.4345 16.4345 16.4350 16.4350 19.2682 19.2696 k = 0.4324 0.4057 0.1168 ( 3296 PWs) bands (ev): -8.2017 -8.2017 -8.2015 -8.2015 -7.6842 -7.6842 -7.6840 -7.6840 2.9854 2.9854 2.9866 2.9866 3.8284 3.8284 3.8308 3.8308 5.0012 5.0012 5.0360 5.0360 5.4116 5.4116 5.4510 5.4510 5.7311 5.7311 5.8615 5.8615 6.7873 6.7873 6.8353 6.8353 7.3087 7.3087 7.4052 7.4052 7.4730 7.4730 7.5620 7.5620 8.5775 8.5775 8.5820 8.5820 9.1686 9.1686 9.1761 9.1761 10.9726 10.9726 10.9776 10.9776 14.0840 14.0840 14.0872 14.0872 16.4430 16.4430 16.4435 16.4435 19.3553 19.3564 k = 0.4279 0.4135 0.1168 ( 3292 PWs) bands (ev): -8.1905 -8.1905 -8.1903 -8.1903 -7.6854 -7.6854 -7.6852 -7.6852 3.0076 3.0076 3.0089 3.0089 3.8410 3.8410 3.8438 3.8438 4.9715 4.9715 5.0087 5.0087 5.4243 5.4243 5.4597 5.4597 5.7341 5.7341 5.8645 5.8645 6.7483 6.7483 6.7930 6.7930 7.3117 7.3117 7.4163 7.4163 7.4808 7.4808 7.5716 7.5716 8.5428 8.5428 8.5491 8.5491 9.1040 9.1040 9.1120 9.1120 10.9648 10.9648 10.9698 10.9698 14.2134 14.2134 14.2165 14.2165 16.4520 16.4520 16.4524 16.4524 19.4464 19.4470 k = 0.4234 0.4213 0.1168 ( 3292 PWs) bands (ev): -8.1788 -8.1788 -8.1786 -8.1786 -7.6869 -7.6869 -7.6866 -7.6866 3.0311 3.0311 3.0325 3.0325 3.8537 3.8537 3.8570 3.8570 4.9376 4.9376 4.9763 4.9763 5.4334 5.4334 5.4627 5.4627 5.7489 5.7489 5.8763 5.8763 6.7076 6.7076 6.7494 6.7494 7.3148 7.3148 7.4266 7.4266 7.4900 7.4900 7.5818 7.5818 8.5065 8.5065 8.5149 8.5149 9.0405 9.0405 9.0491 9.0491 10.9568 10.9568 10.9616 10.9616 14.3462 14.3462 14.3491 14.3491 16.4614 16.4614 16.4619 16.4619 19.5412 19.5417 k = 0.4189 0.4291 0.1168 ( 3300 PWs) bands (ev): -8.1665 -8.1665 -8.1663 -8.1663 -7.6887 -7.6887 -7.6884 -7.6884 3.0557 3.0557 3.0573 3.0573 3.8663 3.8663 3.8701 3.8701 4.9001 4.9001 4.9393 4.9393 5.4394 5.4394 5.4622 5.4622 5.7726 5.7726 5.8960 5.8960 6.6660 6.6660 6.7053 6.7053 7.3178 7.3178 7.4363 7.4363 7.5003 7.5003 7.5923 7.5923 8.4685 8.4685 8.4795 8.4795 8.9785 8.9785 8.9880 8.9880 10.9484 10.9484 10.9532 10.9532 14.4820 14.4820 14.4846 14.4846 16.4714 16.4714 16.4718 16.4718 19.6309 19.6336 k = 0.4144 0.4369 0.1168 ( 3300 PWs) bands (ev): -8.1537 -8.1537 -8.1535 -8.1535 -7.6909 -7.6909 -7.6906 -7.6906 3.0815 3.0815 3.0833 3.0833 3.8786 3.8786 3.8828 3.8828 4.8594 4.8594 4.8982 4.8982 5.4431 5.4431 5.4606 5.4606 5.8017 5.8017 5.9217 5.9217 6.6245 6.6245 6.6618 6.6618 7.3207 7.3207 7.4456 7.4456 7.5114 7.5114 7.6030 7.6030 8.4291 8.4291 8.4433 8.4433 8.9184 8.9184 8.9289 8.9289 10.9397 10.9397 10.9445 10.9445 14.6204 14.6204 14.6228 14.6228 16.4820 16.4820 16.4823 16.4823 19.7218 19.7229 k = 0.4099 0.4447 0.1168 ( 3300 PWs) bands (ev): -8.1405 -8.1405 -8.1402 -8.1402 -7.6934 -7.6934 -7.6931 -7.6931 3.1084 3.1084 3.1103 3.1103 3.8901 3.8901 3.8951 3.8951 4.8164 4.8164 4.8541 4.8541 5.4453 5.4453 5.4595 5.4595 5.8331 5.8331 5.9513 5.9513 6.5841 6.5841 6.6199 6.6199 7.3234 7.3234 7.4547 7.4547 7.5230 7.5230 7.6138 7.6138 8.3884 8.3884 8.4064 8.4064 8.8605 8.8605 8.8722 8.8722 10.9307 10.9307 10.9355 10.9355 14.7614 14.7614 14.7634 14.7634 16.4933 16.4933 16.4936 16.4936 19.8076 19.8078 k = 0.4054 0.4525 0.1168 ( 3290 PWs) bands (ev): -8.1267 -8.1267 -8.1264 -8.1264 -7.6964 -7.6964 -7.6961 -7.6961 3.1363 3.1363 3.1384 3.1384 3.9008 3.9008 3.9063 3.9063 4.7717 4.7717 4.8080 4.8080 5.4469 5.4469 5.4597 5.4597 5.8641 5.8641 5.9825 5.9825 6.5465 6.5465 6.5811 6.5811 7.3258 7.3258 7.4635 7.4635 7.5348 7.5348 7.6244 7.6244 8.3468 8.3468 8.3693 8.3693 8.8050 8.8050 8.8180 8.8180 10.9215 10.9215 10.9264 10.9264 14.9047 14.9047 14.9062 14.9062 16.5055 16.5055 16.5055 16.5055 19.8836 19.8844 k = 0.4009 0.4603 0.1168 ( 3280 PWs) bands (ev): -8.1125 -8.1125 -8.1122 -8.1122 -7.6999 -7.6999 -7.6995 -7.6995 3.1651 3.1651 3.1675 3.1675 3.9100 3.9100 3.9163 3.9163 4.7265 4.7265 4.7610 4.7610 5.4482 5.4482 5.4615 5.4615 5.8920 5.8920 6.0125 6.0125 6.5134 6.5134 6.5471 6.5471 7.3278 7.3278 7.4721 7.4721 7.5468 7.5468 7.6347 7.6347 8.3044 8.3044 8.3323 8.3323 8.7520 8.7520 8.7666 8.7666 10.9121 10.9121 10.9170 10.9170 15.0500 15.0500 15.0510 15.0510 16.5184 16.5184 16.5185 16.5185 19.9347 19.9357 k = 0.3964 0.4681 0.1168 ( 3278 PWs) bands (ev): -8.0980 -8.0980 -8.0977 -8.0977 -7.7039 -7.7039 -7.7035 -7.7035 3.1949 3.1949 3.1976 3.1976 3.9174 3.9174 3.9245 3.9245 4.6816 4.6816 4.7143 4.7143 5.4494 5.4494 5.4650 5.4650 5.9145 5.9145 6.0381 6.0381 6.4874 6.4874 6.5198 6.5198 7.3292 7.3292 7.4806 7.4806 7.5588 7.5588 7.6447 7.6447 8.2617 8.2617 8.2959 8.2959 8.7017 8.7017 8.7181 8.7181 10.9026 10.9026 10.9076 10.9076 15.1971 15.1971 15.1974 15.1974 16.5322 16.5322 16.5325 16.5325 19.9450 19.9499 k = 0.3919 0.4759 0.1168 ( 3282 PWs) bands (ev): -8.0831 -8.0831 -8.0827 -8.0827 -7.7084 -7.7084 -7.7079 -7.7079 3.2255 3.2255 3.2284 3.2284 3.9224 3.9224 3.9303 3.9303 4.6381 4.6381 4.6690 4.6690 5.4507 5.4507 5.4700 5.4700 5.9290 5.9290 6.0561 6.0561 6.4715 6.4715 6.5011 6.5011 7.3300 7.3300 7.4888 7.4888 7.5709 7.5709 7.6541 7.6541 8.2191 8.2191 8.2607 8.2607 8.6542 8.6542 8.6725 8.6725 10.8930 10.8930 10.8981 10.8981 15.3454 15.3454 15.3460 15.3460 16.5472 16.5472 16.5477 16.5477 19.8918 19.8920 k = 0.3874 0.4837 0.1168 ( 3286 PWs) bands (ev): -8.0680 -8.0680 -8.0676 -8.0676 -7.7134 -7.7134 -7.7130 -7.7130 3.2568 3.2568 3.2601 3.2601 3.9244 3.9244 3.9331 3.9331 4.5970 4.5970 4.6260 4.6260 5.4519 5.4519 5.4764 5.4764 5.9338 5.9338 6.0636 6.0636 6.4679 6.4679 6.4925 6.4925 7.3302 7.3302 7.4969 7.4969 7.5829 7.5829 7.6628 7.6628 8.1770 8.1770 8.2271 8.2271 8.6094 8.6094 8.6299 8.6299 10.8834 10.8834 10.8886 10.8886 15.4946 15.4946 15.4964 15.4964 16.5634 16.5634 16.5643 16.5643 19.7756 19.7757 k = 0.3829 0.4915 0.1168 ( 3286 PWs) bands (ev): -8.0526 -8.0526 -8.0521 -8.0521 -7.7191 -7.7191 -7.7186 -7.7186 3.2887 3.2887 3.2925 3.2925 3.9229 3.9229 3.9323 3.9323 4.5592 4.5592 4.5864 4.5864 5.4531 5.4531 5.4841 5.4841 5.9285 5.9285 6.0602 6.0602 6.4770 6.4770 6.4939 6.4939 7.3295 7.3295 7.5048 7.5048 7.5949 7.5949 7.6708 7.6708 8.1358 8.1358 8.1958 8.1958 8.5675 8.5675 8.5904 8.5904 10.8739 10.8739 10.8793 10.8793 15.6448 15.6448 15.6481 15.6481 16.5810 16.5810 16.5824 16.5824 19.6187 19.6187 k = 0.3784 0.4993 0.1168 ( 3290 PWs) bands (ev): -8.0370 -8.0370 -8.0365 -8.0365 -7.7254 -7.7254 -7.7249 -7.7249 3.3212 3.3212 3.3255 3.3255 3.9171 3.9171 3.9273 3.9273 4.5257 4.5257 4.5510 4.5510 5.4540 5.4540 5.4930 5.4930 5.9139 5.9139 6.0475 6.0475 6.4966 6.4966 6.5041 6.5041 7.3282 7.3282 7.5126 7.5126 7.6068 7.6068 7.6778 7.6778 8.0961 8.0961 8.1672 8.1672 8.5284 8.5284 8.5539 8.5539 10.8646 10.8646 10.8701 10.8701 15.7957 15.7957 15.8010 15.8010 16.6002 16.6002 16.6022 16.6022 19.4393 19.4394 k = 0.3739 0.5071 0.1168 ( 3290 PWs) bands (ev): -8.0213 -8.0213 -8.0208 -8.0208 -7.7323 -7.7323 -7.7317 -7.7317 3.3541 3.3541 3.3590 3.3590 3.9069 3.9069 3.9177 3.9177 4.4970 4.4970 4.5205 4.5205 5.4546 5.4546 5.5029 5.5029 5.8920 5.8920 6.0286 6.0286 6.5210 6.5210 6.5234 6.5234 7.3261 7.3261 7.5204 7.5204 7.6184 7.6184 7.6839 7.6839 8.0582 8.0582 8.1420 8.1420 8.4923 8.4923 8.5205 8.5205 10.8557 10.8557 10.8613 10.8613 15.9468 15.9468 15.9548 15.9548 16.6211 16.6211 16.6239 16.6239 19.2476 19.2476 k = 0.3694 0.5149 0.1168 ( 3294 PWs) bands (ev): -8.0057 -8.0057 -8.0051 -8.0051 -7.7398 -7.7398 -7.7392 -7.7392 3.3873 3.3873 3.3930 3.3930 3.8919 3.8919 3.9033 3.9033 4.4736 4.4736 4.4951 4.4951 5.4548 5.4548 5.5139 5.5139 5.8650 5.8650 6.0067 6.0067 6.5418 6.5418 6.5539 6.5539 7.3234 7.3234 7.5281 7.5281 7.6297 7.6297 7.6888 7.6888 8.0227 8.0227 8.1205 8.1205 8.4592 8.4592 8.4902 8.4902 10.8472 10.8472 10.8529 10.8529 16.0976 16.0976 16.1093 16.1093 16.6439 16.6439 16.6479 16.6479 19.0487 19.0487 k = 0.3649 0.5227 0.1168 ( 3294 PWs) bands (ev): -7.9901 -7.9901 -7.9894 -7.9894 -7.7479 -7.7479 -7.7472 -7.7472 3.4206 3.4206 3.4272 3.4272 3.8723 3.8723 3.8844 3.8844 4.4554 4.4554 4.4749 4.4749 5.4543 5.4543 5.5259 5.5259 5.8350 5.8350 5.9842 5.9842 6.5642 6.5642 6.5853 6.5853 7.3203 7.3203 7.5360 7.5360 7.6403 7.6403 7.6926 7.6926 7.9899 7.9899 8.1029 8.1029 8.4292 8.4292 8.4633 8.4633 10.8392 10.8392 10.8450 10.8450 16.2473 16.2473 16.2641 16.2641 16.6688 16.6688 16.6747 16.6747 18.8459 18.8459 k = 0.3604 0.5305 0.1168 ( 3300 PWs) bands (ev): -7.9748 -7.9748 -7.9741 -7.9741 -7.7565 -7.7565 -7.7557 -7.7557 3.4537 3.4537 3.4617 3.4617 3.8486 3.8486 3.8616 3.8616 4.4419 4.4419 4.4595 4.4595 5.4533 5.4533 5.5388 5.5388 5.8037 5.8037 5.9627 5.9627 6.5863 6.5863 6.6155 6.6155 7.3171 7.3171 7.5441 7.5441 7.6500 7.6500 7.6952 7.6952 7.9604 7.9604 8.0892 8.0892 8.4024 8.4024 8.4397 8.4397 10.8319 10.8319 10.8379 10.8379 16.3942 16.3942 16.4187 16.4187 16.6960 16.6960 16.7050 16.7050 18.6413 18.6413 k = 0.3559 0.5383 0.1168 ( 3304 PWs) bands (ev): -7.9600 -7.9600 -7.9591 -7.9591 -7.7655 -7.7655 -7.7646 -7.7646 3.4864 3.4864 3.4961 3.4961 3.8216 3.8216 3.8359 3.8359 4.4324 4.4324 4.4483 4.4483 5.4517 5.4517 5.5526 5.5526 5.7724 5.7724 5.9435 5.9435 6.6064 6.6064 6.6429 6.6429 7.3141 7.3141 7.5523 7.5523 7.6582 7.6582 7.6968 7.6968 7.9348 7.9348 8.0793 8.0793 8.3792 8.3792 8.4196 8.4196 10.8254 10.8254 10.8315 10.8315 16.5348 16.5348 16.5715 16.5715 16.7263 16.7263 16.7409 16.7409 18.4367 18.4367 k = 0.3514 0.5461 0.1168 ( 3300 PWs) bands (ev): -7.9459 -7.9459 -7.9450 -7.9450 -7.7746 -7.7746 -7.7736 -7.7736 3.5181 3.5181 3.5304 3.5304 3.7919 3.7919 3.8084 3.8084 4.4262 4.4262 4.4406 4.4406 5.4497 5.4497 5.5671 5.5671 5.7422 5.7422 5.9274 5.9274 6.6237 6.6237 6.6662 6.6662 7.3115 7.3115 7.5605 7.5605 7.6647 7.6647 7.6976 7.6976 7.9134 7.9134 8.0727 8.0727 8.3597 8.3597 8.4031 8.4031 10.8199 10.8199 10.8260 10.8260 16.6594 16.6594 16.7133 16.7133 16.7678 16.7678 16.7897 16.7897 18.2346 18.2346 k = 0.3468 0.5539 0.1168 ( 3300 PWs) bands (ev): -7.9332 -7.9332 -7.9321 -7.9321 -7.7834 -7.7834 -7.7823 -7.7823 3.5481 3.5481 3.5644 3.5644 3.7607 3.7607 3.7808 3.7808 4.4223 4.4223 4.4356 4.4356 5.4475 5.4475 5.5823 5.5823 5.7140 5.7140 5.9148 5.9148 6.6373 6.6373 6.6845 6.6845 7.3097 7.3097 7.5685 7.5685 7.6689 7.6689 7.6978 7.6978 7.8969 7.8969 8.0689 8.0689 8.3442 8.3442 8.3903 8.3903 10.8154 10.8154 10.8217 10.8217 16.7468 16.7468 16.7785 16.7785 16.8676 16.8676 16.8831 16.8831 18.0384 18.0384 k = 0.3423 0.5617 0.1168 ( 3294 PWs) bands (ev): -7.9226 -7.9226 -7.9214 -7.9214 -7.7912 -7.7912 -7.7899 -7.7899 3.5749 3.5749 3.5979 3.5979 3.7286 3.7286 3.7552 3.7552 4.4202 4.4202 4.4325 4.4325 5.4455 5.4455 5.5978 5.5978 5.6888 5.6888 5.9059 5.9059 6.6469 6.6469 6.6976 6.6976 7.3086 7.3086 7.5756 7.5756 7.6707 7.6707 7.6976 7.6976 7.8855 7.8855 8.0671 8.0671 8.3330 8.3330 8.3812 8.3812 10.8121 10.8121 10.8184 10.8184 16.7998 16.7998 16.8134 16.8134 16.9613 16.9613 17.0188 17.0188 17.8560 17.8560 k = 0.3378 0.5695 0.1168 ( 3294 PWs) bands (ev): -7.9153 -7.9153 -7.9139 -7.9139 -7.7969 -7.7969 -7.7954 -7.7954 3.5950 3.5950 3.6304 3.6304 3.6967 3.6967 3.7355 3.7355 4.4192 4.4192 4.4310 4.4310 5.4440 5.4440 5.6123 5.6123 5.6683 5.6683 5.9006 5.9006 6.6526 6.6526 6.7052 6.7052 7.3081 7.3081 7.5808 7.5808 7.6708 7.6708 7.6973 7.6973 7.8792 7.8792 8.0664 8.0664 8.3262 8.3262 8.3758 8.3758 10.8101 10.8101 10.8164 10.8164 16.8379 16.8379 16.8426 16.8426 17.0304 17.0304 17.1301 17.1301 17.7080 17.7080 k = 0.3333 0.5774 0.1168 ( 3294 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7990 -7.7990 -7.7975 -7.7975 3.6028 3.6028 3.6552 3.6552 3.6719 3.6719 3.7277 3.7277 4.4190 4.4190 4.4306 4.4306 5.4434 5.4434 5.6197 5.6197 5.6589 5.6589 5.8989 5.8989 6.6544 6.6544 6.7076 6.7076 7.3081 7.3081 7.5829 7.5829 7.6704 7.6704 7.6972 7.6972 7.8773 7.8773 8.0664 8.0664 8.3240 8.3240 8.3740 8.3740 10.8094 10.8094 10.8158 10.8158 16.8568 16.8568 16.8573 16.8573 17.0513 17.0513 17.1753 17.1753 17.6455 17.6455 k = 0.3333 0.5774 0.1168 ( 3294 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7990 -7.7990 -7.7975 -7.7975 3.6028 3.6028 3.6552 3.6552 3.6719 3.6719 3.7277 3.7277 4.4190 4.4190 4.4306 4.4306 5.4434 5.4434 5.6197 5.6197 5.6589 5.6589 5.8989 5.8989 6.6544 6.6544 6.7076 6.7076 7.3081 7.3081 7.5829 7.5829 7.6704 7.6704 7.6972 7.6972 7.8773 7.8773 8.0664 8.0664 8.3240 8.3240 8.3740 8.3740 10.8094 10.8094 10.8158 10.8158 16.8568 16.8568 16.8573 16.8573 17.0513 17.0513 17.1753 17.1753 17.6455 17.6455 k = 0.3288 0.5694 0.1168 ( 3298 PWs) bands (ev): -7.9155 -7.9155 -7.9141 -7.9141 -7.7967 -7.7967 -7.7952 -7.7952 3.5953 3.5953 3.6310 3.6310 3.6961 3.6961 3.7352 3.7352 4.4192 4.4192 4.4310 4.4310 5.4441 5.4441 5.6129 5.6129 5.6678 5.6678 5.9006 5.9006 6.6527 6.6527 6.7053 6.7053 7.3080 7.3080 7.5804 7.5804 7.6713 7.6713 7.6974 7.6974 7.8789 7.8789 8.0663 8.0663 8.3262 8.3262 8.3758 8.3758 10.8101 10.8101 10.8165 10.8165 16.8200 16.8200 16.8279 16.8279 17.0518 17.0518 17.1511 17.1511 17.7020 17.7020 k = 0.3242 0.5615 0.1168 ( 3294 PWs) bands (ev): -7.9240 -7.9240 -7.9227 -7.9227 -7.7901 -7.7901 -7.7888 -7.7888 3.5774 3.5774 3.6013 3.6013 3.7257 3.7257 3.7532 3.7532 4.4198 4.4198 4.4321 4.4321 5.4465 5.4465 5.6015 5.6015 5.6858 5.6858 5.9054 5.9054 6.6479 6.6479 6.6990 6.6990 7.3074 7.3074 7.5730 7.5730 7.6744 7.6744 7.6981 7.6981 7.8829 7.8829 8.0659 8.0659 8.3325 8.3325 8.3807 8.3807 10.8123 10.8123 10.8186 10.8186 16.7042 16.7042 16.7211 16.7211 17.0799 17.0799 17.1445 17.1445 17.8241 17.8241 k = 0.3196 0.5536 0.1168 ( 3294 PWs) bands (ev): -7.9370 -7.9370 -7.9359 -7.9359 -7.7804 -7.7804 -7.7792 -7.7792 3.5556 3.5556 3.5731 3.5731 3.7541 3.7541 3.7754 3.7754 4.4209 4.4209 4.4341 4.4341 5.4508 5.4508 5.5914 5.5914 5.7067 5.7067 5.9131 5.9131 6.6407 6.6407 6.6893 6.6893 7.3058 7.3058 7.5612 7.5612 7.6794 7.6794 7.6994 7.6994 7.8885 7.8885 8.0650 8.0650 8.3424 8.3424 8.3886 8.3886 10.8158 10.8158 10.8220 10.8220 16.5428 16.5428 16.5590 16.5590 17.1298 17.1298 17.1763 17.1763 17.9695 17.9695 k = 0.3151 0.5457 0.1168 ( 3294 PWs) bands (ev): -7.9534 -7.9534 -7.9525 -7.9525 -7.7687 -7.7687 -7.7678 -7.7678 3.5330 3.5330 3.5466 3.5466 3.7809 3.7809 3.7986 3.7986 4.4226 4.4226 4.4369 4.4369 5.4571 5.4571 5.5839 5.5839 5.7294 5.7294 5.9235 5.9235 6.6316 6.6316 6.6771 6.6771 7.3028 7.3028 7.5462 7.5462 7.6857 7.6857 7.7014 7.7014 7.8947 7.8947 8.0635 8.0635 8.3551 8.3551 8.3989 8.3989 10.8206 10.8206 10.8267 10.8267 16.3614 16.3614 16.3738 16.3738 17.1909 17.1909 17.2289 17.2289 18.1240 18.1240 k = 0.3105 0.5378 0.1168 ( 3298 PWs) bands (ev): -7.9725 -7.9725 -7.9717 -7.9717 -7.7560 -7.7560 -7.7552 -7.7552 3.5112 3.5112 3.5224 3.5224 3.8056 3.8056 3.8212 3.8212 4.4251 4.4251 4.4408 4.4408 5.4655 5.4655 5.5792 5.5792 5.7533 5.7533 5.9363 5.9363 6.6212 6.6212 6.6632 6.6632 7.2983 7.2983 7.5291 7.5291 7.6926 7.6926 7.7040 7.7040 7.9009 7.9009 8.0614 8.0614 8.3700 8.3700 8.4112 8.4112 10.8265 10.8265 10.8324 10.8324 16.1710 16.1710 16.1798 16.1798 17.2599 17.2599 17.2934 17.2934 18.2825 18.2825 k = 0.3059 0.5299 0.1168 ( 3294 PWs) bands (ev): -7.9936 -7.9936 -7.9930 -7.9930 -7.7427 -7.7427 -7.7420 -7.7420 3.4910 3.4910 3.5004 3.5004 3.8284 3.8284 3.8426 3.8426 4.4287 4.4287 4.4460 4.4460 5.4760 5.4760 5.5774 5.5774 5.7782 5.7782 5.9512 5.9512 6.6101 6.6101 6.6482 6.6482 7.2922 7.2922 7.5106 7.5106 7.6996 7.6996 7.7073 7.7073 7.9067 7.9067 8.0588 8.0588 8.3864 8.3864 8.4252 8.4252 10.8332 10.8332 10.8390 10.8390 15.9769 15.9769 15.9827 15.9827 17.3357 17.3357 17.3666 17.3666 18.4430 18.4430 k = 0.3014 0.5220 0.1168 ( 3290 PWs) bands (ev): -8.0166 -8.0166 -8.0161 -8.0161 -7.7293 -7.7293 -7.7287 -7.7287 3.4728 3.4728 3.4808 3.4808 3.8490 3.8490 3.8623 3.8623 4.4336 4.4336 4.4525 4.4525 5.4885 5.4885 5.5783 5.5783 5.8039 5.8039 5.9682 5.9682 6.5988 6.5988 6.6327 6.6327 7.2843 7.2843 7.4911 7.4911 7.7064 7.7064 7.7111 7.7111 7.9118 7.9118 8.0557 8.0557 8.4039 8.4039 8.4402 8.4402 10.8406 10.8406 10.8462 10.8462 15.7817 15.7817 15.7853 15.7853 17.4178 17.4178 17.4472 17.4472 18.6042 18.6042 k = 0.2968 0.5141 0.1168 ( 3294 PWs) bands (ev): -8.0413 -8.0413 -8.0408 -8.0408 -7.7159 -7.7159 -7.7153 -7.7153 3.4568 3.4568 3.4638 3.4638 3.8676 3.8676 3.8802 3.8802 4.4398 4.4398 4.4604 4.4604 5.5028 5.5028 5.5819 5.5819 5.8301 5.8301 5.9869 5.9869 6.5879 6.5879 6.6172 6.6172 7.2749 7.2749 7.4710 7.4710 7.7129 7.7129 7.7154 7.7154 7.9158 7.9158 8.0518 8.0518 8.4219 8.4219 8.4562 8.4562 10.8481 10.8481 10.8535 10.8535 15.5871 15.5871 15.5890 15.5890 17.5062 17.5062 17.5347 17.5347 18.7654 18.7654 k = 0.2922 0.5062 0.1168 ( 3294 PWs) bands (ev): -8.0674 -8.0674 -8.0670 -8.0670 -7.7027 -7.7027 -7.7022 -7.7022 3.4431 3.4431 3.4493 3.4493 3.8842 3.8842 3.8964 3.8964 4.4476 4.4476 4.4699 4.4699 5.5188 5.5188 5.5879 5.5879 5.8568 5.8568 6.0072 6.0072 6.5779 6.5779 6.6021 6.6021 7.2639 7.2639 7.4504 7.4504 7.7188 7.7188 7.7201 7.7201 7.9188 7.9188 8.0473 8.0473 8.4403 8.4403 8.4726 8.4726 10.8554 10.8554 10.8606 10.8606 15.3943 15.3943 15.3949 15.3949 17.6008 17.6008 17.6288 17.6288 18.9259 18.9259 k = 0.2877 0.4983 0.1168 ( 3300 PWs) bands (ev): -8.0948 -8.0948 -8.0945 -8.0945 -7.6898 -7.6898 -7.6894 -7.6894 3.4319 3.4319 3.4374 3.4374 3.8992 3.8992 3.9109 3.9109 4.4568 4.4568 4.4807 4.4807 5.5364 5.5364 5.5963 5.5963 5.8835 5.8835 6.0289 6.0289 6.5691 6.5691 6.5879 6.5879 7.2516 7.2516 7.4296 7.4296 7.7243 7.7243 7.7251 7.7251 7.9205 7.9205 8.0420 8.0420 8.4588 8.4588 8.4895 8.4895 10.8620 10.8620 10.8668 10.8668 15.2039 15.2039 15.2043 15.2043 17.7016 17.7016 17.7295 17.7295 19.0852 19.0852 k = 0.2831 0.4904 0.1168 ( 3296 PWs) bands (ev): -8.1236 -8.1236 -8.1233 -8.1233 -7.6774 -7.6774 -7.6770 -7.6770 3.4231 3.4231 3.4280 3.4280 3.9128 3.9128 3.9240 3.9240 4.4674 4.4674 4.4929 4.4929 5.5554 5.5554 5.6069 5.6069 5.9100 5.9100 6.0518 6.0518 6.5620 6.5620 6.5750 6.5750 7.2382 7.2382 7.4086 7.4086 7.7290 7.7290 7.7302 7.7302 7.9210 7.9210 8.0358 8.0358 8.4773 8.4773 8.5067 8.5067 10.8672 10.8672 10.8718 10.8718 15.0167 15.0167 15.0178 15.0178 17.8087 17.8087 17.8365 17.8365 19.2425 19.2425 k = 0.2785 0.4824 0.1168 ( 3292 PWs) bands (ev): -8.1536 -8.1536 -8.1533 -8.1533 -7.6654 -7.6654 -7.6651 -7.6651 3.4168 3.4168 3.4211 3.4211 3.9254 3.9254 3.9362 3.9362 4.4792 4.4792 4.5061 4.5061 5.5756 5.5756 5.6195 5.6195 5.9360 5.9360 6.0756 6.0756 6.5571 6.5571 6.5635 6.5635 7.2236 7.2236 7.3875 7.3875 7.7331 7.7331 7.7354 7.7354 7.9203 7.9203 8.0288 8.0288 8.4958 8.4958 8.5240 8.5240 10.8705 10.8705 10.8748 10.8748 14.8339 14.8339 14.8355 14.8355 17.9219 17.9219 17.9499 17.9499 19.3970 19.3970 k = 0.2740 0.4745 0.1168 ( 3300 PWs) bands (ev): -8.1848 -8.1848 -8.1845 -8.1845 -7.6540 -7.6540 -7.6537 -7.6537 3.4129 3.4129 3.4167 3.4167 3.9374 3.9374 3.9478 3.9478 4.4920 4.4920 4.5201 4.5201 5.5970 5.5970 5.6342 5.6342 5.9611 5.9611 6.1001 6.1001 6.5539 6.5539 6.5547 6.5547 7.2082 7.2082 7.3664 7.3664 7.7362 7.7362 7.7404 7.7404 7.9187 7.9187 8.0210 8.0210 8.5142 8.5142 8.5415 8.5415 10.8712 10.8712 10.8751 10.8751 14.6562 14.6562 14.6581 14.6581 18.0413 18.0413 18.0694 18.0694 19.5474 19.5474 k = 0.2694 0.4666 0.1168 ( 3288 PWs) bands (ev): -8.2171 -8.2171 -8.2168 -8.2168 -7.6431 -7.6431 -7.6428 -7.6428 3.4113 3.4113 3.4147 3.4147 3.9492 3.9492 3.9592 3.9592 4.5056 4.5056 4.5347 4.5347 5.6193 5.6193 5.6507 5.6507 5.9850 5.9850 6.1250 6.1250 6.5464 6.5464 6.5551 6.5551 7.1919 7.1919 7.3453 7.3453 7.7383 7.7383 7.7450 7.7450 7.9164 7.9164 8.0127 8.0127 8.5327 8.5327 8.5592 8.5592 10.8686 10.8686 10.8721 10.8721 14.4842 14.4842 14.4863 14.4863 18.1667 18.1667 18.1948 18.1948 19.6921 19.6921 k = 0.2648 0.4587 0.1168 ( 3294 PWs) bands (ev): -8.2504 -8.2504 -8.2502 -8.2502 -7.6329 -7.6329 -7.6327 -7.6327 3.4120 3.4120 3.4150 3.4150 3.9613 3.9613 3.9708 3.9708 4.5197 4.5197 4.5498 4.5498 5.6425 5.6425 5.6690 5.6690 6.0073 6.0073 6.1499 6.1499 6.5413 6.5413 6.5586 6.5586 7.1750 7.1750 7.3242 7.3242 7.7389 7.7389 7.7491 7.7491 7.9138 7.9138 8.0040 8.0040 8.5513 8.5513 8.5771 8.5771 10.8619 10.8619 10.8651 10.8651 14.3185 14.3185 14.3207 14.3207 18.2979 18.2979 18.3259 18.3259 19.8281 19.8281 k = 0.2603 0.4508 0.1168 ( 3290 PWs) bands (ev): -8.2848 -8.2848 -8.2846 -8.2846 -7.6234 -7.6234 -7.6232 -7.6232 3.4149 3.4149 3.4175 3.4175 3.9740 3.9740 3.9830 3.9830 4.5342 4.5342 4.5650 4.5650 5.6663 5.6663 5.6890 5.6890 6.0278 6.0278 6.1747 6.1747 6.5387 6.5387 6.5652 6.5652 7.1576 7.1576 7.3032 7.3032 7.7380 7.7380 7.7523 7.7523 7.9114 7.9114 7.9954 7.9954 8.5699 8.5699 8.5952 8.5952 10.8504 10.8504 10.8532 10.8532 14.1599 14.1599 14.1621 14.1621 18.4344 18.4344 18.4621 18.4621 19.9512 19.9611 k = 0.2557 0.4429 0.1168 ( 3290 PWs) bands (ev): -8.3200 -8.3200 -8.3199 -8.3199 -7.6145 -7.6145 -7.6143 -7.6143 3.4198 3.4198 3.4220 3.4220 3.9876 3.9876 3.9962 3.9962 4.5489 4.5489 4.5803 4.5803 5.6907 5.6907 5.7105 5.7105 6.0462 6.0462 6.1988 6.1988 6.5389 6.5389 6.5751 6.5751 7.1398 7.1398 7.2824 7.2824 7.7350 7.7350 7.7542 7.7542 7.9097 7.9097 7.9874 7.9874 8.5887 8.5887 8.6136 8.6136 10.8335 10.8335 10.8358 10.8358 14.0091 14.0091 14.0112 14.0112 18.5758 18.5758 18.6026 18.6026 20.0547 20.0684 k = 0.2511 0.4350 0.1168 ( 3286 PWs) bands (ev): -8.3562 -8.3562 -8.3561 -8.3561 -7.6064 -7.6064 -7.6062 -7.6062 3.4265 3.4265 3.4285 3.4285 4.0025 4.0025 4.0106 4.0106 4.5638 4.5638 4.5957 4.5957 5.7154 5.7154 5.7333 5.7333 6.0626 6.0626 6.2221 6.2221 6.5419 6.5419 6.5879 6.5879 7.1217 7.1217 7.2618 7.2618 7.7299 7.7299 7.7544 7.7544 7.9091 7.9091 7.9804 7.9804 8.6076 8.6076 8.6322 8.6322 10.8103 10.8103 10.8123 10.8123 13.8665 13.8665 13.8685 13.8685 18.7212 18.7212 18.7464 18.7464 20.1141 20.1142 k = 0.2466 0.4271 0.1168 ( 3290 PWs) bands (ev): -8.3932 -8.3932 -8.3931 -8.3931 -7.5990 -7.5990 -7.5989 -7.5989 3.4350 3.4350 3.4366 3.4366 4.0187 4.0187 4.0265 4.0265 4.5789 4.5789 4.6112 4.6112 5.7403 5.7403 5.7574 5.7574 6.0771 6.0771 6.2443 6.2443 6.5476 6.5476 6.6034 6.6034 7.1037 7.1037 7.2418 7.2418 7.7226 7.7226 7.7526 7.7526 7.9101 7.9101 7.9752 7.9752 8.6268 8.6268 8.6511 8.6511 10.7804 10.7804 10.7819 10.7819 13.7329 13.7329 13.7347 13.7347 18.8693 18.8693 18.8916 18.8916 20.1078 20.1078 k = 0.2420 0.4192 0.1168 ( 3302 PWs) bands (ev): -8.4310 -8.4310 -8.4309 -8.4309 -7.5924 -7.5924 -7.5923 -7.5923 3.4451 3.4451 3.4464 3.4464 4.0366 4.0366 4.0439 4.0439 4.5942 4.5942 4.6267 4.6267 5.7652 5.7652 5.7824 5.7824 6.0897 6.0897 6.2653 6.2653 6.5557 6.5557 6.6209 6.6209 7.0860 7.0860 7.2224 7.2224 7.7131 7.7131 7.7483 7.7483 7.9128 7.9128 7.9723 7.9723 8.6461 8.6461 8.6702 8.6702 10.7432 10.7432 10.7443 10.7443 13.6087 13.6087 13.6103 13.6103 19.0179 19.0179 19.0351 19.0351 20.0785 20.0785 k = 0.2374 0.4113 0.1168 ( 3296 PWs) bands (ev): -8.4695 -8.4695 -8.4694 -8.4694 -7.5866 -7.5866 -7.5864 -7.5864 3.4565 3.4565 3.4576 3.4576 4.0560 4.0560 4.0630 4.0630 4.6100 4.6100 4.6426 4.6426 5.7900 5.7900 5.8081 5.8081 6.1009 6.1009 6.2853 6.2853 6.5657 6.5657 6.6397 6.6397 7.0690 7.0690 7.2042 7.2042 7.7017 7.7017 7.7416 7.7416 7.9172 7.9172 7.9720 7.9720 8.6656 8.6656 8.6896 8.6896 10.6984 10.6984 10.6991 10.6991 13.4943 13.4943 13.4957 13.4957 19.1629 19.1629 19.1714 19.1714 20.0390 20.0390 k = 0.2329 0.4034 0.1168 ( 3292 PWs) bands (ev): -8.5086 -8.5086 -8.5085 -8.5085 -7.5815 -7.5815 -7.5814 -7.5814 3.4692 3.4692 3.4699 3.4699 4.0772 4.0772 4.0838 4.0838 4.6263 4.6263 4.6591 4.6591 5.8142 5.8142 5.8342 5.8342 6.1109 6.1109 6.3041 6.3041 6.5768 6.5768 6.6588 6.6588 7.0533 7.0533 7.1878 7.1878 7.6888 7.6888 7.7325 7.7325 7.9234 7.9234 7.9745 7.9745 8.6852 8.6852 8.7092 8.7092 10.6459 10.6459 10.6462 10.6462 13.3899 13.3899 13.3910 13.3910 19.2902 19.2902 19.2959 19.2959 20.0023 20.0023 k = 0.2283 0.3954 0.1168 ( 3290 PWs) bands (ev): -8.5483 -8.5483 -8.5482 -8.5482 -7.5772 -7.5772 -7.5771 -7.5771 3.4827 3.4827 3.4833 3.4833 4.1000 4.1000 4.1063 4.1063 4.6436 4.6436 4.6763 4.6763 5.8379 5.8379 5.8603 5.8603 6.1202 6.1202 6.3222 6.3222 6.5880 6.5880 6.6770 6.6770 7.0397 7.0397 7.1737 7.1737 7.6747 7.6747 7.7213 7.7213 7.9312 7.9312 7.9798 7.9798 8.7050 8.7050 8.7289 8.7289 10.5857 10.5857 10.5857 10.5857 13.2955 13.2955 13.2963 13.2963 19.3756 19.3756 19.3996 19.3996 19.9877 19.9878 k = 0.2237 0.3875 0.1168 ( 3294 PWs) bands (ev): -8.5885 -8.5885 -8.5884 -8.5884 -7.5737 -7.5737 -7.5736 -7.5736 3.4970 3.4970 3.4974 3.4974 4.1243 4.1243 4.1304 4.1304 4.6621 4.6621 4.6948 4.6948 5.8606 5.8606 5.8859 5.8859 6.1292 6.1292 6.3395 6.3395 6.5982 6.5982 6.6931 6.6931 7.0291 7.0291 7.1631 7.1631 7.6600 7.6600 7.7085 7.7085 7.9404 7.9404 7.9875 7.9875 8.7249 8.7249 8.7487 8.7487 10.5178 10.5178 10.5182 10.5182 13.2109 13.2109 13.2114 13.2114 19.4114 19.4114 19.4494 19.4494 20.0205 20.0205 k = 0.2192 0.3796 0.1168 ( 3294 PWs) bands (ev): -8.6292 -8.6292 -8.6291 -8.6291 -7.5710 -7.5710 -7.5708 -7.5708 3.5119 3.5119 3.5120 3.5120 4.1501 4.1501 4.1560 4.1560 4.6821 4.6821 4.7148 4.7148 5.8822 5.8822 5.9104 5.9104 6.1382 6.1382 6.3561 6.3561 6.6061 6.6061 6.7058 6.7058 7.0226 7.0226 7.1570 7.1570 7.6449 7.6449 7.6945 7.6945 7.9510 7.9510 7.9975 7.9975 8.7448 8.7448 8.7686 8.7686 10.4431 10.4431 10.4438 10.4438 13.1357 13.1357 13.1360 13.1360 19.3968 19.3968 19.4368 19.4368 20.1075 20.1075 k = 0.2146 0.3717 0.1168 ( 3290 PWs) bands (ev): -8.6702 -8.6702 -8.6701 -8.6701 -7.5690 -7.5690 -7.5689 -7.5689 3.5269 3.5269 3.5269 3.5269 4.1771 4.1771 4.1828 4.1828 4.7042 4.7042 4.7368 4.7368 5.9024 5.9024 5.9331 5.9331 6.1480 6.1480 6.3719 6.3719 6.6111 6.6111 6.7141 6.7141 7.0210 7.0210 7.1563 7.1563 7.6297 7.6297 7.6799 7.6799 7.9628 7.9628 8.0094 8.0094 8.7647 8.7647 8.7884 8.7884 10.3623 10.3623 10.3632 10.3632 13.0694 13.0694 13.0695 13.0695 19.3451 19.3451 19.3806 19.3806 20.2245 20.2245 k = 0.2100 0.3638 0.1168 ( 3282 PWs) bands (ev): -8.7115 -8.7115 -8.7115 -8.7115 -7.5678 -7.5678 -7.5677 -7.5677 3.5417 3.5417 3.5419 3.5419 4.2053 4.2053 4.2107 4.2107 4.7288 4.7288 4.7612 4.7612 5.9209 5.9209 5.9531 5.9531 6.1589 6.1589 6.3864 6.3864 6.6130 6.6130 6.7174 6.7174 7.0250 7.0250 7.1618 7.1618 7.6148 7.6148 7.6650 7.6650 7.9758 7.9758 8.0231 8.0231 8.7844 8.7844 8.8082 8.8082 10.2763 10.2763 10.2774 10.2774 13.0112 13.0112 13.0114 13.0114 19.2704 19.2704 19.3003 19.3003 20.3384 20.3384 k = 0.2055 0.3559 0.1168 ( 3294 PWs) bands (ev): -8.7531 -8.7531 -8.7531 -8.7531 -7.5673 -7.5673 -7.5673 -7.5673 3.5563 3.5563 3.5565 3.5565 4.2344 4.2344 4.2396 4.2396 4.7561 4.7561 4.7884 4.7884 5.9375 5.9375 5.9696 5.9696 6.1715 6.1715 6.3985 6.3985 6.6127 6.6127 6.7157 6.7157 7.0347 7.0347 7.1734 7.1734 7.6004 7.6004 7.6501 7.6501 7.9899 7.9899 8.0383 8.0383 8.8040 8.8040 8.8277 8.8277 10.1860 10.1860 10.1872 10.1872 12.9604 12.9604 12.9608 12.9608 19.1816 19.1816 19.2068 19.2068 20.4134 20.4134 k = 0.2009 0.3480 0.1168 ( 3290 PWs) bands (ev): -8.7949 -8.7949 -8.7948 -8.7948 -7.5676 -7.5676 -7.5675 -7.5675 3.5702 3.5702 3.5705 3.5705 4.2643 4.2643 4.2694 4.2694 4.7865 4.7865 4.8188 4.8188 5.9520 5.9520 5.9816 5.9816 6.1861 6.1861 6.4070 6.4070 6.6121 6.6121 6.7098 6.7098 7.0497 7.0497 7.1908 7.1908 7.5865 7.5865 7.6355 7.6355 8.0050 8.0050 8.0548 8.0548 8.8234 8.8234 8.8470 8.8470 10.0924 10.0924 10.0937 10.0937 12.9163 12.9163 12.9169 12.9169 19.0838 19.0838 19.1052 19.1052 20.4333 20.4333 k = 0.1963 0.3401 0.1168 ( 3286 PWs) bands (ev): -8.8367 -8.8367 -8.8367 -8.8367 -7.5686 -7.5686 -7.5685 -7.5685 3.5832 3.5832 3.5835 3.5835 4.2950 4.2950 4.2999 4.2999 4.8203 4.8203 4.8526 4.8526 5.9637 5.9637 5.9886 5.9886 6.2027 6.2027 6.4103 6.4103 6.6138 6.6138 6.7012 6.7012 7.0694 7.0694 7.2131 7.2131 7.5735 7.5735 7.6215 7.6215 8.0210 8.0210 8.0724 8.0724 8.8423 8.8423 8.8658 8.8658 9.9966 9.9966 9.9980 9.9980 12.8781 12.8781 12.8788 12.8788 18.9800 18.9800 18.9982 18.9982 20.4160 20.4161 k = 0.1918 0.3322 0.1168 ( 3288 PWs) bands (ev): -8.8786 -8.8786 -8.8786 -8.8786 -7.5703 -7.5703 -7.5702 -7.5702 3.5949 3.5949 3.5953 3.5953 4.3265 4.3265 4.3312 4.3312 4.8575 4.8575 4.8899 4.8899 5.9724 5.9724 5.9902 5.9902 6.2210 6.2210 6.4075 6.4075 6.6200 6.6200 6.6912 6.6912 7.0928 7.0928 7.2392 7.2392 7.5612 7.5612 7.6081 7.6081 8.0380 8.0380 8.0912 8.0912 8.8606 8.8606 8.8840 8.8840 9.8996 9.8996 9.9011 9.9011 12.8451 12.8451 12.8459 12.8459 18.8719 18.8719 18.8877 18.8877 20.3797 20.3800 k = 0.1872 0.3243 0.1168 ( 3288 PWs) bands (ev): -8.9205 -8.9205 -8.9204 -8.9204 -7.5726 -7.5726 -7.5726 -7.5726 3.6051 3.6051 3.6055 3.6055 4.3590 4.3590 4.3635 4.3635 4.8982 4.8982 4.9306 4.9306 5.9775 5.9775 5.9863 5.9863 6.2405 6.2405 6.3992 6.3992 6.6314 6.6314 6.6816 6.6816 7.1190 7.1190 7.2682 7.2682 7.5499 7.5499 7.5956 7.5956 8.0559 8.0559 8.1108 8.1108 8.8782 8.8782 8.9013 8.9013 9.8026 9.8026 9.8041 9.8041 12.8165 12.8165 12.8174 12.8174 18.7608 18.7608 18.7746 18.7746 20.3325 20.3402 k = 0.1826 0.3164 0.1168 ( 3288 PWs) bands (ev): -8.9622 -8.9622 -8.9622 -8.9622 -7.5756 -7.5756 -7.5756 -7.5756 3.6136 3.6136 3.6139 3.6139 4.3924 4.3924 4.3967 4.3967 4.9420 4.9420 4.9747 4.9747 5.9771 5.9771 5.9784 5.9784 6.2605 6.2605 6.3874 6.3874 6.6477 6.6477 6.6738 6.6738 7.1474 7.1474 7.2991 7.2991 7.5396 7.5396 7.5839 7.5839 8.0746 8.0746 8.1312 8.1312 8.8947 8.8947 8.9175 8.9175 9.7066 9.7066 9.7081 9.7081 12.7917 12.7917 12.7926 12.7926 18.6475 18.6475 18.6596 18.6596 20.2772 20.2821 k = 0.1781 0.3084 0.1168 ( 3282 PWs) bands (ev): -9.0038 -9.0038 -9.0038 -9.0038 -7.5792 -7.5792 -7.5792 -7.5792 3.6200 3.6200 3.6203 3.6203 4.4270 4.4270 4.4312 4.4312 4.9886 4.9886 5.0218 5.0218 5.9628 5.9628 5.9744 5.9744 6.2807 6.2807 6.3743 6.3743 6.6678 6.6678 6.6687 6.6687 7.1773 7.1773 7.3311 7.3311 7.5306 7.5306 7.5732 7.5732 8.0940 8.0940 8.1524 8.1524 8.9096 8.9096 8.9319 8.9319 9.6128 9.6128 9.6144 9.6144 12.7701 12.7701 12.7711 12.7711 18.5326 18.5326 18.5433 18.5433 20.2166 20.2183 k = 0.1735 0.3005 0.1168 ( 3282 PWs) bands (ev): -9.0452 -9.0452 -9.0451 -9.0451 -7.5834 -7.5834 -7.5833 -7.5833 3.6243 3.6243 3.6246 3.6246 4.4628 4.4628 4.4669 4.4669 5.0374 5.0374 5.0712 5.0712 5.9441 5.9441 5.9654 5.9654 6.3004 6.3004 6.3624 6.3624 6.6673 6.6673 6.6906 6.6906 7.2081 7.2081 7.3633 7.3633 7.5230 7.5230 7.5636 7.5636 8.1142 8.1142 8.1740 8.1740 8.9222 8.9222 8.9437 8.9437 9.5227 9.5227 9.5245 9.5245 12.7511 12.7511 12.7522 12.7522 18.4167 18.4167 18.4261 18.4261 20.1506 20.1520 k = 0.1689 0.2926 0.1168 ( 3270 PWs) bands (ev): -9.0862 -9.0862 -9.0862 -9.0862 -7.5881 -7.5881 -7.5880 -7.5880 3.6264 3.6264 3.6266 3.6266 4.5002 4.5002 4.5041 4.5041 5.0876 5.0876 5.1223 5.1223 5.9219 5.9219 5.9517 5.9517 6.3196 6.3196 6.3531 6.3531 6.6697 6.6697 6.7153 6.7153 7.2395 7.2395 7.3948 7.3948 7.5176 7.5176 7.5550 7.5550 8.1350 8.1350 8.1961 8.1961 8.9313 8.9313 8.9517 8.9517 9.4380 9.4380 9.4403 9.4403 12.7344 12.7344 12.7355 12.7355 18.3000 18.3000 18.3084 18.3084 20.0792 20.0805 k = 0.1644 0.2847 0.1168 ( 3270 PWs) bands (ev): -9.1269 -9.1269 -9.1269 -9.1269 -7.5933 -7.5933 -7.5933 -7.5933 3.6261 3.6261 3.6262 3.6262 4.5389 4.5389 4.5428 4.5428 5.1382 5.1382 5.1739 5.1739 5.8975 5.8975 5.9343 5.9343 6.3380 6.3380 6.3473 6.3473 6.6761 6.6761 6.7411 6.7411 7.2709 7.2709 7.4235 7.4235 7.5157 7.5157 7.5477 7.5477 8.1563 8.1563 8.2183 8.2183 8.9349 8.9349 8.9535 8.9535 9.3613 9.3613 9.3646 9.3646 12.7196 12.7196 12.7207 12.7207 18.1829 18.1829 18.1904 18.1904 20.0064 20.0067 k = 0.1598 0.2768 0.1168 ( 3268 PWs) bands (ev): -9.1672 -9.1672 -9.1672 -9.1672 -7.5990 -7.5990 -7.5990 -7.5990 3.6235 3.6235 3.6236 3.6236 4.5791 4.5791 4.5828 4.5828 5.1875 5.1875 5.2245 5.2245 5.8728 5.8728 5.9151 5.9151 6.3451 6.3451 6.3559 6.3559 6.6860 6.6860 6.7677 6.7677 7.3019 7.3019 7.4458 7.4458 7.5209 7.5209 7.5419 7.5419 8.1779 8.1779 8.2406 8.2406 8.9300 8.9300 8.9458 8.9458 9.2961 9.2961 9.3012 9.3012 12.7062 12.7062 12.7073 12.7073 18.0658 18.0658 18.0725 18.0725 19.9277 19.9279 k = 0.1553 0.2689 0.1168 ( 3266 PWs) bands (ev): -9.2071 -9.2071 -9.2070 -9.2070 -7.6051 -7.6051 -7.6051 -7.6051 3.6187 3.6187 3.6187 3.6187 4.6204 4.6204 4.6241 4.6241 5.2338 5.2338 5.2719 5.2719 5.8506 5.8506 5.8970 5.8970 6.3462 6.3462 6.3732 6.3732 6.6990 6.6990 6.7946 6.7946 7.3321 7.3321 7.4579 7.4579 7.5367 7.5367 7.5377 7.5377 8.1996 8.1996 8.2624 8.2624 8.9133 8.9133 8.9250 8.9250 9.2465 9.2465 9.2544 9.2544 12.6941 12.6941 12.6951 12.6951 17.9487 17.9487 17.9547 17.9547 19.8471 19.8473 k = 0.1507 0.2610 0.1168 ( 3264 PWs) bands (ev): -9.2463 -9.2463 -9.2463 -9.2463 -7.6116 -7.6116 -7.6116 -7.6116 3.6117 3.6117 3.6117 3.6117 4.6627 4.6627 4.6663 4.6663 5.2744 5.2744 5.3130 5.3130 5.8345 5.8345 5.8834 5.8834 6.3500 6.3500 6.3902 6.3902 6.7145 6.7145 6.8217 6.8217 7.3607 7.3607 7.4615 7.4615 7.5357 7.5357 7.5611 7.5611 8.2212 8.2212 8.2835 8.2835 8.8829 8.8829 8.8898 8.8898 9.2148 9.2148 9.2259 9.2259 12.6828 12.6828 12.6838 12.6838 17.8320 17.8320 17.8373 17.8373 19.7626 19.7632 k = 0.1461 0.2531 0.1168 ( 3260 PWs) bands (ev): -9.2850 -9.2850 -9.2850 -9.2850 -7.6185 -7.6185 -7.6184 -7.6184 3.6027 3.6027 3.6028 3.6028 4.7052 4.7052 4.7087 4.7087 5.3065 5.3065 5.3443 5.3443 5.8288 5.8288 5.8784 5.8784 6.3560 6.3560 6.4072 6.4072 6.7319 6.7319 6.8486 6.8486 7.3871 7.3871 7.4612 7.4612 7.5366 7.5366 7.5893 7.5893 8.2421 8.2421 8.3031 8.3031 8.8413 8.8413 8.8435 8.8435 9.1995 9.1995 9.2132 9.2132 12.6722 12.6722 12.6732 12.6732 17.7158 17.7158 17.7206 17.7206 19.6785 19.6786 k = 0.1416 0.2452 0.1168 ( 3252 PWs) bands (ev): -9.3231 -9.3231 -9.3231 -9.3231 -7.6257 -7.6257 -7.6256 -7.6256 3.5919 3.5919 3.5919 3.5919 4.7473 4.7473 4.7506 4.7506 5.3279 5.3279 5.3627 5.3627 5.8373 5.8373 5.8854 5.8854 6.3636 6.3636 6.4242 6.4242 6.7507 6.7507 6.8753 6.8753 7.4100 7.4100 7.4597 7.4597 7.5413 7.5413 7.6187 7.6187 8.2617 8.2617 8.3203 8.3203 8.7918 8.7918 8.7942 8.7942 9.1959 9.1959 9.2113 9.2113 12.6622 12.6622 12.6631 12.6631 17.6003 17.6003 17.6046 17.6046 19.5903 19.5910 k = 0.1370 0.2373 0.1168 ( 3256 PWs) bands (ev): -9.3605 -9.3605 -9.3605 -9.3605 -7.6331 -7.6331 -7.6331 -7.6331 3.5793 3.5793 3.5794 3.5794 4.7877 4.7877 4.7907 4.7907 5.3381 5.3381 5.3682 5.3682 5.8615 5.8615 5.9065 5.9065 6.3724 6.3724 6.4416 6.4416 6.7703 6.7703 6.9016 6.9016 7.4285 7.4285 7.4579 7.4579 7.5509 7.5509 7.6480 7.6480 8.2789 8.2789 8.3336 8.3336 8.7398 8.7398 8.7472 8.7472 9.1999 9.1999 9.2162 9.2162 12.6524 12.6524 12.6533 12.6533 17.4858 17.4858 17.4896 17.4896 19.5024 19.5031 k = 0.1324 0.2294 0.1168 ( 3256 PWs) bands (ev): -9.3971 -9.3971 -9.3971 -9.3971 -7.6408 -7.6408 -7.6408 -7.6408 3.5652 3.5652 3.5653 3.5653 4.8246 4.8246 4.8272 4.8272 5.3396 5.3396 5.3641 5.3641 5.8994 5.8994 5.9411 5.9411 6.3820 6.3820 6.4595 6.4595 6.7905 6.7905 6.9273 6.9273 7.4421 7.4421 7.4565 7.4565 7.5656 7.5656 7.6767 7.6767 8.2921 8.2921 8.3410 8.3410 8.6921 8.6921 8.7055 8.7055 9.2085 9.2085 9.2251 9.2251 12.6428 12.6428 12.6437 12.6437 17.3723 17.3723 17.3757 17.3757 19.4128 19.4137 k = 0.1279 0.2214 0.1168 ( 3240 PWs) bands (ev): -9.4329 -9.4329 -9.4329 -9.4329 -7.6486 -7.6486 -7.6486 -7.6486 3.5497 3.5497 3.5499 3.5499 4.8554 4.8554 4.8576 4.8576 5.3372 5.3372 5.3562 5.3562 5.9475 5.9475 5.9867 5.9867 6.3923 6.3923 6.4784 6.4784 6.8108 6.8108 6.9525 6.9525 7.4516 7.4516 7.4556 7.4556 7.5847 7.5847 7.7045 7.7045 8.2992 8.2992 8.3400 8.3400 8.6524 8.6524 8.6734 8.6734 9.2199 9.2199 9.2365 9.2365 12.6333 12.6333 12.6341 12.6341 17.2601 17.2601 17.2631 17.2631 19.3228 19.3237 k = 0.1233 0.2135 0.1168 ( 3240 PWs) bands (ev): -9.4679 -9.4679 -9.4679 -9.4679 -7.6567 -7.6567 -7.6566 -7.6566 3.5331 3.5331 3.5332 3.5332 4.8772 4.8772 4.8786 4.8786 5.3370 5.3370 5.3511 5.3511 6.0017 6.0017 6.0404 6.0404 6.4031 6.4031 6.4984 6.4984 6.8311 6.8311 6.9769 6.9769 7.4554 7.4554 7.4585 7.4585 7.6066 7.6066 7.7312 7.7312 8.2975 8.2975 8.3288 8.3288 8.6240 8.6240 8.6536 8.6536 9.2330 9.2330 9.2494 9.2494 12.6236 12.6236 12.6244 12.6244 17.1493 17.1493 17.1520 17.1520 19.2325 19.2333 k = 0.1187 0.2056 0.1168 ( 3242 PWs) bands (ev): -9.5020 -9.5020 -9.5020 -9.5020 -7.6648 -7.6648 -7.6648 -7.6648 3.5154 3.5154 3.5155 3.5155 4.8867 4.8867 4.8873 4.8873 5.3444 5.3444 5.3543 5.3543 6.0589 6.0589 6.0994 6.0994 6.4145 6.4145 6.5203 6.5203 6.8511 6.8511 7.0005 7.0005 7.4561 7.4561 7.4641 7.4641 7.6301 7.6301 7.7566 7.7566 8.2857 8.2857 8.3076 8.3076 8.6090 8.6090 8.6464 8.6464 9.2472 9.2472 9.2633 9.2633 12.6138 12.6138 12.6145 12.6145 17.0402 17.0402 17.0426 17.0426 19.1421 19.1427 k = 0.1142 0.1977 0.1168 ( 3238 PWs) bands (ev): -9.5351 -9.5351 -9.5351 -9.5351 -7.6730 -7.6730 -7.6730 -7.6730 3.4968 3.4968 3.4969 3.4969 4.8824 4.8824 4.8826 4.8826 5.3625 5.3625 5.3692 5.3692 6.1163 6.1163 6.1610 6.1610 6.4265 6.4265 6.5447 6.5447 6.8706 6.8706 7.0233 7.0233 7.4579 7.4579 7.4695 7.4695 7.6543 7.6543 7.7807 7.7807 8.2647 8.2647 8.2790 8.2790 8.6068 8.6068 8.6498 8.6498 9.2622 9.2622 9.2777 9.2777 12.6036 12.6036 12.6043 12.6043 16.9328 16.9328 16.9350 16.9350 19.0521 19.0523 k = 0.1096 0.1898 0.1168 ( 3242 PWs) bands (ev): -9.5673 -9.5673 -9.5673 -9.5673 -7.6812 -7.6812 -7.6812 -7.6812 3.4775 3.4775 3.4776 3.4776 4.8649 4.8649 4.8656 4.8656 5.3917 5.3917 5.3960 5.3960 6.1714 6.1714 6.2229 6.2229 6.4400 6.4400 6.5723 6.5723 6.8896 6.8896 7.0451 7.0451 7.4608 7.4608 7.4755 7.4755 7.6784 7.6784 7.8033 7.8033 8.2371 8.2371 8.2460 8.2460 8.6147 8.6147 8.6607 8.6607 9.2776 9.2776 9.2926 9.2926 12.5931 12.5931 12.5937 12.5937 16.8275 16.8275 16.8294 16.8294 18.9628 18.9629 k = 0.1050 0.1819 0.1168 ( 3238 PWs) bands (ev): -9.5985 -9.5985 -9.5985 -9.5985 -7.6894 -7.6894 -7.6894 -7.6894 3.4575 3.4575 3.4576 3.4576 4.8375 4.8375 4.8384 4.8384 5.4302 5.4302 5.4328 5.4328 6.2224 6.2224 6.2822 6.2822 6.4565 6.4565 6.6040 6.6040 6.9080 6.9080 7.0658 7.0658 7.4651 7.4651 7.4827 7.4827 7.7021 7.7021 7.8245 7.8245 8.2063 8.2063 8.2115 8.2115 8.6295 8.6295 8.6764 8.6764 9.2934 9.2934 9.3077 9.3077 12.5821 12.5821 12.5827 12.5827 16.7243 16.7243 16.7260 16.7260 18.8737 18.8738 k = 0.1005 0.1740 0.1168 ( 3242 PWs) bands (ev): -9.6286 -9.6286 -9.6286 -9.6286 -7.6976 -7.6976 -7.6975 -7.6975 3.4371 3.4371 3.4372 3.4372 4.8032 4.8032 4.8041 4.8041 5.4756 5.4756 5.4770 5.4770 6.2674 6.2674 6.3344 6.3344 6.4790 6.4790 6.6405 6.6405 6.9256 6.9256 7.0854 7.0854 7.4709 7.4709 7.4914 7.4914 7.7251 7.7251 7.8440 7.8440 8.1747 8.1747 8.1771 8.1771 8.6487 8.6487 8.6950 8.6950 9.3094 9.3094 9.3229 9.3229 12.5707 12.5707 12.5712 12.5712 16.6235 16.6235 16.6250 16.6250 18.7860 18.7863 k = 0.0959 0.1661 0.1168 ( 3246 PWs) bands (ev): -9.6577 -9.6577 -9.6577 -9.6577 -7.7056 -7.7056 -7.7056 -7.7056 3.4163 3.4163 3.4164 3.4164 4.7645 4.7645 4.7654 4.7654 5.5257 5.5257 5.5263 5.5263 6.3057 6.3057 6.3746 6.3746 6.5116 6.5116 6.6816 6.6816 6.9427 6.9427 7.1038 7.1038 7.4784 7.4784 7.5020 7.5020 7.7473 7.7473 7.8618 7.8618 8.1440 8.1440 8.1441 8.1441 8.6707 8.6707 8.7154 8.7154 9.3255 9.3255 9.3381 9.3381 12.5587 12.5587 12.5591 12.5591 16.5253 16.5253 16.5266 16.5266 18.6994 18.6996 k = 0.0913 0.1582 0.1168 ( 3240 PWs) bands (ev): -9.6856 -9.6856 -9.6856 -9.6856 -7.7136 -7.7136 -7.7136 -7.7136 3.3954 3.3954 3.3955 3.3955 4.7234 4.7234 4.7242 4.7242 5.5789 5.5789 5.5791 5.5791 6.3371 6.3371 6.4011 6.4011 6.5554 6.5554 6.7265 6.7265 6.9592 6.9592 7.1207 7.1207 7.4881 7.4881 7.5151 7.5151 7.7685 7.7685 7.8777 7.8777 8.1132 8.1132 8.1153 8.1153 8.6943 8.6943 8.7368 8.7368 9.3416 9.3416 9.3534 9.3534 12.5461 12.5461 12.5465 12.5465 16.4299 16.4299 16.4310 16.4310 18.6145 18.6146 k = 0.0868 0.1503 0.1168 ( 3244 PWs) bands (ev): -9.7123 -9.7123 -9.7123 -9.7123 -7.7214 -7.7214 -7.7214 -7.7214 3.3743 3.3743 3.3744 3.3744 4.6812 4.6812 4.6819 4.6819 5.6339 5.6339 5.6339 5.6339 6.3622 6.3622 6.4174 6.4174 6.6057 6.6057 6.7735 6.7735 6.9754 6.9754 7.1361 7.1361 7.5000 7.5000 7.5308 7.5308 7.7886 7.7886 7.8914 7.8914 8.0849 8.0849 8.0894 8.0894 8.7187 8.7187 8.7585 8.7585 9.3577 9.3577 9.3686 9.3686 12.5330 12.5330 12.5334 12.5334 16.3375 16.3375 16.3384 16.3384 18.5315 18.5316 k = 0.0822 0.1424 0.1168 ( 3246 PWs) bands (ev): -9.7379 -9.7379 -9.7379 -9.7379 -7.7290 -7.7290 -7.7290 -7.7290 3.3533 3.3533 3.3533 3.3533 4.6390 4.6390 4.6395 4.6395 5.6898 5.6898 5.6900 5.6900 6.3819 6.3819 6.4279 6.4279 6.6579 6.6579 6.8208 6.8208 6.9915 6.9915 7.1500 7.1500 7.5146 7.5146 7.5494 7.5494 7.8075 7.8075 7.9026 7.9026 8.0593 8.0593 8.0671 8.0671 8.7433 8.7433 8.7801 8.7801 9.3738 9.3738 9.3838 9.3838 12.5193 12.5193 12.5196 12.5196 16.2482 16.2482 16.2491 16.2491 18.4503 18.4506 k = 0.0776 0.1345 0.1168 ( 3242 PWs) bands (ev): -9.7622 -9.7622 -9.7622 -9.7622 -7.7364 -7.7364 -7.7364 -7.7364 3.3324 3.3324 3.3325 3.3325 4.5973 4.5973 4.5978 4.5978 5.7460 5.7460 5.7463 5.7463 6.3972 6.3972 6.4349 6.4349 6.7089 6.7089 6.8659 6.8659 7.0083 7.0083 7.1623 7.1623 7.5321 7.5321 7.5709 7.5709 7.8250 7.8250 7.9108 7.9108 8.0369 8.0369 8.0491 8.0491 8.7678 8.7678 8.8014 8.8014 9.3897 9.3897 9.3988 9.3988 12.5051 12.5051 12.5054 12.5054 16.1624 16.1624 16.1631 16.1631 18.3717 18.3719 k = 0.0731 0.1265 0.1168 ( 3242 PWs) bands (ev): -9.7853 -9.7853 -9.7853 -9.7853 -7.7435 -7.7435 -7.7435 -7.7435 3.3118 3.3118 3.3119 3.3119 4.5568 4.5568 4.5571 4.5571 5.8020 5.8020 5.8023 5.8023 6.4089 6.4089 6.4397 6.4397 6.7572 6.7572 6.9064 6.9064 7.0265 7.0265 7.1729 7.1729 7.5529 7.5529 7.5953 7.5953 7.8411 7.8411 7.9153 7.9153 8.0177 8.0177 8.0360 8.0360 8.7919 8.7919 8.8221 8.8221 9.4055 9.4055 9.4136 9.4136 12.4904 12.4904 12.4906 12.4906 16.0803 16.0803 16.0809 16.0809 18.2957 18.2958 k = 0.0685 0.1186 0.1168 ( 3244 PWs) bands (ev): -9.8072 -9.8072 -9.8072 -9.8072 -7.7504 -7.7504 -7.7504 -7.7504 3.2917 3.2917 3.2917 3.2917 4.5178 4.5178 4.5181 4.5181 5.8573 5.8573 5.8575 5.8575 6.4178 6.4178 6.4428 6.4428 6.8019 6.8019 6.9403 6.9403 7.0470 7.0470 7.1820 7.1820 7.5770 7.5770 7.6224 7.6224 7.8553 7.8553 7.9158 7.9158 8.0021 8.0021 8.0283 8.0283 8.8152 8.8152 8.8420 8.8420 9.4211 9.4211 9.4282 9.4282 12.4752 12.4752 12.4754 12.4754 16.0019 16.0019 16.0024 16.0024 18.2226 18.2227 k = 0.0639 0.1107 0.1168 ( 3244 PWs) bands (ev): -9.8277 -9.8277 -9.8277 -9.8277 -7.7569 -7.7569 -7.7569 -7.7569 3.2720 3.2720 3.2721 3.2721 4.4806 4.4806 4.4808 4.4808 5.9114 5.9114 5.9114 5.9114 6.4244 6.4244 6.4447 6.4447 6.8426 6.8426 6.9666 6.9666 7.0700 7.0700 7.1897 7.1897 7.6043 7.6043 7.6515 7.6515 7.8672 7.8672 7.9128 7.9128 7.9907 7.9907 8.0254 8.0254 8.8376 8.8376 8.8610 8.8610 9.4364 9.4364 9.4426 9.4426 12.4597 12.4597 12.4598 12.4599 15.9276 15.9276 15.9280 15.9280 18.1525 18.1527 k = 0.0594 0.1028 0.1168 ( 3248 PWs) bands (ev): -9.8469 -9.8469 -9.8469 -9.8469 -7.7631 -7.7631 -7.7631 -7.7631 3.2531 3.2531 3.2531 3.2531 4.4455 4.4455 4.4457 4.4457 5.9638 5.9638 5.9639 5.9639 6.4291 6.4291 6.4456 6.4456 6.8791 6.8791 6.9861 6.9861 7.0943 7.0943 7.1960 7.1960 7.6345 7.6345 7.6821 7.6821 7.8763 7.8763 7.9075 7.9075 7.9840 7.9840 8.0262 8.0262 8.8589 8.8589 8.8790 8.8790 9.4513 9.4513 9.4566 9.4566 12.4440 12.4440 12.4441 12.4441 15.8575 15.8575 15.8578 15.8578 18.0860 18.0861 k = 0.0548 0.0949 0.1168 ( 3240 PWs) bands (ev): -9.8648 -9.8648 -9.8648 -9.8648 -7.7690 -7.7690 -7.7690 -7.7690 3.2349 3.2349 3.2349 3.2349 4.4127 4.4127 4.4128 4.4128 6.0141 6.0141 6.0144 6.0144 6.4323 6.4323 6.4457 6.4457 6.9115 6.9115 7.0006 7.0006 7.1178 7.1178 7.2012 7.2012 7.6670 7.6670 7.7132 7.7132 7.8819 7.8819 7.9010 7.9010 7.9826 7.9826 8.0294 8.0294 8.8790 8.8790 8.8959 8.8959 9.4657 9.4657 9.4701 9.4701 12.4282 12.4282 12.4283 12.4283 15.7918 15.7918 15.7921 15.7921 18.0232 18.0232 k = 0.0502 0.0870 0.1168 ( 3242 PWs) bands (ev): -9.8813 -9.8813 -9.8813 -9.8813 -7.7744 -7.7744 -7.7744 -7.7744 3.2177 3.2177 3.2177 3.2177 4.3822 4.3822 4.3823 4.3823 6.0621 6.0621 6.0625 6.0625 6.4343 6.4343 6.4450 6.4450 6.9399 6.9399 7.0117 7.0117 7.1393 7.1393 7.2054 7.2054 7.7009 7.7009 7.7439 7.7439 7.8841 7.8841 7.8944 7.8944 7.9864 7.9864 8.0340 8.0340 8.8977 8.8977 8.9116 8.9116 9.4796 9.4796 9.4832 9.4832 12.4125 12.4125 12.4126 12.4126 15.7308 15.7308 15.7310 15.7310 17.9643 17.9643 k = 0.0457 0.0791 0.1168 ( 3232 PWs) bands (ev): -9.8964 -9.8964 -9.8964 -9.8964 -7.7795 -7.7795 -7.7795 -7.7795 3.2014 3.2014 3.2015 3.2015 4.3542 4.3542 4.3542 4.3542 6.1074 6.1074 6.1081 6.1081 6.4353 6.4353 6.4438 6.4438 6.9645 6.9645 7.0206 7.0206 7.1580 7.1580 7.2088 7.2088 7.7351 7.7351 7.7732 7.7732 7.8839 7.8839 7.8881 7.8881 7.9947 7.9947 8.0394 8.0394 8.9150 8.9150 8.9261 8.9261 9.4928 9.4928 9.4956 9.4956 12.3971 12.3971 12.3971 12.3971 15.6744 15.6744 15.6746 15.6746 17.9095 17.9096 k = 0.0411 0.0712 0.1168 ( 3236 PWs) bands (ev): -9.9102 -9.9102 -9.9102 -9.9102 -7.7841 -7.7841 -7.7841 -7.7841 3.1864 3.1864 3.1864 3.1864 4.3287 4.3287 4.3288 4.3288 6.1498 6.1498 6.1506 6.1506 6.4355 6.4355 6.4421 6.4421 6.9855 6.9855 7.0280 7.0280 7.1738 7.1738 7.2115 7.2115 7.7685 7.7685 7.8002 7.8002 7.8824 7.8824 7.8826 7.8826 8.0063 8.0063 8.0455 8.0455 8.9308 8.9308 8.9394 8.9394 9.5052 9.5052 9.5074 9.5074 12.3821 12.3821 12.3821 12.3821 15.6230 15.6230 15.6231 15.6231 17.8592 17.8593 k = 0.0365 0.0633 0.1168 ( 3234 PWs) bands (ev): -9.9225 -9.9225 -9.9225 -9.9225 -7.7883 -7.7883 -7.7883 -7.7883 3.1725 3.1725 3.1726 3.1726 4.3059 4.3059 4.3059 4.3059 6.1890 6.1890 6.1898 6.1898 6.4350 6.4350 6.4401 6.4401 7.0033 7.0033 7.0341 7.0341 7.1868 7.1868 7.2138 7.2138 7.7999 7.7999 7.8239 7.8239 7.8778 7.8778 7.8807 7.8807 8.0200 8.0200 8.0521 8.0521 8.9451 8.9451 8.9514 8.9514 9.5167 9.5167 9.5183 9.5183 12.3678 12.3678 12.3679 12.3679 15.5767 15.5767 15.5767 15.5767 17.8136 17.8136 k = 0.0320 0.0554 0.1168 ( 3230 PWs) bands (ev): -9.9335 -9.9335 -9.9335 -9.9335 -7.7921 -7.7921 -7.7921 -7.7921 3.1601 3.1601 3.1601 3.1601 4.2856 4.2856 4.2857 4.2857 6.2247 6.2247 6.2255 6.2255 6.4339 6.4339 6.4377 6.4377 7.0181 7.0181 7.0394 7.0394 7.1974 7.1974 7.2158 7.2158 7.8284 7.8284 7.8433 7.8433 7.8739 7.8739 7.8799 7.8799 8.0349 8.0349 8.0593 8.0593 8.9577 8.9577 8.9621 8.9621 9.5272 9.5272 9.5283 9.5283 12.3545 12.3545 12.3545 12.3545 15.5355 15.5355 15.5355 15.5355 17.7727 17.7727 k = 0.0274 0.0475 0.1168 ( 3228 PWs) bands (ev): -9.9429 -9.9429 -9.9429 -9.9429 -7.7953 -7.7953 -7.7953 -7.7953 3.1491 3.1491 3.1491 3.1491 4.2681 4.2681 4.2681 4.2681 6.2567 6.2567 6.2575 6.2575 6.4323 6.4323 6.4351 6.4351 7.0301 7.0301 7.0439 7.0439 7.2057 7.2057 7.2175 7.2175 7.8528 7.8528 7.8567 7.8567 7.8711 7.8711 7.8819 7.8819 8.0500 8.0500 8.0670 8.0670 8.9686 8.9686 8.9715 8.9715 9.5365 9.5365 9.5372 9.5372 12.3424 12.3424 12.3424 12.3424 15.4996 15.4996 15.4996 15.4996 17.7369 17.7370 k = 0.0228 0.0395 0.1168 ( 3226 PWs) bands (ev): -9.9510 -9.9510 -9.9510 -9.9510 -7.7981 -7.7981 -7.7981 -7.7981 3.1396 3.1396 3.1396 3.1396 4.2532 4.2532 4.2533 4.2533 6.2848 6.2848 6.2854 6.2854 6.4304 6.4304 6.4322 6.4322 7.0396 7.0396 7.0478 7.0478 7.2122 7.2122 7.2191 7.2191 7.8625 7.8625 7.8663 7.8663 7.8756 7.8756 7.8886 7.8886 8.0644 8.0644 8.0750 8.0750 8.9778 8.9778 8.9796 8.9796 9.5446 9.5446 9.5451 9.5451 12.3316 12.3316 12.3316 12.3316 15.4690 15.4690 15.4690 15.4690 17.7064 17.7064 k = 0.0183 0.0316 0.1168 ( 3234 PWs) bands (ev): -9.9576 -9.9576 -9.9576 -9.9576 -7.8004 -7.8004 -7.8004 -7.8004 3.1318 3.1318 3.1318 3.1318 4.2411 4.2411 4.2411 4.2411 6.3087 6.3087 6.3092 6.3092 6.4281 6.4281 6.4292 6.4292 7.0468 7.0468 7.0511 7.0511 7.2169 7.2169 7.2205 7.2205 7.8637 7.8637 7.8654 7.8654 7.8906 7.8906 7.8973 7.8973 8.0773 8.0773 8.0830 8.0830 8.9854 8.9854 8.9863 8.9863 9.5514 9.5514 9.5516 9.5516 12.3225 12.3225 12.3225 12.3225 15.4439 15.4439 15.4439 15.4439 17.6811 17.6811 k = 0.0137 0.0237 0.1168 ( 3238 PWs) bands (ev): -9.9627 -9.9627 -9.9627 -9.9627 -7.8022 -7.8022 -7.8022 -7.8022 3.1256 3.1256 3.1256 3.1256 4.2316 4.2316 4.2316 4.2316 6.3282 6.3282 6.3285 6.3285 6.4255 6.4255 6.4261 6.4261 7.0520 7.0520 7.0538 7.0538 7.2203 7.2203 7.2218 7.2218 7.8636 7.8636 7.8641 7.8641 7.9022 7.9022 7.9050 7.9050 8.0879 8.0879 8.0904 8.0904 8.9912 8.9912 8.9916 8.9916 9.5567 9.5567 9.5568 9.5568 12.3152 12.3152 12.3152 12.3152 15.4244 15.4244 15.4244 15.4244 17.6614 17.6614 k = 0.0091 0.0158 0.1168 ( 3242 PWs) bands (ev): -9.9664 -9.9664 -9.9664 -9.9664 -7.8035 -7.8035 -7.8035 -7.8035 3.1212 3.1212 3.1212 3.1212 4.2249 4.2249 4.2249 4.2249 6.3430 6.3430 6.3431 6.3431 6.4230 6.4230 6.4232 6.4232 7.0554 7.0554 7.0559 7.0559 7.2224 7.2224 7.2229 7.2229 7.8631 7.8631 7.8633 7.8633 7.9100 7.9100 7.9108 7.9108 8.0958 8.0958 8.0965 8.0965 8.9953 8.9953 8.9955 8.9955 9.5606 9.5606 9.5606 9.5606 12.3098 12.3098 12.3098 12.3098 15.4103 15.4103 15.4103 15.4103 17.6472 17.6472 k = 0.0046 0.0079 0.1168 ( 3246 PWs) bands (ev): -9.9686 -9.9686 -9.9686 -9.9686 -7.8043 -7.8043 -7.8043 -7.8043 3.1185 3.1185 3.1185 3.1185 4.2208 4.2208 4.2208 4.2208 6.3524 6.3524 6.3524 6.3524 6.4209 6.4209 6.4210 6.4210 7.0572 7.0572 7.0573 7.0573 7.2236 7.2236 7.2236 7.2236 7.8628 7.8628 7.8628 7.8628 7.9144 7.9144 7.9145 7.9145 8.1005 8.1005 8.1006 8.1006 8.9978 8.9978 8.9978 8.9978 9.5629 9.5629 9.5629 9.5629 12.3066 12.3066 12.3066 12.3066 15.4019 15.4019 15.4019 15.4019 17.6386 17.6386 k = 0.0000 0.0000 0.1168 ( 3242 PWs) bands (ev): -9.9693 -9.9693 -9.9693 -9.9693 -7.8045 -7.8045 -7.8045 -7.8045 3.1176 3.1176 3.1176 3.1176 4.2195 4.2195 4.2195 4.2195 6.3556 6.3556 6.3556 6.3556 6.4201 6.4201 6.4201 6.4201 7.0578 7.0578 7.0578 7.0578 7.2239 7.2239 7.2239 7.2239 7.8626 7.8626 7.8626 7.8626 7.9157 7.9157 7.9157 7.9157 8.1020 8.1020 8.1020 8.1020 8.9986 8.9986 8.9986 8.9986 9.5637 9.5637 9.5637 9.5637 12.3055 12.3055 12.3055 12.3055 15.3991 15.3991 15.3991 15.3991 17.6358 17.6358 k = 0.5000 0.2887 0.1168 ( 3284 PWs) bands (ev): -8.2863 -8.2863 -8.2863 -8.2863 -7.6813 -7.6813 -7.6813 -7.6813 2.8187 2.8187 2.8187 2.8187 3.7197 3.7197 3.7197 3.7197 5.1152 5.1152 5.1152 5.1152 5.1928 5.1928 5.1928 5.1928 6.1642 6.1642 6.1642 6.1642 7.0291 7.0291 7.0291 7.0291 7.2685 7.2685 7.2685 7.2685 7.5381 7.5381 7.5381 7.5381 8.8448 8.8448 8.8448 8.8448 9.8635 9.8635 9.8635 9.8635 11.0501 11.0501 11.0501 11.0501 12.9160 12.9160 12.9160 12.9160 16.3688 16.3688 16.3688 16.3688 18.5859 18.5859 k = 0.5000 0.2887 0.1078 ( 3292 PWs) bands (ev): -8.2923 -8.2923 -8.2801 -8.2801 -7.6888 -7.6888 -7.6739 -7.6739 2.8166 2.8166 2.8220 2.8220 3.6945 3.6945 3.7411 3.7411 5.1027 5.1027 5.1326 5.1326 5.1885 5.1885 5.2009 5.2009 6.1489 6.1489 6.1802 6.1802 6.9462 6.9462 7.1044 7.1044 7.2050 7.2050 7.3285 7.3285 7.5042 7.5042 7.5788 7.5788 8.8161 8.8161 8.8721 8.8721 9.8628 9.8628 9.8642 9.8642 11.0364 11.0364 11.0620 11.0620 12.9033 12.9033 12.9289 12.9289 16.3426 16.3426 16.3962 16.3962 18.5707 18.5738 k = 0.5000 0.2887 0.0988 ( 3294 PWs) bands (ev): -8.2982 -8.2982 -8.2739 -8.2739 -7.6964 -7.6964 -7.6668 -7.6668 2.8158 2.8158 2.8265 2.8265 3.6662 3.6662 3.7580 3.7580 5.0972 5.0972 5.1502 5.1502 5.1866 5.1866 5.2166 5.2166 6.1343 6.1343 6.1968 6.1968 6.8603 6.8603 7.1141 7.1141 7.1963 7.1963 7.3731 7.3731 7.4887 7.4887 7.6221 7.6221 8.7863 8.7863 8.8979 8.8979 9.8623 9.8623 9.8650 9.8650 11.0214 11.0214 11.0720 11.0720 12.8911 12.8911 12.9419 12.9419 16.3178 16.3178 16.4245 16.4245 18.5559 18.5559 k = 0.5000 0.2887 0.0898 ( 3292 PWs) bands (ev): -8.3037 -8.3037 -8.2677 -8.2677 -7.7038 -7.7038 -7.6600 -7.6600 2.8163 2.8163 2.8322 2.8322 3.6357 3.6357 3.7702 3.7702 5.0993 5.0993 5.1628 5.1628 5.1873 5.1873 5.2437 5.2437 6.1207 6.1207 6.2137 6.2137 6.7728 6.7728 7.0460 7.0460 7.2476 7.2476 7.3919 7.3919 7.5093 7.5093 7.6661 7.6661 8.7558 8.7558 8.9219 8.9219 9.8618 9.8618 9.8658 9.8658 11.0052 11.0052 11.0802 11.0802 12.8795 12.8795 12.9546 12.9546 16.2948 16.2948 16.4533 16.4533 18.5424 18.5424 k = 0.5000 0.2887 0.0808 ( 3290 PWs) bands (ev): -8.3088 -8.3088 -8.2616 -8.2616 -7.7111 -7.7111 -7.6536 -7.6536 2.8179 2.8179 2.8387 2.8387 3.6040 3.6040 3.7777 3.7777 5.1081 5.1081 5.1691 5.1691 5.1922 5.1922 5.2814 5.2814 6.1080 6.1080 6.2307 6.2307 6.6847 6.6847 6.9712 6.9712 7.2702 7.2702 7.4162 7.4162 7.5530 7.5530 7.7093 7.7093 8.7248 8.7248 8.9440 8.9440 9.8614 9.8614 9.8666 9.8666 10.9882 10.9882 11.0865 11.0865 12.8686 12.8686 12.9669 12.9669 16.2737 16.2737 16.4821 16.4821 18.5299 18.5299 k = 0.5000 0.2887 0.0719 ( 3278 PWs) bands (ev): -8.3136 -8.3136 -8.2557 -8.2557 -7.7182 -7.7182 -7.6477 -7.6477 2.8205 2.8205 2.8460 2.8460 3.5722 3.5722 3.7808 3.7808 5.1209 5.1209 5.1712 5.1712 5.2034 5.2034 5.3263 5.3263 6.0962 6.0962 6.2474 6.2474 6.5971 6.5971 6.8953 6.8953 7.2593 7.2593 7.4645 7.4645 7.6010 7.6010 7.7503 7.7503 8.6940 8.6940 8.9640 8.9640 9.8611 9.8611 9.8675 9.8675 10.9710 10.9710 11.0910 11.0910 12.8587 12.8587 12.9786 12.9786 16.2546 16.2546 16.5104 16.5104 18.5186 18.5186 k = 0.5000 0.2887 0.0629 ( 3278 PWs) bands (ev): -8.3179 -8.3179 -8.2502 -8.2502 -7.7247 -7.7247 -7.6424 -7.6424 2.8240 2.8240 2.8537 2.8537 3.5410 3.5410 3.7803 3.7803 5.1341 5.1341 5.1714 5.1714 5.2228 5.2228 5.3754 5.3754 6.0854 6.0854 6.2637 6.2637 6.5111 6.5111 6.8198 6.8198 7.2356 7.2356 7.5214 7.5214 7.6474 7.6474 7.7879 7.7879 8.6638 8.6638 8.9818 8.9818 9.8609 9.8609 9.8683 9.8683 10.9540 10.9540 11.0940 11.0940 12.8498 12.8498 12.9894 12.9894 16.2376 16.2376 16.5375 16.5375 18.5084 18.5084 k = 0.5000 0.2887 0.0539 ( 3286 PWs) bands (ev): -8.3217 -8.3217 -8.2451 -8.2451 -7.7308 -7.7308 -7.6376 -7.6376 2.8280 2.8280 2.8616 2.8616 3.5116 3.5116 3.7771 3.7771 5.1444 5.1444 5.1711 5.1711 5.2516 5.2516 5.4265 5.4265 6.0755 6.0755 6.2789 6.2789 6.4282 6.4282 6.7462 6.7462 7.2095 7.2095 7.5777 7.5777 7.6903 7.6903 7.8209 7.8209 8.6349 8.6349 8.9975 8.9975 9.8607 9.8607 9.8690 9.8690 10.9378 10.9378 11.0957 11.0957 12.8421 12.8421 12.9992 12.9992 16.2228 16.2228 16.5629 16.5629 18.4994 18.4995 k = 0.5000 0.2887 0.0449 ( 3286 PWs) bands (ev): -8.3250 -8.3250 -8.2406 -8.2406 -7.7361 -7.7361 -7.6335 -7.6335 2.8323 2.8323 2.8694 2.8694 3.4846 3.4846 3.7721 3.7721 5.1514 5.1514 5.1705 5.1705 5.2882 5.2882 5.4776 5.4776 6.0660 6.0660 6.2917 6.2917 6.3514 6.3514 6.6761 6.6761 7.1846 7.1846 7.6301 7.6301 7.7289 7.7289 7.8482 7.8482 8.6081 8.6081 9.0108 9.0108 9.8606 9.8606 9.8697 9.8697 10.9229 10.9229 11.0964 11.0964 12.8354 12.8354 13.0078 13.0078 16.2103 16.2103 16.5858 16.5858 18.4918 18.4918 k = 0.5000 0.2887 0.0359 ( 3280 PWs) bands (ev): -8.3277 -8.3277 -8.2367 -8.2367 -7.7407 -7.7407 -7.6301 -7.6301 2.8365 2.8365 2.8765 2.8765 3.4610 3.4610 3.7664 3.7664 5.1560 5.1560 5.1697 5.1697 5.3293 5.3293 5.5261 5.5261 6.0565 6.0565 6.2734 6.2734 6.3114 6.3114 6.6117 6.6117 7.1626 7.1626 7.6765 7.6765 7.7628 7.7628 7.8690 7.8690 8.5843 8.5843 9.0217 9.0217 9.8606 9.8606 9.8702 9.8702 10.9099 10.9099 11.0965 11.0965 12.8300 12.8300 13.0150 13.0150 16.2000 16.2000 16.6057 16.6057 18.4854 18.4854 k = 0.5000 0.2887 0.0269 ( 3278 PWs) bands (ev): -8.3299 -8.3299 -8.2336 -8.2336 -7.7443 -7.7443 -7.6274 -7.6274 2.8402 2.8402 2.8827 2.8827 3.4416 3.4416 3.7610 3.7610 5.1592 5.1592 5.1689 5.1689 5.3707 5.3707 5.5692 5.5692 6.0460 6.0460 6.2167 6.2167 6.3192 6.3192 6.5554 6.5554 7.1445 7.1445 7.7152 7.7152 7.7917 7.7917 7.8827 7.8827 8.5645 8.5645 9.0303 9.0303 9.8606 9.8606 9.8707 9.8707 10.8992 10.8992 11.0961 11.0961 12.8258 12.8258 13.0207 13.0207 16.1920 16.1920 16.6220 16.6220 18.4804 18.4804 k = 0.5000 0.2887 0.0180 ( 3278 PWs) bands (ev): -8.3314 -8.3314 -8.2313 -8.2313 -7.7470 -7.7470 -7.6255 -7.6255 2.8432 2.8432 2.8875 2.8875 3.4271 3.4271 3.7565 3.7565 5.1615 5.1615 5.1681 5.1681 5.4073 5.4073 5.6035 5.6035 6.0339 6.0339 6.1736 6.1736 6.3269 6.3269 6.5107 6.5107 7.1312 7.1312 7.7445 7.7445 7.8154 7.8154 7.8894 7.8894 8.5496 8.5496 9.0364 9.0364 9.8606 9.8606 9.8711 9.8711 10.8912 10.8912 11.0957 11.0957 12.8227 12.8227 13.0249 13.0249 16.1863 16.1863 16.6340 16.6340 18.4768 18.4768 k = 0.5000 0.2887 0.0090 ( 3278 PWs) bands (ev): -8.3323 -8.3323 -8.2299 -8.2299 -7.7487 -7.7487 -7.6243 -7.6243 2.8451 2.8451 2.8906 2.8906 3.4182 3.4182 3.7535 3.7535 5.1630 5.1630 5.1673 5.1673 5.4332 5.4332 5.6257 5.6257 6.0224 6.0224 6.1486 6.1486 6.3320 6.3320 6.4815 6.4815 7.1229 7.1229 7.7626 7.7626 7.8324 7.8324 7.8907 7.8907 8.5402 8.5402 9.0401 9.0401 9.8606 9.8606 9.8713 9.8713 10.8863 10.8863 11.0953 11.0953 12.8209 12.8209 13.0274 13.0274 16.1828 16.1828 16.6414 16.6414 18.4746 18.4746 k = 0.5000 0.2887-0.0000 ( 3284 PWs) bands (ev): -8.3326 -8.3326 -8.2294 -8.2294 -7.7492 -7.7492 -7.6239 -7.6239 2.8457 2.8457 2.8916 2.8916 3.4151 3.4151 3.7525 3.7525 5.1636 5.1636 5.1669 5.1669 5.4426 5.4426 5.6333 5.6333 6.0175 6.0175 6.1408 6.1408 6.3338 6.3338 6.4713 6.4713 7.1201 7.1201 7.7686 7.7686 7.8391 7.8391 7.8902 7.8902 8.5371 8.5371 9.0413 9.0413 9.8606 9.8606 9.8713 9.8713 10.8847 10.8847 11.0952 11.0952 12.8203 12.8203 13.0282 13.0282 16.1817 16.1817 16.6439 16.6439 18.4739 18.4739 k = 0.3333 0.5774-0.0000 ( 3318 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7991 -7.7991 -7.7975 -7.7975 3.5436 3.5436 3.7532 3.7532 3.7536 3.7536 3.7777 3.7777 4.2145 4.2145 4.2584 4.2584 5.2920 5.2920 5.9174 5.9174 6.0768 6.0768 6.1483 6.1483 6.5992 6.5992 6.6489 6.6489 6.7128 6.7128 7.1987 7.1987 7.5586 7.5586 7.8545 7.8545 7.8629 7.8629 8.2365 8.2365 8.4105 8.4105 8.6421 8.6421 10.7791 10.7791 10.7817 10.7817 16.7946 16.7946 16.8307 16.8307 17.0120 17.0120 17.2351 17.2351 17.6877 17.6877 k = 0.3333 0.5774 0.0090 ( 3312 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7991 -7.7991 -7.7975 -7.7975 3.5441 3.5441 3.7516 3.7516 3.7521 3.7521 3.7771 3.7771 4.2176 4.2176 4.2609 4.2609 5.2937 5.2937 5.9138 5.9138 6.0661 6.0661 6.1438 6.1438 6.6009 6.6009 6.6610 6.6610 6.7127 6.7127 7.2036 7.2036 7.5611 7.5611 7.8537 7.8537 7.8625 7.8625 8.2340 8.2340 8.4096 8.4096 8.6389 8.6389 10.7797 10.7797 10.7821 10.7821 16.7954 16.7954 16.8311 16.8311 17.0125 17.0125 17.2343 17.2343 17.6871 17.6871 k = 0.3333 0.5774 0.0180 ( 3318 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7991 -7.7991 -7.7975 -7.7975 3.5457 3.5457 3.7472 3.7472 3.7478 3.7478 3.7753 3.7753 4.2265 4.2265 4.2684 4.2684 5.2988 5.2988 5.9032 5.9032 6.0365 6.0365 6.1312 6.1312 6.6057 6.6057 6.6949 6.6949 6.7124 6.7124 7.2181 7.2181 7.5687 7.5687 7.8511 7.8511 7.8613 7.8613 8.2265 8.2265 8.4071 8.4071 8.6294 8.6294 10.7813 10.7813 10.7833 10.7833 16.7977 16.7977 16.8322 16.8322 17.0141 17.0141 17.2321 17.2321 17.6854 17.6854 k = 0.3333 0.5774 0.0269 ( 3318 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7991 -7.7991 -7.7975 -7.7975 3.5484 3.5484 3.7403 3.7403 3.7411 3.7411 3.7723 3.7723 4.2406 4.2406 4.2803 4.2803 5.3070 5.3070 5.8860 5.8860 5.9939 5.9939 6.1118 6.1118 6.6125 6.6125 6.7120 6.7120 6.7448 6.7448 7.2415 7.2415 7.5808 7.5808 7.8467 7.8467 7.8594 7.8594 8.2144 8.2144 8.4031 8.4031 8.6140 8.6140 10.7839 10.7839 10.7852 10.7852 16.8015 16.8015 16.8340 16.8340 17.0167 17.0167 17.2285 17.2285 17.6826 17.6826 k = 0.3333 0.5774 0.0359 ( 3315 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7991 -7.7991 -7.7975 -7.7975 3.5520 3.5520 3.7318 3.7318 3.7326 3.7326 3.7682 3.7682 4.2591 4.2591 4.2959 4.2959 5.3183 5.3183 5.8633 5.8633 5.9438 5.9438 6.0878 6.0878 6.6201 6.6201 6.7115 6.7115 6.8050 6.8050 7.2724 7.2724 7.5970 7.5970 7.8400 7.8400 7.8568 7.8568 8.1984 8.1984 8.3976 8.3976 8.5931 8.5931 10.7873 10.7873 10.7878 10.7878 16.8066 16.8066 16.8364 16.8364 17.0201 17.0201 17.2237 17.2237 17.6790 17.6790 k = 0.3333 0.5774 0.0449 ( 3321 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7991 -7.7991 -7.7975 -7.7975 3.5566 3.5566 3.7222 3.7222 3.7229 3.7229 3.7632 3.7632 4.2806 4.2806 4.3142 4.3142 5.3321 5.3321 5.8363 5.8363 5.8907 5.8907 6.0609 6.0609 6.6275 6.6275 6.7109 6.7109 6.8714 6.8714 7.3094 7.3094 7.6164 7.6164 7.8305 7.8305 7.8536 7.8536 8.1794 8.1794 8.3909 8.3909 8.5672 8.5672 10.7908 10.7908 10.7912 10.7912 16.8127 16.8127 16.8392 16.8392 17.0241 17.0241 17.2178 17.2178 17.6746 17.6746 k = 0.3333 0.5774 0.0539 ( 3324 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7991 -7.7991 -7.7975 -7.7975 3.5620 3.5620 3.7124 3.7124 3.7125 3.7125 3.7574 3.7574 4.3041 4.3041 4.3341 4.3341 5.3481 5.3481 5.8064 5.8064 5.8376 5.8376 6.0326 6.0326 6.6342 6.6342 6.7103 6.7103 6.9409 6.9409 7.3505 7.3505 7.6379 7.6379 7.8178 7.8178 7.8503 7.8503 8.1586 8.1586 8.3834 8.3834 8.5375 8.5375 10.7940 10.7940 10.7956 10.7956 16.8196 16.8196 16.8423 16.8423 17.0287 17.0287 17.2112 17.2112 17.6697 17.6697 k = 0.3333 0.5774 0.0629 ( 3318 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7991 -7.7991 -7.7975 -7.7975 3.5682 3.5682 3.7018 3.7018 3.7028 3.7028 3.7514 3.7514 4.3283 4.3283 4.3546 4.3546 5.3655 5.3655 5.7755 5.7755 5.7868 5.7868 6.0043 6.0043 6.6399 6.6399 6.7096 6.7096 7.0115 7.0115 7.3940 7.3940 7.6599 7.6599 7.8012 7.8012 7.8476 7.8476 8.1373 8.1373 8.3752 8.3752 8.5049 8.5049 10.7974 10.7974 10.8000 10.8000 16.8270 16.8270 16.8455 16.8455 17.0334 17.0334 17.2041 17.2041 17.6646 17.6646 k = 0.3333 0.5774 0.0719 ( 3312 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7991 -7.7991 -7.7975 -7.7975 3.5750 3.5750 3.6911 3.6911 3.6940 3.6940 3.7453 3.7453 4.3520 4.3520 4.3746 4.3746 5.3836 5.3836 5.7402 5.7402 5.7452 5.7452 5.9770 5.9770 6.6446 6.6446 6.7091 6.7091 7.0810 7.0810 7.4378 7.4378 7.6799 7.6799 7.7803 7.7803 7.8466 7.8466 8.1172 8.1172 8.3667 8.3667 8.4711 8.4711 10.8006 10.8006 10.8042 10.8042 16.8345 16.8345 16.8486 16.8486 17.0380 17.0380 17.1969 17.1969 17.6596 17.6596 k = 0.3333 0.5774 0.0808 ( 3300 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7990 -7.7990 -7.7975 -7.7975 3.5822 3.5822 3.6809 3.6809 3.6864 3.6864 3.7396 3.7396 4.3738 4.3738 4.3929 4.3929 5.4015 5.4015 5.6993 5.6993 5.7173 5.7173 5.9519 5.9519 6.6483 6.6483 6.7086 6.7086 7.1475 7.1475 7.4800 7.4800 7.6952 7.6952 7.7552 7.7552 7.8490 7.8490 8.0994 8.0994 8.3577 8.3577 8.4385 8.4385 10.8036 10.8036 10.8081 10.8081 16.8416 16.8416 16.8515 16.8515 17.0423 17.0423 17.1901 17.1901 17.6550 17.6550 k = 0.3333 0.5774 0.0898 ( 3294 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7990 -7.7990 -7.7975 -7.7975 3.5893 3.5893 3.6715 3.6715 3.6802 3.6802 3.7347 3.7347 4.3924 4.3924 4.4085 4.4085 5.4179 5.4179 5.6656 5.6656 5.6933 5.6933 5.9302 5.9302 6.6510 6.6510 6.7082 6.7082 7.2082 7.2082 7.5186 7.5186 7.7030 7.7030 7.7274 7.7274 7.8557 7.8557 8.0851 8.0851 8.3480 8.3480 8.4099 8.4099 10.8060 10.8060 10.8113 10.8113 16.8478 16.8478 16.8539 16.8539 17.0460 17.0460 17.1841 17.1841 17.6511 17.6511 k = 0.3333 0.5774 0.0988 ( 3288 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7990 -7.7990 -7.7975 -7.7975 3.5959 3.5959 3.6633 3.6633 3.6756 3.6756 3.7309 3.7309 4.4068 4.4068 4.4205 4.4205 5.4313 5.4313 5.6405 5.6405 5.6748 5.6748 5.9134 5.9134 6.6529 6.6529 6.7079 6.7079 7.2594 7.2594 7.5512 7.5512 7.7001 7.7001 7.7033 7.7033 7.8653 7.8653 8.0747 8.0747 8.3374 8.3374 8.3891 8.3891 10.8079 10.8079 10.8137 10.8137 16.8527 16.8527 16.8558 16.8558 17.0489 17.0489 17.1794 17.1794 17.6481 17.6481 k = 0.3333 0.5774 0.1078 ( 3282 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7990 -7.7990 -7.7975 -7.7975 3.6009 3.6009 3.6575 3.6575 3.6728 3.6728 3.7285 3.7285 4.4159 4.4159 4.4280 4.4280 5.4402 5.4402 5.6249 5.6249 5.6630 5.6630 5.9026 5.9026 6.6540 6.6540 6.7077 6.7077 7.2950 7.2950 7.5742 7.5742 7.6788 7.6788 7.6995 7.6995 7.8739 7.8739 8.0685 8.0685 8.3279 8.3279 8.3776 8.3776 10.8090 10.8090 10.8153 10.8153 16.8558 16.8558 16.8569 16.8569 17.0507 17.0507 17.1764 17.1764 17.6462 17.6462 k = 0.3333 0.5774 0.1168 ( 3294 PWs) bands (ev): -7.9126 -7.9126 -7.9111 -7.9111 -7.7990 -7.7990 -7.7975 -7.7975 3.6028 3.6028 3.6552 3.6552 3.6719 3.6719 3.7277 3.7277 4.4190 4.4190 4.4306 4.4306 5.4434 5.4434 5.6197 5.6197 5.6589 5.6589 5.8989 5.8989 6.6544 6.6544 6.7076 6.7076 7.3081 7.3081 7.5829 7.5829 7.6704 7.6704 7.6972 7.6972 7.8773 7.8773 8.0664 8.0664 8.3240 8.3240 8.3740 8.3740 10.8094 10.8094 10.8158 10.8158 16.8568 16.8568 16.8573 16.8573 17.0513 17.0513 17.1753 17.1753 17.6455 17.6455 Writing output data file AlAuO2.save init_run : 1.64s CPU 1.79s WALL ( 1 calls) electrons : 317.35s CPU 330.80s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 317.34s CPU 330.79s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.08s CPU 0.12s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.08s WALL ( 394 calls) cegterg : 300.49s CPU 304.48s WALL ( 959 calls) Called by sum_band: Called by *egterg: h_psi : 122.54s CPU 125.16s WALL ( 16348 calls) s_psi : 21.95s CPU 22.03s WALL ( 16348 calls) g_psi : 0.40s CPU 0.42s WALL ( 14995 calls) cdiaghg : 132.33s CPU 134.03s WALL ( 15389 calls) cegterg:over : 12.10s CPU 12.35s WALL ( 14995 calls) cegterg:upda : 10.64s CPU 10.53s WALL ( 14995 calls) cegterg:last : 5.35s CPU 5.43s WALL ( 2141 calls) cdiaghg:chol : 7.37s CPU 7.48s WALL ( 15389 calls) cdiaghg:inve : 5.27s CPU 5.31s WALL ( 15389 calls) cdiaghg:para : 8.23s CPU 8.49s WALL ( 30778 calls) Called by h_psi: h_psi:vloc : 92.82s CPU 95.18s WALL ( 16348 calls) h_psi:vnl : 29.34s CPU 29.56s WALL ( 16348 calls) add_vuspsi : 15.78s CPU 15.90s WALL ( 16348 calls) General routines calbec : 13.53s CPU 13.61s WALL ( 16348 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 84.97s CPU 87.17s WALL ( 1612912 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.22s CPU 5.59s WALL ( 788 calls) Parallel routines fft_scatter : 39.41s CPU 40.53s WALL ( 1612935 calls) PWSCF : 5m38.59s CPU 6m42.84s WALL This run was terminated on: 18:42:39 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=