Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:20: 1 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: ./CoSe.save/ 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 28 28 8 1092 1092 170 Max 29 29 9 1101 1101 175 Sum 1039 1039 301 39495 39495 6175 bravais-lattice index = 14 lattice parameter (alat) = 6.8586 a.u. unit-cell volume = 408.0579 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 46.00 number of Kohn-Sham states= 56 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.858572 celldm(2)= 1.000000 celldm(3)= 1.460462 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500000 0.866025 0.000000 ) a(3) = ( 0.000000 0.000000 1.460462 ) 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 0.684715 ) PseudoPot. # 1 for Se read from file: /users/gautes/Pseudo/Se.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 38611c150961c07dbd63be353364166d 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 1211 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 Co read from file: /users/gautes/Pseudo/Co.rel-pbe-oncvpsp.UPF MD5 check sum: 638ceb3e57836b9ea4bada7149e48805 Pseudo is Norm-conserving, Zval = 17.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1388 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 atomic species valence mass pseudopotential Se 6.00 78.96000 Se( 1.00) Co 17.00 58.93320 Co( 1.00) 24 Sym. Ops., with inversion, found (12 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.7302309 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.7302309 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 60 deg rotation - cryst. axis [0,0,1] cryst. s( 5) = ( 1 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 5) = ( 0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.7302309 ) isym = 6 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 6) = ( 0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.7302309 ) isym = 7 120 deg rotation - cryst. axis [0,0,1] cryst. s( 7) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 8) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 9) = ( 0 -1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 9) = ( 0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.7302309 ) isym = 10 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( 1 1 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(10) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.7302309 ) isym = 11 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(11) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 12 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(12) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 13 inversion cryst. s(13) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(13) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(14) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(14) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.7302309 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(15) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.7302309 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s(16) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 17 inv. 60 deg rotation - cryst. axis [0,0,1] cryst. s(17) = ( -1 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(17) = ( -0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.7302309 ) isym = 18 inv. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(18) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(18) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.7302309 ) isym = 19 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s(19) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s(19) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 20 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(20) = ( 1 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(20) = ( 0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 21 inv. 180 deg rotation - cryst. axis [1,-1,0] cryst. s(21) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(21) = ( -0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.7302309 ) isym = 22 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(22) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(22) = ( -0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.7302309 ) 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= 373 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026810 k( 2) = ( 0.0100000 0.0057735 -0.0000000), wk = 0.0026810 k( 3) = ( 0.0200000 0.0115470 -0.0000000), wk = 0.0026810 k( 4) = ( 0.0300000 0.0173205 -0.0000000), wk = 0.0026810 k( 5) = ( 0.0400000 0.0230940 -0.0000000), wk = 0.0026810 k( 6) = ( 0.0500000 0.0288675 -0.0000000), wk = 0.0026810 k( 7) = ( 0.0600000 0.0346410 -0.0000000), wk = 0.0026810 k( 8) = ( 0.0700000 0.0404145 -0.0000000), wk = 0.0026810 k( 9) = ( 0.0800000 0.0461880 -0.0000000), wk = 0.0026810 k( 10) = ( 0.0900000 0.0519615 -0.0000000), wk = 0.0026810 k( 11) = ( 0.1000000 0.0577350 -0.0000000), wk = 0.0026810 k( 12) = ( 0.1100000 0.0635085 -0.0000000), wk = 0.0026810 k( 13) = ( 0.1200000 0.0692820 -0.0000000), wk = 0.0026810 k( 14) = ( 0.1300000 0.0750555 -0.0000000), wk = 0.0026810 k( 15) = ( 0.1400000 0.0808290 -0.0000000), wk = 0.0026810 k( 16) = ( 0.1500000 0.0866025 -0.0000000), wk = 0.0026810 k( 17) = ( 0.1600000 0.0923760 -0.0000000), wk = 0.0026810 k( 18) = ( 0.1700000 0.0981495 -0.0000000), wk = 0.0026810 k( 19) = ( 0.1800000 0.1039230 -0.0000000), wk = 0.0026810 k( 20) = ( 0.1900000 0.1096966 -0.0000000), wk = 0.0026810 k( 21) = ( 0.2000000 0.1154701 -0.0000000), wk = 0.0026810 k( 22) = ( 0.2100000 0.1212436 -0.0000000), wk = 0.0026810 k( 23) = ( 0.2200000 0.1270171 -0.0000000), wk = 0.0026810 k( 24) = ( 0.2300000 0.1327906 -0.0000000), wk = 0.0026810 k( 25) = ( 0.2400000 0.1385641 -0.0000000), wk = 0.0026810 k( 26) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0026810 k( 27) = ( 0.2600000 0.1501111 -0.0000000), wk = 0.0026810 k( 28) = ( 0.2700000 0.1558846 -0.0000000), wk = 0.0026810 k( 29) = ( 0.2800000 0.1616581 -0.0000000), wk = 0.0026810 k( 30) = ( 0.2900000 0.1674316 -0.0000000), wk = 0.0026810 k( 31) = ( 0.3000000 0.1732051 -0.0000000), wk = 0.0026810 k( 32) = ( 0.3100000 0.1789786 -0.0000000), wk = 0.0026810 k( 33) = ( 0.3200000 0.1847521 -0.0000000), wk = 0.0026810 k( 34) = ( 0.3300000 0.1905256 -0.0000000), wk = 0.0026810 k( 35) = ( 0.3400000 0.1962991 -0.0000000), wk = 0.0026810 k( 36) = ( 0.3500000 0.2020726 -0.0000000), wk = 0.0026810 k( 37) = ( 0.3600000 0.2078461 -0.0000000), wk = 0.0026810 k( 38) = ( 0.3700000 0.2136196 -0.0000000), wk = 0.0026810 k( 39) = ( 0.3800000 0.2193931 -0.0000000), wk = 0.0026810 k( 40) = ( 0.3900000 0.2251666 -0.0000000), wk = 0.0026810 k( 41) = ( 0.4000000 0.2309401 -0.0000000), wk = 0.0026810 k( 42) = ( 0.4100000 0.2367136 -0.0000000), wk = 0.0026810 k( 43) = ( 0.4200000 0.2424871 -0.0000000), wk = 0.0026810 k( 44) = ( 0.4300000 0.2482606 -0.0000000), wk = 0.0026810 k( 45) = ( 0.4400000 0.2540341 -0.0000000), wk = 0.0026810 k( 46) = ( 0.4500000 0.2598076 -0.0000000), wk = 0.0026810 k( 47) = ( 0.4600000 0.2655811 -0.0000000), wk = 0.0026810 k( 48) = ( 0.4700000 0.2713546 -0.0000000), wk = 0.0026810 k( 49) = ( 0.4800000 0.2771281 -0.0000000), wk = 0.0026810 k( 50) = ( 0.4900000 0.2829016 -0.0000000), wk = 0.0026810 k( 51) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0026810 k( 52) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0026810 k( 53) = ( 0.4942529 0.2986294 -0.0000000), wk = 0.0026810 k( 54) = ( 0.4885058 0.3085838 -0.0000000), wk = 0.0026810 k( 55) = ( 0.4827586 0.3185381 -0.0000000), wk = 0.0026810 k( 56) = ( 0.4770115 0.3284924 -0.0000000), wk = 0.0026810 k( 57) = ( 0.4712644 0.3384467 -0.0000000), wk = 0.0026810 k( 58) = ( 0.4655172 0.3484010 -0.0000000), wk = 0.0026810 k( 59) = ( 0.4597701 0.3583553 -0.0000000), wk = 0.0026810 k( 60) = ( 0.4540230 0.3683097 -0.0000000), wk = 0.0026810 k( 61) = ( 0.4482759 0.3782640 -0.0000000), wk = 0.0026810 k( 62) = ( 0.4425287 0.3882183 -0.0000000), wk = 0.0026810 k( 63) = ( 0.4367816 0.3981726 -0.0000000), wk = 0.0026810 k( 64) = ( 0.4310345 0.4081269 -0.0000000), wk = 0.0026810 k( 65) = ( 0.4252874 0.4180812 -0.0000000), wk = 0.0026810 k( 66) = ( 0.4195402 0.4280355 -0.0000000), wk = 0.0026810 k( 67) = ( 0.4137931 0.4379899 -0.0000000), wk = 0.0026810 k( 68) = ( 0.4080460 0.4479442 -0.0000000), wk = 0.0026810 k( 69) = ( 0.4022988 0.4578985 -0.0000000), wk = 0.0026810 k( 70) = ( 0.3965517 0.4678528 -0.0000000), wk = 0.0026810 k( 71) = ( 0.3908046 0.4778071 -0.0000000), wk = 0.0026810 k( 72) = ( 0.3850575 0.4877614 -0.0000000), wk = 0.0026810 k( 73) = ( 0.3793103 0.4977157 -0.0000000), wk = 0.0026810 k( 74) = ( 0.3735632 0.5076701 -0.0000000), wk = 0.0026810 k( 75) = ( 0.3678161 0.5176244 -0.0000000), wk = 0.0026810 k( 76) = ( 0.3620690 0.5275787 -0.0000000), wk = 0.0026810 k( 77) = ( 0.3563218 0.5375330 -0.0000000), wk = 0.0026810 k( 78) = ( 0.3505747 0.5474873 -0.0000000), wk = 0.0026810 k( 79) = ( 0.3448276 0.5574416 -0.0000000), wk = 0.0026810 k( 80) = ( 0.3390805 0.5673960 -0.0000000), wk = 0.0026810 k( 81) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0026810 k( 82) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0026810 k( 83) = ( 0.3275862 0.5673960 -0.0000000), wk = 0.0026810 k( 84) = ( 0.3218391 0.5574416 -0.0000000), wk = 0.0026810 k( 85) = ( 0.3160920 0.5474873 -0.0000000), wk = 0.0026810 k( 86) = ( 0.3103448 0.5375330 -0.0000000), wk = 0.0026810 k( 87) = ( 0.3045977 0.5275787 -0.0000000), wk = 0.0026810 k( 88) = ( 0.2988506 0.5176244 -0.0000000), wk = 0.0026810 k( 89) = ( 0.2931034 0.5076701 -0.0000000), wk = 0.0026810 k( 90) = ( 0.2873563 0.4977157 -0.0000000), wk = 0.0026810 k( 91) = ( 0.2816092 0.4877614 -0.0000000), wk = 0.0026810 k( 92) = ( 0.2758621 0.4778071 -0.0000000), wk = 0.0026810 k( 93) = ( 0.2701149 0.4678528 -0.0000000), wk = 0.0026810 k( 94) = ( 0.2643678 0.4578985 -0.0000000), wk = 0.0026810 k( 95) = ( 0.2586207 0.4479442 -0.0000000), wk = 0.0026810 k( 96) = ( 0.2528736 0.4379899 -0.0000000), wk = 0.0026810 k( 97) = ( 0.2471264 0.4280355 -0.0000000), wk = 0.0026810 k( 98) = ( 0.2413793 0.4180812 -0.0000000), wk = 0.0026810 k( 99) = ( 0.2356322 0.4081269 -0.0000000), wk = 0.0026810 k( 100) = ( 0.2298851 0.3981726 -0.0000000), wk = 0.0026810 k( 101) = ( 0.2241379 0.3882183 -0.0000000), wk = 0.0026810 k( 102) = ( 0.2183908 0.3782640 -0.0000000), wk = 0.0026810 k( 103) = ( 0.2126437 0.3683097 -0.0000000), wk = 0.0026810 k( 104) = ( 0.2068966 0.3583553 -0.0000000), wk = 0.0026810 k( 105) = ( 0.2011494 0.3484010 -0.0000000), wk = 0.0026810 k( 106) = ( 0.1954023 0.3384467 -0.0000000), wk = 0.0026810 k( 107) = ( 0.1896552 0.3284924 -0.0000000), wk = 0.0026810 k( 108) = ( 0.1839080 0.3185381 -0.0000000), wk = 0.0026810 k( 109) = ( 0.1781609 0.3085838 -0.0000000), wk = 0.0026810 k( 110) = ( 0.1724138 0.2986294 -0.0000000), wk = 0.0026810 k( 111) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0026810 k( 112) = ( 0.1609195 0.2787208 -0.0000000), wk = 0.0026810 k( 113) = ( 0.1551724 0.2687665 -0.0000000), wk = 0.0026810 k( 114) = ( 0.1494253 0.2588122 -0.0000000), wk = 0.0026810 k( 115) = ( 0.1436782 0.2488579 -0.0000000), wk = 0.0026810 k( 116) = ( 0.1379310 0.2389036 -0.0000000), wk = 0.0026810 k( 117) = ( 0.1321839 0.2289492 -0.0000000), wk = 0.0026810 k( 118) = ( 0.1264368 0.2189949 -0.0000000), wk = 0.0026810 k( 119) = ( 0.1206897 0.2090406 -0.0000000), wk = 0.0026810 k( 120) = ( 0.1149425 0.1990863 -0.0000000), wk = 0.0026810 k( 121) = ( 0.1091954 0.1891320 -0.0000000), wk = 0.0026810 k( 122) = ( 0.1034483 0.1791777 -0.0000000), wk = 0.0026810 k( 123) = ( 0.0977012 0.1692234 -0.0000000), wk = 0.0026810 k( 124) = ( 0.0919540 0.1592690 -0.0000000), wk = 0.0026810 k( 125) = ( 0.0862069 0.1493147 -0.0000000), wk = 0.0026810 k( 126) = ( 0.0804598 0.1393604 -0.0000000), wk = 0.0026810 k( 127) = ( 0.0747126 0.1294061 -0.0000000), wk = 0.0026810 k( 128) = ( 0.0689655 0.1194518 -0.0000000), wk = 0.0026810 k( 129) = ( 0.0632184 0.1094975 -0.0000000), wk = 0.0026810 k( 130) = ( 0.0574713 0.0995431 -0.0000000), wk = 0.0026810 k( 131) = ( 0.0517241 0.0895888 -0.0000000), wk = 0.0026810 k( 132) = ( 0.0459770 0.0796345 -0.0000000), wk = 0.0026810 k( 133) = ( 0.0402299 0.0696802 -0.0000000), wk = 0.0026810 k( 134) = ( 0.0344828 0.0597259 -0.0000000), wk = 0.0026810 k( 135) = ( 0.0287356 0.0497716 -0.0000000), wk = 0.0026810 k( 136) = ( 0.0229885 0.0398173 -0.0000000), wk = 0.0026810 k( 137) = ( 0.0172414 0.0298629 -0.0000000), wk = 0.0026810 k( 138) = ( 0.0114942 0.0199086 -0.0000000), wk = 0.0026810 k( 139) = ( 0.0057471 0.0099543 -0.0000000), wk = 0.0026810 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026810 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026810 k( 142) = ( 0.0000000 0.0000000 0.0114119), wk = 0.0026810 k( 143) = ( 0.0000000 0.0000000 0.0228238), wk = 0.0026810 k( 144) = ( 0.0000000 0.0000000 0.0342357), wk = 0.0026810 k( 145) = ( 0.0000000 0.0000000 0.0456477), wk = 0.0026810 k( 146) = ( 0.0000000 0.0000000 0.0570596), wk = 0.0026810 k( 147) = ( 0.0000000 0.0000000 0.0684715), wk = 0.0026810 k( 148) = ( 0.0000000 0.0000000 0.0798834), wk = 0.0026810 k( 149) = ( 0.0000000 0.0000000 0.0912953), wk = 0.0026810 k( 150) = ( 0.0000000 0.0000000 0.1027072), wk = 0.0026810 k( 151) = ( 0.0000000 0.0000000 0.1141192), wk = 0.0026810 k( 152) = ( 0.0000000 0.0000000 0.1255311), wk = 0.0026810 k( 153) = ( 0.0000000 0.0000000 0.1369430), wk = 0.0026810 k( 154) = ( 0.0000000 0.0000000 0.1483549), wk = 0.0026810 k( 155) = ( 0.0000000 0.0000000 0.1597668), wk = 0.0026810 k( 156) = ( 0.0000000 0.0000000 0.1711787), wk = 0.0026810 k( 157) = ( 0.0000000 0.0000000 0.1825907), wk = 0.0026810 k( 158) = ( 0.0000000 0.0000000 0.1940026), wk = 0.0026810 k( 159) = ( 0.0000000 0.0000000 0.2054145), wk = 0.0026810 k( 160) = ( 0.0000000 0.0000000 0.2168264), wk = 0.0026810 k( 161) = ( 0.0000000 0.0000000 0.2282383), wk = 0.0026810 k( 162) = ( 0.0000000 0.0000000 0.2396502), wk = 0.0026810 k( 163) = ( 0.0000000 0.0000000 0.2510621), wk = 0.0026810 k( 164) = ( 0.0000000 0.0000000 0.2624741), wk = 0.0026810 k( 165) = ( 0.0000000 0.0000000 0.2738860), wk = 0.0026810 k( 166) = ( 0.0000000 0.0000000 0.2852979), wk = 0.0026810 k( 167) = ( 0.0000000 0.0000000 0.2967098), wk = 0.0026810 k( 168) = ( 0.0000000 0.0000000 0.3081217), wk = 0.0026810 k( 169) = ( 0.0000000 0.0000000 0.3195336), wk = 0.0026810 k( 170) = ( 0.0000000 0.0000000 0.3309456), wk = 0.0026810 k( 171) = ( 0.0000000 0.0000000 0.3423575), wk = 0.0026810 k( 172) = ( 0.0000000 0.0000000 0.3423575), wk = 0.0026810 k( 173) = ( 0.0100000 0.0057735 0.3423575), wk = 0.0026810 k( 174) = ( 0.0200000 0.0115470 0.3423575), wk = 0.0026810 k( 175) = ( 0.0300000 0.0173205 0.3423575), wk = 0.0026810 k( 176) = ( 0.0400000 0.0230940 0.3423575), wk = 0.0026810 k( 177) = ( 0.0500000 0.0288675 0.3423575), wk = 0.0026810 k( 178) = ( 0.0600000 0.0346410 0.3423575), wk = 0.0026810 k( 179) = ( 0.0700000 0.0404145 0.3423575), wk = 0.0026810 k( 180) = ( 0.0800000 0.0461880 0.3423575), wk = 0.0026810 k( 181) = ( 0.0900000 0.0519615 0.3423575), wk = 0.0026810 k( 182) = ( 0.1000000 0.0577350 0.3423575), wk = 0.0026810 k( 183) = ( 0.1100000 0.0635085 0.3423575), wk = 0.0026810 k( 184) = ( 0.1200000 0.0692820 0.3423575), wk = 0.0026810 k( 185) = ( 0.1300000 0.0750555 0.3423575), wk = 0.0026810 k( 186) = ( 0.1400000 0.0808290 0.3423575), wk = 0.0026810 k( 187) = ( 0.1500000 0.0866025 0.3423575), wk = 0.0026810 k( 188) = ( 0.1600000 0.0923760 0.3423575), wk = 0.0026810 k( 189) = ( 0.1700000 0.0981495 0.3423575), wk = 0.0026810 k( 190) = ( 0.1800000 0.1039230 0.3423575), wk = 0.0026810 k( 191) = ( 0.1900000 0.1096966 0.3423575), wk = 0.0026810 k( 192) = ( 0.2000000 0.1154701 0.3423575), wk = 0.0026810 k( 193) = ( 0.2100000 0.1212436 0.3423575), wk = 0.0026810 k( 194) = ( 0.2200000 0.1270171 0.3423575), wk = 0.0026810 k( 195) = ( 0.2300000 0.1327906 0.3423575), wk = 0.0026810 k( 196) = ( 0.2400000 0.1385641 0.3423575), wk = 0.0026810 k( 197) = ( 0.2500000 0.1443376 0.3423575), wk = 0.0026810 k( 198) = ( 0.2600000 0.1501111 0.3423575), wk = 0.0026810 k( 199) = ( 0.2700000 0.1558846 0.3423575), wk = 0.0026810 k( 200) = ( 0.2800000 0.1616581 0.3423575), wk = 0.0026810 k( 201) = ( 0.2900000 0.1674316 0.3423575), wk = 0.0026810 k( 202) = ( 0.3000000 0.1732051 0.3423575), wk = 0.0026810 k( 203) = ( 0.3100000 0.1789786 0.3423575), wk = 0.0026810 k( 204) = ( 0.3200000 0.1847521 0.3423575), wk = 0.0026810 k( 205) = ( 0.3300000 0.1905256 0.3423575), wk = 0.0026810 k( 206) = ( 0.3400000 0.1962991 0.3423575), wk = 0.0026810 k( 207) = ( 0.3500000 0.2020726 0.3423575), wk = 0.0026810 k( 208) = ( 0.3600000 0.2078461 0.3423575), wk = 0.0026810 k( 209) = ( 0.3700000 0.2136196 0.3423575), wk = 0.0026810 k( 210) = ( 0.3800000 0.2193931 0.3423575), wk = 0.0026810 k( 211) = ( 0.3900000 0.2251666 0.3423575), wk = 0.0026810 k( 212) = ( 0.4000000 0.2309401 0.3423575), wk = 0.0026810 k( 213) = ( 0.4100000 0.2367136 0.3423575), wk = 0.0026810 k( 214) = ( 0.4200000 0.2424871 0.3423575), wk = 0.0026810 k( 215) = ( 0.4300000 0.2482606 0.3423575), wk = 0.0026810 k( 216) = ( 0.4400000 0.2540341 0.3423575), wk = 0.0026810 k( 217) = ( 0.4500000 0.2598076 0.3423575), wk = 0.0026810 k( 218) = ( 0.4600000 0.2655811 0.3423575), wk = 0.0026810 k( 219) = ( 0.4700000 0.2713546 0.3423575), wk = 0.0026810 k( 220) = ( 0.4800000 0.2771281 0.3423575), wk = 0.0026810 k( 221) = ( 0.4900000 0.2829016 0.3423575), wk = 0.0026810 k( 222) = ( 0.5000000 0.2886751 0.3423575), wk = 0.0026810 k( 223) = ( 0.5000000 0.2886751 0.3423575), wk = 0.0026810 k( 224) = ( 0.4942529 0.2986294 0.3423575), wk = 0.0026810 k( 225) = ( 0.4885058 0.3085838 0.3423575), wk = 0.0026810 k( 226) = ( 0.4827586 0.3185381 0.3423575), wk = 0.0026810 k( 227) = ( 0.4770115 0.3284924 0.3423575), wk = 0.0026810 k( 228) = ( 0.4712644 0.3384467 0.3423575), wk = 0.0026810 k( 229) = ( 0.4655172 0.3484010 0.3423575), wk = 0.0026810 k( 230) = ( 0.4597701 0.3583553 0.3423575), wk = 0.0026810 k( 231) = ( 0.4540230 0.3683097 0.3423575), wk = 0.0026810 k( 232) = ( 0.4482759 0.3782640 0.3423575), wk = 0.0026810 k( 233) = ( 0.4425287 0.3882183 0.3423575), wk = 0.0026810 k( 234) = ( 0.4367816 0.3981726 0.3423575), wk = 0.0026810 k( 235) = ( 0.4310345 0.4081269 0.3423575), wk = 0.0026810 k( 236) = ( 0.4252874 0.4180812 0.3423575), wk = 0.0026810 k( 237) = ( 0.4195402 0.4280355 0.3423575), wk = 0.0026810 k( 238) = ( 0.4137931 0.4379899 0.3423575), wk = 0.0026810 k( 239) = ( 0.4080460 0.4479442 0.3423575), wk = 0.0026810 k( 240) = ( 0.4022988 0.4578985 0.3423575), wk = 0.0026810 k( 241) = ( 0.3965517 0.4678528 0.3423575), wk = 0.0026810 k( 242) = ( 0.3908046 0.4778071 0.3423575), wk = 0.0026810 k( 243) = ( 0.3850575 0.4877614 0.3423575), wk = 0.0026810 k( 244) = ( 0.3793103 0.4977157 0.3423575), wk = 0.0026810 k( 245) = ( 0.3735632 0.5076701 0.3423575), wk = 0.0026810 k( 246) = ( 0.3678161 0.5176244 0.3423575), wk = 0.0026810 k( 247) = ( 0.3620690 0.5275787 0.3423575), wk = 0.0026810 k( 248) = ( 0.3563218 0.5375330 0.3423575), wk = 0.0026810 k( 249) = ( 0.3505747 0.5474873 0.3423575), wk = 0.0026810 k( 250) = ( 0.3448276 0.5574416 0.3423575), wk = 0.0026810 k( 251) = ( 0.3390805 0.5673960 0.3423575), wk = 0.0026810 k( 252) = ( 0.3333333 0.5773503 0.3423575), wk = 0.0026810 k( 253) = ( 0.3333333 0.5773503 0.3423575), wk = 0.0026810 k( 254) = ( 0.3275862 0.5673960 0.3423575), wk = 0.0026810 k( 255) = ( 0.3218391 0.5574416 0.3423575), wk = 0.0026810 k( 256) = ( 0.3160920 0.5474873 0.3423575), wk = 0.0026810 k( 257) = ( 0.3103448 0.5375330 0.3423575), wk = 0.0026810 k( 258) = ( 0.3045977 0.5275787 0.3423575), wk = 0.0026810 k( 259) = ( 0.2988506 0.5176244 0.3423575), wk = 0.0026810 k( 260) = ( 0.2931034 0.5076701 0.3423575), wk = 0.0026810 k( 261) = ( 0.2873563 0.4977157 0.3423575), wk = 0.0026810 k( 262) = ( 0.2816092 0.4877614 0.3423575), wk = 0.0026810 k( 263) = ( 0.2758621 0.4778071 0.3423575), wk = 0.0026810 k( 264) = ( 0.2701149 0.4678528 0.3423575), wk = 0.0026810 k( 265) = ( 0.2643678 0.4578985 0.3423575), wk = 0.0026810 k( 266) = ( 0.2586207 0.4479442 0.3423575), wk = 0.0026810 k( 267) = ( 0.2528736 0.4379899 0.3423575), wk = 0.0026810 k( 268) = ( 0.2471264 0.4280355 0.3423575), wk = 0.0026810 k( 269) = ( 0.2413793 0.4180812 0.3423575), wk = 0.0026810 k( 270) = ( 0.2356322 0.4081269 0.3423575), wk = 0.0026810 k( 271) = ( 0.2298851 0.3981726 0.3423575), wk = 0.0026810 k( 272) = ( 0.2241379 0.3882183 0.3423575), wk = 0.0026810 k( 273) = ( 0.2183908 0.3782640 0.3423575), wk = 0.0026810 k( 274) = ( 0.2126437 0.3683097 0.3423575), wk = 0.0026810 k( 275) = ( 0.2068966 0.3583553 0.3423575), wk = 0.0026810 k( 276) = ( 0.2011494 0.3484010 0.3423575), wk = 0.0026810 k( 277) = ( 0.1954023 0.3384467 0.3423575), wk = 0.0026810 k( 278) = ( 0.1896552 0.3284924 0.3423575), wk = 0.0026810 k( 279) = ( 0.1839080 0.3185381 0.3423575), wk = 0.0026810 k( 280) = ( 0.1781609 0.3085838 0.3423575), wk = 0.0026810 k( 281) = ( 0.1724138 0.2986294 0.3423575), wk = 0.0026810 k( 282) = ( 0.1666667 0.2886751 0.3423575), wk = 0.0026810 k( 283) = ( 0.1609195 0.2787208 0.3423575), wk = 0.0026810 k( 284) = ( 0.1551724 0.2687665 0.3423575), wk = 0.0026810 k( 285) = ( 0.1494253 0.2588122 0.3423575), wk = 0.0026810 k( 286) = ( 0.1436782 0.2488579 0.3423575), wk = 0.0026810 k( 287) = ( 0.1379310 0.2389036 0.3423575), wk = 0.0026810 k( 288) = ( 0.1321839 0.2289492 0.3423575), wk = 0.0026810 k( 289) = ( 0.1264368 0.2189949 0.3423575), wk = 0.0026810 k( 290) = ( 0.1206897 0.2090406 0.3423575), wk = 0.0026810 k( 291) = ( 0.1149425 0.1990863 0.3423575), wk = 0.0026810 k( 292) = ( 0.1091954 0.1891320 0.3423575), wk = 0.0026810 k( 293) = ( 0.1034483 0.1791777 0.3423575), wk = 0.0026810 k( 294) = ( 0.0977012 0.1692234 0.3423575), wk = 0.0026810 k( 295) = ( 0.0919540 0.1592690 0.3423575), wk = 0.0026810 k( 296) = ( 0.0862069 0.1493147 0.3423575), wk = 0.0026810 k( 297) = ( 0.0804598 0.1393604 0.3423575), wk = 0.0026810 k( 298) = ( 0.0747126 0.1294061 0.3423575), wk = 0.0026810 k( 299) = ( 0.0689655 0.1194518 0.3423575), wk = 0.0026810 k( 300) = ( 0.0632184 0.1094975 0.3423575), wk = 0.0026810 k( 301) = ( 0.0574713 0.0995431 0.3423575), wk = 0.0026810 k( 302) = ( 0.0517241 0.0895888 0.3423575), wk = 0.0026810 k( 303) = ( 0.0459770 0.0796345 0.3423575), wk = 0.0026810 k( 304) = ( 0.0402299 0.0696802 0.3423575), wk = 0.0026810 k( 305) = ( 0.0344828 0.0597259 0.3423575), wk = 0.0026810 k( 306) = ( 0.0287356 0.0497716 0.3423575), wk = 0.0026810 k( 307) = ( 0.0229885 0.0398173 0.3423575), wk = 0.0026810 k( 308) = ( 0.0172414 0.0298629 0.3423575), wk = 0.0026810 k( 309) = ( 0.0114942 0.0199086 0.3423575), wk = 0.0026810 k( 310) = ( 0.0057471 0.0099543 0.3423575), wk = 0.0026810 k( 311) = ( 0.0000000 0.0000000 0.3423575), wk = 0.0026810 k( 312) = ( 0.5000000 0.2886751 0.3423575), wk = 0.0026810 k( 313) = ( 0.5000000 0.2886751 0.3309456), wk = 0.0026810 k( 314) = ( 0.5000000 0.2886751 0.3195336), wk = 0.0026810 k( 315) = ( 0.5000000 0.2886751 0.3081217), wk = 0.0026810 k( 316) = ( 0.5000000 0.2886751 0.2967098), wk = 0.0026810 k( 317) = ( 0.5000000 0.2886751 0.2852979), wk = 0.0026810 k( 318) = ( 0.5000000 0.2886751 0.2738860), wk = 0.0026810 k( 319) = ( 0.5000000 0.2886751 0.2624741), wk = 0.0026810 k( 320) = ( 0.5000000 0.2886751 0.2510621), wk = 0.0026810 k( 321) = ( 0.5000000 0.2886751 0.2396502), wk = 0.0026810 k( 322) = ( 0.5000000 0.2886751 0.2282383), wk = 0.0026810 k( 323) = ( 0.5000000 0.2886751 0.2168264), wk = 0.0026810 k( 324) = ( 0.5000000 0.2886751 0.2054145), wk = 0.0026810 k( 325) = ( 0.5000000 0.2886751 0.1940026), wk = 0.0026810 k( 326) = ( 0.5000000 0.2886751 0.1825907), wk = 0.0026810 k( 327) = ( 0.5000000 0.2886751 0.1711787), wk = 0.0026810 k( 328) = ( 0.5000000 0.2886751 0.1597668), wk = 0.0026810 k( 329) = ( 0.5000000 0.2886751 0.1483549), wk = 0.0026810 k( 330) = ( 0.5000000 0.2886751 0.1369430), wk = 0.0026810 k( 331) = ( 0.5000000 0.2886751 0.1255311), wk = 0.0026810 k( 332) = ( 0.5000000 0.2886751 0.1141192), wk = 0.0026810 k( 333) = ( 0.5000000 0.2886751 0.1027072), wk = 0.0026810 k( 334) = ( 0.5000000 0.2886751 0.0912953), wk = 0.0026810 k( 335) = ( 0.5000000 0.2886751 0.0798834), wk = 0.0026810 k( 336) = ( 0.5000000 0.2886751 0.0684715), wk = 0.0026810 k( 337) = ( 0.5000000 0.2886751 0.0570596), wk = 0.0026810 k( 338) = ( 0.5000000 0.2886751 0.0456477), wk = 0.0026810 k( 339) = ( 0.5000000 0.2886751 0.0342357), wk = 0.0026810 k( 340) = ( 0.5000000 0.2886751 0.0228238), wk = 0.0026810 k( 341) = ( 0.5000000 0.2886751 0.0114119), wk = 0.0026810 k( 342) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0026810 k( 343) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0026810 k( 344) = ( 0.3333333 0.5773503 0.0114119), wk = 0.0026810 k( 345) = ( 0.3333333 0.5773503 0.0228238), wk = 0.0026810 k( 346) = ( 0.3333333 0.5773503 0.0342357), wk = 0.0026810 k( 347) = ( 0.3333333 0.5773503 0.0456477), wk = 0.0026810 k( 348) = ( 0.3333333 0.5773503 0.0570596), wk = 0.0026810 k( 349) = ( 0.3333333 0.5773503 0.0684715), wk = 0.0026810 k( 350) = ( 0.3333333 0.5773503 0.0798834), wk = 0.0026810 k( 351) = ( 0.3333333 0.5773503 0.0912953), wk = 0.0026810 k( 352) = ( 0.3333333 0.5773503 0.1027072), wk = 0.0026810 k( 353) = ( 0.3333333 0.5773503 0.1141192), wk = 0.0026810 k( 354) = ( 0.3333333 0.5773503 0.1255311), wk = 0.0026810 k( 355) = ( 0.3333333 0.5773503 0.1369430), wk = 0.0026810 k( 356) = ( 0.3333333 0.5773503 0.1483549), wk = 0.0026810 k( 357) = ( 0.3333333 0.5773503 0.1597668), wk = 0.0026810 k( 358) = ( 0.3333333 0.5773503 0.1711787), wk = 0.0026810 k( 359) = ( 0.3333333 0.5773503 0.1825907), wk = 0.0026810 k( 360) = ( 0.3333333 0.5773503 0.1940026), wk = 0.0026810 k( 361) = ( 0.3333333 0.5773503 0.2054145), wk = 0.0026810 k( 362) = ( 0.3333333 0.5773503 0.2168264), wk = 0.0026810 k( 363) = ( 0.3333333 0.5773503 0.2282383), wk = 0.0026810 k( 364) = ( 0.3333333 0.5773503 0.2396502), wk = 0.0026810 k( 365) = ( 0.3333333 0.5773503 0.2510621), wk = 0.0026810 k( 366) = ( 0.3333333 0.5773503 0.2624741), wk = 0.0026810 k( 367) = ( 0.3333333 0.5773503 0.2738860), wk = 0.0026810 k( 368) = ( 0.3333333 0.5773503 0.2852979), wk = 0.0026810 k( 369) = ( 0.3333333 0.5773503 0.2967098), wk = 0.0026810 k( 370) = ( 0.3333333 0.5773503 0.3081217), wk = 0.0026810 k( 371) = ( 0.3333333 0.5773503 0.3195336), wk = 0.0026810 k( 372) = ( 0.3333333 0.5773503 0.3309456), wk = 0.0026810 k( 373) = ( 0.3333333 0.5773503 0.3423575), wk = 0.0026810 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026810 k( 2) = ( 0.0100000 -0.0000000 -0.0000000), wk = 0.0026810 k( 3) = ( 0.0200000 -0.0000000 -0.0000000), wk = 0.0026810 k( 4) = ( 0.0300000 -0.0000000 -0.0000000), wk = 0.0026810 k( 5) = ( 0.0400000 -0.0000000 -0.0000000), wk = 0.0026810 k( 6) = ( 0.0500000 -0.0000000 -0.0000000), wk = 0.0026810 k( 7) = ( 0.0600000 -0.0000000 -0.0000000), wk = 0.0026810 k( 8) = ( 0.0700000 -0.0000000 -0.0000000), wk = 0.0026810 k( 9) = ( 0.0800000 -0.0000000 -0.0000000), wk = 0.0026810 k( 10) = ( 0.0900000 -0.0000000 -0.0000000), wk = 0.0026810 k( 11) = ( 0.1000000 -0.0000000 -0.0000000), wk = 0.0026810 k( 12) = ( 0.1100000 -0.0000000 -0.0000000), wk = 0.0026810 k( 13) = ( 0.1200000 -0.0000000 -0.0000000), wk = 0.0026810 k( 14) = ( 0.1300000 -0.0000000 -0.0000000), wk = 0.0026810 k( 15) = ( 0.1400000 -0.0000000 -0.0000000), wk = 0.0026810 k( 16) = ( 0.1500000 -0.0000000 -0.0000000), wk = 0.0026810 k( 17) = ( 0.1600000 -0.0000000 -0.0000000), wk = 0.0026810 k( 18) = ( 0.1700000 -0.0000000 -0.0000000), wk = 0.0026810 k( 19) = ( 0.1800000 -0.0000000 -0.0000000), wk = 0.0026810 k( 20) = ( 0.1900000 -0.0000000 -0.0000000), wk = 0.0026810 k( 21) = ( 0.2000000 -0.0000000 -0.0000000), wk = 0.0026810 k( 22) = ( 0.2100000 -0.0000000 -0.0000000), wk = 0.0026810 k( 23) = ( 0.2200000 -0.0000000 -0.0000000), wk = 0.0026810 k( 24) = ( 0.2300000 -0.0000000 -0.0000000), wk = 0.0026810 k( 25) = ( 0.2400000 -0.0000000 -0.0000000), wk = 0.0026810 k( 26) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0026810 k( 27) = ( 0.2600000 -0.0000000 -0.0000000), wk = 0.0026810 k( 28) = ( 0.2700000 -0.0000000 -0.0000000), wk = 0.0026810 k( 29) = ( 0.2800000 -0.0000000 -0.0000000), wk = 0.0026810 k( 30) = ( 0.2900000 -0.0000000 -0.0000000), wk = 0.0026810 k( 31) = ( 0.3000000 -0.0000000 -0.0000000), wk = 0.0026810 k( 32) = ( 0.3100000 -0.0000000 -0.0000000), wk = 0.0026810 k( 33) = ( 0.3200000 -0.0000000 -0.0000000), wk = 0.0026810 k( 34) = ( 0.3300000 -0.0000000 -0.0000000), wk = 0.0026810 k( 35) = ( 0.3400000 -0.0000000 -0.0000000), wk = 0.0026810 k( 36) = ( 0.3500000 -0.0000000 -0.0000000), wk = 0.0026810 k( 37) = ( 0.3600000 -0.0000000 -0.0000000), wk = 0.0026810 k( 38) = ( 0.3700000 -0.0000000 -0.0000000), wk = 0.0026810 k( 39) = ( 0.3800000 -0.0000000 -0.0000000), wk = 0.0026810 k( 40) = ( 0.3900000 -0.0000000 -0.0000000), wk = 0.0026810 k( 41) = ( 0.4000000 -0.0000000 -0.0000000), wk = 0.0026810 k( 42) = ( 0.4100000 -0.0000000 -0.0000000), wk = 0.0026810 k( 43) = ( 0.4200000 -0.0000000 -0.0000000), wk = 0.0026810 k( 44) = ( 0.4300000 -0.0000000 -0.0000000), wk = 0.0026810 k( 45) = ( 0.4400000 -0.0000000 -0.0000000), wk = 0.0026810 k( 46) = ( 0.4500000 -0.0000000 -0.0000000), wk = 0.0026810 k( 47) = ( 0.4600000 -0.0000000 -0.0000000), wk = 0.0026810 k( 48) = ( 0.4700000 -0.0000000 -0.0000000), wk = 0.0026810 k( 49) = ( 0.4800000 -0.0000000 -0.0000000), wk = 0.0026810 k( 50) = ( 0.4900000 0.0000000 -0.0000000), wk = 0.0026810 k( 51) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0026810 k( 52) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0026810 k( 53) = ( 0.4942529 0.0114942 -0.0000000), wk = 0.0026810 k( 54) = ( 0.4885058 0.0229885 -0.0000000), wk = 0.0026810 k( 55) = ( 0.4827586 0.0344828 -0.0000000), wk = 0.0026810 k( 56) = ( 0.4770115 0.0459770 -0.0000000), wk = 0.0026810 k( 57) = ( 0.4712644 0.0574713 -0.0000000), wk = 0.0026810 k( 58) = ( 0.4655172 0.0689655 -0.0000000), wk = 0.0026810 k( 59) = ( 0.4597701 0.0804598 -0.0000000), wk = 0.0026810 k( 60) = ( 0.4540230 0.0919540 -0.0000000), wk = 0.0026810 k( 61) = ( 0.4482759 0.1034483 -0.0000000), wk = 0.0026810 k( 62) = ( 0.4425287 0.1149425 -0.0000000), wk = 0.0026810 k( 63) = ( 0.4367816 0.1264368 -0.0000000), wk = 0.0026810 k( 64) = ( 0.4310345 0.1379310 -0.0000000), wk = 0.0026810 k( 65) = ( 0.4252874 0.1494253 -0.0000000), wk = 0.0026810 k( 66) = ( 0.4195402 0.1609195 -0.0000000), wk = 0.0026810 k( 67) = ( 0.4137931 0.1724138 -0.0000000), wk = 0.0026810 k( 68) = ( 0.4080460 0.1839080 -0.0000000), wk = 0.0026810 k( 69) = ( 0.4022988 0.1954023 -0.0000000), wk = 0.0026810 k( 70) = ( 0.3965517 0.2068965 -0.0000000), wk = 0.0026810 k( 71) = ( 0.3908046 0.2183908 0.0000000), wk = 0.0026810 k( 72) = ( 0.3850575 0.2298851 -0.0000000), wk = 0.0026810 k( 73) = ( 0.3793103 0.2413793 -0.0000000), wk = 0.0026810 k( 74) = ( 0.3735632 0.2528736 -0.0000000), wk = 0.0026810 k( 75) = ( 0.3678161 0.2643678 -0.0000000), wk = 0.0026810 k( 76) = ( 0.3620690 0.2758621 -0.0000000), wk = 0.0026810 k( 77) = ( 0.3563218 0.2873563 -0.0000000), wk = 0.0026810 k( 78) = ( 0.3505747 0.2988506 -0.0000000), wk = 0.0026810 k( 79) = ( 0.3448276 0.3103448 -0.0000000), wk = 0.0026810 k( 80) = ( 0.3390805 0.3218391 -0.0000000), wk = 0.0026810 k( 81) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0026810 k( 82) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0026810 k( 83) = ( 0.3275862 0.3275862 -0.0000000), wk = 0.0026810 k( 84) = ( 0.3218391 0.3218391 -0.0000000), wk = 0.0026810 k( 85) = ( 0.3160920 0.3160920 -0.0000000), wk = 0.0026810 k( 86) = ( 0.3103448 0.3103448 -0.0000000), wk = 0.0026810 k( 87) = ( 0.3045977 0.3045977 0.0000000), wk = 0.0026810 k( 88) = ( 0.2988506 0.2988506 -0.0000000), wk = 0.0026810 k( 89) = ( 0.2931034 0.2931035 -0.0000000), wk = 0.0026810 k( 90) = ( 0.2873563 0.2873563 -0.0000000), wk = 0.0026810 k( 91) = ( 0.2816092 0.2816092 0.0000000), wk = 0.0026810 k( 92) = ( 0.2758621 0.2758621 0.0000000), wk = 0.0026810 k( 93) = ( 0.2701149 0.2701149 -0.0000000), wk = 0.0026810 k( 94) = ( 0.2643678 0.2643678 -0.0000000), wk = 0.0026810 k( 95) = ( 0.2586207 0.2586207 0.0000000), wk = 0.0026810 k( 96) = ( 0.2528736 0.2528736 -0.0000000), wk = 0.0026810 k( 97) = ( 0.2471264 0.2471264 -0.0000000), wk = 0.0026810 k( 98) = ( 0.2413793 0.2413793 -0.0000000), wk = 0.0026810 k( 99) = ( 0.2356322 0.2356322 0.0000000), wk = 0.0026810 k( 100) = ( 0.2298851 0.2298851 -0.0000000), wk = 0.0026810 k( 101) = ( 0.2241379 0.2241379 0.0000000), wk = 0.0026810 k( 102) = ( 0.2183908 0.2183908 -0.0000000), wk = 0.0026810 k( 103) = ( 0.2126437 0.2126437 -0.0000000), wk = 0.0026810 k( 104) = ( 0.2068966 0.2068966 -0.0000000), wk = 0.0026810 k( 105) = ( 0.2011494 0.2011494 -0.0000000), wk = 0.0026810 k( 106) = ( 0.1954023 0.1954023 -0.0000000), wk = 0.0026810 k( 107) = ( 0.1896552 0.1896552 -0.0000000), wk = 0.0026810 k( 108) = ( 0.1839080 0.1839080 0.0000000), wk = 0.0026810 k( 109) = ( 0.1781609 0.1781609 -0.0000000), wk = 0.0026810 k( 110) = ( 0.1724138 0.1724138 0.0000000), wk = 0.0026810 k( 111) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0026810 k( 112) = ( 0.1609195 0.1609195 -0.0000000), wk = 0.0026810 k( 113) = ( 0.1551724 0.1551724 -0.0000000), wk = 0.0026810 k( 114) = ( 0.1494253 0.1494253 0.0000000), wk = 0.0026810 k( 115) = ( 0.1436782 0.1436782 -0.0000000), wk = 0.0026810 k( 116) = ( 0.1379310 0.1379310 -0.0000000), wk = 0.0026810 k( 117) = ( 0.1321839 0.1321839 -0.0000000), wk = 0.0026810 k( 118) = ( 0.1264368 0.1264368 -0.0000000), wk = 0.0026810 k( 119) = ( 0.1206897 0.1206897 0.0000000), wk = 0.0026810 k( 120) = ( 0.1149425 0.1149425 -0.0000000), wk = 0.0026810 k( 121) = ( 0.1091954 0.1091954 -0.0000000), wk = 0.0026810 k( 122) = ( 0.1034483 0.1034483 0.0000000), wk = 0.0026810 k( 123) = ( 0.0977012 0.0977012 -0.0000000), wk = 0.0026810 k( 124) = ( 0.0919540 0.0919540 -0.0000000), wk = 0.0026810 k( 125) = ( 0.0862069 0.0862069 -0.0000000), wk = 0.0026810 k( 126) = ( 0.0804598 0.0804598 -0.0000000), wk = 0.0026810 k( 127) = ( 0.0747126 0.0747126 -0.0000000), wk = 0.0026810 k( 128) = ( 0.0689655 0.0689655 -0.0000000), wk = 0.0026810 k( 129) = ( 0.0632184 0.0632184 -0.0000000), wk = 0.0026810 k( 130) = ( 0.0574713 0.0574713 -0.0000000), wk = 0.0026810 k( 131) = ( 0.0517241 0.0517241 0.0000000), wk = 0.0026810 k( 132) = ( 0.0459770 0.0459770 -0.0000000), wk = 0.0026810 k( 133) = ( 0.0402299 0.0402299 -0.0000000), wk = 0.0026810 k( 134) = ( 0.0344828 0.0344828 -0.0000000), wk = 0.0026810 k( 135) = ( 0.0287356 0.0287356 -0.0000000), wk = 0.0026810 k( 136) = ( 0.0229885 0.0229885 -0.0000000), wk = 0.0026810 k( 137) = ( 0.0172414 0.0172414 -0.0000000), wk = 0.0026810 k( 138) = ( 0.0114942 0.0114942 -0.0000000), wk = 0.0026810 k( 139) = ( 0.0057471 0.0057471 0.0000000), wk = 0.0026810 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026810 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026810 k( 142) = ( 0.0000000 0.0000000 0.0166667), wk = 0.0026810 k( 143) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0026810 k( 144) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0026810 k( 145) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0026810 k( 146) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0026810 k( 147) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0026810 k( 148) = ( 0.0000000 0.0000000 0.1166667), wk = 0.0026810 k( 149) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0026810 k( 150) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0026810 k( 151) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0026810 k( 152) = ( 0.0000000 0.0000000 0.1833333), wk = 0.0026810 k( 153) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0026810 k( 154) = ( 0.0000000 0.0000000 0.2166667), wk = 0.0026810 k( 155) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0026810 k( 156) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0026810 k( 157) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0026810 k( 158) = ( 0.0000000 0.0000000 0.2833333), wk = 0.0026810 k( 159) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0026810 k( 160) = ( 0.0000000 0.0000000 0.3166667), wk = 0.0026810 k( 161) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0026810 k( 162) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0026810 k( 163) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0026810 k( 164) = ( 0.0000000 0.0000000 0.3833333), wk = 0.0026810 k( 165) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0026810 k( 166) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0026810 k( 167) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0026810 k( 168) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0026810 k( 169) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0026810 k( 170) = ( 0.0000000 0.0000000 0.4833333), wk = 0.0026810 k( 171) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026810 k( 172) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026810 k( 173) = ( 0.0100000 -0.0000000 0.5000000), wk = 0.0026810 k( 174) = ( 0.0200000 -0.0000000 0.5000000), wk = 0.0026810 k( 175) = ( 0.0300000 -0.0000000 0.5000000), wk = 0.0026810 k( 176) = ( 0.0400000 -0.0000000 0.5000000), wk = 0.0026810 k( 177) = ( 0.0500000 -0.0000000 0.5000000), wk = 0.0026810 k( 178) = ( 0.0600000 -0.0000000 0.5000000), wk = 0.0026810 k( 179) = ( 0.0700000 -0.0000000 0.5000000), wk = 0.0026810 k( 180) = ( 0.0800000 -0.0000000 0.5000000), wk = 0.0026810 k( 181) = ( 0.0900000 -0.0000000 0.5000000), wk = 0.0026810 k( 182) = ( 0.1000000 -0.0000000 0.5000000), wk = 0.0026810 k( 183) = ( 0.1100000 -0.0000000 0.5000000), wk = 0.0026810 k( 184) = ( 0.1200000 -0.0000000 0.5000000), wk = 0.0026810 k( 185) = ( 0.1300000 -0.0000000 0.5000000), wk = 0.0026810 k( 186) = ( 0.1400000 -0.0000000 0.5000000), wk = 0.0026810 k( 187) = ( 0.1500000 -0.0000000 0.5000000), wk = 0.0026810 k( 188) = ( 0.1600000 -0.0000000 0.5000000), wk = 0.0026810 k( 189) = ( 0.1700000 -0.0000000 0.5000000), wk = 0.0026810 k( 190) = ( 0.1800000 -0.0000000 0.5000000), wk = 0.0026810 k( 191) = ( 0.1900000 -0.0000000 0.5000000), wk = 0.0026810 k( 192) = ( 0.2000000 -0.0000000 0.5000000), wk = 0.0026810 k( 193) = ( 0.2100000 -0.0000000 0.5000000), wk = 0.0026810 k( 194) = ( 0.2200000 -0.0000000 0.5000000), wk = 0.0026810 k( 195) = ( 0.2300000 -0.0000000 0.5000000), wk = 0.0026810 k( 196) = ( 0.2400000 -0.0000000 0.5000000), wk = 0.0026810 k( 197) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0026810 k( 198) = ( 0.2600000 -0.0000000 0.5000000), wk = 0.0026810 k( 199) = ( 0.2700000 -0.0000000 0.5000000), wk = 0.0026810 k( 200) = ( 0.2800000 -0.0000000 0.5000000), wk = 0.0026810 k( 201) = ( 0.2900000 -0.0000000 0.5000000), wk = 0.0026810 k( 202) = ( 0.3000000 -0.0000000 0.5000000), wk = 0.0026810 k( 203) = ( 0.3100000 -0.0000000 0.5000000), wk = 0.0026810 k( 204) = ( 0.3200000 -0.0000000 0.5000000), wk = 0.0026810 k( 205) = ( 0.3300000 -0.0000000 0.5000000), wk = 0.0026810 k( 206) = ( 0.3400000 -0.0000000 0.5000000), wk = 0.0026810 k( 207) = ( 0.3500000 -0.0000000 0.5000000), wk = 0.0026810 k( 208) = ( 0.3600000 -0.0000000 0.5000000), wk = 0.0026810 k( 209) = ( 0.3700000 -0.0000000 0.5000000), wk = 0.0026810 k( 210) = ( 0.3800000 -0.0000000 0.5000000), wk = 0.0026810 k( 211) = ( 0.3900000 -0.0000000 0.5000000), wk = 0.0026810 k( 212) = ( 0.4000000 -0.0000000 0.5000000), wk = 0.0026810 k( 213) = ( 0.4100000 -0.0000000 0.5000000), wk = 0.0026810 k( 214) = ( 0.4200000 -0.0000000 0.5000000), wk = 0.0026810 k( 215) = ( 0.4300000 -0.0000000 0.5000000), wk = 0.0026810 k( 216) = ( 0.4400000 -0.0000000 0.5000000), wk = 0.0026810 k( 217) = ( 0.4500000 -0.0000000 0.5000000), wk = 0.0026810 k( 218) = ( 0.4600000 -0.0000000 0.5000000), wk = 0.0026810 k( 219) = ( 0.4700000 -0.0000000 0.5000000), wk = 0.0026810 k( 220) = ( 0.4800000 -0.0000000 0.5000000), wk = 0.0026810 k( 221) = ( 0.4900000 0.0000000 0.5000000), wk = 0.0026810 k( 222) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0026810 k( 223) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0026810 k( 224) = ( 0.4942529 0.0114942 0.5000000), wk = 0.0026810 k( 225) = ( 0.4885058 0.0229885 0.5000000), wk = 0.0026810 k( 226) = ( 0.4827586 0.0344828 0.5000000), wk = 0.0026810 k( 227) = ( 0.4770115 0.0459770 0.5000000), wk = 0.0026810 k( 228) = ( 0.4712644 0.0574713 0.5000000), wk = 0.0026810 k( 229) = ( 0.4655172 0.0689655 0.5000000), wk = 0.0026810 k( 230) = ( 0.4597701 0.0804598 0.5000000), wk = 0.0026810 k( 231) = ( 0.4540230 0.0919540 0.5000000), wk = 0.0026810 k( 232) = ( 0.4482759 0.1034483 0.5000000), wk = 0.0026810 k( 233) = ( 0.4425287 0.1149425 0.5000000), wk = 0.0026810 k( 234) = ( 0.4367816 0.1264368 0.5000000), wk = 0.0026810 k( 235) = ( 0.4310345 0.1379310 0.5000000), wk = 0.0026810 k( 236) = ( 0.4252874 0.1494253 0.5000000), wk = 0.0026810 k( 237) = ( 0.4195402 0.1609195 0.5000000), wk = 0.0026810 k( 238) = ( 0.4137931 0.1724138 0.5000000), wk = 0.0026810 k( 239) = ( 0.4080460 0.1839080 0.5000000), wk = 0.0026810 k( 240) = ( 0.4022988 0.1954023 0.5000000), wk = 0.0026810 k( 241) = ( 0.3965517 0.2068965 0.5000000), wk = 0.0026810 k( 242) = ( 0.3908046 0.2183908 0.5000000), wk = 0.0026810 k( 243) = ( 0.3850575 0.2298851 0.5000000), wk = 0.0026810 k( 244) = ( 0.3793103 0.2413793 0.5000000), wk = 0.0026810 k( 245) = ( 0.3735632 0.2528736 0.5000000), wk = 0.0026810 k( 246) = ( 0.3678161 0.2643678 0.5000000), wk = 0.0026810 k( 247) = ( 0.3620690 0.2758621 0.5000000), wk = 0.0026810 k( 248) = ( 0.3563218 0.2873563 0.5000000), wk = 0.0026810 k( 249) = ( 0.3505747 0.2988506 0.5000000), wk = 0.0026810 k( 250) = ( 0.3448276 0.3103448 0.5000000), wk = 0.0026810 k( 251) = ( 0.3390805 0.3218391 0.5000000), wk = 0.0026810 k( 252) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0026810 k( 253) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0026810 k( 254) = ( 0.3275862 0.3275862 0.5000000), wk = 0.0026810 k( 255) = ( 0.3218391 0.3218391 0.5000000), wk = 0.0026810 k( 256) = ( 0.3160920 0.3160920 0.5000000), wk = 0.0026810 k( 257) = ( 0.3103448 0.3103448 0.5000000), wk = 0.0026810 k( 258) = ( 0.3045977 0.3045977 0.5000000), wk = 0.0026810 k( 259) = ( 0.2988506 0.2988506 0.5000000), wk = 0.0026810 k( 260) = ( 0.2931034 0.2931035 0.5000000), wk = 0.0026810 k( 261) = ( 0.2873563 0.2873563 0.5000000), wk = 0.0026810 k( 262) = ( 0.2816092 0.2816092 0.5000000), wk = 0.0026810 k( 263) = ( 0.2758621 0.2758621 0.5000000), wk = 0.0026810 k( 264) = ( 0.2701149 0.2701149 0.5000000), wk = 0.0026810 k( 265) = ( 0.2643678 0.2643678 0.5000000), wk = 0.0026810 k( 266) = ( 0.2586207 0.2586207 0.5000000), wk = 0.0026810 k( 267) = ( 0.2528736 0.2528736 0.5000000), wk = 0.0026810 k( 268) = ( 0.2471264 0.2471264 0.5000000), wk = 0.0026810 k( 269) = ( 0.2413793 0.2413793 0.5000000), wk = 0.0026810 k( 270) = ( 0.2356322 0.2356322 0.5000000), wk = 0.0026810 k( 271) = ( 0.2298851 0.2298851 0.5000000), wk = 0.0026810 k( 272) = ( 0.2241379 0.2241379 0.5000000), wk = 0.0026810 k( 273) = ( 0.2183908 0.2183908 0.5000000), wk = 0.0026810 k( 274) = ( 0.2126437 0.2126437 0.5000000), wk = 0.0026810 k( 275) = ( 0.2068966 0.2068966 0.5000000), wk = 0.0026810 k( 276) = ( 0.2011494 0.2011494 0.5000000), wk = 0.0026810 k( 277) = ( 0.1954023 0.1954023 0.5000000), wk = 0.0026810 k( 278) = ( 0.1896552 0.1896552 0.5000000), wk = 0.0026810 k( 279) = ( 0.1839080 0.1839080 0.5000000), wk = 0.0026810 k( 280) = ( 0.1781609 0.1781609 0.5000000), wk = 0.0026810 k( 281) = ( 0.1724138 0.1724138 0.5000000), wk = 0.0026810 k( 282) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0026810 k( 283) = ( 0.1609195 0.1609195 0.5000000), wk = 0.0026810 k( 284) = ( 0.1551724 0.1551724 0.5000000), wk = 0.0026810 k( 285) = ( 0.1494253 0.1494253 0.5000000), wk = 0.0026810 k( 286) = ( 0.1436782 0.1436782 0.5000000), wk = 0.0026810 k( 287) = ( 0.1379310 0.1379310 0.5000000), wk = 0.0026810 k( 288) = ( 0.1321839 0.1321839 0.5000000), wk = 0.0026810 k( 289) = ( 0.1264368 0.1264368 0.5000000), wk = 0.0026810 k( 290) = ( 0.1206897 0.1206897 0.5000000), wk = 0.0026810 k( 291) = ( 0.1149425 0.1149425 0.5000000), wk = 0.0026810 k( 292) = ( 0.1091954 0.1091954 0.5000000), wk = 0.0026810 k( 293) = ( 0.1034483 0.1034483 0.5000000), wk = 0.0026810 k( 294) = ( 0.0977012 0.0977012 0.5000000), wk = 0.0026810 k( 295) = ( 0.0919540 0.0919540 0.5000000), wk = 0.0026810 k( 296) = ( 0.0862069 0.0862069 0.5000000), wk = 0.0026810 k( 297) = ( 0.0804598 0.0804598 0.5000000), wk = 0.0026810 k( 298) = ( 0.0747126 0.0747126 0.5000000), wk = 0.0026810 k( 299) = ( 0.0689655 0.0689655 0.5000000), wk = 0.0026810 k( 300) = ( 0.0632184 0.0632184 0.5000000), wk = 0.0026810 k( 301) = ( 0.0574713 0.0574713 0.5000000), wk = 0.0026810 k( 302) = ( 0.0517241 0.0517241 0.5000000), wk = 0.0026810 k( 303) = ( 0.0459770 0.0459770 0.5000000), wk = 0.0026810 k( 304) = ( 0.0402299 0.0402299 0.5000000), wk = 0.0026810 k( 305) = ( 0.0344828 0.0344828 0.5000000), wk = 0.0026810 k( 306) = ( 0.0287356 0.0287356 0.5000000), wk = 0.0026810 k( 307) = ( 0.0229885 0.0229885 0.5000000), wk = 0.0026810 k( 308) = ( 0.0172414 0.0172414 0.5000000), wk = 0.0026810 k( 309) = ( 0.0114942 0.0114942 0.5000000), wk = 0.0026810 k( 310) = ( 0.0057471 0.0057471 0.5000000), wk = 0.0026810 k( 311) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026810 k( 312) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0026810 k( 313) = ( 0.5000000 0.0000000 0.4833333), wk = 0.0026810 k( 314) = ( 0.5000000 0.0000000 0.4666667), wk = 0.0026810 k( 315) = ( 0.5000000 0.0000000 0.4500000), wk = 0.0026810 k( 316) = ( 0.5000000 0.0000000 0.4333333), wk = 0.0026810 k( 317) = ( 0.5000000 0.0000000 0.4166667), wk = 0.0026810 k( 318) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0026810 k( 319) = ( 0.5000000 0.0000000 0.3833333), wk = 0.0026810 k( 320) = ( 0.5000000 0.0000000 0.3666667), wk = 0.0026810 k( 321) = ( 0.5000000 0.0000000 0.3500000), wk = 0.0026810 k( 322) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0026810 k( 323) = ( 0.5000000 0.0000000 0.3166667), wk = 0.0026810 k( 324) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0026810 k( 325) = ( 0.5000000 0.0000000 0.2833333), wk = 0.0026810 k( 326) = ( 0.5000000 0.0000000 0.2666667), wk = 0.0026810 k( 327) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0026810 k( 328) = ( 0.5000000 0.0000000 0.2333333), wk = 0.0026810 k( 329) = ( 0.5000000 0.0000000 0.2166667), wk = 0.0026810 k( 330) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0026810 k( 331) = ( 0.5000000 0.0000000 0.1833333), wk = 0.0026810 k( 332) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0026810 k( 333) = ( 0.5000000 0.0000000 0.1500000), wk = 0.0026810 k( 334) = ( 0.5000000 0.0000000 0.1333333), wk = 0.0026810 k( 335) = ( 0.5000000 0.0000000 0.1166667), wk = 0.0026810 k( 336) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0026810 k( 337) = ( 0.5000000 0.0000000 0.0833333), wk = 0.0026810 k( 338) = ( 0.5000000 0.0000000 0.0666667), wk = 0.0026810 k( 339) = ( 0.5000000 0.0000000 0.0500000), wk = 0.0026810 k( 340) = ( 0.5000000 0.0000000 0.0333333), wk = 0.0026810 k( 341) = ( 0.5000000 0.0000000 0.0166667), wk = 0.0026810 k( 342) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0026810 k( 343) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0026810 k( 344) = ( 0.3333333 0.3333333 0.0166667), wk = 0.0026810 k( 345) = ( 0.3333333 0.3333333 0.0333333), wk = 0.0026810 k( 346) = ( 0.3333333 0.3333333 0.0500000), wk = 0.0026810 k( 347) = ( 0.3333333 0.3333333 0.0666667), wk = 0.0026810 k( 348) = ( 0.3333333 0.3333333 0.0833333), wk = 0.0026810 k( 349) = ( 0.3333333 0.3333333 0.1000000), wk = 0.0026810 k( 350) = ( 0.3333333 0.3333333 0.1166667), wk = 0.0026810 k( 351) = ( 0.3333333 0.3333333 0.1333333), wk = 0.0026810 k( 352) = ( 0.3333333 0.3333333 0.1500000), wk = 0.0026810 k( 353) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0026810 k( 354) = ( 0.3333333 0.3333333 0.1833333), wk = 0.0026810 k( 355) = ( 0.3333333 0.3333333 0.2000000), wk = 0.0026810 k( 356) = ( 0.3333333 0.3333333 0.2166667), wk = 0.0026810 k( 357) = ( 0.3333333 0.3333333 0.2333333), wk = 0.0026810 k( 358) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0026810 k( 359) = ( 0.3333333 0.3333333 0.2666667), wk = 0.0026810 k( 360) = ( 0.3333333 0.3333333 0.2833333), wk = 0.0026810 k( 361) = ( 0.3333333 0.3333333 0.3000000), wk = 0.0026810 k( 362) = ( 0.3333333 0.3333333 0.3166667), wk = 0.0026810 k( 363) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0026810 k( 364) = ( 0.3333333 0.3333333 0.3500000), wk = 0.0026810 k( 365) = ( 0.3333333 0.3333333 0.3666667), wk = 0.0026810 k( 366) = ( 0.3333333 0.3333333 0.3833333), wk = 0.0026810 k( 367) = ( 0.3333333 0.3333333 0.4000000), wk = 0.0026810 k( 368) = ( 0.3333333 0.3333333 0.4166667), wk = 0.0026810 k( 369) = ( 0.3333333 0.3333333 0.4333333), wk = 0.0026810 k( 370) = ( 0.3333333 0.3333333 0.4500000), wk = 0.0026810 k( 371) = ( 0.3333333 0.3333333 0.4666667), wk = 0.0026810 k( 372) = ( 0.3333333 0.3333333 0.4833333), wk = 0.0026810 k( 373) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0026810 Dense grid: 39495 G-vectors FFT dimensions: ( 40, 40, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.24 Mb ( 280, 56) NL pseudopotentials 0.21 Mb ( 140, 96) Each V/rho on FFT grid 0.05 Mb ( 3200) Each G-vector array 0.01 Mb ( 1101) G-vector shells 0.00 Mb ( 491) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.96 Mb ( 280, 224) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.16 Mb ( 96, 2, 56) The potential is recalculated from file : ./CoSe.save/charge-density.dat Starting wfc are 56 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.1 secs Computing kpt #: 2 total cpu time spent up to now is 2.4 secs Computing kpt #: 3 total cpu time spent up to now is 2.7 secs Computing kpt #: 4 total cpu time spent up to now is 3.1 secs Computing kpt #: 5 total cpu time spent up to now is 3.4 secs Computing kpt #: 6 total cpu time spent up to now is 3.7 secs Computing kpt #: 7 total cpu time spent up to now is 4.1 secs Computing kpt #: 8 total cpu time spent up to now is 4.4 secs Computing kpt #: 9 total cpu time spent up to now is 4.7 secs Computing kpt #: 10 total cpu time spent up to now is 5.1 secs Computing kpt #: 11 total cpu time spent up to now is 5.4 secs Computing kpt #: 12 total cpu time spent up to now is 5.8 secs Computing kpt #: 13 total cpu time spent up to now is 6.1 secs Computing kpt #: 14 total cpu time spent up to now is 6.5 secs Computing kpt #: 15 total cpu time spent up to now is 6.8 secs Computing kpt #: 16 total cpu time spent up to now is 7.2 secs Computing kpt #: 17 total cpu time spent up to now is 7.5 secs Computing kpt #: 18 total cpu time spent up to now is 7.9 secs Computing kpt #: 19 total cpu time spent up to now is 8.3 secs Computing kpt #: 20 total cpu time spent up to now is 8.6 secs Computing kpt #: 21 total cpu time spent up to now is 9.0 secs Computing kpt #: 22 total cpu time spent up to now is 9.3 secs Computing kpt #: 23 total cpu time spent up to now is 9.7 secs Computing kpt #: 24 total cpu time spent up to now is 10.1 secs Computing kpt #: 25 total cpu time spent up to now is 10.4 secs Computing kpt #: 26 total cpu time spent up to now is 10.8 secs Computing kpt #: 27 total cpu time spent up to now is 11.2 secs Computing kpt #: 28 total cpu time spent up to now is 11.7 secs Computing kpt #: 29 total cpu time spent up to now is 12.2 secs Computing kpt #: 30 total cpu time spent up to now is 12.6 secs Computing kpt #: 31 total cpu time spent up to now is 13.1 secs Computing kpt #: 32 total cpu time spent up to now is 13.6 secs Computing kpt #: 33 total cpu time spent up to now is 14.1 secs Computing kpt #: 34 total cpu time spent up to now is 14.5 secs Computing kpt #: 35 total cpu time spent up to now is 15.0 secs Computing kpt #: 36 total cpu time spent up to now is 15.5 secs Computing kpt #: 37 total cpu time spent up to now is 15.8 secs Computing kpt #: 38 total cpu time spent up to now is 16.2 secs Computing kpt #: 39 total cpu time spent up to now is 16.6 secs Computing kpt #: 40 total cpu time spent up to now is 17.0 secs Computing kpt #: 41 total cpu time spent up to now is 17.4 secs Computing kpt #: 42 total cpu time spent up to now is 17.7 secs Computing kpt #: 43 total cpu time spent up to now is 18.1 secs Computing kpt #: 44 total cpu time spent up to now is 18.5 secs Computing kpt #: 45 total cpu time spent up to now is 18.8 secs Computing kpt #: 46 total cpu time spent up to now is 19.2 secs Computing kpt #: 47 total cpu time spent up to now is 19.6 secs Computing kpt #: 48 total cpu time spent up to now is 20.0 secs Computing kpt #: 49 total cpu time spent up to now is 20.3 secs Computing kpt #: 50 total cpu time spent up to now is 20.7 secs Computing kpt #: 51 total cpu time spent up to now is 21.1 secs Computing kpt #: 52 total cpu time spent up to now is 21.5 secs Computing kpt #: 53 total cpu time spent up to now is 21.9 secs Computing kpt #: 54 total cpu time spent up to now is 22.3 secs Computing kpt #: 55 total cpu time spent up to now is 22.7 secs Computing kpt #: 56 total cpu time spent up to now is 23.1 secs Computing kpt #: 57 total cpu time spent up to now is 23.5 secs Computing kpt #: 58 total cpu time spent up to now is 24.0 secs Computing kpt #: 59 total cpu time spent up to now is 24.3 secs Computing kpt #: 60 total cpu time spent up to now is 24.7 secs Computing kpt #: 61 total cpu time spent up to now is 25.1 secs Computing kpt #: 62 total cpu time spent up to now is 25.4 secs Computing kpt #: 63 total cpu time spent up to now is 25.8 secs Computing kpt #: 64 total cpu time spent up to now is 26.2 secs Computing kpt #: 65 total cpu time spent up to now is 26.6 secs Computing kpt #: 66 total cpu time spent up to now is 27.0 secs Computing kpt #: 67 total cpu time spent up to now is 27.3 secs Computing kpt #: 68 total cpu time spent up to now is 27.7 secs Computing kpt #: 69 total cpu time spent up to now is 28.1 secs Computing kpt #: 70 total cpu time spent up to now is 28.5 secs Computing kpt #: 71 total cpu time spent up to now is 28.9 secs Computing kpt #: 72 total cpu time spent up to now is 29.3 secs Computing kpt #: 73 total cpu time spent up to now is 29.7 secs Computing kpt #: 74 total cpu time spent up to now is 30.1 secs Computing kpt #: 75 total cpu time spent up to now is 30.5 secs Computing kpt #: 76 total cpu time spent up to now is 30.9 secs Computing kpt #: 77 total cpu time spent up to now is 31.3 secs Computing kpt #: 78 total cpu time spent up to now is 31.7 secs Computing kpt #: 79 total cpu time spent up to now is 32.1 secs Computing kpt #: 80 total cpu time spent up to now is 32.5 secs Computing kpt #: 81 total cpu time spent up to now is 32.9 secs Computing kpt #: 82 total cpu time spent up to now is 33.2 secs Computing kpt #: 83 total cpu time spent up to now is 33.6 secs Computing kpt #: 84 total cpu time spent up to now is 34.0 secs Computing kpt #: 85 total cpu time spent up to now is 34.4 secs Computing kpt #: 86 total cpu time spent up to now is 34.8 secs Computing kpt #: 87 total cpu time spent up to now is 35.3 secs Computing kpt #: 88 total cpu time spent up to now is 35.7 secs Computing kpt #: 89 total cpu time spent up to now is 36.1 secs Computing kpt #: 90 total cpu time spent up to now is 36.5 secs Computing kpt #: 91 total cpu time spent up to now is 36.9 secs Computing kpt #: 92 total cpu time spent up to now is 37.3 secs Computing kpt #: 93 total cpu time spent up to now is 37.8 secs Computing kpt #: 94 total cpu time spent up to now is 38.2 secs Computing kpt #: 95 total cpu time spent up to now is 38.6 secs Computing kpt #: 96 total cpu time spent up to now is 39.0 secs Computing kpt #: 97 total cpu time spent up to now is 39.4 secs Computing kpt #: 98 total cpu time spent up to now is 39.8 secs Computing kpt #: 99 total cpu time spent up to now is 40.2 secs Computing kpt #: 100 total cpu time spent up to now is 40.6 secs Computing kpt #: 101 total cpu time spent up to now is 41.0 secs Computing kpt #: 102 total cpu time spent up to now is 41.4 secs Computing kpt #: 103 total cpu time spent up to now is 41.8 secs Computing kpt #: 104 total cpu time spent up to now is 42.2 secs Computing kpt #: 105 total cpu time spent up to now is 42.6 secs Computing kpt #: 106 total cpu time spent up to now is 43.0 secs Computing kpt #: 107 total cpu time spent up to now is 43.4 secs Computing kpt #: 108 total cpu time spent up to now is 43.8 secs Computing kpt #: 109 total cpu time spent up to now is 44.3 secs Computing kpt #: 110 total cpu time spent up to now is 44.8 secs Computing kpt #: 111 total cpu time spent up to now is 45.3 secs Computing kpt #: 112 total cpu time spent up to now is 45.9 secs Computing kpt #: 113 total cpu time spent up to now is 46.4 secs Computing kpt #: 114 total cpu time spent up to now is 46.9 secs Computing kpt #: 115 total cpu time spent up to now is 47.6 secs Computing kpt #: 116 total cpu time spent up to now is 48.1 secs Computing kpt #: 117 total cpu time spent up to now is 48.5 secs Computing kpt #: 118 total cpu time spent up to now is 48.9 secs Computing kpt #: 119 total cpu time spent up to now is 49.2 secs Computing kpt #: 120 total cpu time spent up to now is 49.6 secs Computing kpt #: 121 total cpu time spent up to now is 50.0 secs Computing kpt #: 122 total cpu time spent up to now is 50.4 secs Computing kpt #: 123 total cpu time spent up to now is 50.7 secs Computing kpt #: 124 total cpu time spent up to now is 51.1 secs Computing kpt #: 125 total cpu time spent up to now is 51.4 secs Computing kpt #: 126 total cpu time spent up to now is 51.8 secs Computing kpt #: 127 total cpu time spent up to now is 52.1 secs Computing kpt #: 128 total cpu time spent up to now is 52.5 secs Computing kpt #: 129 total cpu time spent up to now is 52.8 secs Computing kpt #: 130 total cpu time spent up to now is 53.2 secs Computing kpt #: 131 total cpu time spent up to now is 53.5 secs Computing kpt #: 132 total cpu time spent up to now is 53.8 secs Computing kpt #: 133 total cpu time spent up to now is 54.2 secs Computing kpt #: 134 total cpu time spent up to now is 54.5 secs Computing kpt #: 135 total cpu time spent up to now is 54.8 secs Computing kpt #: 136 total cpu time spent up to now is 55.1 secs Computing kpt #: 137 total cpu time spent up to now is 55.5 secs Computing kpt #: 138 total cpu time spent up to now is 55.8 secs Computing kpt #: 139 total cpu time spent up to now is 56.1 secs Computing kpt #: 140 total cpu time spent up to now is 56.4 secs Computing kpt #: 141 total cpu time spent up to now is 56.7 secs Computing kpt #: 142 total cpu time spent up to now is 57.1 secs Computing kpt #: 143 total cpu time spent up to now is 57.4 secs Computing kpt #: 144 total cpu time spent up to now is 57.7 secs Computing kpt #: 145 total cpu time spent up to now is 58.0 secs Computing kpt #: 146 total cpu time spent up to now is 58.3 secs Computing kpt #: 147 total cpu time spent up to now is 58.7 secs Computing kpt #: 148 total cpu time spent up to now is 59.0 secs Computing kpt #: 149 total cpu time spent up to now is 59.3 secs Computing kpt #: 150 total cpu time spent up to now is 59.6 secs Computing kpt #: 151 total cpu time spent up to now is 60.0 secs Computing kpt #: 152 total cpu time spent up to now is 60.3 secs Computing kpt #: 153 total cpu time spent up to now is 60.6 secs Computing kpt #: 154 total cpu time spent up to now is 60.9 secs Computing kpt #: 155 total cpu time spent up to now is 61.3 secs Computing kpt #: 156 total cpu time spent up to now is 61.6 secs Computing kpt #: 157 total cpu time spent up to now is 61.9 secs Computing kpt #: 158 total cpu time spent up to now is 62.2 secs Computing kpt #: 159 total cpu time spent up to now is 62.6 secs Computing kpt #: 160 total cpu time spent up to now is 62.9 secs Computing kpt #: 161 total cpu time spent up to now is 63.2 secs Computing kpt #: 162 total cpu time spent up to now is 63.5 secs Computing kpt #: 163 total cpu time spent up to now is 63.9 secs Computing kpt #: 164 total cpu time spent up to now is 64.2 secs Computing kpt #: 165 total cpu time spent up to now is 64.6 secs Computing kpt #: 166 total cpu time spent up to now is 64.9 secs Computing kpt #: 167 total cpu time spent up to now is 65.2 secs Computing kpt #: 168 total cpu time spent up to now is 65.6 secs Computing kpt #: 169 total cpu time spent up to now is 65.9 secs Computing kpt #: 170 total cpu time spent up to now is 66.3 secs Computing kpt #: 171 total cpu time spent up to now is 66.6 secs Computing kpt #: 172 total cpu time spent up to now is 66.9 secs Computing kpt #: 173 total cpu time spent up to now is 67.3 secs Computing kpt #: 174 total cpu time spent up to now is 67.6 secs Computing kpt #: 175 total cpu time spent up to now is 68.0 secs Computing kpt #: 176 total cpu time spent up to now is 68.3 secs Computing kpt #: 177 total cpu time spent up to now is 68.6 secs Computing kpt #: 178 total cpu time spent up to now is 69.0 secs Computing kpt #: 179 total cpu time spent up to now is 69.3 secs Computing kpt #: 180 total cpu time spent up to now is 69.7 secs Computing kpt #: 181 total cpu time spent up to now is 70.0 secs Computing kpt #: 182 total cpu time spent up to now is 70.4 secs Computing kpt #: 183 total cpu time spent up to now is 70.7 secs Computing kpt #: 184 total cpu time spent up to now is 71.1 secs Computing kpt #: 185 total cpu time spent up to now is 71.5 secs Computing kpt #: 186 total cpu time spent up to now is 71.8 secs Computing kpt #: 187 total cpu time spent up to now is 72.2 secs Computing kpt #: 188 total cpu time spent up to now is 72.6 secs Computing kpt #: 189 total cpu time spent up to now is 72.9 secs Computing kpt #: 190 total cpu time spent up to now is 73.3 secs Computing kpt #: 191 total cpu time spent up to now is 73.7 secs Computing kpt #: 192 total cpu time spent up to now is 74.0 secs Computing kpt #: 193 total cpu time spent up to now is 74.4 secs Computing kpt #: 194 total cpu time spent up to now is 74.7 secs Computing kpt #: 195 total cpu time spent up to now is 75.1 secs Computing kpt #: 196 total cpu time spent up to now is 75.5 secs Computing kpt #: 197 total cpu time spent up to now is 75.8 secs Computing kpt #: 198 total cpu time spent up to now is 76.2 secs Computing kpt #: 199 total cpu time spent up to now is 76.5 secs Computing kpt #: 200 total cpu time spent up to now is 76.9 secs Computing kpt #: 201 total cpu time spent up to now is 77.2 secs Computing kpt #: 202 total cpu time spent up to now is 77.6 secs Computing kpt #: 203 total cpu time spent up to now is 77.9 secs Computing kpt #: 204 total cpu time spent up to now is 78.2 secs Computing kpt #: 205 total cpu time spent up to now is 78.6 secs Computing kpt #: 206 total cpu time spent up to now is 78.9 secs Computing kpt #: 207 total cpu time spent up to now is 79.3 secs Computing kpt #: 208 total cpu time spent up to now is 79.6 secs Computing kpt #: 209 total cpu time spent up to now is 79.9 secs Computing kpt #: 210 total cpu time spent up to now is 80.2 secs Computing kpt #: 211 total cpu time spent up to now is 80.6 secs Computing kpt #: 212 total cpu time spent up to now is 80.9 secs Computing kpt #: 213 total cpu time spent up to now is 81.2 secs Computing kpt #: 214 total cpu time spent up to now is 81.5 secs Computing kpt #: 215 total cpu time spent up to now is 81.9 secs Computing kpt #: 216 total cpu time spent up to now is 82.2 secs Computing kpt #: 217 total cpu time spent up to now is 82.5 secs Computing kpt #: 218 total cpu time spent up to now is 82.8 secs Computing kpt #: 219 total cpu time spent up to now is 83.1 secs Computing kpt #: 220 total cpu time spent up to now is 83.5 secs Computing kpt #: 221 total cpu time spent up to now is 83.8 secs Computing kpt #: 222 total cpu time spent up to now is 84.1 secs Computing kpt #: 223 total cpu time spent up to now is 84.4 secs Computing kpt #: 224 total cpu time spent up to now is 84.7 secs Computing kpt #: 225 total cpu time spent up to now is 85.1 secs Computing kpt #: 226 total cpu time spent up to now is 85.4 secs Computing kpt #: 227 total cpu time spent up to now is 85.7 secs Computing kpt #: 228 total cpu time spent up to now is 86.1 secs Computing kpt #: 229 total cpu time spent up to now is 86.4 secs Computing kpt #: 230 total cpu time spent up to now is 86.7 secs Computing kpt #: 231 total cpu time spent up to now is 87.1 secs Computing kpt #: 232 total cpu time spent up to now is 87.4 secs Computing kpt #: 233 total cpu time spent up to now is 87.8 secs Computing kpt #: 234 total cpu time spent up to now is 88.1 secs Computing kpt #: 235 total cpu time spent up to now is 88.4 secs Computing kpt #: 236 total cpu time spent up to now is 88.8 secs Computing kpt #: 237 total cpu time spent up to now is 89.1 secs Computing kpt #: 238 total cpu time spent up to now is 89.5 secs Computing kpt #: 239 total cpu time spent up to now is 89.8 secs Computing kpt #: 240 total cpu time spent up to now is 90.1 secs Computing kpt #: 241 total cpu time spent up to now is 90.5 secs Computing kpt #: 242 total cpu time spent up to now is 90.9 secs Computing kpt #: 243 total cpu time spent up to now is 91.2 secs Computing kpt #: 244 total cpu time spent up to now is 91.6 secs Computing kpt #: 245 total cpu time spent up to now is 92.0 secs Computing kpt #: 246 total cpu time spent up to now is 92.4 secs Computing kpt #: 247 total cpu time spent up to now is 92.8 secs Computing kpt #: 248 total cpu time spent up to now is 93.2 secs Computing kpt #: 249 total cpu time spent up to now is 93.6 secs Computing kpt #: 250 total cpu time spent up to now is 94.0 secs Computing kpt #: 251 total cpu time spent up to now is 94.3 secs Computing kpt #: 252 total cpu time spent up to now is 94.7 secs Computing kpt #: 253 total cpu time spent up to now is 95.1 secs Computing kpt #: 254 total cpu time spent up to now is 95.5 secs Computing kpt #: 255 total cpu time spent up to now is 95.9 secs Computing kpt #: 256 total cpu time spent up to now is 96.3 secs Computing kpt #: 257 total cpu time spent up to now is 96.7 secs Computing kpt #: 258 total cpu time spent up to now is 97.1 secs Computing kpt #: 259 total cpu time spent up to now is 97.5 secs Computing kpt #: 260 total cpu time spent up to now is 97.8 secs Computing kpt #: 261 total cpu time spent up to now is 98.2 secs Computing kpt #: 262 total cpu time spent up to now is 98.6 secs Computing kpt #: 263 total cpu time spent up to now is 99.0 secs Computing kpt #: 264 total cpu time spent up to now is 99.4 secs Computing kpt #: 265 total cpu time spent up to now is 99.8 secs Computing kpt #: 266 total cpu time spent up to now is 100.1 secs Computing kpt #: 267 total cpu time spent up to now is 100.5 secs Computing kpt #: 268 total cpu time spent up to now is 100.9 secs Computing kpt #: 269 total cpu time spent up to now is 101.3 secs Computing kpt #: 270 total cpu time spent up to now is 101.6 secs Computing kpt #: 271 total cpu time spent up to now is 102.0 secs Computing kpt #: 272 total cpu time spent up to now is 102.4 secs Computing kpt #: 273 total cpu time spent up to now is 102.7 secs Computing kpt #: 274 total cpu time spent up to now is 103.1 secs Computing kpt #: 275 total cpu time spent up to now is 103.5 secs Computing kpt #: 276 total cpu time spent up to now is 103.9 secs Computing kpt #: 277 total cpu time spent up to now is 104.2 secs Computing kpt #: 278 total cpu time spent up to now is 104.6 secs Computing kpt #: 279 total cpu time spent up to now is 105.0 secs Computing kpt #: 280 total cpu time spent up to now is 105.4 secs Computing kpt #: 281 total cpu time spent up to now is 105.7 secs Computing kpt #: 282 total cpu time spent up to now is 106.1 secs Computing kpt #: 283 total cpu time spent up to now is 106.5 secs Computing kpt #: 284 total cpu time spent up to now is 106.8 secs Computing kpt #: 285 total cpu time spent up to now is 107.2 secs Computing kpt #: 286 total cpu time spent up to now is 107.6 secs Computing kpt #: 287 total cpu time spent up to now is 108.0 secs Computing kpt #: 288 total cpu time spent up to now is 108.3 secs Computing kpt #: 289 total cpu time spent up to now is 108.7 secs Computing kpt #: 290 total cpu time spent up to now is 109.1 secs Computing kpt #: 291 total cpu time spent up to now is 109.4 secs Computing kpt #: 292 total cpu time spent up to now is 109.8 secs Computing kpt #: 293 total cpu time spent up to now is 110.1 secs Computing kpt #: 294 total cpu time spent up to now is 110.5 secs Computing kpt #: 295 total cpu time spent up to now is 110.8 secs Computing kpt #: 296 total cpu time spent up to now is 111.2 secs Computing kpt #: 297 total cpu time spent up to now is 111.5 secs Computing kpt #: 298 total cpu time spent up to now is 111.9 secs Computing kpt #: 299 total cpu time spent up to now is 112.3 secs Computing kpt #: 300 total cpu time spent up to now is 112.6 secs Computing kpt #: 301 total cpu time spent up to now is 113.0 secs Computing kpt #: 302 total cpu time spent up to now is 113.3 secs Computing kpt #: 303 total cpu time spent up to now is 113.7 secs Computing kpt #: 304 total cpu time spent up to now is 114.0 secs Computing kpt #: 305 total cpu time spent up to now is 114.4 secs Computing kpt #: 306 total cpu time spent up to now is 114.7 secs Computing kpt #: 307 total cpu time spent up to now is 115.1 secs Computing kpt #: 308 total cpu time spent up to now is 115.4 secs Computing kpt #: 309 total cpu time spent up to now is 115.8 secs Computing kpt #: 310 total cpu time spent up to now is 116.1 secs Computing kpt #: 311 total cpu time spent up to now is 116.5 secs Computing kpt #: 312 total cpu time spent up to now is 116.8 secs Computing kpt #: 313 total cpu time spent up to now is 117.1 secs Computing kpt #: 314 total cpu time spent up to now is 117.4 secs Computing kpt #: 315 total cpu time spent up to now is 117.8 secs Computing kpt #: 316 total cpu time spent up to now is 118.1 secs Computing kpt #: 317 total cpu time spent up to now is 118.5 secs Computing kpt #: 318 total cpu time spent up to now is 118.8 secs Computing kpt #: 319 total cpu time spent up to now is 119.1 secs Computing kpt #: 320 total cpu time spent up to now is 119.5 secs Computing kpt #: 321 total cpu time spent up to now is 119.8 secs Computing kpt #: 322 total cpu time spent up to now is 120.2 secs Computing kpt #: 323 total cpu time spent up to now is 120.5 secs Computing kpt #: 324 total cpu time spent up to now is 120.9 secs Computing kpt #: 325 total cpu time spent up to now is 121.2 secs Computing kpt #: 326 total cpu time spent up to now is 121.6 secs Computing kpt #: 327 total cpu time spent up to now is 121.9 secs Computing kpt #: 328 total cpu time spent up to now is 122.2 secs Computing kpt #: 329 total cpu time spent up to now is 122.6 secs Computing kpt #: 330 total cpu time spent up to now is 122.9 secs Computing kpt #: 331 total cpu time spent up to now is 123.2 secs Computing kpt #: 332 total cpu time spent up to now is 123.6 secs Computing kpt #: 333 total cpu time spent up to now is 123.9 secs Computing kpt #: 334 total cpu time spent up to now is 124.3 secs Computing kpt #: 335 total cpu time spent up to now is 124.6 secs Computing kpt #: 336 total cpu time spent up to now is 125.0 secs Computing kpt #: 337 total cpu time spent up to now is 125.3 secs Computing kpt #: 338 total cpu time spent up to now is 125.7 secs Computing kpt #: 339 total cpu time spent up to now is 126.0 secs Computing kpt #: 340 total cpu time spent up to now is 126.4 secs Computing kpt #: 341 total cpu time spent up to now is 126.8 secs Computing kpt #: 342 total cpu time spent up to now is 127.2 secs Computing kpt #: 343 total cpu time spent up to now is 127.5 secs Computing kpt #: 344 total cpu time spent up to now is 127.9 secs Computing kpt #: 345 total cpu time spent up to now is 128.2 secs Computing kpt #: 346 total cpu time spent up to now is 128.6 secs Computing kpt #: 347 total cpu time spent up to now is 128.9 secs Computing kpt #: 348 total cpu time spent up to now is 129.3 secs Computing kpt #: 349 total cpu time spent up to now is 129.7 secs Computing kpt #: 350 total cpu time spent up to now is 130.1 secs Computing kpt #: 351 total cpu time spent up to now is 130.5 secs Computing kpt #: 352 total cpu time spent up to now is 130.9 secs Computing kpt #: 353 total cpu time spent up to now is 131.3 secs Computing kpt #: 354 total cpu time spent up to now is 131.8 secs Computing kpt #: 355 total cpu time spent up to now is 132.3 secs Computing kpt #: 356 total cpu time spent up to now is 132.8 secs Computing kpt #: 357 total cpu time spent up to now is 133.5 secs Computing kpt #: 358 total cpu time spent up to now is 134.2 secs Computing kpt #: 359 total cpu time spent up to now is 134.9 secs Computing kpt #: 360 total cpu time spent up to now is 135.7 secs Computing kpt #: 361 total cpu time spent up to now is 136.3 secs Computing kpt #: 362 total cpu time spent up to now is 137.1 secs Computing kpt #: 363 total cpu time spent up to now is 137.9 secs Computing kpt #: 364 total cpu time spent up to now is 138.5 secs Computing kpt #: 365 total cpu time spent up to now is 139.0 secs Computing kpt #: 366 total cpu time spent up to now is 139.7 secs Computing kpt #: 367 total cpu time spent up to now is 140.3 secs Computing kpt #: 368 total cpu time spent up to now is 140.7 secs Computing kpt #: 369 total cpu time spent up to now is 141.1 secs Computing kpt #: 370 total cpu time spent up to now is 141.5 secs Computing kpt #: 371 total cpu time spent up to now is 142.0 secs Computing kpt #: 372 total cpu time spent up to now is 142.4 secs Computing kpt #: 373 total cpu time spent up to now is 142.7 secs ethr = 2.17E-08, avg # of iterations = 13.6 total cpu time spent up to now is 142.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4901 PWs) bands (ev): -78.6228 -78.6228 -78.6164 -78.6164 -44.3385 -44.3385 -44.3078 -44.3078 -42.6582 -42.6582 -42.5901 -42.5901 -42.5603 -42.5603 -42.5498 -42.5498 -2.7486 -2.7486 -0.4119 -0.4119 5.7445 5.7445 8.4134 8.4134 8.5376 8.5376 10.3266 10.3266 11.0861 11.0861 11.0873 11.0873 11.3739 11.3739 11.4748 11.4748 11.5592 11.5592 11.9273 11.9273 12.3353 12.3353 12.3924 12.3924 13.0476 13.0476 13.5497 13.5497 15.2044 15.2044 15.2887 15.2887 16.2033 16.2033 17.2253 17.2253 k = 0.0100 0.0058-0.0000 ( 4907 PWs) bands (ev): -78.6237 -78.6237 -78.6159 -78.6159 -44.3383 -44.3383 -44.3080 -44.3080 -42.6580 -42.6580 -42.5903 -42.5903 -42.5605 -42.5605 -42.5497 -42.5497 -2.7476 -2.7476 -0.4118 -0.4118 5.7460 5.7460 8.4130 8.4130 8.5372 8.5372 10.3250 10.3250 11.0791 11.0791 11.0831 11.0831 11.3699 11.3699 11.4720 11.4720 11.5673 11.5673 11.9283 11.9283 12.3322 12.3322 12.3891 12.3891 13.0525 13.0525 13.5494 13.5494 15.1970 15.1970 15.2806 15.2806 16.2188 16.2188 17.2328 17.2328 k = 0.0200 0.0115-0.0000 ( 4911 PWs) bands (ev): -78.6239 -78.6239 -78.6159 -78.6159 -44.3383 -44.3383 -44.3081 -44.3081 -42.6580 -42.6580 -42.5903 -42.5903 -42.5605 -42.5605 -42.5497 -42.5497 -2.7443 -2.7443 -0.4113 -0.4113 5.7503 5.7503 8.4118 8.4118 8.5361 8.5361 10.3198 10.3198 11.0563 11.0563 11.0684 11.0684 11.3563 11.3563 11.4648 11.4648 11.5875 11.5875 11.9313 11.9313 12.3308 12.3308 12.3873 12.3873 13.0673 13.0673 13.5494 13.5494 15.1746 15.1746 15.2639 15.2639 16.2629 16.2629 17.2554 17.2554 k = 0.0300 0.0173-0.0000 ( 4917 PWs) bands (ev): -78.6240 -78.6240 -78.6161 -78.6161 -44.3384 -44.3384 -44.3081 -44.3081 -42.6581 -42.6581 -42.5904 -42.5904 -42.5606 -42.5606 -42.5498 -42.5498 -2.7389 -2.7389 -0.4105 -0.4105 5.7574 5.7574 8.4096 8.4096 8.5344 8.5344 10.3111 10.3111 11.0202 11.0202 11.0445 11.0445 11.3354 11.3354 11.4577 11.4577 11.6133 11.6133 11.9366 11.9366 12.3292 12.3292 12.3851 12.3851 13.0911 13.0911 13.5473 13.5473 15.1328 15.1328 15.2466 15.2466 16.3300 16.3300 17.2931 17.2931 k = 0.0400 0.0231-0.0000 ( 4917 PWs) bands (ev): -78.6240 -78.6240 -78.6161 -78.6161 -44.3384 -44.3384 -44.3081 -44.3081 -42.6581 -42.6581 -42.5904 -42.5904 -42.5606 -42.5606 -42.5498 -42.5498 -2.7313 -2.7313 -0.4094 -0.4094 5.7673 5.7673 8.4064 8.4064 8.5322 8.5322 10.2983 10.2983 10.9737 10.9737 11.0128 11.0128 11.3079 11.3079 11.4532 11.4532 11.6407 11.6407 11.9447 11.9447 12.3275 12.3275 12.3830 12.3830 13.1232 13.1232 13.5449 13.5449 15.0744 15.0744 15.2316 15.2316 16.4140 16.4140 17.3457 17.3457 k = 0.0500 0.0289-0.0000 ( 4921 PWs) bands (ev): -78.6241 -78.6241 -78.6161 -78.6161 -44.3384 -44.3384 -44.3082 -44.3082 -42.6581 -42.6581 -42.5905 -42.5905 -42.5606 -42.5606 -42.5498 -42.5498 -2.7216 -2.7216 -0.4079 -0.4079 5.7800 5.7800 8.4019 8.4019 8.5298 8.5298 10.2797 10.2797 10.9196 10.9196 10.9746 10.9746 11.2739 11.2739 11.4511 11.4511 11.6668 11.6668 11.9561 11.9561 12.3249 12.3249 12.3799 12.3799 13.1625 13.1625 13.5418 13.5418 15.0054 15.0054 15.2173 15.2173 16.5095 16.5095 17.4123 17.4123 k = 0.0600 0.0346-0.0000 ( 4917 PWs) bands (ev): -78.6240 -78.6240 -78.6161 -78.6161 -44.3384 -44.3384 -44.3082 -44.3082 -42.6581 -42.6581 -42.5904 -42.5904 -42.5606 -42.5606 -42.5499 -42.5499 -2.7098 -2.7098 -0.4062 -0.4062 5.7955 5.7955 8.3959 8.3959 8.5273 8.5273 10.2542 10.2542 10.8609 10.8609 10.9313 10.9313 11.2340 11.2340 11.4515 11.4515 11.6900 11.6900 11.9710 11.9710 12.3230 12.3230 12.3784 12.3784 13.2079 13.2079 13.5380 13.5380 14.9303 14.9303 15.2030 15.2030 16.6125 16.6125 17.4930 17.4930 k = 0.0700 0.0404-0.0000 ( 4925 PWs) bands (ev): -78.6243 -78.6243 -78.6161 -78.6161 -44.3384 -44.3384 -44.3083 -44.3083 -42.6581 -42.6581 -42.5905 -42.5905 -42.5607 -42.5607 -42.5499 -42.5499 -2.6959 -2.6959 -0.4043 -0.4043 5.8138 5.8138 8.3882 8.3882 8.5250 8.5250 10.2194 10.2194 10.8010 10.8010 10.8839 10.8839 11.1887 11.1887 11.4538 11.4538 11.7095 11.7095 11.9894 11.9894 12.3184 12.3184 12.3750 12.3750 13.2582 13.2582 13.5335 13.5335 14.8514 14.8514 15.1874 15.1874 16.7196 16.7196 17.5863 17.5863 k = 0.0800 0.0462-0.0000 ( 4929 PWs) bands (ev): -78.6245 -78.6245 -78.6161 -78.6161 -44.3384 -44.3384 -44.3084 -44.3084 -42.6581 -42.6581 -42.5906 -42.5906 -42.5608 -42.5608 -42.5499 -42.5499 -2.6798 -2.6798 -0.4021 -0.4021 5.8348 5.8348 8.3783 8.3783 8.5230 8.5230 10.1727 10.1727 10.7433 10.7433 10.8337 10.8337 11.1391 11.1391 11.4580 11.4580 11.7249 11.7249 12.0109 12.0109 12.3150 12.3150 12.3729 12.3729 13.3124 13.3124 13.5285 13.5285 14.7699 14.7699 15.1715 15.1715 16.8283 16.8283 17.6917 17.6917 k = 0.0900 0.0520-0.0000 ( 4925 PWs) bands (ev): -78.6244 -78.6244 -78.6160 -78.6160 -44.3384 -44.3384 -44.3084 -44.3084 -42.6581 -42.6581 -42.5906 -42.5906 -42.5608 -42.5608 -42.5499 -42.5499 -2.6617 -2.6617 -0.3996 -0.3996 5.8587 5.8587 8.3663 8.3663 8.5218 8.5218 10.1123 10.1123 10.6910 10.6910 10.7819 10.7819 11.0861 11.0861 11.4640 11.4640 11.7370 11.7370 12.0347 12.0347 12.3123 12.3123 12.3716 12.3716 13.3694 13.3694 13.5234 13.5234 14.6877 14.6877 15.1559 15.1559 16.9366 16.9366 17.8080 17.8080 k = 0.1000 0.0577-0.0000 ( 4921 PWs) bands (ev): -78.6244 -78.6244 -78.6158 -78.6158 -44.3384 -44.3384 -44.3084 -44.3084 -42.6580 -42.6580 -42.5906 -42.5906 -42.5609 -42.5609 -42.5499 -42.5499 -2.6415 -2.6415 -0.3970 -0.3970 5.8853 5.8853 8.3522 8.3522 8.5213 8.5213 10.0377 10.0377 10.6458 10.6458 10.7294 10.7294 11.0299 11.0299 11.4711 11.4711 11.7466 11.7466 12.0596 12.0596 12.3087 12.3087 12.3700 12.3700 13.4270 13.4270 13.5191 13.5191 14.6055 14.6055 15.1399 15.1399 17.0427 17.0427 17.9335 17.9335 k = 0.1100 0.0635-0.0000 ( 4929 PWs) bands (ev): -78.6246 -78.6246 -78.6159 -78.6159 -44.3385 -44.3385 -44.3085 -44.3085 -42.6581 -42.6581 -42.5906 -42.5906 -42.5610 -42.5610 -42.5500 -42.5500 -2.6192 -2.6192 -0.3942 -0.3942 5.9146 5.9146 8.3354 8.3354 8.5213 8.5213 9.9491 9.9491 10.6064 10.6064 10.6772 10.6772 10.9705 10.9705 11.4793 11.4793 11.7539 11.7539 12.0844 12.0844 12.3046 12.3046 12.3684 12.3684 13.4759 13.4759 13.5232 13.5232 14.5231 14.5231 15.1234 15.1234 17.1451 17.1451 18.0662 18.0662 k = 0.1200 0.0693-0.0000 ( 4923 PWs) bands (ev): -78.6245 -78.6245 -78.6157 -78.6157 -44.3384 -44.3384 -44.3085 -44.3085 -42.6580 -42.6580 -42.5906 -42.5906 -42.5610 -42.5610 -42.5500 -42.5500 -2.5950 -2.5950 -0.3912 -0.3912 5.9466 5.9466 8.3162 8.3162 8.5223 8.5223 9.8491 9.8491 10.5702 10.5702 10.6292 10.6292 10.9092 10.9092 11.4898 11.4898 11.7603 11.7603 12.1088 12.1088 12.3007 12.3007 12.3673 12.3673 13.4867 13.4867 13.5658 13.5658 14.4415 14.4415 15.1088 15.1088 17.2425 17.2425 18.2038 18.2038 k = 0.1300 0.0751-0.0000 ( 4911 PWs) bands (ev): -78.6243 -78.6243 -78.6154 -78.6154 -44.3383 -44.3383 -44.3084 -44.3084 -42.6580 -42.6580 -42.5906 -42.5906 -42.5610 -42.5610 -42.5500 -42.5500 -2.5688 -2.5688 -0.3882 -0.3882 5.9813 5.9813 8.2945 8.2945 8.5240 8.5240 9.7396 9.7396 10.5302 10.5302 10.5904 10.5904 10.8477 10.8477 11.5014 11.5014 11.7658 11.7658 12.1318 12.1318 12.2975 12.2975 12.3665 12.3665 13.4807 13.4807 13.6252 13.6252 14.3605 14.3605 15.0953 15.0953 17.3334 17.3334 18.3435 18.3435 k = 0.1400 0.0808-0.0000 ( 4915 PWs) bands (ev): -78.6243 -78.6243 -78.6156 -78.6156 -44.3384 -44.3384 -44.3085 -44.3085 -42.6580 -42.6580 -42.5906 -42.5906 -42.5611 -42.5611 -42.5500 -42.5500 -2.5406 -2.5406 -0.3851 -0.3851 6.0185 6.0185 8.2697 8.2697 8.5263 8.5263 9.6231 9.6231 10.4825 10.4825 10.5631 10.5631 10.7847 10.7847 11.5125 11.5125 11.7701 11.7701 12.1527 12.1527 12.2934 12.2934 12.3657 12.3657 13.4692 13.4692 13.6867 13.6867 14.2792 14.2792 15.0831 15.0831 17.4166 17.4166 18.4822 18.4822 k = 0.1500 0.0866-0.0000 ( 4919 PWs) bands (ev): -78.6245 -78.6245 -78.6156 -78.6156 -44.3384 -44.3384 -44.3086 -44.3086 -42.6580 -42.6580 -42.5907 -42.5907 -42.5611 -42.5611 -42.5501 -42.5501 -2.5106 -2.5106 -0.3820 -0.3820 6.0584 6.0584 8.2420 8.2420 8.5292 8.5292 9.5020 9.5020 10.4303 10.4303 10.5430 10.5430 10.7212 10.7212 11.5244 11.5244 11.7741 11.7741 12.1712 12.1712 12.2892 12.2892 12.3649 12.3649 13.4569 13.4569 13.7482 13.7482 14.1990 14.1990 15.0727 15.0727 17.4910 17.4910 18.6161 18.6161 k = 0.1600 0.0924-0.0000 ( 4921 PWs) bands (ev): -78.6248 -78.6248 -78.6154 -78.6154 -44.3384 -44.3384 -44.3087 -44.3087 -42.6580 -42.6580 -42.5908 -42.5908 -42.5613 -42.5613 -42.5501 -42.5501 -2.4787 -2.4787 -0.3788 -0.3788 6.1008 6.1008 8.2109 8.2109 8.5324 8.5324 9.3786 9.3786 10.3764 10.3764 10.5277 10.5277 10.6578 10.6578 11.5371 11.5371 11.7785 11.7785 12.1865 12.1865 12.2846 12.2846 12.3642 12.3642 13.4432 13.4432 13.8085 13.8085 14.1200 14.1200 15.0636 15.0636 17.5558 17.5558 18.7425 18.7425 k = 0.1700 0.0981-0.0000 ( 4929 PWs) bands (ev): -78.6249 -78.6249 -78.6155 -78.6155 -44.3385 -44.3385 -44.3088 -44.3088 -42.6581 -42.6581 -42.5908 -42.5908 -42.5614 -42.5614 -42.5502 -42.5502 -2.4450 -2.4450 -0.3758 -0.3758 6.1458 6.1458 8.1761 8.1761 8.5361 8.5361 9.2546 9.2546 10.3219 10.3219 10.5144 10.5144 10.5945 10.5945 11.5498 11.5498 11.7826 11.7826 12.1988 12.1988 12.2800 12.2800 12.3634 12.3634 13.4277 13.4277 13.8656 13.8656 14.0435 14.0435 15.0566 15.0566 17.6103 17.6103 18.8579 18.8579 k = 0.1800 0.1039-0.0000 ( 4933 PWs) bands (ev): -78.6251 -78.6251 -78.6155 -78.6155 -44.3385 -44.3385 -44.3089 -44.3089 -42.6581 -42.6581 -42.5909 -42.5909 -42.5615 -42.5615 -42.5503 -42.5503 -2.4096 -2.4096 -0.3729 -0.3729 6.1932 6.1932 8.1367 8.1367 8.5403 8.5403 9.1319 9.1319 10.2678 10.2678 10.4991 10.4991 10.5351 10.5351 11.5637 11.5637 11.7864 11.7864 12.2083 12.2083 12.2759 12.2759 12.3631 12.3631 13.4108 13.4108 13.9095 13.9095 13.9789 13.9789 15.0525 15.0525 17.6544 17.6544 18.9602 18.9602 k = 0.1900 0.1097-0.0000 ( 4937 PWs) bands (ev): -78.6249 -78.6249 -78.6159 -78.6159 -44.3386 -44.3386 -44.3088 -44.3088 -42.6581 -42.6581 -42.5909 -42.5909 -42.5616 -42.5616 -42.5505 -42.5505 -2.3724 -2.3724 -0.3702 -0.3702 6.2431 6.2431 8.0923 8.0923 8.5449 8.5449 9.0125 9.0125 10.2140 10.2140 10.4578 10.4578 10.5026 10.5026 11.5772 11.5772 11.7909 11.7909 12.2149 12.2149 12.2722 12.2722 12.3628 12.3628 13.3917 13.3917 13.8738 13.8738 13.9938 13.9938 15.0510 15.0510 17.6884 17.6884 19.0482 19.0482 k = 0.2000 0.1155-0.0000 ( 4937 PWs) bands (ev): -78.6245 -78.6245 -78.6162 -78.6162 -44.3388 -44.3388 -44.3088 -44.3088 -42.6583 -42.6583 -42.5908 -42.5908 -42.5615 -42.5615 -42.5506 -42.5506 -2.3336 -2.3336 -0.3677 -0.3677 6.2952 6.2952 8.0418 8.0418 8.5498 8.5498 8.8981 8.8981 10.1609 10.1609 10.3974 10.3974 10.4908 10.4908 11.5921 11.5921 11.7956 11.7956 12.2187 12.2187 12.2687 12.2687 12.3631 12.3631 13.3700 13.3700 13.8037 13.8037 14.0424 14.0424 15.0518 15.0518 17.7131 17.7131 19.1208 19.1208 k = 0.2100 0.1212-0.0000 ( 4937 PWs) bands (ev): -78.6245 -78.6245 -78.6162 -78.6162 -44.3388 -44.3388 -44.3088 -44.3088 -42.6583 -42.6583 -42.5909 -42.5909 -42.5616 -42.5616 -42.5506 -42.5506 -2.2932 -2.2932 -0.3655 -0.3655 6.3497 6.3497 7.9837 7.9837 8.5545 8.5545 8.7911 8.7911 10.1085 10.1085 10.3353 10.3353 10.4818 10.4818 11.6075 11.6075 11.8005 11.8005 12.2194 12.2194 12.2648 12.2648 12.3630 12.3630 13.3481 13.3481 13.7316 13.7316 14.0915 14.0915 15.0546 15.0546 17.7295 17.7295 19.1770 19.1770 k = 0.2200 0.1270-0.0000 ( 4937 PWs) bands (ev): -78.6247 -78.6247 -78.6160 -78.6160 -44.3388 -44.3388 -44.3089 -44.3089 -42.6582 -42.6582 -42.5909 -42.5909 -42.5617 -42.5617 -42.5507 -42.5507 -2.2513 -2.2513 -0.3637 -0.3637 6.4066 6.4066 7.9172 7.9172 8.5583 8.5583 8.6941 8.6941 10.0570 10.0570 10.2734 10.2734 10.4736 10.4736 11.6233 11.6233 11.8058 11.8058 12.2174 12.2174 12.2599 12.2599 12.3627 12.3627 13.3245 13.3245 13.6605 13.6605 14.1382 14.1382 15.0596 15.0596 17.7388 17.7388 19.2156 19.2156 k = 0.2300 0.1328-0.0000 ( 4931 PWs) bands (ev): -78.6246 -78.6246 -78.6158 -78.6158 -44.3388 -44.3388 -44.3089 -44.3089 -42.6582 -42.6582 -42.5909 -42.5909 -42.5618 -42.5618 -42.5507 -42.5507 -2.2080 -2.2080 -0.3623 -0.3623 6.4655 6.4655 7.8418 7.8418 8.5561 8.5561 8.6134 8.6134 10.0064 10.0064 10.2120 10.2120 10.4659 10.4659 11.6400 11.6400 11.8112 11.8112 12.2137 12.2137 12.2553 12.2553 12.3630 12.3630 13.2987 13.2987 13.5913 13.5913 14.1820 14.1820 15.0670 15.0670 17.7423 17.7423 19.2357 19.2357 k = 0.2400 0.1386-0.0000 ( 4933 PWs) bands (ev): -78.6247 -78.6247 -78.6158 -78.6158 -44.3388 -44.3388 -44.3090 -44.3090 -42.6582 -42.6582 -42.5910 -42.5910 -42.5619 -42.5619 -42.5508 -42.5508 -2.1633 -2.1633 -0.3614 -0.3614 6.5266 6.5266 7.7574 7.7574 8.5126 8.5126 8.5843 8.5843 9.9567 9.9567 10.1515 10.1515 10.4577 10.4577 11.6561 11.6561 11.8163 11.8163 12.2080 12.2080 12.2504 12.2504 12.3627 12.3627 13.2709 13.2709 13.5236 13.5236 14.2225 14.2225 15.0760 15.0760 17.7411 17.7411 19.2371 19.2371 k = 0.2500 0.1443-0.0000 ( 4933 PWs) bands (ev): -78.6247 -78.6247 -78.6158 -78.6158 -44.3388 -44.3388 -44.3090 -44.3090 -42.6582 -42.6582 -42.5910 -42.5910 -42.5620 -42.5620 -42.5508 -42.5508 -2.1173 -2.1173 -0.3610 -0.3610 6.5896 6.5896 7.6650 7.6650 8.4486 8.4486 8.5859 8.5859 9.9078 9.9078 10.0919 10.0919 10.4497 10.4497 11.6724 11.6724 11.8214 11.8214 12.2006 12.2006 12.2448 12.2448 12.3627 12.3627 13.2409 13.2409 13.4591 13.4591 14.2593 14.2593 15.0865 15.0865 17.7363 17.7363 19.2210 19.2210 k = 0.2600 0.1501-0.0000 ( 4917 PWs) bands (ev): -78.6245 -78.6245 -78.6152 -78.6152 -44.3387 -44.3387 -44.3090 -44.3090 -42.6581 -42.6581 -42.5910 -42.5910 -42.5621 -42.5621 -42.5508 -42.5508 -2.0701 -2.0701 -0.3613 -0.3613 6.6545 6.6545 7.5660 7.5660 8.3905 8.3905 8.5913 8.5913 9.8600 9.8600 10.0340 10.0340 10.4419 10.4419 11.6894 11.6894 11.8266 11.8266 12.1920 12.1920 12.2397 12.2397 12.3633 12.3633 13.2110 13.2110 13.3973 13.3973 14.2937 14.2937 15.0992 15.0992 17.7289 17.7289 19.1899 19.1899 k = 0.2700 0.1559-0.0000 ( 4919 PWs) bands (ev): -78.6245 -78.6245 -78.6153 -78.6153 -44.3387 -44.3387 -44.3091 -44.3091 -42.6582 -42.6582 -42.5910 -42.5910 -42.5622 -42.5622 -42.5509 -42.5509 -2.0218 -2.0218 -0.3623 -0.3623 6.7210 6.7210 7.4624 7.4624 8.3393 8.3393 8.5975 8.5975 9.8129 9.8129 9.9766 9.9766 10.4336 10.4336 11.7049 11.7049 11.8313 11.8313 12.1816 12.1816 12.2335 12.2335 12.3634 12.3634 13.1761 13.1761 13.3385 13.3385 14.3234 14.3234 15.1126 15.1126 17.7197 17.7197 19.1462 19.1462 k = 0.2800 0.1617-0.0000 ( 4925 PWs) bands (ev): -78.6242 -78.6242 -78.6158 -78.6158 -44.3389 -44.3389 -44.3090 -44.3090 -42.6582 -42.6582 -42.5910 -42.5910 -42.5622 -42.5622 -42.5511 -42.5511 -1.9726 -1.9726 -0.3642 -0.3642 6.7888 6.7888 7.3562 7.3562 8.2943 8.2943 8.6042 8.6042 9.7663 9.7663 9.9198 9.9198 10.4253 10.4253 11.7203 11.7203 11.8357 11.8357 12.1704 12.1704 12.2270 12.2270 12.3637 12.3637 13.1377 13.1377 13.2829 13.2829 14.3479 14.3479 15.1275 15.1275 17.7092 17.7092 19.0928 19.0928 k = 0.2900 0.1674-0.0000 ( 4931 PWs) bands (ev): -78.6245 -78.6245 -78.6158 -78.6158 -44.3389 -44.3389 -44.3092 -44.3092 -42.6583 -42.6583 -42.5910 -42.5910 -42.5623 -42.5623 -42.5512 -42.5512 -1.9224 -1.9224 -0.3669 -0.3669 6.8572 6.8572 7.2494 7.2494 8.2546 8.2546 8.6109 8.6109 9.7202 9.7202 9.8651 9.8651 10.4166 10.4166 11.7363 11.7363 11.8389 11.8389 12.1569 12.1569 12.2201 12.2201 12.3641 12.3641 13.0987 13.0987 13.2301 13.2301 14.3701 14.3701 15.1427 15.1427 17.6981 17.6981 19.0325 19.0325 k = 0.3000 0.1732-0.0000 ( 4927 PWs) bands (ev): -78.6243 -78.6243 -78.6158 -78.6158 -44.3390 -44.3390 -44.3091 -44.3091 -42.6583 -42.6583 -42.5910 -42.5910 -42.5623 -42.5623 -42.5512 -42.5512 -1.8715 -1.8715 -0.3705 -0.3705 6.9233 6.9233 7.1462 7.1462 8.2191 8.2191 8.6178 8.6178 9.6745 9.6745 9.8123 9.8123 10.4078 10.4078 11.7521 11.7521 11.8421 11.8421 12.1432 12.1432 12.2139 12.2139 12.3654 12.3654 13.0578 13.0578 13.1815 13.1815 14.3889 14.3889 15.1589 15.1589 17.6868 17.6868 18.9676 18.9676 k = 0.3100 0.1790-0.0000 ( 4943 PWs) bands (ev): -78.6247 -78.6247 -78.6162 -78.6162 -44.3391 -44.3391 -44.3093 -44.3093 -42.6584 -42.6584 -42.5911 -42.5911 -42.5625 -42.5625 -42.5514 -42.5514 -1.8199 -1.8199 -0.3752 -0.3752 6.9636 6.9636 7.0712 7.0712 8.1871 8.1871 8.6245 8.6245 9.6285 9.6285 9.7614 9.7614 10.3981 10.3981 11.7665 11.7665 11.8442 11.8442 12.1272 12.1272 12.2069 12.2069 12.3654 12.3654 13.0141 13.0141 13.1357 13.1357 14.4043 14.4043 15.1745 15.1745 17.6755 17.6755 18.8993 18.8993 k = 0.3200 0.1848-0.0000 ( 4951 PWs) bands (ev): -78.6248 -78.6248 -78.6163 -78.6163 -44.3392 -44.3392 -44.3094 -44.3094 -42.6584 -42.6584 -42.5912 -42.5912 -42.5626 -42.5626 -42.5515 -42.5515 -1.7679 -1.7679 -0.3809 -0.3809 6.9021 6.9021 7.1011 7.1011 8.1583 8.1583 8.6314 8.6314 9.5821 9.5821 9.7131 9.7131 10.3886 10.3886 11.7808 11.7808 11.8457 11.8457 12.1112 12.1112 12.2001 12.2001 12.3657 12.3657 12.9703 12.9703 13.0935 13.0935 14.4166 14.4166 15.1908 15.1908 17.6648 17.6648 18.8293 18.8293 k = 0.3300 0.1905-0.0000 ( 4951 PWs) bands (ev): -78.6250 -78.6250 -78.6161 -78.6161 -44.3391 -44.3391 -44.3095 -44.3095 -42.6584 -42.6584 -42.5913 -42.5913 -42.5628 -42.5628 -42.5515 -42.5515 -1.7154 -1.7154 -0.3879 -0.3879 6.8056 6.8056 7.1699 7.1699 8.1321 8.1321 8.6384 8.6384 9.5349 9.5349 9.6678 9.6678 10.3791 10.3791 11.7952 11.7952 11.8464 11.8464 12.0951 12.0951 12.1935 12.1935 12.3669 12.3669 12.9258 12.9258 13.0551 13.0551 14.4266 14.4266 15.2077 15.2077 17.6548 17.6548 18.7588 18.7588 k = 0.3400 0.1963-0.0000 ( 4951 PWs) bands (ev): -78.6250 -78.6250 -78.6161 -78.6161 -44.3392 -44.3392 -44.3095 -44.3095 -42.6584 -42.6584 -42.5913 -42.5913 -42.5628 -42.5628 -42.5516 -42.5516 -1.6627 -1.6627 -0.3960 -0.3960 6.7075 6.7075 7.2445 7.2445 8.1082 8.1082 8.6453 8.6453 9.4866 9.4866 9.6254 9.6254 10.3693 10.3693 11.8089 11.8089 11.8462 11.8462 12.0791 12.0791 12.1873 12.1873 12.3683 12.3683 12.8809 12.8809 13.0198 13.0198 14.4340 14.4340 15.2244 15.2244 17.6458 17.6458 18.6883 18.6883 k = 0.3500 0.2021-0.0000 ( 4947 PWs) bands (ev): -78.6250 -78.6250 -78.6159 -78.6159 -44.3391 -44.3391 -44.3096 -44.3096 -42.6584 -42.6584 -42.5913 -42.5913 -42.5629 -42.5629 -42.5516 -42.5516 -1.6100 -1.6100 -0.4055 -0.4055 6.6118 6.6118 7.3213 7.3213 8.0866 8.0866 8.6522 8.6522 9.4370 9.4370 9.5862 9.5862 10.3594 10.3594 11.8221 11.8221 11.8453 11.8453 12.0636 12.0636 12.1808 12.1808 12.3700 12.3700 12.8366 12.8366 12.9879 12.9879 14.4394 14.4394 15.2411 15.2411 17.6377 17.6377 18.6186 18.6186 k = 0.3600 0.2078-0.0000 ( 4955 PWs) bands (ev): -78.6252 -78.6252 -78.6161 -78.6161 -44.3392 -44.3392 -44.3097 -44.3097 -42.6584 -42.6584 -42.5914 -42.5914 -42.5630 -42.5630 -42.5517 -42.5517 -1.5573 -1.5573 -0.4163 -0.4163 6.5197 6.5197 7.3992 7.3992 8.0669 8.0669 8.6589 8.6589 9.3860 9.3860 9.5501 9.5501 10.3495 10.3495 11.8322 11.8322 11.8443 11.8443 12.0477 12.0477 12.1736 12.1736 12.3710 12.3710 12.7915 12.7915 12.9591 12.9591 14.4428 14.4428 15.2571 15.2571 17.6308 17.6308 18.5504 18.5504 k = 0.3700 0.2136-0.0000 ( 4945 PWs) bands (ev): -78.6250 -78.6250 -78.6158 -78.6158 -44.3391 -44.3391 -44.3096 -44.3096 -42.6584 -42.6584 -42.5913 -42.5913 -42.5630 -42.5630 -42.5517 -42.5517 -1.5050 -1.5050 -0.4284 -0.4284 6.4322 6.4322 7.4778 7.4778 8.0493 8.0493 8.6655 8.6655 9.3336 9.3336 9.5169 9.5169 10.3399 10.3399 11.8371 11.8371 11.8495 11.8495 12.0339 12.0339 12.1669 12.1669 12.3732 12.3732 12.7481 12.7481 12.9340 12.9340 14.4451 14.4451 15.2730 15.2730 17.6253 17.6253 18.4842 18.4842 k = 0.3800 0.2194-0.0000 ( 4943 PWs) bands (ev): -78.6251 -78.6251 -78.6156 -78.6156 -44.3391 -44.3391 -44.3097 -44.3097 -42.6583 -42.6583 -42.5914 -42.5914 -42.5631 -42.5631 -42.5517 -42.5517 -1.4531 -1.4531 -0.4420 -0.4420 6.3494 6.3494 7.5566 7.5566 8.0338 8.0338 8.6719 8.6719 9.2802 9.2802 9.4866 9.4866 10.3302 10.3302 11.8344 11.8344 11.8590 11.8590 12.0195 12.0195 12.1596 12.1596 12.3750 12.3750 12.7062 12.7062 12.9121 12.9121 14.4460 14.4460 15.2879 15.2879 17.6211 17.6211 18.4204 18.4204 k = 0.3900 0.2252-0.0000 ( 4941 PWs) bands (ev): -78.6251 -78.6251 -78.6155 -78.6155 -44.3391 -44.3391 -44.3097 -44.3097 -42.6583 -42.6583 -42.5914 -42.5914 -42.5632 -42.5632 -42.5517 -42.5517 -1.4020 -1.4020 -0.4569 -0.4569 6.2720 6.2720 7.6350 7.6350 8.0205 8.0205 8.6779 8.6779 9.2254 9.2254 9.4589 9.4589 10.3209 10.3209 11.8304 11.8304 11.8684 11.8684 12.0066 12.0066 12.1519 12.1519 12.3768 12.3768 12.6656 12.6656 12.8932 12.8932 14.4460 14.4460 15.3021 15.3021 17.6184 17.6184 18.3594 18.3594 k = 0.4000 0.2309-0.0000 ( 4933 PWs) bands (ev): -78.6251 -78.6251 -78.6151 -78.6151 -44.3390 -44.3390 -44.3098 -44.3098 -42.6582 -42.6582 -42.5914 -42.5914 -42.5632 -42.5632 -42.5517 -42.5517 -1.3519 -1.3519 -0.4732 -0.4732 6.2002 6.2002 7.7121 7.7121 8.0102 8.0102 8.6841 8.6841 9.1695 9.1695 9.4338 9.4338 10.3117 10.3117 11.8256 11.8256 11.8773 11.8773 11.9956 11.9956 12.1437 12.1437 12.3787 12.3787 12.6280 12.6280 12.8774 12.8774 14.4451 14.4451 15.3166 15.3166 17.6170 17.6170 18.3015 18.3015 k = 0.4100 0.2367-0.0000 ( 4937 PWs) bands (ev): -78.6251 -78.6251 -78.6153 -78.6153 -44.3391 -44.3391 -44.3098 -44.3098 -42.6583 -42.6583 -42.5915 -42.5915 -42.5633 -42.5633 -42.5518 -42.5518 -1.3030 -1.3030 -0.4907 -0.4907 6.1343 6.1343 7.7862 7.7862 8.0044 8.0044 8.6893 8.6893 9.1123 9.1123 9.4110 9.4110 10.3031 10.3031 11.8204 11.8204 11.8841 11.8841 11.9849 11.9849 12.1352 12.1352 12.3801 12.3801 12.5924 12.5924 12.8634 12.8634 14.4435 14.4435 15.3287 15.3287 17.6170 17.6170 18.2468 18.2468 k = 0.4200 0.2425-0.0000 ( 4937 PWs) bands (ev): -78.6251 -78.6251 -78.6153 -78.6153 -44.3391 -44.3391 -44.3098 -44.3098 -42.6583 -42.6583 -42.5915 -42.5915 -42.5633 -42.5633 -42.5518 -42.5518 -1.2558 -1.2558 -0.5093 -0.5093 6.0746 6.0746 7.8522 7.8522 8.0077 8.0077 8.6941 8.6941 9.0541 9.0541 9.3907 9.3907 10.2950 10.2950 11.8152 11.8152 11.8905 11.8905 11.9758 11.9758 12.1264 12.1264 12.3816 12.3816 12.5602 12.5602 12.8519 12.8519 14.4418 14.4418 15.3400 15.3400 17.6185 17.6185 18.1960 18.1960 k = 0.4300 0.2483-0.0000 ( 4929 PWs) bands (ev): -78.6251 -78.6251 -78.6149 -78.6149 -44.3390 -44.3390 -44.3098 -44.3098 -42.6582 -42.6582 -42.5915 -42.5915 -42.5633 -42.5633 -42.5517 -42.5517 -1.2106 -1.2106 -0.5287 -0.5287 6.0214 6.0214 7.8987 7.8987 8.0314 8.0314 8.6984 8.6984 8.9949 8.9949 9.3727 9.3727 10.2877 10.2877 11.8102 11.8102 11.8966 11.8966 11.9684 11.9684 12.1176 12.1176 12.3835 12.3835 12.5321 12.5321 12.8431 12.8431 14.4400 14.4400 15.3507 15.3507 17.6213 17.6213 18.1493 18.1493 k = 0.4400 0.2540-0.0000 ( 4941 PWs) bands (ev): -78.6256 -78.6256 -78.6150 -78.6150 -44.3390 -44.3390 -44.3100 -44.3100 -42.6582 -42.6582 -42.5916 -42.5916 -42.5635 -42.5635 -42.5517 -42.5517 -1.1679 -1.1679 -0.5487 -0.5487 5.9747 5.9747 7.9185 7.9185 8.0823 8.0823 8.7014 8.7014 8.9349 8.9349 9.3571 9.3571 10.2807 10.2807 11.8040 11.8040 11.8997 11.8997 11.9614 11.9614 12.1079 12.1079 12.3844 12.3844 12.5083 12.5083 12.8345 12.8345 14.4381 14.4381 15.3591 15.3591 17.6250 17.6250 18.1063 18.1063 k = 0.4500 0.2598-0.0000 ( 4943 PWs) bands (ev): -78.6256 -78.6256 -78.6151 -78.6151 -44.3390 -44.3390 -44.3100 -44.3100 -42.6583 -42.6583 -42.5916 -42.5916 -42.5635 -42.5635 -42.5518 -42.5518 -1.1285 -1.1285 -0.5687 -0.5687 5.9349 5.9349 7.9233 7.9233 8.1485 8.1485 8.7030 8.7030 8.8746 8.8746 9.3438 9.3438 10.2743 10.2743 11.7996 11.7996 11.9017 11.9017 11.9569 11.9569 12.1004 12.1004 12.3850 12.3850 12.4880 12.4880 12.8279 12.8279 14.4363 14.4363 15.3667 15.3667 17.6297 17.6297 18.0686 18.0686 k = 0.4600 0.2656-0.0000 ( 4940 PWs) bands (ev): -78.6254 -78.6254 -78.6150 -78.6150 -44.3390 -44.3390 -44.3100 -44.3100 -42.6582 -42.6582 -42.5915 -42.5915 -42.5635 -42.5635 -42.5518 -42.5518 -1.0933 -1.0933 -0.5878 -0.5878 5.9023 5.9023 7.9231 7.9231 8.2197 8.2197 8.7014 8.7014 8.8159 8.8159 9.3330 9.3330 10.2695 10.2695 11.7965 11.7965 11.9026 11.9026 11.9544 11.9544 12.0929 12.0929 12.3853 12.3853 12.4714 12.4714 12.8238 12.8238 14.4348 14.4348 15.3733 15.3733 17.6349 17.6349 18.0366 18.0366 k = 0.4700 0.2714-0.0000 ( 4936 PWs) bands (ev): -78.6253 -78.6253 -78.6150 -78.6150 -44.3391 -44.3391 -44.3099 -44.3099 -42.6582 -42.6582 -42.5915 -42.5915 -42.5635 -42.5635 -42.5518 -42.5518 -1.0633 -1.0633 -0.6051 -0.6051 5.8767 5.8767 7.9216 7.9216 8.2915 8.2915 8.6893 8.6893 8.7662 8.7662 9.3245 9.3245 10.2657 10.2657 11.7934 11.7934 11.9027 11.9027 11.9530 11.9530 12.0876 12.0876 12.3853 12.3853 12.4595 12.4595 12.8205 12.8205 14.4337 14.4337 15.3782 15.3782 17.6400 17.6400 18.0108 18.0108 k = 0.4800 0.2771-0.0000 ( 4938 PWs) bands (ev): -78.6251 -78.6251 -78.6153 -78.6153 -44.3391 -44.3391 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5635 -42.5635 -42.5519 -42.5519 -1.0401 -1.0401 -0.6192 -0.6192 5.8583 5.8583 7.9201 7.9201 8.3614 8.3614 8.6525 8.6525 8.7408 8.7408 9.3184 9.3184 10.2629 10.2629 11.7915 11.7915 11.9023 11.9023 11.9521 11.9521 12.0833 12.0833 12.3847 12.3847 12.4505 12.4505 12.8178 12.8178 14.4329 14.4329 15.3817 15.3817 17.6443 17.6443 17.9914 17.9914 k = 0.4900 0.2829-0.0000 ( 4938 PWs) bands (ev): -78.6251 -78.6251 -78.6153 -78.6153 -44.3391 -44.3391 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5635 -42.5635 -42.5519 -42.5519 -1.0252 -1.0252 -0.6286 -0.6286 5.8473 5.8473 7.9190 7.9190 8.4250 8.4250 8.6008 8.6008 8.7337 8.7337 9.3147 9.3147 10.2612 10.2612 11.7901 11.7901 11.9020 11.9020 11.9518 11.9518 12.0802 12.0802 12.3844 12.3844 12.4457 12.4457 12.8164 12.8164 14.4324 14.4324 15.3838 15.3838 17.6472 17.6472 17.9794 17.9794 k = 0.5000 0.2887-0.0000 ( 4954 PWs) bands (ev): -78.6251 -78.6251 -78.6160 -78.6160 -44.3393 -44.3393 -44.3099 -44.3099 -42.6584 -42.6584 -42.5915 -42.5915 -42.5635 -42.5635 -42.5521 -42.5521 -1.0201 -1.0201 -0.6319 -0.6319 5.8435 5.8435 7.9187 7.9187 8.4598 8.4598 8.5689 8.5689 8.7319 8.7319 9.3135 9.3135 10.2605 10.2605 11.7895 11.7895 11.9009 11.9009 11.9507 11.9507 12.0790 12.0790 12.3834 12.3834 12.4431 12.4431 12.8150 12.8150 14.4310 14.4310 15.3835 15.3835 17.6482 17.6482 17.9750 17.9750 k = 0.5000 0.2887-0.0000 ( 4954 PWs) bands (ev): -78.6251 -78.6251 -78.6160 -78.6160 -44.3393 -44.3393 -44.3099 -44.3099 -42.6584 -42.6584 -42.5915 -42.5915 -42.5635 -42.5635 -42.5521 -42.5521 -1.0201 -1.0201 -0.6319 -0.6319 5.8435 5.8435 7.9187 7.9187 8.4598 8.4598 8.5689 8.5689 8.7319 8.7319 9.3135 9.3135 10.2605 10.2605 11.7895 11.7895 11.9009 11.9009 11.9507 11.9507 12.0790 12.0790 12.3834 12.3834 12.4431 12.4431 12.8150 12.8150 14.4310 14.4310 15.3835 15.3835 17.6482 17.6482 17.9750 17.9750 k = 0.4943 0.2986-0.0000 ( 4942 PWs) bands (ev): -78.6251 -78.6251 -78.6155 -78.6155 -44.3392 -44.3392 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5635 -42.5635 -42.5520 -42.5520 -1.0196 -1.0196 -0.6316 -0.6316 5.8443 5.8443 7.9169 7.9169 8.4597 8.4597 8.5700 8.5700 8.7342 8.7342 9.3007 9.3007 10.2700 10.2700 11.7900 11.7900 11.9022 11.9022 11.9521 11.9521 12.0793 12.0793 12.3839 12.3839 12.4433 12.4433 12.8172 12.8172 14.4299 14.4299 15.3717 15.3717 17.6649 17.6649 17.9801 17.9801 k = 0.4885 0.3086-0.0000 ( 4938 PWs) bands (ev): -78.6251 -78.6251 -78.6153 -78.6153 -44.3391 -44.3391 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5635 -42.5635 -42.5519 -42.5519 -1.0182 -1.0182 -0.6309 -0.6309 5.8464 5.8464 7.9117 7.9117 8.4596 8.4596 8.5727 8.5727 8.7398 8.7398 9.2639 9.2639 10.2966 10.2966 11.7914 11.7914 11.9042 11.9042 11.9542 11.9542 12.0800 12.0800 12.3839 12.3839 12.4434 12.4434 12.8215 12.8215 14.4232 14.4232 15.3343 15.3343 17.7137 17.7137 17.9947 17.9947 k = 0.4828 0.3185-0.0000 ( 4942 PWs) bands (ev): -78.6249 -78.6249 -78.6157 -78.6157 -44.3393 -44.3393 -44.3098 -44.3098 -42.6584 -42.6584 -42.5915 -42.5915 -42.5634 -42.5634 -42.5520 -42.5520 -1.0157 -1.0157 -0.6298 -0.6298 5.8500 5.8500 7.9031 7.9031 8.4593 8.4593 8.5770 8.5770 8.7486 8.7486 9.2073 9.2073 10.3370 10.3370 11.7936 11.7936 11.9072 11.9072 11.9577 11.9577 12.0809 12.0809 12.3832 12.3832 12.4411 12.4411 12.8286 12.8286 14.4118 14.4118 15.2740 15.2740 17.7914 17.7914 18.0194 18.0194 k = 0.4770 0.3285-0.0000 ( 4944 PWs) bands (ev): -78.6250 -78.6250 -78.6157 -78.6157 -44.3393 -44.3393 -44.3099 -44.3099 -42.6584 -42.6584 -42.5915 -42.5915 -42.5635 -42.5635 -42.5520 -42.5520 -1.0123 -1.0123 -0.6282 -0.6282 5.8550 5.8550 7.8916 7.8916 8.4591 8.4591 8.5829 8.5829 8.7610 8.7610 9.1357 9.1357 10.3855 10.3855 11.7961 11.7961 11.9106 11.9106 11.9625 11.9625 12.0824 12.0824 12.3821 12.3821 12.4396 12.4396 12.8382 12.8382 14.3961 14.3961 15.1979 15.1979 17.8936 17.8936 18.0534 18.0534 k = 0.4713 0.3384-0.0000 ( 4940 PWs) bands (ev): -78.6250 -78.6250 -78.6155 -78.6155 -44.3392 -44.3392 -44.3099 -44.3099 -42.6584 -42.6584 -42.5915 -42.5915 -42.5635 -42.5635 -42.5520 -42.5520 -1.0079 -1.0079 -0.6263 -0.6263 5.8613 5.8613 7.8773 7.8773 8.4589 8.4589 8.5902 8.5902 8.7763 8.7763 9.0538 9.0538 10.4389 10.4389 11.7994 11.7994 11.9145 11.9145 11.9696 11.9696 12.0844 12.0844 12.3813 12.3813 12.4379 12.4379 12.8514 12.8514 14.3760 14.3760 15.1089 15.1089 18.0144 18.0144 18.0976 18.0976 k = 0.4655 0.3484-0.0000 ( 4940 PWs) bands (ev): -78.6248 -78.6248 -78.6157 -78.6157 -44.3393 -44.3393 -44.3098 -44.3098 -42.6584 -42.6584 -42.5914 -42.5914 -42.5634 -42.5634 -42.5520 -42.5520 -1.0026 -1.0026 -0.6239 -0.6239 5.8688 5.8688 7.8608 7.8608 8.4584 8.4584 8.5986 8.5986 8.7932 8.7932 8.9655 8.9655 10.4939 10.4939 11.8031 11.8031 11.9186 11.9186 11.9788 11.9788 12.0869 12.0869 12.3808 12.3808 12.4357 12.4357 12.8659 12.8659 14.3511 14.3511 15.0102 15.0102 18.1186 18.1186 18.1535 18.1535 k = 0.4598 0.3584-0.0000 ( 4932 PWs) bands (ev): -78.6248 -78.6248 -78.6153 -78.6153 -44.3392 -44.3392 -44.3098 -44.3098 -42.6584 -42.6584 -42.5914 -42.5914 -42.5634 -42.5634 -42.5519 -42.5519 -0.9964 -0.9964 -0.6213 -0.6213 5.8776 5.8776 7.8423 7.8423 8.4572 8.4572 8.6082 8.6082 8.8075 8.8075 8.8783 8.8783 10.5487 10.5487 11.8065 11.8065 11.9226 11.9226 11.9908 11.9908 12.0901 12.0901 12.3800 12.3800 12.4338 12.4338 12.8835 12.8835 14.3227 14.3227 14.9061 14.9061 18.0276 18.0276 18.2136 18.2136 k = 0.4540 0.3683-0.0000 ( 4920 PWs) bands (ev): -78.6246 -78.6246 -78.6149 -78.6149 -44.3391 -44.3391 -44.3098 -44.3098 -42.6583 -42.6583 -42.5914 -42.5914 -42.5634 -42.5634 -42.5518 -42.5518 -0.9892 -0.9892 -0.6184 -0.6184 5.8875 5.8875 7.8222 7.8222 8.4544 8.4544 8.6186 8.6186 8.7656 8.7656 8.8482 8.8482 10.6022 10.6022 11.8100 11.8100 11.9265 11.9265 12.0054 12.0054 12.0940 12.0940 12.3795 12.3795 12.4321 12.4321 12.9036 12.9036 14.2887 14.2887 14.7983 14.7983 17.9046 17.9046 18.2863 18.2863 k = 0.4483 0.3783-0.0000 ( 4920 PWs) bands (ev): -78.6244 -78.6244 -78.6151 -78.6151 -44.3391 -44.3391 -44.3097 -44.3097 -42.6584 -42.6584 -42.5914 -42.5914 -42.5633 -42.5633 -42.5519 -42.5519 -0.9811 -0.9811 -0.6154 -0.6154 5.8985 5.8985 7.8007 7.8007 8.4468 8.4468 8.6297 8.6297 8.6795 8.6795 8.8669 8.8669 10.6527 10.6527 11.8133 11.8133 11.9306 11.9306 12.0202 12.0202 12.0986 12.0986 12.3778 12.3778 12.4286 12.4286 12.9245 12.9245 14.2510 14.2510 14.6884 14.6884 17.7842 17.7842 18.3680 18.3680 k = 0.4425 0.3882-0.0000 ( 4928 PWs) bands (ev): -78.6245 -78.6245 -78.6153 -78.6153 -44.3392 -44.3392 -44.3098 -44.3098 -42.6584 -42.6584 -42.5914 -42.5914 -42.5634 -42.5634 -42.5519 -42.5519 -0.9722 -0.9722 -0.6122 -0.6122 5.9103 5.9103 7.7783 7.7783 8.4266 8.4266 8.6018 8.6018 8.6421 8.6421 8.8903 8.8903 10.6999 10.6999 11.8153 11.8153 11.9334 11.9334 12.0359 12.0359 12.1041 12.1041 12.3755 12.3755 12.4251 12.4251 12.9480 12.9480 14.2061 14.2061 14.5789 14.5789 17.6692 17.6692 18.4589 18.4589 k = 0.4368 0.3982-0.0000 ( 4930 PWs) bands (ev): -78.6248 -78.6248 -78.6152 -78.6152 -44.3392 -44.3392 -44.3098 -44.3098 -42.6584 -42.6584 -42.5915 -42.5915 -42.5635 -42.5635 -42.5519 -42.5519 -0.9624 -0.9624 -0.6090 -0.6090 5.9229 5.9229 7.7552 7.7552 8.3794 8.3794 8.5526 8.5526 8.6543 8.6543 8.9151 8.9151 10.7436 10.7436 11.8164 11.8164 11.9355 11.9355 12.0525 12.0525 12.1116 12.1116 12.3737 12.3737 12.4219 12.4219 12.9739 12.9739 14.1579 14.1579 14.4712 14.4712 17.5603 17.5603 18.5591 18.5591 k = 0.4310 0.4081-0.0000 ( 4932 PWs) bands (ev): -78.6249 -78.6249 -78.6152 -78.6152 -44.3392 -44.3392 -44.3099 -44.3099 -42.6584 -42.6584 -42.5915 -42.5915 -42.5635 -42.5635 -42.5519 -42.5519 -0.9517 -0.9517 -0.6059 -0.6059 5.9362 5.9362 7.7315 7.7315 8.3049 8.3049 8.5325 8.5325 8.6671 8.6671 8.9404 8.9404 10.7844 10.7844 11.8172 11.8172 11.9380 11.9380 12.0676 12.0676 12.1218 12.1218 12.3716 12.3716 12.4188 12.4188 13.0002 13.0002 14.1052 14.1052 14.3657 14.3657 17.4580 17.4580 18.6680 18.6680 k = 0.4253 0.4181-0.0000 ( 4928 PWs) bands (ev): -78.6249 -78.6249 -78.6149 -78.6149 -44.3391 -44.3391 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5636 -42.5636 -42.5519 -42.5519 -0.9403 -0.9403 -0.6030 -0.6030 5.9498 5.9498 7.7076 7.7076 8.2185 8.2185 8.5272 8.5272 8.6803 8.6803 8.9658 8.9658 10.8216 10.8216 11.8169 11.8169 11.9398 11.9398 12.0809 12.0809 12.1360 12.1360 12.3703 12.3703 12.4169 12.4169 13.0274 13.0274 14.0490 14.0490 14.2643 14.2643 17.3625 17.3625 18.7850 18.7850 k = 0.4195 0.4280-0.0000 ( 4930 PWs) bands (ev): -78.6248 -78.6248 -78.6151 -78.6151 -44.3392 -44.3392 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5636 -42.5636 -42.5520 -42.5520 -0.9281 -0.9281 -0.6004 -0.6004 5.9637 5.9637 7.6832 7.6832 8.1299 8.1299 8.5282 8.5282 8.6934 8.6934 8.9909 8.9909 10.8558 10.8558 11.8163 11.8163 11.9416 11.9416 12.0911 12.0911 12.1532 12.1532 12.3680 12.3680 12.4158 12.4158 13.0552 13.0552 13.9868 13.9868 14.1662 14.1662 17.2734 17.2734 18.9102 18.9102 k = 0.4138 0.4380-0.0000 ( 4930 PWs) bands (ev): -78.6248 -78.6248 -78.6151 -78.6151 -44.3392 -44.3392 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5636 -42.5636 -42.5520 -42.5520 -0.9152 -0.9152 -0.5981 -0.5981 5.9775 5.9775 7.6587 7.6587 8.0427 8.0427 8.5324 8.5324 8.7064 8.7064 9.0154 9.0154 10.8864 10.8864 11.8149 11.8149 11.9426 11.9426 12.0996 12.0996 12.1728 12.1728 12.3653 12.3653 12.4175 12.4175 13.0828 13.0828 13.9222 13.9222 14.0725 14.0725 17.1916 17.1916 19.0429 19.0429 k = 0.4080 0.4479-0.0000 ( 4926 PWs) bands (ev): -78.6246 -78.6246 -78.6151 -78.6151 -44.3392 -44.3392 -44.3098 -44.3098 -42.6583 -42.6583 -42.5914 -42.5914 -42.5635 -42.5635 -42.5520 -42.5520 -0.9016 -0.9016 -0.5964 -0.5964 5.9912 5.9912 7.6339 7.6339 7.9592 7.9592 8.5387 8.5387 8.7191 8.7191 9.0389 9.0389 10.9142 10.9142 11.8134 11.8134 11.9435 11.9435 12.1075 12.1075 12.1928 12.1928 12.3618 12.3618 12.4232 12.4232 13.1102 13.1102 13.8545 13.8545 13.9839 13.9839 17.1167 17.1167 19.1826 19.1826 k = 0.4023 0.4579-0.0000 ( 4918 PWs) bands (ev): -78.6244 -78.6244 -78.6150 -78.6150 -44.3391 -44.3391 -44.3098 -44.3098 -42.6583 -42.6583 -42.5914 -42.5914 -42.5635 -42.5635 -42.5520 -42.5520 -0.8874 -0.8874 -0.5953 -0.5953 6.0042 6.0042 7.6088 7.6088 7.8809 7.8809 8.5465 8.5465 8.7313 8.7313 9.0616 9.0616 10.9393 10.9393 11.8112 11.8112 11.9436 11.9436 12.1151 12.1151 12.2115 12.2115 12.3575 12.3575 12.4341 12.4341 13.1370 13.1370 13.7840 13.7840 13.9016 13.9016 17.0486 17.0486 19.3286 19.3286 k = 0.3966 0.4679-0.0000 ( 4910 PWs) bands (ev): -78.6244 -78.6244 -78.6146 -78.6146 -44.3391 -44.3391 -44.3098 -44.3098 -42.6582 -42.6582 -42.5914 -42.5914 -42.5636 -42.5636 -42.5520 -42.5520 -0.8725 -0.8725 -0.5950 -0.5950 6.0165 6.0165 7.5832 7.5832 7.8090 7.8090 8.5556 8.5556 8.7427 8.7427 9.0829 9.0829 10.9615 10.9615 11.8078 11.8078 11.9425 11.9425 12.1226 12.1226 12.2276 12.2276 12.3519 12.3519 12.4526 12.4526 13.1631 13.1631 13.7118 13.7118 13.8243 13.8243 16.9879 16.9879 19.4800 19.4800 k = 0.3908 0.4778-0.0000 ( 4906 PWs) bands (ev): -78.6244 -78.6244 -78.6144 -78.6144 -44.3390 -44.3390 -44.3098 -44.3098 -42.6582 -42.6582 -42.5914 -42.5914 -42.5636 -42.5636 -42.5519 -42.5519 -0.8571 -0.8571 -0.5956 -0.5956 6.0276 6.0276 7.5566 7.5566 7.7448 7.7448 8.5657 8.5657 8.7529 8.7529 9.1027 9.1027 10.9815 10.9815 11.8044 11.8044 11.9413 11.9413 12.1298 12.1298 12.2393 12.2393 12.3451 12.3451 12.4757 12.4757 13.1882 13.1882 13.6376 13.6376 13.7535 13.7535 16.9331 16.9331 19.6359 19.6359 k = 0.3851 0.4878-0.0000 ( 4910 PWs) bands (ev): -78.6246 -78.6246 -78.6145 -78.6145 -44.3390 -44.3390 -44.3099 -44.3099 -42.6582 -42.6582 -42.5914 -42.5914 -42.5636 -42.5636 -42.5520 -42.5520 -0.8411 -0.8411 -0.5973 -0.5973 6.0373 6.0373 7.5288 7.5288 7.6892 7.6892 8.5769 8.5769 8.7617 8.7617 9.1207 9.1207 10.9991 10.9991 11.8003 11.8003 11.9391 11.9391 12.1371 12.1371 12.2467 12.2467 12.3372 12.3372 12.5046 12.5046 13.2119 13.2119 13.5624 13.5624 13.6877 13.6877 16.8846 16.8846 19.7949 19.7949 k = 0.3793 0.4977-0.0000 ( 4910 PWs) bands (ev): -78.6248 -78.6248 -78.6143 -78.6143 -44.3390 -44.3390 -44.3099 -44.3099 -42.6582 -42.6582 -42.5915 -42.5915 -42.5637 -42.5637 -42.5519 -42.5519 -0.8247 -0.8247 -0.6002 -0.6002 6.0454 6.0454 7.4999 7.4999 7.6429 7.6429 8.5891 8.5891 8.7688 8.7688 9.1370 9.1370 11.0136 11.0136 11.7964 11.7964 11.9368 11.9368 12.1450 12.1450 12.2517 12.2517 12.3288 12.3288 12.5399 12.5399 13.2344 13.2344 13.4873 13.4873 13.6280 13.6280 16.8425 16.8425 19.9556 19.9556 k = 0.3736 0.5077-0.0000 ( 4908 PWs) bands (ev): -78.6247 -78.6247 -78.6143 -78.6143 -44.3390 -44.3390 -44.3099 -44.3099 -42.6582 -42.6582 -42.5915 -42.5915 -42.5636 -42.5636 -42.5519 -42.5519 -0.8078 -0.8078 -0.6044 -0.6044 6.0518 6.0518 7.4707 7.4707 7.6056 7.6056 8.6023 8.6023 8.7737 8.7737 9.1513 9.1513 11.0274 11.0274 11.7930 11.7930 11.9348 11.9348 12.1531 12.1531 12.2543 12.2543 12.3200 12.3200 12.5784 12.5784 13.2554 13.2554 13.4122 13.4122 13.5744 13.5744 16.8058 16.8058 20.1166 20.1166 k = 0.3678 0.5176-0.0000 ( 4918 PWs) bands (ev): -78.6253 -78.6253 -78.6141 -78.6141 -44.3390 -44.3390 -44.3101 -44.3101 -42.6582 -42.6582 -42.5916 -42.5916 -42.5638 -42.5638 -42.5519 -42.5519 -0.7906 -0.7906 -0.6101 -0.6101 6.0563 6.0563 7.4429 7.4429 7.5759 7.5759 8.6164 8.6164 8.7764 8.7764 9.1637 9.1637 11.0379 11.0379 11.7876 11.7876 11.9307 11.9307 12.1613 12.1613 12.2542 12.2542 12.3106 12.3106 12.6208 12.6208 13.2749 13.2749 13.3392 13.3392 13.5272 13.5272 16.7750 16.7750 20.2748 20.2748 k = 0.3621 0.5276-0.0000 ( 4918 PWs) bands (ev): -78.6251 -78.6251 -78.6143 -78.6143 -44.3390 -44.3390 -44.3100 -44.3100 -42.6582 -42.6582 -42.5916 -42.5916 -42.5638 -42.5638 -42.5519 -42.5519 -0.7731 -0.7731 -0.6174 -0.6174 6.0591 6.0591 7.4184 7.4184 7.5521 7.5521 8.6315 8.6315 8.7763 8.7763 9.1740 9.1740 11.0482 11.0482 11.7845 11.7845 11.9284 11.9284 12.1703 12.1703 12.2542 12.2542 12.3013 12.3013 12.6655 12.6655 13.2661 13.2661 13.2933 13.2933 13.4848 13.4848 16.7491 16.7491 20.4276 20.4276 k = 0.3563 0.5375-0.0000 ( 4922 PWs) bands (ev): -78.6253 -78.6253 -78.6143 -78.6143 -44.3390 -44.3390 -44.3101 -44.3101 -42.6582 -42.6582 -42.5916 -42.5916 -42.5638 -42.5638 -42.5520 -42.5520 -0.7553 -0.7553 -0.6265 -0.6265 6.0603 6.0603 7.3985 7.3985 7.5333 7.5333 8.6476 8.6476 8.7729 8.7729 9.1823 9.1823 11.0561 11.0561 11.7809 11.7809 11.9256 11.9256 12.1792 12.1792 12.2527 12.2527 12.2926 12.2926 12.7128 12.7128 13.1948 13.1948 13.3099 13.3099 13.4499 13.4499 16.7281 16.7281 20.5698 20.5698 k = 0.3506 0.5475-0.0000 ( 4922 PWs) bands (ev): -78.6253 -78.6253 -78.6143 -78.6143 -44.3390 -44.3390 -44.3101 -44.3101 -42.6582 -42.6582 -42.5916 -42.5916 -42.5638 -42.5638 -42.5520 -42.5520 -0.7373 -0.7373 -0.6374 -0.6374 6.0603 6.0603 7.3837 7.3837 7.5186 7.5186 8.6646 8.6646 8.7663 8.7663 9.1886 9.1886 11.0622 11.0622 11.7785 11.7785 11.9236 11.9236 12.1883 12.1883 12.2505 12.2505 12.2839 12.2839 12.7615 12.7615 13.1281 13.1281 13.3250 13.3250 13.4205 13.4205 16.7121 16.7121 20.6945 20.6945 k = 0.3448 0.5574-0.0000 ( 4910 PWs) bands (ev): -78.6247 -78.6247 -78.6143 -78.6143 -44.3390 -44.3390 -44.3099 -44.3099 -42.6582 -42.6582 -42.5915 -42.5915 -42.5637 -42.5637 -42.5520 -42.5520 -0.7192 -0.7192 -0.6503 -0.6503 6.0597 6.0597 7.3740 7.3740 7.5078 7.5078 8.6826 8.6826 8.7562 8.7562 9.1929 9.1929 11.0672 11.0672 11.7780 11.7780 11.9234 11.9234 12.1973 12.1973 12.2490 12.2490 12.2768 12.2768 12.8105 12.8105 13.0661 13.0661 13.3386 13.3386 13.3969 13.3969 16.7010 16.7010 20.7926 20.7926 k = 0.3391 0.5674-0.0000 ( 4910 PWs) bands (ev): -78.6247 -78.6247 -78.6143 -78.6143 -44.3390 -44.3390 -44.3099 -44.3099 -42.6582 -42.6582 -42.5915 -42.5915 -42.5637 -42.5637 -42.5520 -42.5520 -0.7011 -0.7011 -0.6651 -0.6651 6.0588 6.0588 7.3690 7.3690 7.5009 7.5009 8.7011 8.7011 8.7424 8.7424 9.1954 9.1954 11.0699 11.0699 11.7768 11.7768 11.9222 11.9222 12.2038 12.2038 12.2472 12.2472 12.2710 12.2710 12.8556 12.8556 13.0132 13.0132 13.3500 13.3500 13.3796 13.3796 16.6943 16.6943 20.8542 20.8542 k = 0.3333 0.5774-0.0000 ( 4902 PWs) bands (ev): -78.6246 -78.6246 -78.6141 -78.6141 -44.3390 -44.3390 -44.3099 -44.3099 -42.6582 -42.6582 -42.5915 -42.5915 -42.5637 -42.5637 -42.5520 -42.5520 -0.6856 -0.6856 -0.6795 -0.6795 6.0583 6.0583 7.3676 7.3676 7.4986 7.4986 8.7153 8.7153 8.7300 8.7300 9.1962 9.1962 11.0708 11.0708 11.7765 11.7765 11.9220 11.9220 12.2071 12.2071 12.2468 12.2468 12.2694 12.2694 12.8793 12.8793 12.9876 12.9876 13.3559 13.3559 13.3728 13.3728 16.6923 16.6923 20.8743 20.8743 k = 0.3333 0.5774-0.0000 ( 4902 PWs) bands (ev): -78.6246 -78.6246 -78.6141 -78.6141 -44.3390 -44.3390 -44.3099 -44.3099 -42.6582 -42.6582 -42.5915 -42.5915 -42.5637 -42.5637 -42.5520 -42.5520 -0.6856 -0.6856 -0.6795 -0.6795 6.0583 6.0583 7.3676 7.3676 7.4986 7.4986 8.7153 8.7153 8.7300 8.7300 9.1962 9.1962 11.0708 11.0708 11.7765 11.7765 11.9220 11.9220 12.2071 12.2071 12.2468 12.2468 12.2694 12.2694 12.8793 12.8793 12.9876 12.9876 13.3559 13.3559 13.3728 13.3728 16.6923 16.6923 20.8743 20.8743 k = 0.3276 0.5674-0.0000 ( 4914 PWs) bands (ev): -78.6249 -78.6249 -78.6143 -78.6143 -44.3390 -44.3390 -44.3100 -44.3100 -42.6582 -42.6582 -42.5916 -42.5916 -42.5637 -42.5637 -42.5520 -42.5520 -0.7022 -0.7022 -0.6641 -0.6641 6.0590 6.0590 7.3685 7.3685 7.5011 7.5011 8.6985 8.6985 8.7449 8.7449 9.1955 9.1955 11.0698 11.0698 11.7766 11.7766 11.9221 11.9221 12.2032 12.2032 12.2464 12.2464 12.2711 12.2711 12.8566 12.8566 13.0122 13.0122 13.3520 13.3520 13.3776 13.3776 16.6943 16.6943 20.8570 20.8570 k = 0.3218 0.5574-0.0000 ( 4922 PWs) bands (ev): -78.6251 -78.6251 -78.6145 -78.6145 -44.3391 -44.3391 -44.3100 -44.3100 -42.6582 -42.6582 -42.5916 -42.5916 -42.5638 -42.5638 -42.5521 -42.5521 -0.7237 -0.7237 -0.6460 -0.6460 6.0614 6.0614 7.3708 7.3708 7.5093 7.5093 8.6716 8.6716 8.7665 8.7665 9.1934 9.1934 11.0669 11.0669 11.7772 11.7772 11.9229 11.9229 12.1970 12.1970 12.2447 12.2447 12.2800 12.2800 12.8149 12.8149 13.0612 13.0612 13.3487 13.3487 13.3853 13.3853 16.7006 16.7006 20.8134 20.8134 k = 0.3161 0.5475-0.0000 ( 4922 PWs) bands (ev): -78.6251 -78.6251 -78.6145 -78.6145 -44.3391 -44.3391 -44.3100 -44.3100 -42.6582 -42.6582 -42.5916 -42.5916 -42.5638 -42.5638 -42.5521 -42.5521 -0.7477 -0.7477 -0.6281 -0.6281 6.0663 6.0663 7.3735 7.3735 7.5235 7.5235 8.6398 8.6398 8.7896 8.7896 9.1904 9.1904 11.0626 11.0626 11.7793 11.7793 11.9253 11.9253 12.1889 12.1889 12.2423 12.2423 12.2927 12.2927 12.7726 12.7726 13.1171 13.1171 13.3491 13.3491 13.3939 13.3939 16.7113 16.7113 20.7534 20.7534 k = 0.3103 0.5375-0.0000 ( 4920 PWs) bands (ev): -78.6250 -78.6250 -78.6145 -78.6145 -44.3391 -44.3391 -44.3100 -44.3100 -42.6582 -42.6582 -42.5916 -42.5916 -42.5637 -42.5637 -42.5520 -42.5520 -0.7740 -0.7740 -0.6103 -0.6103 6.0742 6.0742 7.3763 7.3763 7.5433 7.5433 8.6033 8.6033 8.8138 8.8138 9.1866 9.1866 11.0568 11.0568 11.7829 11.7829 11.9292 11.9292 12.1796 12.1796 12.2397 12.2397 12.3073 12.3073 12.7332 12.7332 13.1756 13.1756 13.3531 13.3531 13.4022 13.4022 16.7262 16.7262 20.6840 20.6840 k = 0.3046 0.5276-0.0000 ( 4920 PWs) bands (ev): -78.6248 -78.6248 -78.6147 -78.6147 -44.3391 -44.3391 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5637 -42.5637 -42.5520 -42.5520 -0.8027 -0.8027 -0.5928 -0.5928 6.0857 6.0857 7.3792 7.3792 7.5680 7.5680 8.5622 8.5622 8.8391 8.8391 9.1822 9.1822 11.0494 11.0494 11.7876 11.7876 11.9345 11.9345 12.1695 12.1695 12.2370 12.2370 12.3223 12.3223 12.6980 12.6980 13.2356 13.2356 13.3601 13.3601 13.4101 13.4101 16.7451 16.7451 20.6098 20.6098 k = 0.2989 0.5176-0.0000 ( 4924 PWs) bands (ev): -78.6250 -78.6250 -78.6147 -78.6147 -44.3391 -44.3391 -44.3100 -44.3100 -42.6583 -42.6583 -42.5916 -42.5916 -42.5637 -42.5637 -42.5520 -42.5520 -0.8336 -0.8336 -0.5756 -0.5756 6.1009 6.1009 7.3826 7.3826 7.5970 7.5970 8.5166 8.5166 8.8654 8.8654 9.1778 9.1778 11.0400 11.0400 11.7914 11.7914 11.9396 11.9396 12.1593 12.1593 12.2345 12.2345 12.3379 12.3379 12.6682 12.6682 13.2963 13.2963 13.3708 13.3708 13.4179 13.4179 16.7685 16.7685 20.5334 20.5334 k = 0.2931 0.5077-0.0000 ( 4916 PWs) bands (ev): -78.6249 -78.6249 -78.6145 -78.6145 -44.3390 -44.3390 -44.3099 -44.3099 -42.6582 -42.6582 -42.5915 -42.5915 -42.5637 -42.5637 -42.5520 -42.5520 -0.8669 -0.8669 -0.5588 -0.5588 6.1205 6.1205 7.3868 7.3868 7.6295 7.6295 8.4670 8.4670 8.8926 8.8926 9.1735 9.1735 11.0300 11.0300 11.7968 11.7968 11.9466 11.9466 12.1492 12.1492 12.2329 12.2329 12.3528 12.3528 12.6447 12.6447 13.3579 13.3579 13.3853 13.3853 13.4262 13.4262 16.7961 16.7961 20.4568 20.4568 k = 0.2874 0.4977-0.0000 ( 4924 PWs) bands (ev): -78.6251 -78.6251 -78.6146 -78.6146 -44.3391 -44.3391 -44.3100 -44.3100 -42.6582 -42.6582 -42.5915 -42.5915 -42.5637 -42.5637 -42.5520 -42.5520 -0.9023 -0.9023 -0.5425 -0.5425 6.1446 6.1446 7.3919 7.3919 7.6646 7.6646 8.4133 8.4133 8.9206 8.9206 9.1698 9.1698 11.0177 11.0177 11.8023 11.8023 11.9541 11.9541 12.1378 12.1378 12.2306 12.2306 12.3643 12.3643 12.6278 12.6278 13.4013 13.4013 13.4181 13.4181 13.4356 13.4356 16.8277 16.8277 20.3804 20.3804 k = 0.2816 0.4878-0.0000 ( 4932 PWs) bands (ev): -78.6253 -78.6253 -78.6148 -78.6148 -44.3391 -44.3391 -44.3100 -44.3100 -42.6583 -42.6583 -42.5916 -42.5916 -42.5637 -42.5637 -42.5520 -42.5520 -0.9399 -0.9399 -0.5266 -0.5266 6.1736 6.1736 7.3981 7.3981 7.7017 7.7017 8.3560 8.3560 8.9491 8.9491 9.1670 9.1670 11.0044 11.0044 11.8087 11.8087 11.9630 11.9630 12.1260 12.1260 12.2275 12.2275 12.3729 12.3729 12.6202 12.6202 13.4194 13.4194 13.4413 13.4413 13.4814 13.4814 16.8637 16.8637 20.3051 20.3051 k = 0.2759 0.4778-0.0000 ( 4932 PWs) bands (ev): -78.6253 -78.6253 -78.6148 -78.6148 -44.3391 -44.3391 -44.3100 -44.3100 -42.6582 -42.6582 -42.5916 -42.5916 -42.5637 -42.5637 -42.5520 -42.5520 -0.9794 -0.9794 -0.5113 -0.5113 6.2075 6.2075 7.4057 7.4057 7.7402 7.7402 8.2956 8.2956 8.9781 8.9781 9.1658 9.1658 10.9901 10.9901 11.8156 11.8156 11.9729 11.9729 12.1144 12.1144 12.2256 12.2256 12.3779 12.3779 12.6211 12.6211 13.4388 13.4388 13.4516 13.4516 13.5422 13.5422 16.9046 16.9046 20.2318 20.2318 k = 0.2701 0.4679-0.0000 ( 4936 PWs) bands (ev): -78.6255 -78.6255 -78.6148 -78.6148 -44.3391 -44.3391 -44.3101 -44.3101 -42.6583 -42.6583 -42.5916 -42.5916 -42.5637 -42.5637 -42.5519 -42.5519 -1.0209 -1.0209 -0.4965 -0.4965 6.2465 6.2465 7.4146 7.4146 7.7795 7.7795 8.2326 8.2326 9.0071 9.0071 9.1668 9.1668 10.9758 10.9758 11.8225 11.8225 11.9836 11.9836 12.1015 12.1015 12.2226 12.2226 12.3783 12.3783 12.6309 12.6309 13.4550 13.4550 13.4660 13.4660 13.6034 13.6034 16.9504 16.9504 20.1606 20.1606 k = 0.2644 0.4579-0.0000 ( 4932 PWs) bands (ev): -78.6255 -78.6255 -78.6146 -78.6146 -44.3390 -44.3390 -44.3100 -44.3100 -42.6582 -42.6582 -42.5916 -42.5916 -42.5637 -42.5637 -42.5518 -42.5518 -1.0642 -1.0642 -0.4824 -0.4824 6.2906 6.2906 7.4250 7.4250 7.8187 7.8187 8.1678 8.1678 9.0352 9.0352 9.1712 9.1712 10.9597 10.9597 11.8301 11.8301 11.9949 11.9949 12.0895 12.0895 12.2211 12.2211 12.3769 12.3769 12.6477 12.6477 13.4674 13.4674 13.4877 13.4877 13.6635 13.6635 17.0008 17.0008 20.0916 20.0916 k = 0.2586 0.4479-0.0000 ( 4934 PWs) bands (ev): -78.6254 -78.6254 -78.6148 -78.6148 -44.3390 -44.3390 -44.3100 -44.3100 -42.6582 -42.6582 -42.5916 -42.5916 -42.5636 -42.5636 -42.5518 -42.5518 -1.1092 -1.1092 -0.4689 -0.4689 6.3399 6.3399 7.4367 7.4367 7.8563 7.8563 8.1029 8.1029 9.0609 9.0609 9.1802 9.1802 10.9431 10.9431 11.8379 11.8379 12.0066 12.0066 12.0768 12.0768 12.2197 12.2197 12.3723 12.3723 12.6703 12.6703 13.4793 13.4793 13.5117 13.5117 13.7216 13.7216 17.0553 17.0553 20.0251 20.0251 k = 0.2529 0.4380-0.0000 ( 4934 PWs) bands (ev): -78.6255 -78.6255 -78.6147 -78.6147 -44.3390 -44.3390 -44.3100 -44.3100 -42.6582 -42.6582 -42.5916 -42.5916 -42.5636 -42.5636 -42.5518 -42.5518 -1.1556 -1.1556 -0.4561 -0.4561 6.3943 6.3943 7.4499 7.4499 7.8875 7.8875 8.0427 8.0427 9.0832 9.0832 9.1957 9.1957 10.9257 10.9257 11.8449 11.8449 12.0165 12.0165 12.0656 12.0656 12.2184 12.2184 12.3676 12.3676 12.6974 12.6974 13.4918 13.4918 13.5383 13.5383 13.7787 13.7787 17.1151 17.1151 19.9611 19.9611 k = 0.2471 0.4280-0.0000 ( 4938 PWs) bands (ev): -78.6255 -78.6255 -78.6149 -78.6149 -44.3390 -44.3390 -44.3100 -44.3100 -42.6583 -42.6583 -42.5916 -42.5916 -42.5636 -42.5636 -42.5518 -42.5518 -1.2035 -1.2035 -0.4441 -0.4441 6.4538 6.4538 7.4639 7.4639 7.8931 7.8931 8.0066 8.0066 9.1012 9.1012 9.2184 9.2184 10.9079 10.9079 11.8524 11.8524 12.0209 12.0209 12.0594 12.0594 12.2175 12.2175 12.3623 12.3623 12.7270 12.7270 13.5060 13.5060 13.5635 13.5635 13.8343 13.8343 17.1798 17.1798 19.8998 19.8998 k = 0.2414 0.4181-0.0000 ( 4944 PWs) bands (ev): -78.6256 -78.6256 -78.6151 -78.6151 -44.3391 -44.3391 -44.3100 -44.3100 -42.6583 -42.6583 -42.5916 -42.5916 -42.5635 -42.5635 -42.5518 -42.5518 -1.2525 -1.2525 -0.4328 -0.4328 6.5183 6.5183 7.4785 7.4785 7.8511 7.8511 8.0173 8.0173 9.1159 9.1159 9.2474 9.2474 10.8900 10.8900 11.8593 11.8593 12.0143 12.0143 12.0635 12.0635 12.2168 12.2168 12.3574 12.3574 12.7593 12.7593 13.5221 13.5221 13.5894 13.5894 13.8877 13.8877 17.2495 17.2495 19.8412 19.8412 k = 0.2356 0.4081-0.0000 ( 4940 PWs) bands (ev): -78.6255 -78.6255 -78.6151 -78.6151 -44.3391 -44.3391 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5634 -42.5634 -42.5517 -42.5517 -1.3026 -1.3026 -0.4223 -0.4223 6.5878 6.5878 7.4928 7.4928 7.7887 7.7887 8.0488 8.0488 9.1292 9.1292 9.2815 9.2815 10.8718 10.8718 11.8664 11.8664 12.0010 12.0010 12.0753 12.0753 12.2169 12.2169 12.3536 12.3536 12.7931 12.7931 13.5403 13.5403 13.6162 13.6162 13.9393 13.9393 17.3245 17.3245 19.7853 19.7853 k = 0.2299 0.3982-0.0000 ( 4944 PWs) bands (ev): -78.6255 -78.6255 -78.6153 -78.6153 -44.3391 -44.3391 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5634 -42.5634 -42.5517 -42.5517 -1.3536 -1.3536 -0.4125 -0.4125 6.6620 6.6620 7.5040 7.5040 7.7247 7.7247 8.0847 8.0847 9.1424 9.1424 9.3191 9.3191 10.8536 10.8536 11.8729 11.8729 11.9842 11.9842 12.0887 12.0887 12.2169 12.2169 12.3500 12.3500 12.8278 12.8278 13.5607 13.5607 13.6425 13.6425 13.9878 13.9878 17.4046 17.4046 19.7322 19.7322 k = 0.2241 0.3882-0.0000 ( 4942 PWs) bands (ev): -78.6255 -78.6255 -78.6152 -78.6152 -44.3390 -44.3390 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5633 -42.5633 -42.5516 -42.5516 -1.4053 -1.4053 -0.4036 -0.4036 6.7410 6.7410 7.5049 7.5049 7.6703 7.6703 8.1213 8.1213 9.1567 9.1567 9.3594 9.3594 10.8354 10.8354 11.8789 11.8789 11.9668 11.9668 12.1032 12.1032 12.2174 12.2174 12.3477 12.3477 12.8633 12.8633 13.5834 13.5834 13.6690 13.6690 14.0338 14.0338 17.4902 17.4902 19.6819 19.6819 k = 0.2184 0.3783-0.0000 ( 4938 PWs) bands (ev): -78.6253 -78.6253 -78.6152 -78.6152 -44.3390 -44.3390 -44.3098 -44.3098 -42.6583 -42.6583 -42.5915 -42.5915 -42.5632 -42.5632 -42.5516 -42.5516 -1.4575 -1.4575 -0.3955 -0.3955 6.8244 6.8244 7.4810 7.4810 7.6411 7.6411 8.1573 8.1573 9.1726 9.1726 9.4020 9.4020 10.8175 10.8175 11.8844 11.8844 11.9485 11.9485 12.1185 12.1185 12.2188 12.2188 12.3460 12.3460 12.8990 12.8990 13.6088 13.6088 13.6951 13.6951 14.0766 14.0766 17.5811 17.5811 19.6344 19.6344 k = 0.2126 0.3683-0.0000 ( 4940 PWs) bands (ev): -78.6253 -78.6253 -78.6153 -78.6153 -44.3390 -44.3390 -44.3098 -44.3098 -42.6583 -42.6583 -42.5914 -42.5914 -42.5631 -42.5631 -42.5516 -42.5516 -1.5102 -1.5102 -0.3881 -0.3881 6.9121 6.9121 7.4291 7.4291 7.6410 7.6410 8.1923 8.1923 9.1904 9.1904 9.4463 9.4463 10.7998 10.7998 11.8886 11.8886 11.9294 11.9294 12.1331 12.1331 12.2201 12.2201 12.3446 12.3446 12.9345 12.9345 13.6368 13.6368 13.7205 13.7205 14.1156 14.1156 17.6773 17.6773 19.5896 19.5896 k = 0.2069 0.3584-0.0000 ( 4934 PWs) bands (ev): -78.6253 -78.6253 -78.6151 -78.6151 -44.3389 -44.3389 -44.3097 -44.3097 -42.6582 -42.6582 -42.5914 -42.5914 -42.5630 -42.5630 -42.5514 -42.5514 -1.5631 -1.5631 -0.3816 -0.3816 7.0037 7.0037 7.3634 7.3634 7.6563 7.6563 8.2260 8.2260 9.2107 9.2107 9.4926 9.4926 10.7831 10.7831 11.8906 11.8906 11.9122 11.9122 12.1473 12.1473 12.2221 12.2221 12.3443 12.3443 12.9700 12.9700 13.6680 13.6680 13.7455 13.7455 14.1516 14.1516 17.7791 17.7791 19.5478 19.5478 k = 0.2011 0.3484-0.0000 ( 4934 PWs) bands (ev): -78.6251 -78.6251 -78.6153 -78.6153 -44.3390 -44.3390 -44.3096 -44.3096 -42.6583 -42.6583 -42.5914 -42.5914 -42.5629 -42.5629 -42.5514 -42.5514 -1.6161 -1.6161 -0.3759 -0.3759 7.0980 7.0980 7.2939 7.2939 7.6783 7.6783 8.2579 8.2579 9.2335 9.2335 9.5402 9.5402 10.7664 10.7664 11.8829 11.8829 11.9040 11.9040 12.1613 12.1613 12.2245 12.2245 12.3442 12.3442 13.0044 13.0044 13.7013 13.7013 13.7696 13.7696 14.1823 14.1823 17.8862 17.8862 19.5087 19.5087 k = 0.1954 0.3384-0.0000 ( 4934 PWs) bands (ev): -78.6251 -78.6251 -78.6153 -78.6153 -44.3389 -44.3389 -44.3096 -44.3096 -42.6583 -42.6583 -42.5913 -42.5913 -42.5628 -42.5628 -42.5513 -42.5513 -1.6691 -1.6691 -0.3709 -0.3709 7.1785 7.1785 7.2401 7.2401 7.7038 7.7038 8.2882 8.2882 9.2591 9.2591 9.5894 9.5894 10.7503 10.7503 11.8646 11.8646 11.9038 11.9038 12.1744 12.1744 12.2276 12.2276 12.3442 12.3442 13.0383 13.0383 13.7377 13.7377 13.7936 13.7936 14.2093 14.2093 17.9984 17.9984 19.4721 19.4721 k = 0.1897 0.3285-0.0000 ( 4946 PWs) bands (ev): -78.6253 -78.6253 -78.6157 -78.6157 -44.3390 -44.3390 -44.3096 -44.3096 -42.6583 -42.6583 -42.5914 -42.5914 -42.5628 -42.5628 -42.5514 -42.5514 -1.7219 -1.7219 -0.3668 -0.3668 7.1360 7.1360 7.3126 7.3126 7.7314 7.7314 8.3165 8.3165 9.2875 9.2875 9.6393 9.6393 10.7346 10.7346 11.8437 11.8437 11.9043 11.9043 12.1861 12.1861 12.2309 12.2309 12.3441 12.3441 13.0708 13.0708 13.7766 13.7766 13.8171 13.8171 14.2297 14.2297 18.1158 18.1158 19.4379 19.4379 k = 0.1839 0.3185-0.0000 ( 4942 PWs) bands (ev): -78.6249 -78.6249 -78.6159 -78.6159 -44.3391 -44.3391 -44.3094 -44.3094 -42.6584 -42.6584 -42.5913 -42.5913 -42.5626 -42.5626 -42.5514 -42.5514 -1.7744 -1.7744 -0.3633 -0.3633 7.0649 7.0649 7.4175 7.4175 7.7606 7.7606 8.3430 8.3430 9.3185 9.3185 9.6911 9.6911 10.7202 10.7202 11.8235 11.8235 11.9047 11.9047 12.1972 12.1972 12.2364 12.2364 12.3462 12.3462 13.1029 13.1029 13.8162 13.8162 13.8419 13.8419 14.2462 14.2462 18.2390 18.2390 19.4064 19.4064 k = 0.1782 0.3086-0.0000 ( 4942 PWs) bands (ev): -78.6249 -78.6249 -78.6159 -78.6159 -44.3390 -44.3390 -44.3094 -44.3094 -42.6583 -42.6583 -42.5912 -42.5912 -42.5625 -42.5625 -42.5513 -42.5513 -1.8264 -1.8264 -0.3606 -0.3606 6.9926 6.9926 7.5276 7.5276 7.7909 7.7909 8.3674 8.3674 9.3529 9.3529 9.7441 9.7441 10.7063 10.7063 11.8032 11.8032 11.9041 11.9041 12.2060 12.2060 12.2422 12.2422 12.3474 12.3474 13.1340 13.1340 13.8498 13.8498 13.8757 13.8757 14.2574 14.2574 18.3673 18.3673 19.3769 19.3769 k = 0.1724 0.2986-0.0000 ( 4946 PWs) bands (ev): -78.6251 -78.6251 -78.6159 -78.6159 -44.3390 -44.3390 -44.3094 -44.3094 -42.6583 -42.6583 -42.5912 -42.5912 -42.5625 -42.5625 -42.5512 -42.5512 -1.8778 -1.8778 -0.3585 -0.3585 6.9209 6.9209 7.6411 7.6411 7.8219 7.8219 8.3897 8.3897 9.3904 9.3904 9.7982 9.7982 10.6933 10.6933 11.7830 11.7830 11.9018 11.9018 12.2130 12.2130 12.2485 12.2485 12.3488 12.3488 13.1640 13.1640 13.8746 13.8746 13.9205 13.9205 14.2632 14.2632 18.5007 18.5007 19.3481 19.3481 k = 0.1667 0.2887-0.0000 ( 4938 PWs) bands (ev): -78.6247 -78.6247 -78.6159 -78.6159 -44.3390 -44.3390 -44.3092 -44.3092 -42.6583 -42.6583 -42.5911 -42.5911 -42.5624 -42.5624 -42.5512 -42.5512 -1.9286 -1.9286 -0.3571 -0.3571 6.8502 6.8502 7.7575 7.7575 7.8538 7.8538 8.4102 8.4102 9.4310 9.4310 9.8537 9.8537 10.6821 10.6821 11.7629 11.7629 11.8999 11.8999 12.2195 12.2195 12.2558 12.2558 12.3509 12.3509 13.1928 13.1928 13.8969 13.8969 13.9706 13.9706 14.2640 14.2640 18.6391 18.6391 19.3166 19.3166 k = 0.1609 0.2787-0.0000 ( 4930 PWs) bands (ev): -78.6247 -78.6247 -78.6156 -78.6156 -44.3388 -44.3388 -44.3092 -44.3092 -42.6583 -42.6583 -42.5911 -42.5911 -42.5623 -42.5623 -42.5510 -42.5510 -1.9785 -1.9785 -0.3563 -0.3563 6.7808 6.7808 7.8721 7.8721 7.8904 7.8904 8.4289 8.4289 9.4749 9.4749 9.9104 9.9104 10.6709 10.6709 11.7445 11.7445 11.8970 11.8970 12.2247 12.2247 12.2622 12.2622 12.3526 12.3526 13.2212 13.2212 13.9185 13.9185 14.0239 14.0239 14.2597 14.2597 18.7821 18.7821 19.2609 19.2609 k = 0.1552 0.2688-0.0000 ( 4930 PWs) bands (ev): -78.6247 -78.6247 -78.6156 -78.6156 -44.3388 -44.3388 -44.3091 -44.3091 -42.6582 -42.6582 -42.5910 -42.5910 -42.5622 -42.5622 -42.5509 -42.5509 -2.0275 -2.0275 -0.3561 -0.3561 6.7129 6.7129 7.9160 7.9160 8.0000 8.0000 8.4459 8.4459 9.5217 9.5217 9.9681 9.9681 10.6604 10.6604 11.7247 11.7247 11.8936 11.8936 12.2296 12.2296 12.2675 12.2675 12.3539 12.3539 13.2474 13.2474 13.9392 13.9392 14.0796 14.0796 14.2505 14.2505 18.9278 18.9278 19.1631 19.1631 k = 0.1494 0.2588-0.0000 ( 4932 PWs) bands (ev): -78.6246 -78.6246 -78.6158 -78.6158 -44.3388 -44.3388 -44.3091 -44.3091 -42.6583 -42.6583 -42.5910 -42.5910 -42.5621 -42.5621 -42.5509 -42.5509 -2.0755 -2.0755 -0.3564 -0.3564 6.6467 6.6467 7.9484 7.9484 8.1228 8.1228 8.4616 8.4616 9.5715 9.5715 10.0267 10.0267 10.6512 10.6512 11.7044 11.7044 11.8894 11.8894 12.2337 12.2337 12.2720 12.2720 12.3551 12.3551 13.2719 13.2719 13.9603 13.9603 14.1361 14.1361 14.2374 14.2374 19.0213 19.0213 19.1063 19.1063 k = 0.1437 0.2489-0.0000 ( 4936 PWs) bands (ev): -78.6247 -78.6247 -78.6160 -78.6160 -44.3389 -44.3389 -44.3090 -44.3090 -42.6583 -42.6583 -42.5910 -42.5910 -42.5620 -42.5620 -42.5509 -42.5509 -2.1224 -2.1224 -0.3572 -0.3572 6.5822 6.5822 7.9803 7.9803 8.2463 8.2463 8.4767 8.4767 9.6242 9.6242 10.0864 10.0864 10.6428 10.6428 11.6852 11.6852 11.8838 11.8838 12.2377 12.2377 12.2751 12.2751 12.3567 12.3567 13.2952 13.2952 13.9811 13.9811 14.1838 14.1838 14.2302 14.2302 18.9168 18.9168 19.2466 19.2466 k = 0.1379 0.2389-0.0000 ( 4932 PWs) bands (ev): -78.6247 -78.6247 -78.6158 -78.6158 -44.3388 -44.3388 -44.3090 -44.3090 -42.6582 -42.6582 -42.5910 -42.5910 -42.5619 -42.5619 -42.5508 -42.5508 -2.1681 -2.1681 -0.3584 -0.3584 6.5198 6.5198 8.0119 8.0119 8.3659 8.3659 8.4962 8.4962 9.6801 9.6801 10.1470 10.1470 10.6356 10.6356 11.6665 11.6665 11.8781 11.8781 12.2413 12.2413 12.2770 12.2770 12.3576 12.3576 13.3180 13.3180 14.0017 14.0017 14.1838 14.1838 14.2699 14.2699 18.7974 18.7974 19.2670 19.2670 k = 0.1322 0.2289-0.0000 ( 4932 PWs) bands (ev): -78.6247 -78.6247 -78.6158 -78.6158 -44.3388 -44.3388 -44.3089 -44.3089 -42.6582 -42.6582 -42.5909 -42.5909 -42.5618 -42.5618 -42.5507 -42.5507 -2.2125 -2.2125 -0.3601 -0.3601 6.4592 6.4592 8.0430 8.0430 8.4538 8.4538 8.5469 8.5469 9.7385 9.7385 10.2084 10.2084 10.6296 10.6296 11.6479 11.6479 11.8717 11.8717 12.2443 12.2443 12.2774 12.2774 12.3583 12.3583 13.3390 13.3390 14.0194 14.0194 14.1640 14.1640 14.3297 14.3297 18.6764 18.6764 19.2563 19.2563 k = 0.1264 0.2190-0.0000 ( 4922 PWs) bands (ev): -78.6243 -78.6243 -78.6158 -78.6158 -44.3387 -44.3387 -44.3088 -44.3088 -42.6582 -42.6582 -42.5908 -42.5908 -42.5617 -42.5617 -42.5506 -42.5506 -2.2555 -2.2555 -0.3621 -0.3621 6.4007 6.4007 8.0736 8.0736 8.4826 8.4826 8.6564 8.6564 9.7994 9.7994 10.2707 10.2707 10.6249 10.6249 11.6307 11.6307 11.8651 11.8651 12.2475 12.2475 12.2777 12.2777 12.3593 12.3593 13.3592 13.3592 14.0281 14.0281 14.1485 14.1485 14.3930 14.3930 18.5549 18.5549 19.2451 19.2451 k = 0.1207 0.2090-0.0000 ( 4926 PWs) bands (ev): -78.6243 -78.6243 -78.6160 -78.6160 -44.3387 -44.3387 -44.3087 -44.3087 -42.6582 -42.6582 -42.5908 -42.5908 -42.5616 -42.5616 -42.5506 -42.5506 -2.2971 -2.2971 -0.3644 -0.3644 6.3444 6.3444 8.1036 8.1036 8.4939 8.4939 8.7824 8.7824 9.8624 9.8624 10.3331 10.3331 10.6210 10.6210 11.6135 11.6135 11.8579 11.8579 12.2469 12.2469 12.2766 12.2766 12.3597 12.3597 13.3779 13.3779 14.0178 14.0178 14.1488 14.1488 14.4568 14.4568 18.4329 18.4329 19.2284 19.2284 k = 0.1149 0.1991-0.0000 ( 4917 PWs) bands (ev): -78.6243 -78.6243 -78.6156 -78.6156 -44.3386 -44.3386 -44.3087 -44.3087 -42.6581 -42.6581 -42.5908 -42.5908 -42.5615 -42.5615 -42.5504 -42.5504 -2.3372 -2.3372 -0.3669 -0.3669 6.2904 6.2904 8.1327 8.1327 8.5010 8.5010 8.9116 8.9116 9.9284 9.9284 10.3963 10.3963 10.6190 10.6190 11.5972 11.5972 11.8507 11.8507 12.2439 12.2439 12.2766 12.2766 12.3602 12.3602 13.3958 13.3958 13.9883 13.9883 14.1676 14.1676 14.5213 14.5213 18.3109 18.3109 19.1987 19.1987 k = 0.1092 0.1891-0.0000 ( 4921 PWs) bands (ev): -78.6243 -78.6243 -78.6158 -78.6158 -44.3386 -44.3386 -44.3086 -44.3086 -42.6581 -42.6581 -42.5908 -42.5908 -42.5614 -42.5614 -42.5504 -42.5504 -2.3757 -2.3757 -0.3697 -0.3697 6.2386 6.2386 8.1609 8.1609 8.5059 8.5059 9.0414 9.0414 9.9954 9.9954 10.4589 10.4589 10.6189 10.6189 11.5810 11.5810 11.8426 11.8426 12.2367 12.2367 12.2777 12.2777 12.3606 12.3606 13.4120 13.4120 13.9465 13.9465 14.1966 14.1966 14.5850 14.5850 18.1885 18.1885 19.1398 19.1398 k = 0.1034 0.1792-0.0000 ( 4923 PWs) bands (ev): -78.6245 -78.6245 -78.6157 -78.6157 -44.3386 -44.3386 -44.3087 -44.3087 -42.6581 -42.6581 -42.5908 -42.5908 -42.5614 -42.5614 -42.5504 -42.5504 -2.4125 -2.4125 -0.3726 -0.3726 6.1893 6.1893 8.1880 8.1880 8.5093 8.5093 9.1705 9.1705 10.0640 10.0640 10.5209 10.5209 10.6218 10.6218 11.5656 11.5656 11.8343 11.8343 12.2257 12.2257 12.2798 12.2798 12.3611 12.3611 13.4284 13.4284 13.8984 13.8984 14.2317 14.2317 14.6476 14.6476 18.0658 18.0658 19.0414 19.0414 k = 0.0977 0.1692-0.0000 ( 4923 PWs) bands (ev): -78.6245 -78.6245 -78.6157 -78.6157 -44.3385 -44.3385 -44.3086 -44.3086 -42.6581 -42.6581 -42.5908 -42.5908 -42.5613 -42.5613 -42.5503 -42.5503 -2.4477 -2.4477 -0.3757 -0.3757 6.1422 6.1422 8.2140 8.2140 8.5119 8.5119 9.2982 9.2982 10.1340 10.1340 10.5770 10.5770 10.6327 10.6327 11.5509 11.5509 11.8261 11.8261 12.2116 12.2116 12.2829 12.2829 12.3617 12.3617 13.4426 13.4426 13.8458 13.8458 14.2717 14.2717 14.7094 14.7094 17.9429 17.9429 18.9139 18.9139 k = 0.0920 0.1593-0.0000 ( 4927 PWs) bands (ev): -78.6245 -78.6245 -78.6159 -78.6159 -44.3386 -44.3386 -44.3086 -44.3086 -42.6581 -42.6581 -42.5907 -42.5907 -42.5612 -42.5612 -42.5503 -42.5503 -2.4811 -2.4811 -0.3788 -0.3788 6.0976 6.0976 8.2387 8.2387 8.5137 8.5137 9.4235 9.4235 10.2045 10.2045 10.6092 10.6092 10.6695 10.6695 11.5365 11.5365 11.8177 11.8177 12.1945 12.1945 12.2863 12.2863 12.3624 12.3624 13.4557 13.4557 13.7900 13.7900 14.3156 14.3156 14.7695 14.7695 17.8195 17.8195 18.7722 18.7722 k = 0.0862 0.1493-0.0000 ( 4931 PWs) bands (ev): -78.6247 -78.6247 -78.6159 -78.6159 -44.3385 -44.3385 -44.3086 -44.3086 -42.6581 -42.6581 -42.5907 -42.5907 -42.5612 -42.5612 -42.5502 -42.5502 -2.5127 -2.5127 -0.3820 -0.3820 6.0556 6.0556 8.2621 8.2621 8.5149 8.5149 9.5452 9.5452 10.2758 10.2758 10.6231 10.6231 10.7272 10.7272 11.5234 11.5234 11.8091 11.8091 12.1750 12.1750 12.2896 12.2896 12.3630 12.3630 13.4679 13.4679 13.7317 13.7317 14.3632 14.3632 14.8274 14.8274 17.6960 17.6960 18.6252 18.6252 k = 0.0805 0.1394-0.0000 ( 4931 PWs) bands (ev): -78.6247 -78.6247 -78.6159 -78.6159 -44.3385 -44.3385 -44.3086 -44.3086 -42.6581 -42.6581 -42.5907 -42.5907 -42.5611 -42.5611 -42.5502 -42.5502 -2.5425 -2.5425 -0.3852 -0.3852 6.0160 6.0160 8.2840 8.2840 8.5159 8.5159 9.6624 9.6624 10.3472 10.3472 10.6360 10.6360 10.7891 10.7891 11.5110 11.5110 11.8006 11.8006 12.1535 12.1535 12.2938 12.2938 12.3632 12.3632 13.4791 13.4791 13.6719 13.6719 14.4147 14.4147 14.8833 14.8833 17.5723 17.5723 18.4773 18.4773 k = 0.0747 0.1294-0.0000 ( 4931 PWs) bands (ev): -78.6248 -78.6248 -78.6157 -78.6157 -44.3384 -44.3384 -44.3086 -44.3086 -42.6580 -42.6580 -42.5907 -42.5907 -42.5611 -42.5611 -42.5501 -42.5501 -2.5704 -2.5704 -0.3883 -0.3883 5.9791 5.9791 8.3042 8.3042 8.5165 8.5165 9.7731 9.7731 10.4179 10.4179 10.6520 10.6520 10.8518 10.8518 11.4999 11.4999 11.7911 11.7911 12.1303 12.1303 12.2973 12.2973 12.3651 12.3651 13.4909 13.4909 13.6110 13.6110 14.4695 14.4695 14.9350 14.9350 17.4485 17.4485 18.3312 18.3312 k = 0.0690 0.1195-0.0000 ( 4925 PWs) bands (ev): -78.6248 -78.6248 -78.6156 -78.6156 -44.3384 -44.3384 -44.3085 -44.3085 -42.6580 -42.6580 -42.5907 -42.5907 -42.5611 -42.5611 -42.5500 -42.5500 -2.5964 -2.5964 -0.3914 -0.3914 5.9448 5.9448 8.3230 8.3230 8.5172 8.5172 9.8764 9.8764 10.4876 10.4876 10.6735 10.6735 10.9138 10.9138 11.4899 11.4899 11.7816 11.7816 12.1060 12.1060 12.3013 12.3013 12.3664 12.3664 13.5009 13.5009 13.5495 13.5495 14.5286 14.5286 14.9839 14.9839 17.3249 17.3249 18.1889 18.1889 k = 0.0632 0.1095-0.0000 ( 4923 PWs) bands (ev): -78.6247 -78.6247 -78.6156 -78.6156 -44.3383 -44.3383 -44.3085 -44.3085 -42.6580 -42.6580 -42.5906 -42.5906 -42.5610 -42.5610 -42.5499 -42.5499 -2.6204 -2.6204 -0.3943 -0.3943 5.9131 5.9131 8.3400 8.3400 8.5180 8.5180 9.9700 9.9700 10.5554 10.5554 10.7013 10.7013 10.9740 10.9740 11.4805 11.4805 11.7712 11.7712 12.0811 12.0811 12.3050 12.3050 12.3677 12.3677 13.4880 13.4880 13.5095 13.5095 14.5914 14.5914 15.0290 15.0290 17.2019 17.2019 18.0516 18.0516 k = 0.0575 0.0995-0.0000 ( 4931 PWs) bands (ev): -78.6247 -78.6247 -78.6160 -78.6160 -44.3384 -44.3384 -44.3085 -44.3085 -42.6580 -42.6580 -42.5906 -42.5906 -42.5609 -42.5609 -42.5500 -42.5500 -2.6424 -2.6424 -0.3971 -0.3971 5.8841 5.8841 8.3550 8.3550 8.5191 8.5191 10.0520 10.0520 10.6207 10.6207 10.7365 10.7365 11.0316 11.0316 11.4713 11.4713 11.7595 11.7595 12.0559 12.0559 12.3085 12.3085 12.3692 12.3692 13.4270 13.4270 13.5163 13.5163 14.6568 14.6568 15.0700 15.0700 17.0796 17.0796 17.9209 17.9209 k = 0.0517 0.0896-0.0000 ( 4921 PWs) bands (ev): -78.6242 -78.6242 -78.6160 -78.6160 -44.3384 -44.3384 -44.3083 -44.3083 -42.6581 -42.6581 -42.5905 -42.5905 -42.5608 -42.5608 -42.5499 -42.5499 -2.6624 -2.6624 -0.3997 -0.3997 5.8577 5.8577 8.3683 8.3683 8.5207 8.5207 10.1216 10.1216 10.6839 10.6839 10.7792 10.7792 11.0880 11.0880 11.4644 11.4644 11.7464 11.7464 12.0316 12.0316 12.3128 12.3128 12.3719 12.3719 13.3678 13.3678 13.5231 13.5231 14.7264 14.7264 15.1071 15.1071 16.9588 16.9588 17.7982 17.7982 k = 0.0460 0.0796-0.0000 ( 4921 PWs) bands (ev): -78.6240 -78.6240 -78.6162 -78.6162 -44.3385 -44.3385 -44.3082 -44.3082 -42.6581 -42.6581 -42.5904 -42.5904 -42.5607 -42.5607 -42.5500 -42.5500 -2.6804 -2.6804 -0.4022 -0.4022 5.8341 5.8341 8.3795 8.3795 8.5225 8.5225 10.1782 10.1782 10.7457 10.7457 10.8271 10.8271 11.1406 11.1406 11.4580 11.4580 11.7310 11.7310 12.0085 12.0085 12.3164 12.3164 12.3746 12.3746 13.3106 13.3106 13.5286 13.5286 14.7968 14.7968 15.1395 15.1395 16.8402 16.8402 17.6848 17.6848 k = 0.0402 0.0697-0.0000 ( 4919 PWs) bands (ev): -78.6240 -78.6240 -78.6162 -78.6162 -44.3385 -44.3385 -44.3082 -44.3082 -42.6581 -42.6581 -42.5904 -42.5904 -42.5607 -42.5607 -42.5499 -42.5499 -2.6963 -2.6963 -0.4043 -0.4043 5.8132 5.8132 8.3888 8.3888 8.5248 8.5248 10.2224 10.2224 10.8067 10.8067 10.8772 10.8772 11.1898 11.1898 11.4538 11.4538 11.7128 11.7128 11.9878 11.9878 12.3195 12.3195 12.3765 12.3765 13.2566 13.2566 13.5339 13.5339 14.8690 14.8690 15.1679 15.1679 16.7248 16.7248 17.5816 17.5816 k = 0.0345 0.0597-0.0000 ( 4919 PWs) bands (ev): -78.6240 -78.6240 -78.6162 -78.6162 -44.3384 -44.3384 -44.3082 -44.3082 -42.6581 -42.6581 -42.5904 -42.5904 -42.5606 -42.5606 -42.5499 -42.5499 -2.7101 -2.7101 -0.4063 -0.4063 5.7950 5.7950 8.3963 8.3963 8.5272 8.5272 10.2559 10.2559 10.8666 10.8666 10.9263 10.9263 11.2346 11.2346 11.4514 11.4514 11.6914 11.6914 11.9700 11.9700 12.3224 12.3224 12.3786 12.3786 13.2065 13.2065 13.5384 13.5384 14.9411 14.9411 15.1918 15.1918 16.6138 16.6138 17.4898 17.4898 k = 0.0287 0.0498-0.0000 ( 4911 PWs) bands (ev): -78.6238 -78.6238 -78.6160 -78.6160 -44.3384 -44.3384 -44.3081 -44.3081 -42.6580 -42.6580 -42.5903 -42.5903 -42.5606 -42.5606 -42.5498 -42.5498 -2.7219 -2.7219 -0.4080 -0.4080 5.7797 5.7797 8.4021 8.4021 8.5299 8.5299 10.2807 10.2807 10.9239 10.9239 10.9721 10.9721 11.2745 11.2745 11.4517 11.4517 11.6672 11.6672 11.9556 11.9556 12.3260 12.3260 12.3814 12.3814 13.1616 13.1616 13.5425 13.5425 15.0116 15.0116 15.2124 15.2124 16.5090 16.5090 17.4106 17.4106 k = 0.0230 0.0398-0.0000 ( 4911 PWs) bands (ev): -78.6238 -78.6238 -78.6160 -78.6160 -44.3384 -44.3384 -44.3081 -44.3081 -42.6580 -42.6580 -42.5903 -42.5903 -42.5605 -42.5605 -42.5498 -42.5498 -2.7315 -2.7315 -0.4094 -0.4094 5.7671 5.7671 8.4065 8.4065 8.5323 8.5323 10.2987 10.2987 10.9763 10.9763 11.0119 11.0119 11.3083 11.3083 11.4537 11.4537 11.6405 11.6405 11.9445 11.9445 12.3281 12.3281 12.3837 12.3837 13.1226 13.1226 13.5456 13.5456 15.0775 15.0775 15.2300 15.2300 16.4129 16.4129 17.3446 17.3446 k = 0.0172 0.0299-0.0000 ( 4915 PWs) bands (ev): -78.6240 -78.6240 -78.6160 -78.6160 -44.3384 -44.3384 -44.3081 -44.3081 -42.6580 -42.6580 -42.5904 -42.5904 -42.5606 -42.5606 -42.5498 -42.5498 -2.7390 -2.7390 -0.4105 -0.4105 5.7573 5.7573 8.4097 8.4097 8.5345 8.5345 10.3112 10.3112 11.0214 11.0214 11.0444 11.0444 11.3356 11.3356 11.4581 11.4581 11.6130 11.6130 11.9365 11.9365 12.3291 12.3291 12.3852 12.3852 13.0907 13.0907 13.5480 13.5480 15.1339 15.1339 15.2465 15.2465 16.3291 16.3291 17.2925 17.2925 k = 0.0115 0.0199-0.0000 ( 4907 PWs) bands (ev): -78.6238 -78.6238 -78.6158 -78.6158 -44.3383 -44.3383 -44.3080 -44.3080 -42.6580 -42.6580 -42.5903 -42.5903 -42.5605 -42.5605 -42.5497 -42.5497 -2.7443 -2.7443 -0.4113 -0.4113 5.7503 5.7503 8.4118 8.4118 8.5362 8.5362 10.3199 10.3199 11.0568 11.0568 11.0687 11.0687 11.3566 11.3566 11.4648 11.4648 11.5873 11.5873 11.9313 11.9313 12.3311 12.3311 12.3876 12.3876 13.0671 13.0671 13.5500 13.5500 15.1751 15.1751 15.2642 15.2642 16.2624 16.2624 17.2552 17.2552 k = 0.0057 0.0100-0.0000 ( 4903 PWs) bands (ev): -78.6236 -78.6236 -78.6158 -78.6158 -44.3383 -44.3383 -44.3080 -44.3080 -42.6580 -42.6580 -42.5902 -42.5902 -42.5605 -42.5605 -42.5497 -42.5497 -2.7476 -2.7476 -0.4118 -0.4118 5.7460 5.7460 8.4130 8.4130 8.5373 8.5373 10.3250 10.3250 11.0793 11.0793 11.0833 11.0833 11.3699 11.3699 11.4720 11.4720 11.5672 11.5672 11.9283 11.9283 12.3326 12.3326 12.3894 12.3894 13.0525 13.0525 13.5501 13.5501 15.1972 15.1972 15.2808 15.2808 16.2186 16.2186 17.2327 17.2327 k = 0.0000 0.0000 0.0000 ( 4901 PWs) bands (ev): -78.6228 -78.6228 -78.6164 -78.6164 -44.3385 -44.3385 -44.3078 -44.3078 -42.6582 -42.6582 -42.5901 -42.5901 -42.5603 -42.5603 -42.5498 -42.5498 -2.7486 -2.7486 -0.4119 -0.4119 5.7445 5.7445 8.4134 8.4134 8.5376 8.5376 10.3266 10.3266 11.0861 11.0861 11.0873 11.0873 11.3739 11.3739 11.4748 11.4748 11.5592 11.5592 11.9273 11.9273 12.3353 12.3353 12.3924 12.3924 13.0476 13.0476 13.5497 13.5497 15.2044 15.2044 15.2887 15.2887 16.2033 16.2033 17.2253 17.2253 k = 0.0000 0.0000 0.0000 ( 4901 PWs) bands (ev): -78.6228 -78.6228 -78.6164 -78.6164 -44.3385 -44.3385 -44.3078 -44.3078 -42.6582 -42.6582 -42.5901 -42.5901 -42.5603 -42.5603 -42.5498 -42.5498 -2.7486 -2.7486 -0.4119 -0.4119 5.7445 5.7445 8.4134 8.4134 8.5376 8.5376 10.3266 10.3266 11.0861 11.0861 11.0873 11.0873 11.3739 11.3739 11.4748 11.4748 11.5592 11.5592 11.9273 11.9273 12.3353 12.3353 12.3924 12.3924 13.0476 13.0476 13.5497 13.5497 15.2044 15.2044 15.2887 15.2887 16.2033 16.2033 17.2253 17.2253 k = 0.0000 0.0000 0.0114 ( 4901 PWs) bands (ev): -78.6237 -78.6237 -78.6156 -78.6156 -44.3382 -44.3382 -44.3080 -44.3080 -42.6579 -42.6579 -42.5903 -42.5903 -42.5605 -42.5605 -42.5497 -42.5497 -2.7475 -2.7475 -0.4145 -0.4145 5.7491 5.7491 8.4145 8.4145 8.5387 8.5387 10.3268 10.3268 11.0875 11.0875 11.0892 11.0892 11.3634 11.3634 11.4238 11.4238 11.6091 11.6091 11.9352 11.9352 12.3333 12.3333 12.3927 12.3927 13.0405 13.0405 13.5483 13.5483 15.2025 15.2025 15.2870 15.2870 16.2072 16.2072 17.2321 17.2321 k = 0.0000 0.0000 0.0228 ( 4913 PWs) bands (ev): -78.6242 -78.6242 -78.6157 -78.6157 -44.3382 -44.3382 -44.3083 -44.3083 -42.6578 -42.6578 -42.5906 -42.5906 -42.5605 -42.5605 -42.5497 -42.5497 -2.7442 -2.7442 -0.4224 -0.4224 5.7623 5.7623 8.4174 8.4174 8.5416 8.5416 10.3267 10.3267 11.0880 11.0880 11.0910 11.0910 11.3325 11.3325 11.3441 11.3441 11.6838 11.6838 11.9561 11.9561 12.3340 12.3340 12.4005 12.4005 13.0197 13.0197 13.5382 13.5382 15.1992 15.1992 15.2839 15.2839 16.2186 16.2186 17.2522 17.2522 k = 0.0000 0.0000 0.0342 ( 4913 PWs) bands (ev): -78.6242 -78.6242 -78.6157 -78.6157 -44.3381 -44.3381 -44.3084 -44.3084 -42.6576 -42.6576 -42.5909 -42.5909 -42.5605 -42.5605 -42.5497 -42.5497 -2.7387 -2.7387 -0.4354 -0.4354 5.7842 5.7842 8.4224 8.4224 8.5466 8.5466 10.3267 10.3267 11.0884 11.0884 11.0943 11.0943 11.2611 11.2611 11.2876 11.2876 11.7580 11.7580 11.9842 11.9842 12.3399 12.3399 12.4189 12.4189 12.9857 12.9857 13.5216 13.5216 15.1942 15.1942 15.2793 15.2793 16.2376 16.2376 17.2857 17.2857 k = 0.0000 0.0000 0.0456 ( 4913 PWs) bands (ev): -78.6242 -78.6242 -78.6158 -78.6158 -44.3379 -44.3379 -44.3085 -44.3085 -42.6573 -42.6573 -42.5913 -42.5913 -42.5604 -42.5604 -42.5498 -42.5498 -2.7309 -2.7309 -0.4534 -0.4534 5.8146 5.8146 8.4294 8.4294 8.5535 8.5535 10.3284 10.3284 11.0866 11.0866 11.0988 11.0988 11.1769 11.1769 11.2354 11.2354 11.8280 11.8280 12.0130 12.0130 12.3483 12.3483 12.4455 12.4455 12.9400 12.9400 13.4988 13.4988 15.1869 15.1869 15.2725 15.2725 16.2637 16.2637 17.3318 17.3318 k = 0.0000 0.0000 0.0571 ( 4913 PWs) bands (ev): -78.6241 -78.6241 -78.6158 -78.6158 -44.3377 -44.3377 -44.3087 -44.3087 -42.6569 -42.6569 -42.5917 -42.5917 -42.5604 -42.5604 -42.5499 -42.5499 -2.7210 -2.7210 -0.4763 -0.4763 5.8535 5.8535 8.4383 8.4383 8.5624 8.5624 10.3304 10.3304 11.0765 11.0765 11.0925 11.0925 11.1047 11.1047 11.1857 11.1857 11.8909 11.8909 12.0377 12.0377 12.3617 12.3617 12.4823 12.4823 12.8843 12.8843 13.4702 13.4702 15.1775 15.1775 15.2638 15.2638 16.2967 16.2967 17.3888 17.3888 k = 0.0000 0.0000 0.0685 ( 4937 PWs) bands (ev): -78.6246 -78.6246 -78.6164 -78.6164 -44.3377 -44.3377 -44.3091 -44.3091 -42.6565 -42.6565 -42.5924 -42.5924 -42.5604 -42.5604 -42.5501 -42.5501 -2.7088 -2.7088 -0.5038 -0.5038 5.9005 5.9005 8.4491 8.4491 8.5730 8.5730 10.3320 10.3320 11.0073 11.0073 11.0427 11.0427 11.1111 11.1111 11.1544 11.1544 11.9429 11.9429 12.0547 12.0547 12.3793 12.3793 12.5279 12.5279 12.8212 12.8212 13.4352 13.4352 15.1654 15.1654 15.2525 15.2525 16.3362 16.3362 17.4550 17.4550 k = 0.0000 0.0000 0.0799 ( 4949 PWs) bands (ev): -78.6246 -78.6246 -78.6171 -78.6171 -44.3376 -44.3376 -44.3093 -44.3093 -42.6561 -42.6561 -42.5930 -42.5930 -42.5603 -42.5603 -42.5502 -42.5502 -2.6945 -2.6945 -0.5356 -0.5356 5.9551 5.9551 8.4619 8.4619 8.5857 8.5857 10.3332 10.3332 10.9232 10.9232 10.9854 10.9854 11.1187 11.1187 11.1462 11.1462 11.9836 11.9836 12.0653 12.0653 12.4047 12.4047 12.5847 12.5847 12.7552 12.7552 13.3926 13.3926 15.1516 15.1516 15.2396 15.2396 16.3817 16.3817 17.5296 17.5296 k = 0.0000 0.0000 0.0913 ( 4937 PWs) bands (ev): -78.6245 -78.6245 -78.6167 -78.6167 -44.3371 -44.3371 -44.3096 -44.3096 -42.6553 -42.6553 -42.5937 -42.5937 -42.5602 -42.5602 -42.5503 -42.5503 -2.6779 -2.6779 -0.5716 -0.5716 6.0177 6.0177 8.4770 8.4770 8.6007 8.6007 10.3334 10.3334 10.8398 10.8398 10.9173 10.9173 11.1295 11.1295 11.1503 11.1503 12.0112 12.0112 12.0695 12.0695 12.4283 12.4283 12.6491 12.6491 12.6962 12.6962 13.3498 13.3498 15.1361 15.1361 15.2252 15.2252 16.4331 16.4331 17.6107 17.6107 k = 0.0000 0.0000 0.1027 ( 4943 PWs) bands (ev): -78.6247 -78.6247 -78.6168 -78.6168 -44.3367 -44.3367 -44.3100 -44.3100 -42.6546 -42.6546 -42.5946 -42.5946 -42.5601 -42.5601 -42.5504 -42.5504 -2.6593 -2.6593 -0.6114 -0.6114 6.0873 6.0873 8.4939 8.4939 8.6175 8.6175 10.3303 10.3303 10.7569 10.7569 10.8444 10.8444 11.1403 11.1403 11.1577 11.1577 12.0263 12.0263 12.0679 12.0679 12.4290 12.4290 12.6661 12.6661 12.7192 12.7192 13.3020 13.3020 15.1182 15.1182 15.2085 15.2085 16.4896 16.4896 17.6960 17.6960 k = 0.0000 0.0000 0.1141 ( 4937 PWs) bands (ev): -78.6243 -78.6243 -78.6169 -78.6169 -44.3364 -44.3364 -44.3103 -44.3103 -42.6538 -42.6538 -42.5953 -42.5953 -42.5599 -42.5599 -42.5505 -42.5505 -2.6384 -2.6384 -0.6546 -0.6546 6.1640 6.1640 8.5128 8.5128 8.6362 8.6362 10.3278 10.3278 10.6750 10.6750 10.7697 10.7697 11.1523 11.1523 11.1677 11.1677 12.0311 12.0311 12.0619 12.0619 12.3875 12.3875 12.6844 12.6844 12.7939 12.7939 13.2507 13.2507 15.0980 15.0980 15.1897 15.1897 16.5508 16.5508 17.7857 17.7857 k = 0.0000 0.0000 0.1255 ( 4931 PWs) bands (ev): -78.6239 -78.6239 -78.6171 -78.6171 -44.3359 -44.3359 -44.3106 -44.3106 -42.6529 -42.6529 -42.5962 -42.5962 -42.5597 -42.5597 -42.5507 -42.5507 -2.6154 -2.6154 -0.7010 -0.7010 6.2471 6.2471 8.5336 8.5336 8.6569 8.6569 10.3197 10.3197 10.5943 10.5943 10.6942 10.6942 11.1656 11.1656 11.1797 11.1797 12.0278 12.0278 12.0527 12.0527 12.3183 12.3183 12.7367 12.7367 12.8720 12.8720 13.1963 13.1963 15.0760 15.0760 15.1692 15.1692 16.6165 16.6165 17.8767 17.8767 k = 0.0000 0.0000 0.1369 ( 4931 PWs) bands (ev): -78.6238 -78.6238 -78.6172 -78.6172 -44.3355 -44.3355 -44.3111 -44.3111 -42.6519 -42.6519 -42.5973 -42.5973 -42.5596 -42.5596 -42.5509 -42.5509 -2.5904 -2.5904 -0.7503 -0.7503 6.3365 6.3365 8.5564 8.5564 8.6794 8.6794 10.3063 10.3063 10.5154 10.5154 10.6184 10.6184 11.1800 11.1800 11.1931 11.1931 12.0171 12.0171 12.0402 12.0402 12.2400 12.2400 12.8041 12.8041 12.9518 12.9518 13.1391 13.1391 15.0514 15.0514 15.1463 15.1463 16.6862 16.6862 17.9678 17.9678 k = 0.0000 0.0000 0.1484 ( 4931 PWs) bands (ev): -78.6237 -78.6237 -78.6174 -78.6174 -44.3350 -44.3350 -44.3115 -44.3115 -42.6509 -42.6509 -42.5984 -42.5984 -42.5594 -42.5594 -42.5510 -42.5510 -2.5632 -2.5632 -0.8021 -0.8021 6.4317 6.4317 8.5811 8.5811 8.7039 8.7039 10.2852 10.2852 10.4392 10.4392 10.5426 10.5426 11.1956 11.1956 11.2079 11.2079 11.9989 11.9989 12.0252 12.0252 12.1631 12.1631 12.8789 12.8789 13.0330 13.0330 13.0797 13.0797 15.0246 15.0246 15.1211 15.1211 16.7596 16.7596 18.0575 18.0575 k = 0.0000 0.0000 0.1598 ( 4919 PWs) bands (ev): -78.6230 -78.6230 -78.6176 -78.6176 -44.3345 -44.3345 -44.3119 -44.3119 -42.6498 -42.6498 -42.5994 -42.5994 -42.5592 -42.5592 -42.5512 -42.5512 -2.5339 -2.5339 -0.8561 -0.8561 6.5324 6.5324 8.6078 8.6078 8.7304 8.7304 10.2543 10.2543 10.3682 10.3682 10.4674 10.4674 11.2122 11.2122 11.2239 11.2239 11.9716 11.9716 12.0089 12.0089 12.0958 12.0958 12.9585 12.9585 13.0183 13.0183 13.1159 13.1159 14.9955 14.9955 15.0939 15.0939 16.8363 16.8363 18.1450 18.1450 k = 0.0000 0.0000 0.1712 ( 4913 PWs) bands (ev): -78.6228 -78.6228 -78.6175 -78.6175 -44.3338 -44.3338 -44.3124 -44.3124 -42.6485 -42.6485 -42.6006 -42.6006 -42.5590 -42.5590 -42.5514 -42.5514 -2.5027 -2.5027 -0.9121 -0.9121 6.6383 6.6383 8.6365 8.6365 8.7588 8.7588 10.2071 10.2071 10.3046 10.3046 10.3926 10.3926 11.2306 11.2306 11.2417 11.2417 11.9315 11.9315 11.9901 11.9901 12.0438 12.0438 12.9558 12.9558 13.0395 13.0395 13.1985 13.1985 14.9643 14.9643 15.0646 15.0646 16.9162 16.9162 18.2275 18.2275 k = 0.0000 0.0000 0.1826 ( 4912 PWs) bands (ev): -78.6226 -78.6226 -78.6177 -78.6177 -44.3333 -44.3333 -44.3129 -44.3129 -42.6473 -42.6473 -42.6019 -42.6019 -42.5587 -42.5587 -42.5516 -42.5516 -2.4694 -2.4694 -0.9696 -0.9696 6.7489 6.7489 8.6670 8.6670 8.7890 8.7890 10.1450 10.1450 10.2471 10.2471 10.3185 10.3185 11.2493 11.2493 11.2600 11.2600 11.8829 11.8829 11.9696 11.9696 12.0065 12.0065 12.8916 12.8916 13.1218 13.1218 13.2812 13.2812 14.9305 14.9305 15.0329 15.0329 16.9987 16.9987 18.3041 18.3041 k = 0.0000 0.0000 0.1940 ( 4924 PWs) bands (ev): -78.6224 -78.6224 -78.6184 -78.6184 -44.3328 -44.3328 -44.3135 -44.3135 -42.6461 -42.6461 -42.6033 -42.6033 -42.5585 -42.5585 -42.5519 -42.5519 -2.4341 -2.4341 -1.0285 -1.0285 6.8637 6.8637 8.6992 8.6992 8.8208 8.8208 10.0731 10.0731 10.1892 10.1892 10.2451 10.2451 11.2679 11.2679 11.2780 11.2780 11.8349 11.8349 11.9476 11.9476 11.9768 11.9768 12.8259 12.8259 13.2045 13.2045 13.3638 13.3638 14.8938 14.8938 14.9984 14.9984 17.0835 17.0835 18.3733 18.3733 k = 0.0000 0.0000 0.2054 ( 4924 PWs) bands (ev): -78.6222 -78.6222 -78.6186 -78.6186 -44.3322 -44.3322 -44.3141 -44.3141 -42.6448 -42.6448 -42.6047 -42.6047 -42.5583 -42.5583 -42.5521 -42.5521 -2.3969 -2.3969 -1.0885 -1.0885 6.9828 6.9828 8.7336 8.7336 8.8547 8.8547 9.9959 9.9959 10.1263 10.1263 10.1727 10.1727 11.2886 11.2886 11.2983 11.2983 11.7940 11.7940 11.9247 11.9247 11.9502 11.9502 12.7602 12.7602 13.2875 13.2875 13.4461 13.4461 14.8553 14.8553 14.9620 14.9620 17.1706 17.1706 18.4336 18.4336 k = 0.0000 0.0000 0.2168 ( 4924 PWs) bands (ev): -78.6220 -78.6220 -78.6189 -78.6189 -44.3315 -44.3315 -44.3147 -44.3147 -42.6433 -42.6433 -42.6062 -42.6062 -42.5581 -42.5581 -42.5524 -42.5524 -2.3578 -2.3578 -1.1494 -1.1494 7.1056 7.1056 8.7698 8.7698 8.8905 8.8905 9.9144 9.9144 10.0570 10.0570 10.1014 10.1014 11.3102 11.3102 11.3196 11.3196 11.7625 11.7625 11.9006 11.9006 11.9249 11.9249 12.6941 12.6941 13.3702 13.3702 13.5277 13.5277 14.8144 14.8144 14.9234 14.9234 17.2595 17.2595 18.4837 18.4837 k = 0.0000 0.0000 0.2282 ( 4918 PWs) bands (ev): -78.6218 -78.6218 -78.6188 -78.6188 -44.3308 -44.3308 -44.3154 -44.3154 -42.6418 -42.6418 -42.6077 -42.6077 -42.5578 -42.5578 -42.5526 -42.5526 -2.3169 -2.3169 -1.2108 -1.2108 7.2320 7.2320 8.8080 8.8080 8.9282 8.9282 9.8282 9.8282 9.9823 9.9823 10.0312 10.0312 11.3330 11.3330 11.3420 11.3420 11.7413 11.7413 11.8757 11.8757 11.9002 11.9002 12.6293 12.6293 13.4525 13.4525 13.6087 13.6087 14.7712 14.7712 14.8825 14.8825 17.3506 17.3506 18.5224 18.5224 k = 0.0000 0.0000 0.2397 ( 4918 PWs) bands (ev): -78.6216 -78.6216 -78.6190 -78.6190 -44.3301 -44.3301 -44.3160 -44.3160 -42.6402 -42.6402 -42.6093 -42.6093 -42.5575 -42.5575 -42.5529 -42.5529 -2.2741 -2.2741 -1.2726 -1.2726 7.3614 7.3614 8.8480 8.8480 8.9677 8.9677 9.7359 9.7359 9.9047 9.9047 9.9621 9.9621 11.3563 11.3563 11.3649 11.3649 11.7296 11.7296 11.8501 11.8501 11.8765 11.8765 12.5632 12.5632 13.5340 13.5340 13.6887 13.6887 14.7254 14.7254 14.8392 14.8392 17.4422 17.4422 18.5488 18.5488 k = 0.0000 0.0000 0.2511 ( 4918 PWs) bands (ev): -78.6213 -78.6213 -78.6193 -78.6193 -44.3293 -44.3293 -44.3167 -44.3167 -42.6387 -42.6387 -42.6109 -42.6109 -42.5573 -42.5573 -42.5531 -42.5531 -2.2295 -2.2295 -1.3346 -1.3346 7.4935 7.4935 8.8898 8.8898 9.0089 9.0089 9.6358 9.6358 9.8267 9.8267 9.8942 9.8942 11.3804 11.3804 11.3887 11.3887 11.7256 11.7256 11.8237 11.8237 11.8549 11.8549 12.4976 12.4976 13.6146 13.6146 13.7676 13.7676 14.6774 14.6774 14.7936 14.7936 17.5347 17.5347 18.5623 18.5623 k = 0.0000 0.0000 0.2625 ( 4918 PWs) bands (ev): -78.6211 -78.6211 -78.6195 -78.6195 -44.3286 -44.3286 -44.3174 -44.3174 -42.6371 -42.6371 -42.6126 -42.6126 -42.5570 -42.5570 -42.5534 -42.5534 -2.1833 -2.1833 -1.3966 -1.3966 7.6281 7.6281 8.9336 8.9336 9.0519 9.0519 9.5274 9.5274 9.7506 9.7506 9.8277 9.8277 11.4052 11.4052 11.4132 11.4132 11.7257 11.7257 11.7969 11.7969 11.8378 11.8378 12.4326 12.4326 13.6941 13.6941 13.8453 13.8453 14.6269 14.6269 14.7456 14.7456 17.6275 17.6275 18.5625 18.5625 k = 0.0000 0.0000 0.2739 ( 4936 PWs) bands (ev): -78.6214 -78.6214 -78.6200 -78.6200 -44.3279 -44.3279 -44.3183 -44.3183 -42.6355 -42.6355 -42.6144 -42.6144 -42.5568 -42.5568 -42.5538 -42.5538 -2.1354 -2.1354 -1.4584 -1.4584 7.7648 7.7648 8.9790 8.9790 9.0965 9.0965 9.4109 9.4109 9.6768 9.6768 9.7619 9.7619 11.4302 11.4302 11.4379 11.4379 11.7229 11.7229 11.7680 11.7680 11.8298 11.8298 12.3682 12.3682 13.7714 13.7714 13.9208 13.9208 14.5735 14.5735 14.6947 14.6947 17.7202 17.7202 18.5493 18.5493 k = 0.0000 0.0000 0.2853 ( 4936 PWs) bands (ev): -78.6211 -78.6211 -78.6203 -78.6203 -44.3272 -44.3272 -44.3190 -44.3190 -42.6338 -42.6338 -42.6161 -42.6161 -42.5566 -42.5566 -42.5540 -42.5540 -2.0858 -2.0858 -1.5198 -1.5198 7.9032 7.9032 9.0264 9.0264 9.1431 9.1431 9.2875 9.2875 9.6063 9.6063 9.6981 9.6981 11.4562 11.4562 11.4637 11.4637 11.7126 11.7126 11.7403 11.7403 11.8379 11.8379 12.3054 12.3054 13.8483 13.8483 13.9956 13.9956 14.5184 14.5184 14.6421 14.6421 17.8124 17.8124 18.5238 18.5238 k = 0.0000 0.0000 0.2967 ( 4936 PWs) bands (ev): -78.6209 -78.6209 -78.6205 -78.6205 -44.3264 -44.3264 -44.3198 -44.3198 -42.6321 -42.6321 -42.6178 -42.6178 -42.5563 -42.5563 -42.5543 -42.5543 -2.0347 -2.0347 -1.5807 -1.5807 8.0431 8.0431 9.0756 9.0756 9.1584 9.1584 9.1912 9.1912 9.5387 9.5387 9.6357 9.6357 11.4826 11.4826 11.4899 11.4899 11.6947 11.6947 11.7129 11.7129 11.8595 11.8595 12.2441 12.2441 13.9240 13.9240 14.0692 14.0692 14.4606 14.4606 14.5868 14.5868 17.9035 17.9035 18.4865 18.4865 k = 0.0000 0.0000 0.3081 ( 4930 PWs) bands (ev): -78.6206 -78.6206 -78.6205 -78.6205 -44.3256 -44.3256 -44.3205 -44.3205 -42.6304 -42.6304 -42.6195 -42.6195 -42.5560 -42.5560 -42.5545 -42.5545 -1.9822 -1.9822 -1.6410 -1.6410 8.1838 8.1838 9.0251 9.0251 9.1268 9.1268 9.2412 9.2412 9.4738 9.4738 9.5749 9.5749 11.5101 11.5101 11.5173 11.5173 11.6721 11.6721 11.6852 11.6852 11.8914 11.8914 12.1838 12.1838 13.9982 13.9982 14.1412 14.1412 14.4010 14.4010 14.5297 14.5297 17.9923 17.9923 18.4385 18.4385 k = 0.0000 0.0000 0.3195 ( 4930 PWs) bands (ev): -78.6209 -78.6209 -78.6202 -78.6202 -44.3246 -44.3246 -44.3214 -44.3214 -42.6286 -42.6286 -42.6215 -42.6215 -42.5557 -42.5557 -42.5546 -42.5546 -1.9283 -1.9283 -1.7005 -1.7005 8.3253 8.3253 8.8879 8.8879 9.1799 9.1799 9.2930 9.2930 9.4111 9.4111 9.5157 9.5157 11.5379 11.5379 11.5451 11.5451 11.6467 11.6467 11.6571 11.6571 11.9282 11.9282 12.1270 12.1270 14.0707 14.0707 14.2114 14.2114 14.3392 14.3392 14.4704 14.4704 18.0788 18.0788 18.3788 18.3788 k = 0.0000 0.0000 0.3309 ( 4930 PWs) bands (ev): -78.6207 -78.6207 -78.6204 -78.6204 -44.3239 -44.3239 -44.3222 -44.3222 -42.6268 -42.6268 -42.6232 -42.6232 -42.5555 -42.5555 -42.5549 -42.5549 -1.8731 -1.8731 -1.7590 -1.7590 8.4670 8.4670 8.7489 8.7489 9.2348 9.2348 9.3462 9.3462 9.3503 9.3503 9.4576 9.4576 11.5652 11.5652 11.5727 11.5727 11.6202 11.6202 11.6290 11.6290 11.9722 11.9722 12.0722 12.0722 14.1408 14.1408 14.2751 14.2751 14.2793 14.2793 14.4087 14.4087 18.1617 18.1617 18.3131 18.3131 k = 0.0000 0.0000 0.3424 ( 4924 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3230 -44.3230 -44.3230 -44.3230 -42.6250 -42.6250 -42.6250 -42.6250 -42.5552 -42.5552 -42.5552 -42.5552 -1.8166 -1.8166 -1.8166 -1.8166 8.6085 8.6085 8.6085 8.6085 9.2917 9.2917 9.2917 9.2917 9.4012 9.4012 9.4012 9.4012 11.5931 11.5931 11.5931 11.5931 11.6011 11.6011 11.6011 11.6011 12.0206 12.0206 12.0206 12.0206 14.2091 14.2091 14.2091 14.2091 14.3452 14.3452 14.3452 14.3452 18.2405 18.2405 18.2405 18.2405 k = 0.0000 0.0000 0.3424 ( 4924 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3230 -44.3230 -44.3230 -44.3230 -42.6250 -42.6250 -42.6250 -42.6250 -42.5552 -42.5552 -42.5552 -42.5552 -1.8166 -1.8166 -1.8166 -1.8166 8.6085 8.6085 8.6085 8.6085 9.2917 9.2917 9.2917 9.2917 9.4012 9.4012 9.4012 9.4012 11.5931 11.5931 11.5931 11.5931 11.6011 11.6011 11.6011 11.6011 12.0206 12.0206 12.0206 12.0206 14.2091 14.2091 14.2091 14.2091 14.3452 14.3452 14.3452 14.3452 18.2405 18.2405 18.2405 18.2405 k = 0.0100 0.0058 0.3424 ( 4930 PWs) bands (ev): -78.6206 -78.6206 -78.6206 -78.6206 -44.3230 -44.3230 -44.3230 -44.3230 -42.6250 -42.6250 -42.6250 -42.6250 -42.5552 -42.5552 -42.5552 -42.5552 -1.8158 -1.8158 -1.8158 -1.8158 8.6043 8.6043 8.6043 8.6043 9.2922 9.2922 9.2922 9.2922 9.4020 9.4020 9.4020 9.4020 11.5921 11.5921 11.5921 11.5921 11.6011 11.6011 11.6011 11.6011 12.0221 12.0221 12.0221 12.0221 14.2063 14.2063 14.2063 14.2063 14.3422 14.3422 14.3422 14.3422 18.2463 18.2463 18.2463 18.2463 k = 0.0200 0.0115 0.3424 ( 4930 PWs) bands (ev): -78.6206 -78.6206 -78.6206 -78.6206 -44.3230 -44.3230 -44.3230 -44.3230 -42.6250 -42.6250 -42.6250 -42.6250 -42.5552 -42.5552 -42.5552 -42.5552 -1.8133 -1.8133 -1.8133 -1.8133 8.5921 8.5921 8.5921 8.5921 9.2939 9.2939 9.2939 9.2939 9.4048 9.4048 9.4048 9.4048 11.5901 11.5901 11.5901 11.5901 11.6019 11.6019 11.6019 11.6019 12.0272 12.0272 12.0272 12.0272 14.1980 14.1980 14.1980 14.1980 14.3340 14.3340 14.3340 14.3340 18.2643 18.2643 18.2643 18.2643 k = 0.0300 0.0173 0.3424 ( 4940 PWs) bands (ev): -78.6208 -78.6208 -78.6208 -78.6208 -44.3231 -44.3231 -44.3231 -44.3231 -42.6251 -42.6251 -42.6251 -42.6251 -42.5553 -42.5553 -42.5553 -42.5553 -1.8092 -1.8092 -1.8092 -1.8092 8.5721 8.5721 8.5721 8.5721 9.2960 9.2960 9.2960 9.2960 9.4093 9.4093 9.4093 9.4093 11.5865 11.5865 11.5865 11.5865 11.6026 11.6026 11.6026 11.6026 12.0354 12.0354 12.0354 12.0354 14.1830 14.1830 14.1830 14.1830 14.3210 14.3210 14.3210 14.3210 18.2936 18.2936 18.2936 18.2936 k = 0.0400 0.0231 0.3424 ( 4936 PWs) bands (ev): -78.6207 -78.6207 -78.6207 -78.6207 -44.3231 -44.3231 -44.3231 -44.3231 -42.6251 -42.6251 -42.6251 -42.6251 -42.5552 -42.5552 -42.5552 -42.5552 -1.8034 -1.8034 -1.8034 -1.8034 8.5451 8.5451 8.5451 8.5451 9.2983 9.2983 9.2983 9.2983 9.4162 9.4162 9.4162 9.4162 11.5828 11.5828 11.5828 11.5828 11.6042 11.6042 11.6042 11.6042 12.0470 12.0470 12.0470 12.0470 14.1614 14.1614 14.1614 14.1614 14.3058 14.3058 14.3058 14.3058 18.3334 18.3334 18.3334 18.3334 k = 0.0500 0.0289 0.3424 ( 4936 PWs) bands (ev): -78.6207 -78.6207 -78.6207 -78.6207 -44.3231 -44.3231 -44.3231 -44.3231 -42.6251 -42.6251 -42.6251 -42.6251 -42.5553 -42.5553 -42.5553 -42.5553 -1.7960 -1.7960 -1.7960 -1.7960 8.5116 8.5116 8.5116 8.5116 9.3000 9.3000 9.3000 9.3000 9.4250 9.4250 9.4250 9.4250 11.5782 11.5782 11.5782 11.5782 11.6059 11.6059 11.6059 11.6059 12.0617 12.0617 12.0617 12.0617 14.1317 14.1317 14.1317 14.1317 14.2889 14.2889 14.2889 14.2889 18.3823 18.3823 18.3823 18.3823 k = 0.0600 0.0346 0.3424 ( 4936 PWs) bands (ev): -78.6207 -78.6207 -78.6207 -78.6207 -44.3231 -44.3231 -44.3231 -44.3231 -42.6251 -42.6251 -42.6251 -42.6251 -42.5553 -42.5553 -42.5553 -42.5553 -1.7869 -1.7869 -1.7869 -1.7869 8.4723 8.4723 8.4723 8.4723 9.3006 9.3006 9.3006 9.3006 9.4357 9.4357 9.4357 9.4357 11.5728 11.5728 11.5728 11.5728 11.6079 11.6079 11.6079 11.6079 12.0793 12.0793 12.0793 12.0793 14.0942 14.0942 14.0942 14.0942 14.2716 14.2716 14.2716 14.2716 18.4385 18.4385 18.4385 18.4385 k = 0.0700 0.0404 0.3424 ( 4934 PWs) bands (ev): -78.6207 -78.6207 -78.6207 -78.6207 -44.3231 -44.3231 -44.3231 -44.3231 -42.6251 -42.6251 -42.6251 -42.6251 -42.5553 -42.5553 -42.5553 -42.5553 -1.7763 -1.7763 -1.7763 -1.7763 8.4280 8.4280 8.4280 8.4280 9.3000 9.3000 9.3000 9.3000 9.4481 9.4481 9.4481 9.4481 11.5668 11.5668 11.5668 11.5668 11.6100 11.6100 11.6100 11.6100 12.0999 12.0999 12.0999 12.0999 14.0496 14.0496 14.0496 14.0496 14.2540 14.2540 14.2540 14.2540 18.4999 18.4999 18.4999 18.4999 k = 0.0800 0.0462 0.3424 ( 4938 PWs) bands (ev): -78.6207 -78.6207 -78.6207 -78.6207 -44.3232 -44.3232 -44.3232 -44.3232 -42.6251 -42.6251 -42.6251 -42.6251 -42.5554 -42.5554 -42.5554 -42.5554 -1.7641 -1.7641 -1.7641 -1.7641 8.3790 8.3790 8.3790 8.3790 9.2982 9.2982 9.2982 9.2982 9.4614 9.4614 9.4614 9.4614 11.5595 11.5595 11.5595 11.5595 11.6121 11.6121 11.6121 11.6121 12.1230 12.1230 12.1230 12.1230 13.9985 13.9985 13.9985 13.9985 14.2362 14.2362 14.2362 14.2362 18.5636 18.5636 18.5636 18.5636 k = 0.0900 0.0520 0.3424 ( 4930 PWs) bands (ev): -78.6205 -78.6205 -78.6205 -78.6205 -44.3231 -44.3231 -44.3231 -44.3231 -42.6250 -42.6250 -42.6250 -42.6250 -42.5554 -42.5554 -42.5554 -42.5554 -1.7503 -1.7503 -1.7503 -1.7503 8.3262 8.3262 8.3262 8.3262 9.2954 9.2954 9.2954 9.2954 9.4754 9.4754 9.4754 9.4754 11.5519 11.5519 11.5519 11.5519 11.6153 11.6153 11.6153 11.6153 12.1492 12.1492 12.1492 12.1492 13.9428 13.9428 13.9428 13.9428 14.2184 14.2184 14.2184 14.2184 18.6264 18.6264 18.6264 18.6264 k = 0.1000 0.0577 0.3424 ( 4926 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3231 -44.3231 -44.3231 -44.3231 -42.6250 -42.6250 -42.6250 -42.6250 -42.5554 -42.5554 -42.5554 -42.5554 -1.7351 -1.7351 -1.7351 -1.7351 8.2698 8.2698 8.2698 8.2698 9.2916 9.2916 9.2916 9.2916 9.4897 9.4897 9.4897 9.4897 11.5434 11.5434 11.5434 11.5434 11.6187 11.6187 11.6187 11.6187 12.1774 12.1774 12.1774 12.1774 13.8831 13.8831 13.8831 13.8831 14.1998 14.1998 14.1998 14.1998 18.6833 18.6833 18.6833 18.6833 k = 0.1100 0.0635 0.3424 ( 4926 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3231 -44.3231 -44.3231 -44.3231 -42.6250 -42.6250 -42.6250 -42.6250 -42.5555 -42.5555 -42.5555 -42.5555 -1.7183 -1.7183 -1.7183 -1.7183 8.2101 8.2101 8.2101 8.2101 9.2868 9.2868 9.2868 9.2868 9.5039 9.5039 9.5039 9.5039 11.5338 11.5338 11.5338 11.5338 11.6225 11.6225 11.6225 11.6225 12.2074 12.2074 12.2074 12.2074 13.8211 13.8211 13.8211 13.8211 14.1802 14.1802 14.1802 14.1802 18.7290 18.7290 18.7290 18.7290 k = 0.1200 0.0693 0.3424 ( 4922 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3231 -44.3231 -44.3231 -44.3231 -42.6250 -42.6250 -42.6250 -42.6250 -42.5555 -42.5555 -42.5555 -42.5555 -1.7001 -1.7001 -1.7001 -1.7001 8.1476 8.1476 8.1476 8.1476 9.2812 9.2812 9.2812 9.2812 9.5178 9.5178 9.5178 9.5178 11.5236 11.5236 11.5236 11.5236 11.6270 11.6270 11.6270 11.6270 12.2392 12.2392 12.2392 12.2392 13.7576 13.7576 13.7576 13.7576 14.1600 14.1600 14.1600 14.1600 18.7588 18.7588 18.7588 18.7588 k = 0.1300 0.0751 0.3424 ( 4922 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3232 -44.3232 -44.3232 -44.3232 -42.6250 -42.6250 -42.6250 -42.6250 -42.5556 -42.5556 -42.5556 -42.5556 -1.6805 -1.6805 -1.6805 -1.6805 8.0825 8.0825 8.0825 8.0825 9.2748 9.2748 9.2748 9.2748 9.5312 9.5312 9.5312 9.5312 11.5126 11.5126 11.5126 11.5126 11.6318 11.6318 11.6318 11.6318 12.2723 12.2723 12.2723 12.2723 13.6937 13.6937 13.6937 13.6937 14.1385 14.1385 14.1385 14.1385 18.7692 18.7692 18.7692 18.7692 k = 0.1400 0.0808 0.3424 ( 4922 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3232 -44.3232 -44.3232 -44.3232 -42.6250 -42.6250 -42.6250 -42.6250 -42.5556 -42.5556 -42.5556 -42.5556 -1.6596 -1.6596 -1.6596 -1.6596 8.0152 8.0152 8.0152 8.0152 9.2678 9.2678 9.2678 9.2678 9.5440 9.5440 9.5440 9.5440 11.5009 11.5009 11.5009 11.5009 11.6373 11.6373 11.6373 11.6373 12.3062 12.3062 12.3062 12.3062 13.6302 13.6302 13.6302 13.6302 14.1163 14.1163 14.1163 14.1163 18.7597 18.7597 18.7597 18.7597 k = 0.1500 0.0866 0.3424 ( 4922 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3232 -44.3232 -44.3232 -44.3232 -42.6250 -42.6250 -42.6250 -42.6250 -42.5557 -42.5557 -42.5557 -42.5557 -1.6373 -1.6373 -1.6373 -1.6373 7.9460 7.9460 7.9460 7.9460 9.2600 9.2600 9.2600 9.2600 9.5558 9.5558 9.5558 9.5558 11.4887 11.4887 11.4887 11.4887 11.6431 11.6431 11.6431 11.6431 12.3410 12.3410 12.3410 12.3410 13.5680 13.5680 13.5680 13.5680 14.0930 14.0930 14.0930 14.0930 18.7321 18.7321 18.7321 18.7321 k = 0.1600 0.0924 0.3424 ( 4918 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3232 -44.3232 -44.3232 -44.3232 -42.6250 -42.6250 -42.6250 -42.6250 -42.5557 -42.5557 -42.5557 -42.5557 -1.6138 -1.6138 -1.6138 -1.6138 7.8750 7.8750 7.8750 7.8750 9.2518 9.2518 9.2518 9.2518 9.5667 9.5667 9.5667 9.5667 11.4766 11.4766 11.4766 11.4766 11.6496 11.6496 11.6496 11.6496 12.3757 12.3757 12.3757 12.3757 13.5082 13.5082 13.5082 13.5082 14.0688 14.0688 14.0688 14.0688 18.6902 18.6902 18.6902 18.6902 k = 0.1700 0.0981 0.3424 ( 4930 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3233 -44.3233 -44.3233 -44.3233 -42.6251 -42.6251 -42.6251 -42.6251 -42.5559 -42.5559 -42.5559 -42.5559 -1.5891 -1.5891 -1.5891 -1.5891 7.8025 7.8025 7.8025 7.8025 9.2428 9.2428 9.2428 9.2428 9.5763 9.5763 9.5763 9.5763 11.4635 11.4635 11.4635 11.4635 11.6564 11.6564 11.6564 11.6564 12.4094 12.4094 12.4094 12.4094 13.4504 13.4504 13.4504 13.4504 14.0432 14.0432 14.0432 14.0432 18.6376 18.6376 18.6376 18.6376 k = 0.1800 0.1039 0.3424 ( 4934 PWs) bands (ev): -78.6205 -78.6205 -78.6205 -78.6205 -44.3234 -44.3234 -44.3234 -44.3234 -42.6251 -42.6251 -42.6251 -42.6251 -42.5560 -42.5560 -42.5560 -42.5560 -1.5633 -1.5633 -1.5633 -1.5633 7.7287 7.7287 7.7287 7.7287 9.2335 9.2335 9.2335 9.2335 9.5849 9.5849 9.5849 9.5849 11.4503 11.4503 11.4503 11.4503 11.6640 11.6640 11.6640 11.6640 12.4421 12.4421 12.4421 12.4421 13.3973 13.3973 13.3973 13.3973 14.0173 14.0173 14.0173 14.0173 18.5779 18.5779 18.5779 18.5779 k = 0.1900 0.1097 0.3424 ( 4938 PWs) bands (ev): -78.6206 -78.6206 -78.6206 -78.6206 -44.3234 -44.3234 -44.3234 -44.3234 -42.6251 -42.6251 -42.6251 -42.6251 -42.5561 -42.5561 -42.5561 -42.5561 -1.5364 -1.5364 -1.5364 -1.5364 7.6539 7.6539 7.6539 7.6539 9.2237 9.2237 9.2237 9.2237 9.5922 9.5922 9.5922 9.5922 11.4371 11.4371 11.4371 11.4371 11.6720 11.6720 11.6720 11.6720 12.4726 12.4726 12.4726 12.4726 13.3496 13.3496 13.3496 13.3496 13.9906 13.9906 13.9906 13.9906 18.5134 18.5134 18.5134 18.5134 k = 0.2000 0.1155 0.3424 ( 4936 PWs) bands (ev): -78.6205 -78.6205 -78.6205 -78.6205 -44.3234 -44.3234 -44.3234 -44.3234 -42.6251 -42.6251 -42.6251 -42.6251 -42.5561 -42.5561 -42.5561 -42.5561 -1.5085 -1.5085 -1.5085 -1.5085 7.5784 7.5784 7.5784 7.5784 9.2137 9.2137 9.2137 9.2137 9.5983 9.5983 9.5983 9.5983 11.4241 11.4241 11.4241 11.4241 11.6811 11.6811 11.6811 11.6811 12.4998 12.4998 12.4998 12.4998 13.3087 13.3087 13.3087 13.3087 13.9635 13.9635 13.9635 13.9635 18.4460 18.4460 18.4460 18.4460 k = 0.2100 0.1212 0.3424 ( 4928 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3234 -44.3234 -44.3234 -44.3234 -42.6251 -42.6251 -42.6251 -42.6251 -42.5561 -42.5561 -42.5561 -42.5561 -1.4798 -1.4798 -1.4798 -1.4798 7.5022 7.5022 7.5022 7.5022 9.2034 9.2034 9.2034 9.2034 9.6031 9.6031 9.6031 9.6031 11.4116 11.4116 11.4116 11.4116 11.6915 11.6915 11.6915 11.6915 12.5227 12.5227 12.5227 12.5227 13.2754 13.2754 13.2754 13.2754 13.9360 13.9360 13.9360 13.9360 18.3770 18.3770 18.3770 18.3770 k = 0.2200 0.1270 0.3424 ( 4930 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3234 -44.3234 -44.3234 -44.3234 -42.6251 -42.6251 -42.6251 -42.6251 -42.5562 -42.5562 -42.5562 -42.5562 -1.4502 -1.4502 -1.4502 -1.4502 7.4255 7.4255 7.4255 7.4255 9.1928 9.1928 9.1928 9.1928 9.6064 9.6064 9.6064 9.6064 11.3992 11.3992 11.3992 11.3992 11.7020 11.7020 11.7020 11.7020 12.5395 12.5395 12.5395 12.5395 13.2504 13.2504 13.2504 13.2504 13.9078 13.9078 13.9078 13.9078 18.3071 18.3071 18.3071 18.3071 k = 0.2300 0.1328 0.3424 ( 4938 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3235 -44.3235 -44.3235 -44.3235 -42.6252 -42.6252 -42.6252 -42.6252 -42.5563 -42.5563 -42.5563 -42.5563 -1.4199 -1.4199 -1.4199 -1.4199 7.3485 7.3485 7.3485 7.3485 9.1818 9.1818 9.1818 9.1818 9.6082 9.6082 9.6082 9.6082 11.3871 11.3871 11.3871 11.3871 11.7131 11.7131 11.7131 11.7131 12.5491 12.5491 12.5491 12.5491 13.2349 13.2349 13.2349 13.2349 13.8788 13.8788 13.8788 13.8788 18.2370 18.2370 18.2370 18.2370 k = 0.2400 0.1386 0.3424 ( 4930 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3235 -44.3235 -44.3235 -44.3235 -42.6251 -42.6251 -42.6251 -42.6251 -42.5564 -42.5564 -42.5564 -42.5564 -1.3890 -1.3890 -1.3890 -1.3890 7.2716 7.2716 7.2716 7.2716 9.1709 9.1709 9.1709 9.1709 9.6086 9.6086 9.6086 9.6086 11.3767 11.3767 11.3767 11.3767 11.7253 11.7253 11.7253 11.7253 12.5517 12.5517 12.5517 12.5517 13.2308 13.2308 13.2308 13.2308 13.8500 13.8500 13.8500 13.8500 18.1677 18.1677 18.1677 18.1677 k = 0.2500 0.1443 0.3424 ( 4930 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3235 -44.3235 -44.3235 -44.3235 -42.6251 -42.6251 -42.6251 -42.6251 -42.5565 -42.5565 -42.5565 -42.5565 -1.3575 -1.3575 -1.3575 -1.3575 7.1949 7.1949 7.1949 7.1949 9.1597 9.1597 9.1597 9.1597 9.6076 9.6076 9.6076 9.6076 11.3667 11.3667 11.3667 11.3667 11.7375 11.7375 11.7375 11.7375 12.5464 12.5464 12.5464 12.5464 13.2373 13.2373 13.2373 13.2373 13.8204 13.8204 13.8204 13.8204 18.0991 18.0991 18.0991 18.0991 k = 0.2600 0.1501 0.3424 ( 4926 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3235 -44.3235 -44.3235 -44.3235 -42.6251 -42.6251 -42.6251 -42.6251 -42.5565 -42.5565 -42.5565 -42.5565 -1.3257 -1.3257 -1.3257 -1.3257 7.1187 7.1187 7.1187 7.1187 9.1484 9.1484 9.1484 9.1484 9.6053 9.6053 9.6053 9.6053 11.3572 11.3572 11.3572 11.3572 11.7510 11.7510 11.7510 11.7510 12.5355 12.5355 12.5355 12.5355 13.2526 13.2526 13.2526 13.2526 13.7909 13.7909 13.7909 13.7909 18.0316 18.0316 18.0316 18.0316 k = 0.2700 0.1559 0.3424 ( 4922 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3235 -44.3235 -44.3235 -44.3235 -42.6251 -42.6251 -42.6251 -42.6251 -42.5566 -42.5566 -42.5566 -42.5566 -1.2935 -1.2935 -1.2935 -1.2935 7.0430 7.0430 7.0430 7.0430 9.1372 9.1372 9.1372 9.1372 9.6016 9.6016 9.6016 9.6016 11.3492 11.3492 11.3492 11.3492 11.7648 11.7648 11.7648 11.7648 12.5187 12.5187 12.5187 12.5187 13.2760 13.2760 13.2760 13.2760 13.7614 13.7614 13.7614 13.7614 17.9653 17.9653 17.9653 17.9653 k = 0.2800 0.1617 0.3424 ( 4922 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3236 -44.3236 -44.3236 -44.3236 -42.6252 -42.6252 -42.6252 -42.6252 -42.5566 -42.5566 -42.5566 -42.5566 -1.2612 -1.2612 -1.2612 -1.2612 6.9682 6.9682 6.9682 6.9682 9.1259 9.1259 9.1259 9.1259 9.5965 9.5965 9.5965 9.5965 11.3419 11.3419 11.3419 11.3419 11.7792 11.7792 11.7792 11.7792 12.4988 12.4988 12.4988 12.4988 13.3052 13.3052 13.3052 13.3052 13.7314 13.7314 13.7314 13.7314 17.9005 17.9005 17.9005 17.9005 k = 0.2900 0.1674 0.3424 ( 4922 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3236 -44.3236 -44.3236 -44.3236 -42.6252 -42.6252 -42.6252 -42.6252 -42.5567 -42.5567 -42.5567 -42.5567 -1.2288 -1.2288 -1.2288 -1.2288 6.8945 6.8945 6.8945 6.8945 9.1146 9.1146 9.1146 9.1146 9.5902 9.5902 9.5902 9.5902 11.3361 11.3361 11.3361 11.3361 11.7940 11.7940 11.7940 11.7940 12.4753 12.4753 12.4753 12.4753 13.3395 13.3395 13.3395 13.3395 13.7018 13.7018 13.7018 13.7018 17.8372 17.8372 17.8372 17.8372 k = 0.3000 0.1732 0.3424 ( 4930 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3237 -44.3237 -44.3237 -44.3237 -42.6252 -42.6252 -42.6252 -42.6252 -42.5568 -42.5568 -42.5568 -42.5568 -1.1964 -1.1964 -1.1964 -1.1964 6.8220 6.8220 6.8220 6.8220 9.1035 9.1035 9.1035 9.1035 9.5828 9.5828 9.5828 9.5828 11.3315 11.3315 11.3315 11.3315 11.8087 11.8087 11.8087 11.8087 12.4494 12.4494 12.4494 12.4494 13.3773 13.3773 13.3773 13.3773 13.6722 13.6722 13.6722 13.6722 17.7756 17.7756 17.7756 17.7756 k = 0.3100 0.1790 0.3424 ( 4924 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3237 -44.3237 -44.3237 -44.3237 -42.6252 -42.6252 -42.6252 -42.6252 -42.5569 -42.5569 -42.5569 -42.5569 -1.1643 -1.1643 -1.1643 -1.1643 6.7511 6.7511 6.7511 6.7511 9.0926 9.0926 9.0926 9.0926 9.5745 9.5745 9.5745 9.5745 11.3285 11.3285 11.3285 11.3285 11.8244 11.8244 11.8244 11.8244 12.4237 12.4237 12.4237 12.4237 13.4178 13.4178 13.4178 13.4178 13.6437 13.6437 13.6437 13.6437 17.7159 17.7159 17.7159 17.7159 k = 0.3200 0.1848 0.3424 ( 4932 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3238 -44.3238 -44.3238 -44.3238 -42.6253 -42.6253 -42.6253 -42.6253 -42.5570 -42.5570 -42.5570 -42.5570 -1.1326 -1.1326 -1.1326 -1.1326 6.6819 6.6819 6.6819 6.6819 9.0819 9.0819 9.0819 9.0819 9.5652 9.5652 9.5652 9.5652 11.3261 11.3261 11.3261 11.3261 11.8402 11.8402 11.8402 11.8402 12.3973 12.3973 12.3973 12.3973 13.4580 13.4580 13.4580 13.4580 13.6160 13.6160 13.6160 13.6160 17.6578 17.6578 17.6578 17.6578 k = 0.3300 0.1905 0.3424 ( 4922 PWs) bands (ev): -78.6199 -78.6199 -78.6199 -78.6199 -44.3237 -44.3237 -44.3237 -44.3237 -42.6253 -42.6253 -42.6253 -42.6253 -42.5570 -42.5570 -42.5570 -42.5570 -1.1013 -1.1013 -1.1013 -1.1013 6.6148 6.6148 6.6148 6.6148 9.0715 9.0715 9.0715 9.0715 9.5555 9.5555 9.5555 9.5555 11.3259 11.3259 11.3259 11.3259 11.8569 11.8569 11.8569 11.8569 12.3718 12.3718 12.3718 12.3718 13.4972 13.4972 13.4972 13.4972 13.5924 13.5924 13.5924 13.5924 17.6020 17.6020 17.6020 17.6020 k = 0.3400 0.1963 0.3424 ( 4926 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3238 -44.3238 -44.3238 -44.3238 -42.6253 -42.6253 -42.6253 -42.6253 -42.5571 -42.5571 -42.5571 -42.5571 -1.0707 -1.0707 -1.0707 -1.0707 6.5498 6.5498 6.5498 6.5498 9.0614 9.0614 9.0614 9.0614 9.5450 9.5450 9.5450 9.5450 11.3262 11.3262 11.3262 11.3262 11.8727 11.8727 11.8727 11.8727 12.3461 12.3461 12.3461 12.3461 13.5214 13.5214 13.5214 13.5214 13.5839 13.5839 13.5839 13.5839 17.5480 17.5480 17.5480 17.5480 k = 0.3500 0.2021 0.3424 ( 4938 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3239 -44.3239 -44.3239 -44.3239 -42.6253 -42.6253 -42.6253 -42.6253 -42.5572 -42.5572 -42.5572 -42.5572 -1.0409 -1.0409 -1.0409 -1.0409 6.4873 6.4873 6.4873 6.4873 9.0516 9.0516 9.0516 9.0516 9.5340 9.5340 9.5340 9.5340 11.3272 11.3272 11.3272 11.3272 11.8885 11.8885 11.8885 11.8885 12.3210 12.3210 12.3210 12.3210 13.5121 13.5121 13.5121 13.5121 13.6087 13.6087 13.6087 13.6087 17.4961 17.4961 17.4961 17.4961 k = 0.3600 0.2078 0.3424 ( 4938 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3239 -44.3239 -44.3239 -44.3239 -42.6253 -42.6253 -42.6253 -42.6253 -42.5573 -42.5573 -42.5573 -42.5573 -1.0121 -1.0121 -1.0121 -1.0121 6.4274 6.4274 6.4274 6.4274 9.0422 9.0422 9.0422 9.0422 9.5230 9.5230 9.5230 9.5230 11.3296 11.3296 11.3296 11.3296 11.9046 11.9046 11.9046 11.9046 12.2975 12.2975 12.2975 12.2975 13.4898 13.4898 13.4898 13.4898 13.6477 13.6477 13.6477 13.6477 17.4466 17.4466 17.4466 17.4466 k = 0.3700 0.2136 0.3424 ( 4938 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3239 -44.3239 -44.3239 -44.3239 -42.6254 -42.6254 -42.6254 -42.6254 -42.5573 -42.5573 -42.5573 -42.5573 -0.9844 -0.9844 -0.9844 -0.9844 6.3705 6.3705 6.3705 6.3705 9.0334 9.0334 9.0334 9.0334 9.5118 9.5118 9.5118 9.5118 11.3325 11.3325 11.3325 11.3325 11.9211 11.9211 11.9211 11.9211 12.2752 12.2752 12.2752 12.2752 13.4657 13.4657 13.4657 13.4657 13.6883 13.6883 13.6883 13.6883 17.3995 17.3995 17.3995 17.3995 k = 0.3800 0.2194 0.3424 ( 4938 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3240 -44.3240 -44.3240 -44.3240 -42.6254 -42.6254 -42.6254 -42.6254 -42.5574 -42.5574 -42.5574 -42.5574 -0.9579 -0.9579 -0.9579 -0.9579 6.3168 6.3168 6.3168 6.3168 9.0250 9.0250 9.0250 9.0250 9.5008 9.5008 9.5008 9.5008 11.3365 11.3365 11.3365 11.3365 11.9365 11.9365 11.9365 11.9365 12.2542 12.2542 12.2542 12.2542 13.4413 13.4413 13.4413 13.4413 13.7292 13.7292 13.7292 13.7292 17.3549 17.3549 17.3549 17.3549 k = 0.3900 0.2252 0.3424 ( 4938 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3240 -44.3240 -44.3240 -44.3240 -42.6254 -42.6254 -42.6254 -42.6254 -42.5574 -42.5574 -42.5574 -42.5574 -0.9329 -0.9329 -0.9329 -0.9329 6.2664 6.2664 6.2664 6.2664 9.0172 9.0172 9.0172 9.0172 9.4901 9.4901 9.4901 9.4901 11.3411 11.3411 11.3411 11.3411 11.9514 11.9514 11.9514 11.9514 12.2346 12.2346 12.2346 12.2346 13.4177 13.4177 13.4177 13.4177 13.7687 13.7687 13.7687 13.7687 17.3129 17.3129 17.3129 17.3129 k = 0.4000 0.2309 0.3424 ( 4946 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3241 -44.3241 -44.3241 -44.3241 -42.6254 -42.6254 -42.6254 -42.6254 -42.5575 -42.5575 -42.5575 -42.5575 -0.9094 -0.9094 -0.9094 -0.9094 6.2195 6.2195 6.2195 6.2195 9.0098 9.0098 9.0098 9.0098 9.4797 9.4797 9.4797 9.4797 11.3457 11.3457 11.3457 11.3457 11.9651 11.9651 11.9651 11.9651 12.2161 12.2161 12.2161 12.2161 13.3951 13.3951 13.3951 13.3951 13.8061 13.8061 13.8061 13.8061 17.2737 17.2737 17.2737 17.2737 k = 0.4100 0.2367 0.3424 ( 4936 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3240 -44.3240 -44.3240 -44.3240 -42.6254 -42.6254 -42.6254 -42.6254 -42.5575 -42.5575 -42.5575 -42.5575 -0.8876 -0.8876 -0.8876 -0.8876 6.1765 6.1765 6.1765 6.1765 9.0032 9.0032 9.0032 9.0032 9.4700 9.4700 9.4700 9.4700 11.3510 11.3510 11.3510 11.3510 11.9789 11.9789 11.9789 11.9789 12.2006 12.2006 12.2006 12.2006 13.3741 13.3741 13.3741 13.3741 13.8419 13.8419 13.8419 13.8419 17.2376 17.2376 17.2376 17.2376 k = 0.4200 0.2425 0.3424 ( 4940 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3241 -44.3241 -44.3241 -44.3241 -42.6254 -42.6254 -42.6254 -42.6254 -42.5575 -42.5575 -42.5575 -42.5575 -0.8678 -0.8678 -0.8678 -0.8678 6.1374 6.1374 6.1374 6.1374 8.9970 8.9970 8.9970 8.9970 9.4608 9.4608 9.4608 9.4608 11.3562 11.3562 11.3562 11.3562 11.9905 11.9905 11.9905 11.9905 12.1861 12.1861 12.1861 12.1861 13.3544 13.3544 13.3544 13.3544 13.8747 13.8747 13.8747 13.8747 17.2045 17.2045 17.2045 17.2045 k = 0.4300 0.2483 0.3424 ( 4932 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3240 -44.3240 -44.3240 -44.3240 -42.6254 -42.6254 -42.6254 -42.6254 -42.5575 -42.5575 -42.5575 -42.5575 -0.8499 -0.8499 -0.8499 -0.8499 6.1025 6.1025 6.1025 6.1025 8.9915 8.9915 8.9915 8.9915 9.4527 9.4527 9.4527 9.4527 11.3618 11.3618 11.3618 11.3618 12.0014 12.0014 12.0014 12.0014 12.1738 12.1738 12.1738 12.1738 13.3363 13.3363 13.3363 13.3363 13.9055 13.9055 13.9055 13.9055 17.1750 17.1750 17.1750 17.1750 k = 0.4400 0.2540 0.3424 ( 4944 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5576 -42.5576 -42.5576 -42.5576 -0.8341 -0.8341 -0.8341 -0.8341 6.0718 6.0718 6.0718 6.0718 8.9867 8.9867 8.9867 8.9867 9.4452 9.4452 9.4452 9.4452 11.3664 11.3664 11.3664 11.3664 12.0100 12.0100 12.0100 12.0100 12.1623 12.1623 12.1623 12.1623 13.3200 13.3200 13.3200 13.3200 13.9316 13.9316 13.9316 13.9316 17.1485 17.1485 17.1485 17.1485 k = 0.4500 0.2598 0.3424 ( 4948 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5577 -42.5577 -42.5577 -42.5577 -0.8205 -0.8205 -0.8205 -0.8205 6.0456 6.0456 6.0456 6.0456 8.9825 8.9825 8.9825 8.9825 9.4387 9.4387 9.4387 9.4387 11.3706 11.3706 11.3706 11.3706 12.0177 12.0177 12.0177 12.0177 12.1537 12.1537 12.1537 12.1537 13.3054 13.3054 13.3054 13.3054 13.9547 13.9547 13.9547 13.9547 17.1259 17.1259 17.1259 17.1259 k = 0.4600 0.2656 0.3424 ( 4942 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5577 -42.5577 -42.5577 -42.5577 -0.8093 -0.8093 -0.8093 -0.8093 6.0241 6.0241 6.0241 6.0241 8.9792 8.9792 8.9792 8.9792 9.4334 9.4334 9.4334 9.4334 11.3748 11.3748 11.3748 11.3748 12.0236 12.0236 12.0236 12.0236 12.1474 12.1474 12.1474 12.1474 13.2939 13.2939 13.2939 13.2939 13.9744 13.9744 13.9744 13.9744 17.1073 17.1073 17.1073 17.1073 k = 0.4700 0.2714 0.3424 ( 4942 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5577 -42.5577 -42.5577 -42.5577 -0.8005 -0.8005 -0.8005 -0.8005 6.0071 6.0071 6.0071 6.0071 8.9765 8.9765 8.9765 8.9765 9.4292 9.4292 9.4292 9.4292 11.3780 11.3780 11.3780 11.3780 12.0277 12.0277 12.0277 12.0277 12.1428 12.1428 12.1428 12.1428 13.2847 13.2847 13.2847 13.2847 13.9897 13.9897 13.9897 13.9897 17.0925 17.0925 17.0925 17.0925 k = 0.4800 0.2771 0.3424 ( 4936 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5577 -42.5577 -42.5577 -42.5577 -0.7942 -0.7942 -0.7942 -0.7942 5.9950 5.9950 5.9950 5.9950 8.9746 8.9746 8.9746 8.9746 9.4262 9.4262 9.4262 9.4262 11.3807 11.3807 11.3807 11.3807 12.0304 12.0304 12.0304 12.0304 12.1401 12.1401 12.1401 12.1401 13.2781 13.2781 13.2781 13.2781 14.0012 14.0012 14.0012 14.0012 17.0820 17.0820 17.0820 17.0820 k = 0.4900 0.2829 0.3424 ( 4936 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5577 -42.5577 -42.5577 -42.5577 -0.7903 -0.7903 -0.7903 -0.7903 5.9877 5.9877 5.9877 5.9877 8.9735 8.9735 8.9735 8.9735 9.4244 9.4244 9.4244 9.4244 11.3821 11.3821 11.3821 11.3821 12.0319 12.0319 12.0319 12.0319 12.1385 12.1385 12.1385 12.1385 13.2741 13.2741 13.2741 13.2741 14.0079 14.0079 14.0079 14.0079 17.0756 17.0756 17.0756 17.0756 k = 0.5000 0.2887 0.3424 ( 4936 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5577 -42.5577 -42.5577 -42.5577 -0.7891 -0.7891 -0.7891 -0.7891 5.9853 5.9853 5.9853 5.9853 8.9731 8.9731 8.9731 8.9731 9.4238 9.4238 9.4238 9.4238 11.3825 11.3825 11.3825 11.3825 12.0322 12.0322 12.0322 12.0322 12.1382 12.1382 12.1382 12.1382 13.2727 13.2727 13.2727 13.2727 14.0103 14.0103 14.0103 14.0103 17.0734 17.0734 17.0734 17.0734 k = 0.5000 0.2887 0.3424 ( 4936 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5577 -42.5577 -42.5577 -42.5577 -0.7891 -0.7891 -0.7891 -0.7891 5.9853 5.9853 5.9853 5.9853 8.9731 8.9731 8.9731 8.9731 9.4238 9.4238 9.4238 9.4238 11.3825 11.3825 11.3825 11.3825 12.0322 12.0322 12.0322 12.0322 12.1382 12.1382 12.1382 12.1382 13.2727 13.2727 13.2727 13.2727 14.0103 14.0103 14.0103 14.0103 17.0734 17.0734 17.0734 17.0734 k = 0.4943 0.2986 0.3424 ( 4934 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5577 -42.5577 -42.5577 -42.5577 -0.7889 -0.7889 -0.7885 -0.7885 5.9864 5.9864 5.9865 5.9865 8.9627 8.9627 8.9738 8.9738 9.4203 9.4203 9.4289 9.4289 11.3825 11.3825 11.3845 11.3845 12.0300 12.0300 12.0347 12.0347 12.1362 12.1362 12.1386 12.1386 13.2641 13.2641 13.2666 13.2666 14.0152 14.0152 14.0240 14.0240 17.0761 17.0761 17.0800 17.0800 k = 0.4885 0.3086 0.3424 ( 4934 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6254 -42.6254 -42.5577 -42.5577 -42.5577 -42.5577 -0.7880 -0.7880 -0.7874 -0.7874 5.9899 5.9899 5.9903 5.9903 8.9429 8.9429 8.9643 8.9643 9.4184 9.4184 9.4350 9.4350 11.3839 11.3839 11.3879 11.3879 12.0276 12.0276 12.0368 12.0368 12.1333 12.1333 12.1381 12.1381 13.2420 13.2420 13.2463 13.2463 14.0379 14.0379 14.0547 14.0547 17.0881 17.0881 17.0959 17.0959 k = 0.4828 0.3185 0.3424 ( 4938 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5577 -42.5577 -42.5577 -42.5577 -0.7865 -0.7865 -0.7855 -0.7855 5.9959 5.9959 5.9964 5.9964 8.9143 8.9143 8.9450 8.9450 9.4180 9.4180 9.4416 9.4416 11.3867 11.3867 11.3926 11.3926 12.0249 12.0249 12.0387 12.0387 12.1294 12.1294 12.1365 12.1365 13.2095 13.2095 13.2145 13.2145 14.0752 14.0752 14.0988 14.0988 17.1095 17.1095 17.1210 17.1210 k = 0.4770 0.3285 0.3424 ( 4938 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5577 -42.5577 -42.5577 -42.5577 -0.7843 -0.7843 -0.7830 -0.7830 6.0042 6.0042 6.0050 6.0050 8.8779 8.8779 8.9164 8.9164 9.4192 9.4192 9.4482 9.4482 11.3913 11.3913 11.3989 11.3989 12.0221 12.0221 12.0405 12.0405 12.1246 12.1246 12.1340 12.1340 13.1705 13.1705 13.1752 13.1752 14.1236 14.1236 14.1530 14.1530 17.1400 17.1400 17.1551 17.1551 k = 0.4713 0.3384 0.3424 ( 4930 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3241 -44.3241 -44.3241 -44.3241 -42.6254 -42.6254 -42.6254 -42.6254 -42.5577 -42.5577 -42.5577 -42.5577 -0.7815 -0.7815 -0.7799 -0.7799 6.0150 6.0150 6.0160 6.0160 8.8345 8.8345 8.8796 8.8796 9.4212 9.4212 9.4546 9.4546 11.3975 11.3975 11.4068 11.4068 12.0193 12.0193 12.0422 12.0422 12.1194 12.1194 12.1309 12.1309 13.1286 13.1286 13.1322 13.1322 14.1797 14.1797 14.2139 14.2139 17.1797 17.1797 17.1981 17.1981 k = 0.4655 0.3484 0.3424 ( 4942 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3242 -44.3242 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5578 -42.5578 -42.5577 -42.5577 -0.7780 -0.7780 -0.7761 -0.7761 6.0281 6.0281 6.0294 6.0294 8.7842 8.7842 8.8346 8.8346 9.4232 9.4232 9.4598 9.4598 11.4044 11.4044 11.4152 11.4152 12.0151 12.0151 12.0425 12.0425 12.1133 12.1133 12.1271 12.1271 13.0840 13.0840 13.0858 13.0858 14.2395 14.2395 14.2777 14.2777 17.2282 17.2282 17.2497 17.2497 k = 0.4598 0.3584 0.3424 ( 4942 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3242 -44.3242 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5578 -42.5578 -42.5577 -42.5577 -0.7740 -0.7740 -0.7718 -0.7718 6.0435 6.0435 6.0451 6.0451 8.7283 8.7283 8.7830 8.7830 9.4257 9.4257 9.4646 9.4646 11.4129 11.4129 11.4251 11.4251 12.0105 12.0105 12.0416 12.0416 12.1080 12.1080 12.1232 12.1232 13.0401 13.0401 13.0405 13.0405 14.3026 14.3026 14.3441 14.3441 17.2853 17.2853 17.3095 17.3095 k = 0.4540 0.3683 0.3424 ( 4946 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5578 -42.5578 -42.5578 -42.5578 -0.7694 -0.7694 -0.7669 -0.7669 6.0612 6.0612 6.0633 6.0633 8.6670 8.6670 8.7253 8.7253 9.4276 9.4276 9.4682 9.4682 11.4222 11.4222 11.4356 11.4356 12.0050 12.0050 12.0386 12.0386 12.1043 12.1043 12.1196 12.1196 12.9951 12.9951 12.9979 12.9979 14.3663 14.3663 14.4106 14.4106 17.3507 17.3507 17.3772 17.3772 k = 0.4483 0.3783 0.3424 ( 4954 PWs) bands (ev): -78.6206 -78.6206 -78.6206 -78.6206 -44.3243 -44.3243 -44.3242 -44.3242 -42.6256 -42.6256 -42.6255 -42.6255 -42.5579 -42.5579 -42.5578 -42.5578 -0.7643 -0.7643 -0.7615 -0.7615 6.0812 6.0812 6.0837 6.0837 8.6009 8.6009 8.6622 8.6622 9.4290 9.4290 9.4707 9.4707 11.4323 11.4323 11.4467 11.4467 11.9981 11.9981 12.0329 12.0329 12.1025 12.1025 12.1166 12.1166 12.9516 12.9516 12.9571 12.9571 14.4293 14.4293 14.4761 14.4761 17.4238 17.4238 17.4522 17.4522 k = 0.4425 0.3882 0.3424 ( 4954 PWs) bands (ev): -78.6206 -78.6206 -78.6206 -78.6206 -44.3243 -44.3243 -44.3242 -44.3242 -42.6256 -42.6256 -42.6255 -42.6255 -42.5579 -42.5579 -42.5578 -42.5578 -0.7587 -0.7587 -0.7556 -0.7556 6.1035 6.1035 6.1065 6.1065 8.5307 8.5307 8.5946 8.5946 9.4300 9.4300 9.4725 9.4725 11.4432 11.4432 11.4585 11.4585 11.9903 11.9903 12.0248 12.0248 12.1038 12.1038 12.1153 12.1153 12.9106 12.9106 12.9188 12.9188 14.4914 14.4914 14.5403 14.5403 17.5040 17.5040 17.5338 17.5338 k = 0.4368 0.3982 0.3424 ( 4942 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5578 -42.5578 -42.5578 -42.5578 -0.7527 -0.7527 -0.7493 -0.7493 6.1279 6.1279 6.1316 6.1316 8.4571 8.4571 8.5232 8.5232 9.4306 9.4306 9.4736 9.4736 11.4552 11.4552 11.4711 11.4711 11.9813 11.9813 12.0145 12.0145 12.1080 12.1080 12.1158 12.1158 12.8729 12.8729 12.8840 12.8840 14.5522 14.5522 14.6027 14.6027 17.5906 17.5906 17.6212 17.6212 k = 0.4310 0.4081 0.3424 ( 4950 PWs) bands (ev): -78.6205 -78.6205 -78.6205 -78.6205 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5579 -42.5579 -0.7463 -0.7463 -0.7427 -0.7427 6.1544 6.1544 6.1589 6.1589 8.3801 8.3801 8.4483 8.4483 9.4303 9.4303 9.4736 9.4736 11.4668 11.4668 11.4832 11.4832 11.9702 11.9702 12.0020 12.0020 12.1131 12.1131 12.1172 12.1172 12.8363 12.8363 12.8504 12.8504 14.6099 14.6099 14.6618 14.6618 17.6827 17.6827 17.7135 17.7135 k = 0.4253 0.4181 0.3424 ( 4948 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5578 -42.5578 -0.7396 -0.7396 -0.7357 -0.7357 6.1830 6.1830 6.1885 6.1885 8.3006 8.3006 8.3708 8.3708 9.4295 9.4295 9.4729 9.4729 11.4788 11.4788 11.4955 11.4955 11.9586 11.9586 11.9886 11.9886 12.1211 12.1211 12.1211 12.1211 12.8026 12.8026 12.8196 12.8196 14.6651 14.6651 14.7180 14.7180 17.7794 17.7794 17.8099 17.8099 k = 0.4195 0.4280 0.3424 ( 4944 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5578 -42.5578 -0.7327 -0.7327 -0.7285 -0.7285 6.2135 6.2135 6.2202 6.2202 8.2192 8.2192 8.2912 8.2912 9.4283 9.4283 9.4718 9.4718 11.4911 11.4911 11.5081 11.5081 11.9457 11.9457 11.9741 11.9741 12.1270 12.1270 12.1310 12.1310 12.7708 12.7708 12.7910 12.7910 14.7177 14.7177 14.7715 14.7715 17.8796 17.8796 17.9090 17.9090 k = 0.4138 0.4380 0.3424 ( 4940 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5578 -42.5578 -0.7255 -0.7255 -0.7211 -0.7211 6.2459 6.2459 6.2539 6.2539 8.1362 8.1362 8.2102 8.2102 9.4266 9.4266 9.4701 9.4701 11.5035 11.5035 11.5207 11.5207 11.9318 11.9318 11.9591 11.9591 12.1345 12.1345 12.1422 12.1422 12.7413 12.7413 12.7645 12.7645 14.7673 14.7673 14.8217 14.8217 17.9822 17.9822 18.0098 18.0098 k = 0.4080 0.4479 0.3424 ( 4944 PWs) bands (ev): -78.6203 -78.6203 -78.6203 -78.6203 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5579 -42.5579 -0.7183 -0.7183 -0.7136 -0.7136 6.2799 6.2799 6.2896 6.2896 8.0523 8.0523 8.1284 8.1284 9.4245 9.4245 9.4679 9.4679 11.5157 11.5157 11.5330 11.5330 11.9170 11.9170 11.9435 11.9435 12.1430 12.1430 12.1541 12.1541 12.7130 12.7130 12.7394 12.7394 14.8136 14.8136 14.8684 14.8684 18.0859 18.0859 18.1111 18.1111 k = 0.4023 0.4579 0.3424 ( 4936 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5578 -42.5578 -0.7110 -0.7110 -0.7061 -0.7061 6.3156 6.3156 6.3272 6.3272 7.9680 7.9680 8.0464 8.0464 9.4222 9.4222 9.4656 9.4656 11.5282 11.5282 11.5455 11.5455 11.9017 11.9017 11.9278 11.9278 12.1532 12.1532 12.1676 12.1676 12.6877 12.6877 12.7174 12.7174 14.8575 14.8575 14.9126 14.9126 18.1897 18.1897 18.2115 18.2115 k = 0.3966 0.4679 0.3424 ( 4928 PWs) bands (ev): -78.6199 -78.6199 -78.6199 -78.6199 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5578 -42.5578 -42.5578 -42.5578 -0.7037 -0.7037 -0.6986 -0.6986 6.3526 6.3526 6.3666 6.3666 7.8838 7.8838 7.9648 7.9648 9.4198 9.4198 9.4632 9.4632 11.5406 11.5406 11.5581 11.5581 11.8861 11.8861 11.9121 11.9121 12.1650 12.1650 12.1826 12.1826 12.6630 12.6630 12.6962 12.6962 14.8982 14.8982 14.9535 14.9535 18.2923 18.2923 18.3100 18.3100 k = 0.3908 0.4778 0.3424 ( 4928 PWs) bands (ev): -78.6199 -78.6199 -78.6199 -78.6199 -44.3242 -44.3242 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5578 -42.5578 -0.6966 -0.6966 -0.6913 -0.6913 6.3908 6.3908 6.4076 6.4076 7.8002 7.8002 7.8843 7.8843 9.4170 9.4170 9.4603 9.4603 11.5526 11.5526 11.5704 11.5704 11.8699 11.8699 11.8962 11.8962 12.1773 12.1773 12.1981 12.1981 12.6395 12.6395 12.6763 12.6763 14.9355 14.9355 14.9909 14.9909 18.3925 18.3925 18.4051 18.4051 k = 0.3851 0.4878 0.3424 ( 4928 PWs) bands (ev): -78.6199 -78.6199 -78.6199 -78.6199 -44.3242 -44.3242 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5578 -42.5578 -0.6897 -0.6897 -0.6843 -0.6843 6.4298 6.4298 6.4501 6.4501 7.7179 7.7179 7.8057 7.8057 9.4143 9.4143 9.4576 9.4576 11.5644 11.5644 11.5828 11.5828 11.8535 11.8535 11.8805 11.8805 12.1901 12.1901 12.2143 12.2143 12.6169 12.6169 12.6575 12.6575 14.9697 14.9697 15.0251 15.0251 18.4891 18.4891 18.4956 18.4956 k = 0.3793 0.4977 0.3424 ( 4928 PWs) bands (ev): -78.6199 -78.6199 -78.6199 -78.6199 -44.3242 -44.3242 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5579 -42.5579 -0.6832 -0.6832 -0.6775 -0.6775 6.4691 6.4691 6.4937 6.4937 7.6375 7.6375 7.7296 7.7296 9.4116 9.4116 9.4548 9.4548 11.5761 11.5761 11.5952 11.5952 11.8372 11.8372 11.8651 11.8651 12.2032 12.2032 12.2312 12.2312 12.5951 12.5951 12.6400 12.6400 15.0008 15.0008 15.0562 15.0562 18.5803 18.5803 18.5808 18.5808 k = 0.3736 0.5077 0.3424 ( 4920 PWs) bands (ev): -78.6197 -78.6197 -78.6197 -78.6197 -44.3241 -44.3241 -44.3241 -44.3241 -42.6254 -42.6254 -42.6254 -42.6254 -42.5579 -42.5579 -42.5578 -42.5578 -0.6770 -0.6770 -0.6712 -0.6712 6.5084 6.5084 6.5381 6.5381 7.5597 7.5597 7.6570 7.6570 9.4091 9.4091 9.4523 9.4523 11.5877 11.5877 11.6080 11.6080 11.8208 11.8208 11.8502 11.8502 12.2179 12.2179 12.2501 12.2501 12.5744 12.5744 12.6240 12.6240 15.0288 15.0288 15.0842 15.0842 18.6580 18.6580 18.6664 18.6664 k = 0.3678 0.5176 0.3424 ( 4920 PWs) bands (ev): -78.6197 -78.6197 -78.6197 -78.6197 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6254 -42.6254 -42.5579 -42.5579 -42.5578 -42.5578 -0.6713 -0.6713 -0.6654 -0.6654 6.5468 6.5468 6.5827 6.5827 7.4852 7.4852 7.5888 7.5888 9.4066 9.4066 9.4497 9.4497 11.5987 11.5987 11.6208 11.6208 11.8040 11.8040 11.8355 11.8355 12.2318 12.2318 12.2688 12.2688 12.5540 12.5540 12.6090 12.6090 15.0532 15.0532 15.1086 15.1086 18.7271 18.7271 18.7443 18.7443 k = 0.3621 0.5276 0.3424 ( 4918 PWs) bands (ev): -78.6197 -78.6197 -78.6197 -78.6197 -44.3241 -44.3241 -44.3241 -44.3241 -42.6254 -42.6254 -42.6254 -42.6254 -42.5579 -42.5579 -42.5578 -42.5578 -0.6663 -0.6663 -0.6602 -0.6602 6.5834 6.5834 6.6268 6.6268 7.4154 7.4154 7.5265 7.5265 9.4044 9.4044 9.4476 9.4476 11.6094 11.6094 11.6340 11.6340 11.7878 11.7878 11.8221 11.8221 12.2443 12.2443 12.2866 12.2866 12.5349 12.5349 12.5956 12.5956 15.0745 15.0745 15.1298 15.1298 18.7867 18.7867 18.8132 18.8132 k = 0.3563 0.5375 0.3424 ( 4916 PWs) bands (ev): -78.6196 -78.6196 -78.6196 -78.6196 -44.3241 -44.3241 -44.3241 -44.3241 -42.6254 -42.6254 -42.6254 -42.6254 -42.5579 -42.5579 -42.5578 -42.5578 -0.6619 -0.6619 -0.6558 -0.6558 6.6170 6.6170 6.6691 6.6691 7.3515 7.3515 7.4714 7.4714 9.4024 9.4024 9.4455 9.4455 11.6188 11.6188 11.6470 11.6470 11.7716 11.7716 11.8097 11.8097 12.2560 12.2560 12.3042 12.3042 12.5177 12.5177 12.5847 12.5847 15.0918 15.0918 15.1471 15.1471 18.8357 18.8357 18.8713 18.8713 k = 0.3506 0.5475 0.3424 ( 4924 PWs) bands (ev): -78.6198 -78.6198 -78.6198 -78.6198 -44.3242 -44.3242 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5579 -42.5579 -0.6583 -0.6583 -0.6522 -0.6522 6.6459 6.6459 6.7078 6.7078 7.2957 7.2957 7.4254 7.4254 9.4006 9.4006 9.4437 9.4437 11.6269 11.6269 11.6600 11.6600 11.7553 11.7553 11.7987 11.7987 12.2657 12.2657 12.3204 12.3204 12.5008 12.5008 12.5746 12.5746 15.1053 15.1053 15.1606 15.1606 18.8731 18.8731 18.9171 18.9171 k = 0.3448 0.5574 0.3424 ( 4932 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5580 -42.5580 -42.5579 -42.5579 -0.6557 -0.6557 -0.6494 -0.6494 6.6683 6.6683 6.7399 6.7399 7.2511 7.2511 7.3906 7.3906 9.3993 9.3993 9.4424 9.4424 11.6334 11.6334 11.6729 11.6729 11.7399 11.7399 11.7900 11.7900 12.2733 12.2733 12.3348 12.3348 12.4855 12.4855 12.5664 12.5664 15.1152 15.1152 15.1705 15.1705 18.8988 18.8988 18.9496 18.9496 k = 0.3391 0.5674 0.3424 ( 4932 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5580 -42.5580 -42.5579 -42.5579 -0.6540 -0.6540 -0.6477 -0.6477 6.6825 6.6825 6.7616 6.7616 7.2218 7.2218 7.3688 7.3688 9.3985 9.3985 9.4417 9.4417 11.6380 11.6380 11.6858 11.6858 11.7259 11.7259 11.7844 11.7844 12.2782 12.2782 12.3449 12.3449 12.4755 12.4755 12.5618 12.5618 15.1213 15.1213 15.1766 15.1766 18.9133 18.9133 18.9683 18.9683 k = 0.3333 0.5774 0.3424 ( 4932 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5580 -42.5580 -42.5579 -42.5579 -0.6534 -0.6534 -0.6472 -0.6472 6.6873 6.6873 6.7693 6.7693 7.2116 7.2116 7.3615 7.3615 9.3983 9.3983 9.4414 9.4414 11.6397 11.6397 11.6933 11.6933 11.7181 11.7181 11.7824 11.7824 12.2798 12.2798 12.3487 12.3487 12.4717 12.4717 12.5601 12.5601 15.1234 15.1234 15.1787 15.1787 18.9177 18.9177 18.9742 18.9742 k = 0.3333 0.5774 0.3424 ( 4932 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5580 -42.5580 -42.5579 -42.5579 -0.6534 -0.6534 -0.6472 -0.6472 6.6873 6.6873 6.7693 6.7693 7.2116 7.2116 7.3615 7.3615 9.3983 9.3983 9.4414 9.4414 11.6397 11.6397 11.6933 11.6933 11.7181 11.7181 11.7824 11.7824 12.2798 12.2798 12.3487 12.3487 12.4717 12.4717 12.5601 12.5601 15.1234 15.1234 15.1787 15.1787 18.9177 18.9177 18.9742 18.9742 k = 0.3276 0.5674 0.3424 ( 4936 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5580 -42.5580 -42.5580 -42.5580 -0.6540 -0.6540 -0.6478 -0.6478 6.6827 6.6827 6.7620 6.7620 7.2215 7.2215 7.3686 7.3686 9.3984 9.3984 9.4416 9.4416 11.6378 11.6378 11.6854 11.6854 11.7259 11.7259 11.7843 11.7843 12.2780 12.2780 12.3446 12.3446 12.4754 12.4754 12.5616 12.5616 15.1211 15.1211 15.1765 15.1765 18.9140 18.9140 18.9692 18.9692 k = 0.3218 0.5574 0.3424 ( 4940 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3243 -44.3243 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5580 -42.5580 -42.5580 -42.5580 -0.6559 -0.6559 -0.6497 -0.6497 6.6702 6.6702 6.7424 6.7424 7.2489 7.2489 7.3890 7.3890 9.3992 9.3992 9.4424 9.4424 11.6329 11.6329 11.6720 11.6720 11.7404 11.7404 11.7901 11.7901 12.2723 12.2723 12.3335 12.3335 12.4854 12.4854 12.5661 12.5661 15.1146 15.1146 15.1699 15.1699 18.9042 18.9042 18.9561 18.9561 k = 0.3161 0.5475 0.3424 ( 4932 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5580 -42.5580 -42.5579 -42.5579 -0.6591 -0.6591 -0.6529 -0.6529 6.6517 6.6517 6.7152 6.7152 7.2893 7.2893 7.4207 7.4207 9.4008 9.4008 9.4439 9.4439 11.6261 11.6261 11.6582 11.6582 11.7571 11.7571 11.7996 11.7996 12.2641 12.2641 12.3185 12.3185 12.5004 12.5004 12.5740 12.5740 15.1042 15.1042 15.1594 15.1594 18.8907 18.8907 18.9379 18.9379 k = 0.3103 0.5375 0.3424 ( 4924 PWs) bands (ev): -78.6198 -78.6198 -78.6198 -78.6198 -44.3242 -44.3242 -44.3241 -44.3241 -42.6255 -42.6255 -42.6254 -42.6254 -42.5579 -42.5579 -42.5579 -42.5579 -0.6637 -0.6637 -0.6576 -0.6576 6.6297 6.6297 6.6846 6.6846 7.3387 7.3387 7.4613 7.4613 9.4031 9.4031 9.4462 9.4462 11.6175 11.6175 11.6444 11.6444 11.7746 11.7746 11.8117 11.8117 12.2530 12.2530 12.3007 12.3007 12.5176 12.5176 12.5841 12.5841 15.0895 15.0895 15.1447 15.1447 18.8754 18.8754 18.9172 18.9172 k = 0.3046 0.5276 0.3424 ( 4920 PWs) bands (ev): -78.6197 -78.6197 -78.6197 -78.6197 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6254 -42.6254 -42.5579 -42.5579 -42.5578 -42.5578 -0.6698 -0.6698 -0.6638 -0.6638 6.6061 6.6061 6.6533 6.6533 7.3940 7.3940 7.5089 7.5089 9.4060 9.4060 9.4489 9.4489 11.6070 11.6070 11.6303 11.6303 11.7931 11.7931 11.8259 11.8259 12.2390 12.2390 12.2806 12.2806 12.5365 12.5365 12.5963 12.5963 15.0701 15.0701 15.1251 15.1251 18.8600 18.8600 18.8961 18.8961 k = 0.2989 0.5176 0.3424 ( 4918 PWs) bands (ev): -78.6197 -78.6197 -78.6197 -78.6197 -44.3241 -44.3241 -44.3241 -44.3241 -42.6254 -42.6254 -42.6254 -42.6254 -42.5579 -42.5579 -42.5578 -42.5578 -0.6775 -0.6775 -0.6715 -0.6715 6.5827 6.5827 6.6233 6.6233 7.4536 7.4536 7.5618 7.5618 9.4094 9.4094 9.4522 9.4522 11.5961 11.5961 11.6166 11.6166 11.8118 11.8118 11.8414 11.8414 12.2234 12.2234 12.2597 12.2597 12.5555 12.5555 12.6096 12.6096 15.0463 15.0463 15.1012 15.1012 18.8457 18.8457 18.8761 18.8761 k = 0.2931 0.5077 0.3424 ( 4930 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3242 -44.3242 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5579 -42.5579 -0.6867 -0.6867 -0.6809 -0.6809 6.5605 6.5605 6.5957 6.5957 7.5161 7.5161 7.6187 7.6187 9.4134 9.4134 9.4561 9.4561 11.5838 11.5838 11.6025 11.6025 11.8308 11.8308 11.8582 11.8582 12.2049 12.2049 12.2365 12.2365 12.5742 12.5742 12.6231 12.6231 15.0182 15.0182 15.0729 15.0729 18.8333 18.8333 18.8581 18.8581 k = 0.2874 0.4977 0.3424 ( 4934 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5579 -42.5579 -0.6975 -0.6975 -0.6918 -0.6918 6.5406 6.5406 6.5713 6.5713 7.5807 7.5807 7.6786 7.6786 9.4183 9.4183 9.4606 9.4606 11.5716 11.5716 11.5890 11.5890 11.8509 11.8509 11.8764 11.8764 12.1863 12.1863 12.2142 12.2142 12.5926 12.5926 12.6372 12.6372 14.9863 14.9863 15.0407 15.0407 18.8235 18.8235 18.8429 18.8429 k = 0.2816 0.4878 0.3424 ( 4930 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3242 -44.3242 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5578 -42.5578 -0.7099 -0.7099 -0.7044 -0.7044 6.5237 6.5237 6.5506 6.5506 7.6469 7.6469 7.7409 7.7409 9.4238 9.4238 9.4659 9.4659 11.5593 11.5593 11.5759 11.5759 11.8718 11.8718 11.8958 11.8958 12.1677 12.1677 12.1924 12.1924 12.6118 12.6118 12.6524 12.6524 14.9507 14.9507 15.0048 15.0048 18.8167 18.8167 18.8308 18.8308 k = 0.2759 0.4778 0.3424 ( 4946 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3243 -44.3243 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5579 -42.5579 -0.7239 -0.7239 -0.7186 -0.7186 6.5101 6.5101 6.5340 6.5340 7.7141 7.7141 7.8047 7.8047 9.4300 9.4300 9.4716 9.4716 11.5467 11.5467 11.5630 11.5630 11.8917 11.8917 11.9148 11.9148 12.1473 12.1473 12.1691 12.1691 12.6294 12.6294 12.6665 12.6665 14.9113 14.9113 14.9651 14.9651 18.8125 18.8125 18.8216 18.8216 k = 0.2701 0.4679 0.3424 ( 4946 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5579 -42.5579 -42.5578 -42.5578 -0.7396 -0.7396 -0.7345 -0.7345 6.5004 6.5004 6.5217 6.5217 7.7821 7.7821 7.8698 7.8698 9.4370 9.4370 9.4781 9.4781 11.5344 11.5344 11.5507 11.5507 11.9125 11.9125 11.9351 11.9351 12.1281 12.1281 12.1472 12.1472 12.6479 12.6479 12.6819 12.6819 14.8692 14.8692 14.9226 14.9226 18.8112 18.8112 18.8154 18.8154 k = 0.2644 0.4579 0.3424 ( 4940 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5578 -42.5578 -42.5578 -42.5578 -0.7569 -0.7569 -0.7520 -0.7520 6.4946 6.4946 6.5138 6.5138 7.8506 7.8506 7.9357 7.9357 9.4449 9.4449 9.4854 9.4854 11.5226 11.5226 11.5392 11.5392 11.9328 11.9328 11.9557 11.9557 12.1105 12.1105 12.1269 12.1269 12.6661 12.6661 12.6973 12.6973 14.8246 14.8246 14.8776 14.8776 18.8118 18.8118 18.8124 18.8124 k = 0.2586 0.4479 0.3424 ( 4932 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6254 -42.6254 -42.5577 -42.5577 -42.5577 -42.5577 -0.7758 -0.7758 -0.7710 -0.7710 6.4930 6.4930 6.5105 6.5105 7.9192 7.9192 8.0019 8.0019 9.4534 9.4534 9.4931 9.4931 11.5110 11.5110 11.5281 11.5281 11.9509 11.9509 11.9746 11.9746 12.0960 12.0960 12.1096 12.1096 12.6839 12.6839 12.7125 12.7125 14.7777 14.7777 14.8302 14.8302 18.8104 18.8104 18.8157 18.8157 k = 0.2529 0.4380 0.3424 ( 4932 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6254 -42.6254 -42.5577 -42.5577 -42.5576 -42.5576 -0.7962 -0.7962 -0.7916 -0.7916 6.4957 6.4957 6.5117 6.5117 7.9876 7.9876 8.0682 8.0682 9.4624 9.4624 9.5013 9.5013 11.4992 11.4992 11.5171 11.5171 11.9634 11.9634 11.9887 11.9887 12.0869 12.0869 12.0974 12.0974 12.7011 12.7011 12.7275 12.7275 14.7284 14.7284 14.7805 14.7805 18.8105 18.8105 18.8203 18.8203 k = 0.2471 0.4280 0.3424 ( 4932 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5576 -42.5576 -42.5576 -42.5576 -0.8181 -0.8181 -0.8138 -0.8138 6.5027 6.5027 6.5175 6.5175 8.0556 8.0556 8.1342 8.1342 9.4721 9.4721 9.5100 9.5100 11.4881 11.4881 11.5070 11.5070 11.9661 11.9661 11.9924 11.9924 12.0877 12.0877 12.0962 12.0962 12.7182 12.7182 12.7424 12.7424 14.6775 14.6775 14.7291 14.7291 18.8116 18.8116 18.8260 18.8260 k = 0.2414 0.4181 0.3424 ( 4924 PWs) bands (ev): -78.6199 -78.6199 -78.6199 -78.6199 -44.3240 -44.3240 -44.3240 -44.3240 -42.6254 -42.6254 -42.6254 -42.6254 -42.5575 -42.5575 -42.5575 -42.5575 -0.8414 -0.8414 -0.8373 -0.8373 6.5141 6.5141 6.5279 6.5279 8.1232 8.1232 8.1998 8.1998 9.4826 9.4826 9.5192 9.5192 11.4775 11.4775 11.4977 11.4977 11.9592 11.9592 11.9852 11.9852 12.1006 12.1006 12.1087 12.1087 12.7342 12.7342 12.7566 12.7566 14.6261 14.6261 14.6773 14.6773 18.8134 18.8134 18.8323 18.8323 k = 0.2356 0.4081 0.3424 ( 4924 PWs) bands (ev): -78.6199 -78.6199 -78.6199 -78.6199 -44.3240 -44.3240 -44.3240 -44.3240 -42.6254 -42.6254 -42.6254 -42.6254 -42.5575 -42.5575 -42.5574 -42.5574 -0.8661 -0.8661 -0.8622 -0.8622 6.5297 6.5297 6.5426 6.5426 8.1898 8.1898 8.2644 8.2644 9.4933 9.4933 9.5286 9.5286 11.4671 11.4671 11.4888 11.4888 11.9448 11.9448 11.9701 11.9701 12.1212 12.1212 12.1299 12.1299 12.7493 12.7493 12.7700 12.7700 14.5736 14.5736 14.6243 14.6243 18.8152 18.8152 18.8384 18.8384 k = 0.2299 0.3982 0.3424 ( 4920 PWs) bands (ev): -78.6198 -78.6198 -78.6198 -78.6198 -44.3239 -44.3239 -44.3239 -44.3239 -42.6254 -42.6254 -42.6254 -42.6254 -42.5574 -42.5574 -42.5574 -42.5574 -0.8920 -0.8920 -0.8883 -0.8883 6.5496 6.5496 6.5618 6.5618 8.2554 8.2554 8.3280 8.3280 9.5046 9.5046 9.5383 9.5383 11.4575 11.4575 11.4807 11.4807 11.9272 11.9272 11.9519 11.9519 12.1469 12.1469 12.1564 12.1564 12.7636 12.7636 12.7829 12.7829 14.5210 14.5210 14.5712 14.5712 18.8168 18.8168 18.8442 18.8442 k = 0.2241 0.3882 0.3424 ( 4916 PWs) bands (ev): -78.6197 -78.6197 -78.6197 -78.6197 -44.3239 -44.3239 -44.3239 -44.3239 -42.6254 -42.6254 -42.6253 -42.6253 -42.5573 -42.5573 -42.5573 -42.5573 -0.9191 -0.9191 -0.9156 -0.9156 6.5737 6.5737 6.5853 6.5853 8.3198 8.3198 8.3902 8.3902 9.5162 9.5162 9.5482 9.5482 11.4483 11.4483 11.4733 11.4733 11.9074 11.9074 11.9319 11.9319 12.1762 12.1762 12.1865 12.1865 12.7769 12.7769 12.7950 12.7950 14.4687 14.4687 14.5184 14.5184 18.8180 18.8180 18.8493 18.8493 k = 0.2184 0.3783 0.3424 ( 4920 PWs) bands (ev): -78.6198 -78.6198 -78.6198 -78.6198 -44.3239 -44.3239 -44.3239 -44.3239 -42.6254 -42.6254 -42.6253 -42.6253 -42.5573 -42.5573 -42.5573 -42.5573 -0.9473 -0.9473 -0.9440 -0.9440 6.6018 6.6018 6.6128 6.6128 8.3826 8.3826 8.4508 8.4508 9.5281 9.5281 9.5581 9.5581 11.4398 11.4398 11.4668 11.4668 11.8867 11.8867 11.9114 11.9114 12.2069 12.2069 12.2181 12.2181 12.7886 12.7886 12.8057 12.8057 14.4167 14.4167 14.4660 14.4660 18.8182 18.8182 18.8532 18.8532 k = 0.2126 0.3683 0.3424 ( 4932 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3239 -44.3239 -44.3239 -44.3239 -42.6254 -42.6254 -42.6254 -42.6254 -42.5573 -42.5573 -42.5573 -42.5573 -0.9764 -0.9764 -0.9734 -0.9734 6.6338 6.6338 6.6444 6.6444 8.4438 8.4438 8.5096 8.5096 9.5399 9.5399 9.5678 9.5678 11.4311 11.4311 11.4602 11.4602 11.8654 11.8654 11.8907 11.8907 12.2397 12.2397 12.2521 12.2521 12.7985 12.7985 12.8151 12.8151 14.3655 14.3655 14.4143 14.4143 18.8177 18.8177 18.8560 18.8560 k = 0.2069 0.3584 0.3424 ( 4928 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3239 -44.3239 -44.3239 -44.3239 -42.6254 -42.6254 -42.6253 -42.6253 -42.5572 -42.5572 -42.5572 -42.5572 -1.0064 -1.0064 -1.0036 -1.0036 6.6697 6.6697 6.6799 6.6799 8.5034 8.5034 8.5666 8.5666 9.5520 9.5520 9.5777 9.5777 11.4240 11.4240 11.4554 11.4554 11.8446 11.8446 11.8707 11.8707 12.2745 12.2745 12.2883 12.2883 12.8080 12.8080 12.8244 12.8244 14.3167 14.3167 14.3650 14.3650 18.8167 18.8167 18.8581 18.8581 k = 0.2011 0.3484 0.3424 ( 4932 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3239 -44.3239 -44.3239 -44.3239 -42.6254 -42.6254 -42.6253 -42.6253 -42.5572 -42.5572 -42.5572 -42.5572 -1.0372 -1.0372 -1.0346 -1.0346 6.7092 6.7092 6.7191 6.7191 8.5609 8.5609 8.6214 8.6214 9.5638 9.5638 9.5870 9.5870 11.4172 11.4172 11.4510 11.4510 11.8243 11.8243 11.8513 11.8513 12.3103 12.3103 12.3260 12.3260 12.8157 12.8157 12.8324 12.8324 14.2694 14.2694 14.3171 14.3171 18.8151 18.8151 18.8592 18.8592 k = 0.1954 0.3384 0.3424 ( 4932 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3238 -44.3238 -44.3238 -44.3238 -42.6253 -42.6253 -42.6253 -42.6253 -42.5571 -42.5571 -42.5571 -42.5571 -1.0686 -1.0686 -1.0662 -1.0662 6.7523 6.7523 6.7618 6.7618 8.6164 8.6164 8.6740 8.6740 9.5754 9.5754 9.5960 9.5960 11.4116 11.4116 11.4478 11.4478 11.8044 11.8044 11.8326 11.8326 12.3475 12.3475 12.3656 12.3656 12.8218 12.8218 12.8394 12.8394 14.2248 14.2248 14.2718 14.2718 18.8134 18.8134 18.8598 18.8598 k = 0.1897 0.3285 0.3424 ( 4930 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3238 -44.3238 -44.3238 -44.3238 -42.6253 -42.6253 -42.6253 -42.6253 -42.5570 -42.5570 -42.5570 -42.5570 -1.1005 -1.1005 -1.0983 -1.0983 6.7987 6.7987 6.8079 6.8079 8.6698 8.6698 8.7243 8.7243 9.5865 9.5865 9.6044 9.6044 11.4069 11.4069 11.4456 11.4456 11.7854 11.7854 11.8148 11.8148 12.3857 12.3857 12.4069 12.4069 12.8261 12.8261 12.8453 12.8453 14.1831 14.1831 14.2295 14.2295 18.8119 18.8119 18.8603 18.8603 k = 0.1839 0.3185 0.3424 ( 4922 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3237 -44.3237 -44.3237 -44.3237 -42.6252 -42.6252 -42.6252 -42.6252 -42.5570 -42.5570 -42.5569 -42.5569 -1.1328 -1.1328 -1.1308 -1.1308 6.8482 6.8482 6.8572 6.8572 8.7210 8.7210 8.7723 8.7723 9.5972 9.5972 9.6122 9.6122 11.4035 11.4035 11.4447 11.4447 11.7669 11.7669 11.7977 11.7977 12.4247 12.4247 12.4499 12.4499 12.8287 12.8287 12.8506 12.8506 14.1453 14.1453 14.1908 14.1908 18.8108 18.8108 18.8609 18.8609 k = 0.1782 0.3086 0.3424 ( 4922 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3237 -44.3237 -44.3237 -44.3237 -42.6252 -42.6252 -42.6252 -42.6252 -42.5569 -42.5569 -42.5568 -42.5568 -1.1654 -1.1654 -1.1635 -1.1635 6.9006 6.9006 6.9093 6.9093 8.7697 8.7697 8.8176 8.8176 9.6068 9.6068 9.6190 9.6190 11.4008 11.4008 11.4444 11.4444 11.7499 11.7499 11.7821 11.7821 12.4629 12.4629 12.4931 12.4931 12.8290 12.8290 12.8548 12.8548 14.1108 14.1108 14.1553 14.1553 18.8105 18.8105 18.8619 18.8619 k = 0.1724 0.2986 0.3424 ( 4926 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3237 -44.3237 -44.3237 -44.3237 -42.6252 -42.6252 -42.6252 -42.6252 -42.5568 -42.5568 -42.5568 -42.5568 -1.1982 -1.1982 -1.1965 -1.1965 6.9558 6.9558 6.9642 6.9642 8.8160 8.8160 8.8604 8.8604 9.6154 9.6154 9.6248 9.6248 11.3991 11.3991 11.4450 11.4450 11.7333 11.7333 11.7669 11.7669 12.4996 12.4996 12.5362 12.5362 12.8281 12.8281 12.8592 12.8592 14.0804 14.0804 14.1238 14.1238 18.8111 18.8111 18.8637 18.8637 k = 0.1667 0.2887 0.3424 ( 4926 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3236 -44.3236 -44.3236 -44.3236 -42.6252 -42.6252 -42.6252 -42.6252 -42.5568 -42.5568 -42.5567 -42.5567 -1.2310 -1.2310 -1.2294 -1.2294 7.0134 7.0134 7.0217 7.0217 8.8600 8.8600 8.9009 8.9009 9.6230 9.6230 9.6297 9.6297 11.3983 11.3983 11.4464 11.4464 11.7182 11.7182 11.7531 11.7531 12.5334 12.5334 12.5777 12.5777 12.8276 12.8276 12.8655 12.8655 14.0547 14.0547 14.0969 14.0969 18.8132 18.8132 18.8667 18.8667 k = 0.1609 0.2787 0.3424 ( 4918 PWs) bands (ev): -78.6199 -78.6199 -78.6199 -78.6199 -44.3235 -44.3235 -44.3235 -44.3235 -42.6251 -42.6251 -42.6251 -42.6251 -42.5566 -42.5566 -42.5566 -42.5566 -1.2637 -1.2637 -1.2623 -1.2623 7.0735 7.0735 7.0815 7.0815 8.9017 8.9017 8.9390 8.9390 9.6292 9.6292 9.6332 9.6332 11.3989 11.3989 11.4489 11.4489 11.7040 11.7040 11.7404 11.7404 12.5625 12.5625 12.6151 12.6151 12.8312 12.8312 12.8766 12.8766 14.0341 14.0341 14.0748 14.0748 18.8171 18.8171 18.8714 18.8714 k = 0.1552 0.2688 0.3424 ( 4914 PWs) bands (ev): -78.6198 -78.6198 -78.6198 -78.6198 -44.3235 -44.3235 -44.3235 -44.3235 -42.6251 -42.6251 -42.6251 -42.6251 -42.5565 -42.5565 -42.5565 -42.5565 -1.2963 -1.2963 -1.2950 -1.2950 7.1356 7.1356 7.1433 7.1433 8.9407 8.9407 8.9745 8.9745 9.6339 9.6339 9.6354 9.6354 11.4006 11.4006 11.4524 11.4524 11.6912 11.6912 11.7287 11.7287 12.5839 12.5839 12.6426 12.6426 12.8427 12.8427 12.8936 12.8936 14.0177 14.0177 14.0568 14.0568 18.8229 18.8229 18.8778 18.8778 k = 0.1494 0.2588 0.3424 ( 4920 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3235 -44.3235 -44.3235 -44.3235 -42.6251 -42.6251 -42.6251 -42.6251 -42.5565 -42.5565 -42.5565 -42.5565 -1.3286 -1.3286 -1.3275 -1.3275 7.1996 7.1996 7.2070 7.2070 8.9773 8.9773 9.0075 9.0075 9.6363 9.6363 9.6370 9.6370 11.4032 11.4032 11.4564 11.4564 11.6789 11.6789 11.7176 11.7176 12.5951 12.5951 12.6550 12.6550 12.8668 12.8668 12.9182 12.9182 14.0057 14.0057 14.0430 14.0430 18.8305 18.8305 18.8860 18.8860 k = 0.1437 0.2489 0.3424 ( 4926 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3235 -44.3235 -44.3235 -44.3235 -42.6251 -42.6251 -42.6251 -42.6251 -42.5565 -42.5565 -42.5564 -42.5564 -1.3605 -1.3605 -1.3595 -1.3595 7.2651 7.2651 7.2723 7.2723 9.0117 9.0117 9.0384 9.0384 9.6357 9.6357 9.6386 9.6386 11.4063 11.4063 11.4608 11.4608 11.6674 11.6674 11.7071 11.7071 12.5968 12.5968 12.6528 12.6528 12.9047 12.9047 12.9519 12.9519 13.9983 13.9983 14.0338 14.0338 18.8404 18.8404 18.8963 18.8963 k = 0.1379 0.2389 0.3424 ( 4914 PWs) bands (ev): -78.6199 -78.6199 -78.6199 -78.6199 -44.3234 -44.3234 -44.3234 -44.3234 -42.6250 -42.6250 -42.6250 -42.6250 -42.5563 -42.5563 -42.5563 -42.5563 -1.3920 -1.3920 -1.3911 -1.3911 7.3322 7.3322 7.3390 7.3390 9.0440 9.0440 9.0674 9.0674 9.6338 9.6338 9.6386 9.6386 11.4112 11.4112 11.4666 11.4666 11.6577 11.6577 11.6984 11.6984 12.5896 12.5896 12.6394 12.6394 12.9540 12.9540 12.9947 12.9947 13.9963 13.9963 14.0299 14.0299 18.8526 18.8526 18.9089 18.9089 k = 0.1322 0.2289 0.3424 ( 4914 PWs) bands (ev): -78.6199 -78.6199 -78.6199 -78.6199 -44.3233 -44.3233 -44.3233 -44.3233 -42.6250 -42.6250 -42.6250 -42.6250 -42.5562 -42.5562 -42.5562 -42.5562 -1.4228 -1.4228 -1.4221 -1.4221 7.4003 7.4003 7.4069 7.4069 9.0739 9.0739 9.0940 9.0940 9.6305 9.6305 9.6368 9.6368 11.4171 11.4171 11.4731 11.4731 11.6488 11.6488 11.6901 11.6901 12.5743 12.5743 12.6178 12.6178 13.0091 13.0091 13.0432 13.0432 13.9974 13.9974 14.0292 14.0292 18.8666 18.8666 18.9232 18.9232 k = 0.1264 0.2190 0.3424 ( 4922 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3234 -44.3234 -44.3234 -44.3234 -42.6251 -42.6251 -42.6251 -42.6251 -42.5562 -42.5562 -42.5562 -42.5562 -1.4530 -1.4530 -1.4524 -1.4524 7.4693 7.4693 7.4755 7.4755 9.1013 9.1013 9.1184 9.1184 9.6257 9.6257 9.6333 9.6333 11.4231 11.4231 11.4794 11.4794 11.6407 11.6407 11.6825 11.6825 12.5532 12.5532 12.5910 12.5910 13.0685 13.0685 13.0964 13.0964 14.0018 14.0018 14.0317 14.0317 18.8822 18.8822 18.9391 18.9391 k = 0.1207 0.2090 0.3424 ( 4920 PWs) bands (ev): -78.6201 -78.6201 -78.6201 -78.6201 -44.3233 -44.3233 -44.3233 -44.3233 -42.6251 -42.6251 -42.6251 -42.6251 -42.5561 -42.5561 -42.5561 -42.5561 -1.4825 -1.4825 -1.4819 -1.4819 7.5390 7.5390 7.5449 7.5449 9.1271 9.1271 9.1413 9.1413 9.6195 9.6195 9.6282 9.6282 11.4305 11.4305 11.4868 11.4868 11.6332 11.6332 11.6754 11.6754 12.5275 12.5275 12.5603 12.5603 13.1319 13.1319 13.1547 13.1547 14.0103 14.0103 14.0382 14.0382 18.8989 18.8989 18.9559 18.9559 k = 0.1149 0.1991 0.3424 ( 4924 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3233 -44.3233 -44.3233 -44.3233 -42.6251 -42.6251 -42.6251 -42.6251 -42.5560 -42.5560 -42.5560 -42.5560 -1.5111 -1.5111 -1.5106 -1.5106 7.6091 7.6091 7.6146 7.6146 9.1507 9.1507 9.1622 9.1622 9.6121 9.6121 9.6216 9.6216 11.4383 11.4383 11.4942 11.4942 11.6266 11.6266 11.6689 11.6689 12.4987 12.4987 12.5273 12.5273 13.1972 13.1972 13.2154 13.2154 14.0209 14.0209 14.0470 14.0470 18.9159 18.9159 18.9728 18.9728 k = 0.1092 0.1891 0.3424 ( 4930 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3233 -44.3233 -44.3233 -44.3233 -42.6251 -42.6251 -42.6251 -42.6251 -42.5560 -42.5560 -42.5560 -42.5560 -1.5388 -1.5388 -1.5383 -1.5383 7.6794 7.6794 7.6845 7.6845 9.1721 9.1721 9.1812 9.1812 9.6035 9.6035 9.6135 9.6135 11.4465 11.4465 11.5015 11.5015 11.6210 11.6210 11.6631 11.6631 12.4676 12.4676 12.4924 12.4924 13.2642 13.2642 13.2784 13.2784 14.0337 14.0337 14.0582 14.0582 18.9316 18.9316 18.9881 18.9881 k = 0.1034 0.1792 0.3424 ( 4934 PWs) bands (ev): -78.6205 -78.6205 -78.6205 -78.6205 -44.3233 -44.3233 -44.3233 -44.3233 -42.6251 -42.6251 -42.6251 -42.6251 -42.5560 -42.5560 -42.5560 -42.5560 -1.5655 -1.5655 -1.5651 -1.5651 7.7495 7.7495 7.7542 7.7542 9.1919 9.1919 9.1987 9.1987 9.5937 9.5937 9.6041 9.6041 11.4552 11.4552 11.5091 11.5091 11.6161 11.6161 11.6579 11.6579 12.4346 12.4346 12.4561 12.4561 13.3328 13.3328 13.3436 13.3436 14.0489 14.0489 14.0716 14.0716 18.9442 18.9442 18.9997 18.9997 k = 0.0977 0.1692 0.3424 ( 4930 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3233 -44.3233 -44.3233 -44.3233 -42.6251 -42.6251 -42.6251 -42.6251 -42.5559 -42.5559 -42.5559 -42.5559 -1.5911 -1.5911 -1.5908 -1.5908 7.8193 7.8193 7.8236 7.8236 9.2100 9.2100 9.2148 9.2148 9.5829 9.5829 9.5934 9.5934 11.4647 11.4647 11.5171 11.5171 11.6119 11.6119 11.6531 11.6531 12.4010 12.4010 12.4195 12.4195 13.4030 13.4030 13.4108 13.4108 14.0658 14.0658 14.0869 14.0869 18.9513 18.9513 19.0046 19.0046 k = 0.0920 0.1593 0.3424 ( 4930 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3233 -44.3233 -44.3233 -44.3233 -42.6251 -42.6251 -42.6251 -42.6251 -42.5558 -42.5558 -42.5558 -42.5558 -1.6156 -1.6156 -1.6153 -1.6153 7.8884 7.8884 7.8923 7.8923 9.2262 9.2262 9.2292 9.2292 9.5712 9.5712 9.5816 9.5816 11.4744 11.4744 11.5251 11.5251 11.6081 11.6081 11.6485 11.6485 12.3670 12.3670 12.3829 12.3829 13.4734 13.4734 13.4785 13.4785 14.0836 14.0836 14.1032 14.1032 18.9499 18.9499 18.9996 18.9996 k = 0.0862 0.1493 0.3424 ( 4930 PWs) bands (ev): -78.6205 -78.6205 -78.6205 -78.6205 -44.3232 -44.3232 -44.3232 -44.3232 -42.6251 -42.6251 -42.6251 -42.6251 -42.5557 -42.5557 -42.5557 -42.5557 -1.6389 -1.6389 -1.6387 -1.6387 7.9566 7.9566 7.9601 7.9601 9.2406 9.2406 9.2423 9.2423 9.5586 9.5586 9.5687 9.5687 11.4843 11.4843 11.5330 11.5330 11.6050 11.6050 11.6444 11.6444 12.3327 12.3327 12.3463 12.3463 13.5441 13.5441 13.5469 13.5469 14.1022 14.1022 14.1203 14.1203 18.9374 18.9374 18.9817 18.9817 k = 0.0805 0.1394 0.3424 ( 4928 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3232 -44.3232 -44.3232 -44.3232 -42.6250 -42.6250 -42.6250 -42.6250 -42.5557 -42.5557 -42.5557 -42.5557 -1.6610 -1.6610 -1.6608 -1.6608 8.0236 8.0236 8.0267 8.0267 9.2535 9.2535 9.2539 9.2539 9.5453 9.5453 9.5550 9.5550 11.4945 11.4945 11.5409 11.5409 11.6023 11.6023 11.6405 11.6405 12.2987 12.2987 12.3102 12.3102 13.6147 13.6147 13.6156 13.6156 14.1214 14.1214 14.1380 14.1380 18.9119 18.9119 18.9497 18.9497 k = 0.0747 0.1294 0.3424 ( 4928 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3232 -44.3232 -44.3232 -44.3232 -42.6250 -42.6250 -42.6250 -42.6250 -42.5556 -42.5556 -42.5556 -42.5556 -1.6818 -1.6818 -1.6816 -1.6816 8.0890 8.0890 8.0917 8.0917 9.2642 9.2642 9.2648 9.2648 9.5314 9.5314 9.5405 9.5405 11.5046 11.5046 11.5483 11.5483 11.6005 11.6005 11.6369 11.6369 12.2655 12.2655 12.2750 12.2750 13.6836 13.6836 13.6844 13.6844 14.1406 14.1406 14.1559 14.1559 18.8734 18.8734 18.9042 18.9042 k = 0.0690 0.1195 0.3424 ( 4928 PWs) bands (ev): -78.6205 -78.6205 -78.6205 -78.6205 -44.3232 -44.3232 -44.3232 -44.3232 -42.6250 -42.6250 -42.6250 -42.6250 -42.5556 -42.5556 -42.5556 -42.5556 -1.7012 -1.7012 -1.7011 -1.7011 8.1526 8.1526 8.1549 8.1549 9.2732 9.2732 9.2745 9.2745 9.5171 9.5171 9.5254 9.5254 11.5146 11.5146 11.5554 11.5554 11.5987 11.5987 11.6334 11.6334 12.2333 12.2333 12.2411 12.2411 13.7508 13.7508 13.7530 13.7530 14.1598 14.1598 14.1738 14.1738 18.8235 18.8235 18.8477 18.8477 k = 0.0632 0.1095 0.3424 ( 4928 PWs) bands (ev): -78.6205 -78.6205 -78.6205 -78.6205 -44.3232 -44.3232 -44.3231 -44.3231 -42.6250 -42.6250 -42.6250 -42.6250 -42.5555 -42.5555 -42.5555 -42.5555 -1.7192 -1.7192 -1.7191 -1.7191 8.2139 8.2139 8.2158 8.2158 9.2808 9.2808 9.2827 9.2827 9.5026 9.5026 9.5100 9.5100 11.5245 11.5245 11.5622 11.5622 11.5972 11.5972 11.6299 11.6299 12.2024 12.2024 12.2087 12.2087 13.8168 13.8168 13.8201 13.8201 14.1788 14.1788 14.1914 14.1914 18.7646 18.7646 18.7830 18.7830 k = 0.0575 0.0995 0.3424 ( 4924 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3231 -44.3231 -44.3231 -44.3231 -42.6250 -42.6250 -42.6250 -42.6250 -42.5554 -42.5554 -42.5554 -42.5554 -1.7358 -1.7358 -1.7358 -1.7358 8.2727 8.2727 8.2743 8.2743 9.2873 9.2873 9.2894 9.2894 9.4880 9.4880 9.4945 9.4945 11.5341 11.5341 11.5685 11.5685 11.5963 11.5963 11.6266 11.6266 12.1735 12.1735 12.1785 12.1785 13.8805 13.8805 13.8845 13.8845 14.1977 14.1977 14.2089 14.2089 18.7002 18.7002 18.7138 18.7138 k = 0.0517 0.0896 0.3424 ( 4924 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3231 -44.3231 -44.3231 -44.3231 -42.6250 -42.6250 -42.6250 -42.6250 -42.5554 -42.5554 -42.5554 -42.5554 -1.7510 -1.7510 -1.7509 -1.7509 8.3285 8.3285 8.3298 8.3298 9.2924 9.2924 9.2946 9.2946 9.4735 9.4735 9.4791 9.4791 11.5433 11.5433 11.5740 11.5740 11.5957 11.5957 11.6232 11.6232 12.1464 12.1464 12.1501 12.1501 13.9408 13.9408 13.9453 13.9453 14.2160 14.2160 14.2259 14.2259 18.6328 18.6328 18.6426 18.6426 k = 0.0460 0.0796 0.3424 ( 4928 PWs) bands (ev): -78.6205 -78.6205 -78.6205 -78.6205 -44.3231 -44.3231 -44.3231 -44.3231 -42.6250 -42.6250 -42.6250 -42.6250 -42.5554 -42.5554 -42.5554 -42.5554 -1.7646 -1.7646 -1.7645 -1.7645 8.3809 8.3809 8.3818 8.3818 9.2962 9.2962 9.2983 9.2983 9.4595 9.4595 9.4640 9.4640 11.5516 11.5516 11.5785 11.5785 11.5955 11.5955 11.6199 11.6199 12.1212 12.1212 12.1240 12.1240 13.9971 13.9971 14.0014 14.0014 14.2341 14.2341 14.2423 14.2423 18.5649 18.5649 18.5717 18.5717 k = 0.0402 0.0697 0.3424 ( 4936 PWs) bands (ev): -78.6207 -78.6207 -78.6207 -78.6207 -44.3231 -44.3231 -44.3231 -44.3231 -42.6251 -42.6251 -42.6251 -42.6251 -42.5553 -42.5553 -42.5553 -42.5553 -1.7767 -1.7767 -1.7767 -1.7767 8.4293 8.4293 8.4300 8.4300 9.2986 9.2986 9.3004 9.3004 9.4462 9.4462 9.4497 9.4497 11.5593 11.5593 11.5819 11.5819 11.5957 11.5957 11.6166 11.6166 12.0980 12.0980 12.1000 12.1000 14.0482 14.0482 14.0522 14.0522 14.2519 14.2519 14.2586 14.2586 18.4985 18.4985 18.5030 18.5030 k = 0.0345 0.0597 0.3424 ( 4940 PWs) bands (ev): -78.6208 -78.6208 -78.6208 -78.6208 -44.3232 -44.3232 -44.3232 -44.3232 -42.6251 -42.6251 -42.6251 -42.6251 -42.5553 -42.5553 -42.5553 -42.5553 -1.7872 -1.7872 -1.7872 -1.7872 8.4733 8.4733 8.4738 8.4738 9.2996 9.2996 9.3009 9.3009 9.4343 9.4343 9.4368 9.4368 11.5665 11.5665 11.5845 11.5845 11.5965 11.5965 11.6134 11.6134 12.0781 12.0781 12.0793 12.0793 14.0930 14.0930 14.0965 14.0965 14.2695 14.2695 14.2748 14.2748 18.4366 18.4366 18.4394 18.4394 k = 0.0287 0.0498 0.3424 ( 4944 PWs) bands (ev): -78.6209 -78.6209 -78.6209 -78.6209 -44.3232 -44.3232 -44.3232 -44.3232 -42.6251 -42.6251 -42.6251 -42.6251 -42.5553 -42.5553 -42.5553 -42.5553 -1.7962 -1.7962 -1.7962 -1.7962 8.5123 8.5123 8.5126 8.5126 9.2992 9.2992 9.3002 9.3002 9.4239 9.4239 9.4255 9.4255 11.5732 11.5732 11.5863 11.5863 11.5976 11.5976 11.6100 11.6100 12.0607 12.0607 12.0615 12.0615 14.1307 14.1307 14.1333 14.1333 14.2872 14.2872 14.2908 14.2908 18.3806 18.3806 18.3823 18.3823 k = 0.0230 0.0398 0.3424 ( 4944 PWs) bands (ev): -78.6209 -78.6209 -78.6209 -78.6209 -44.3232 -44.3232 -44.3232 -44.3232 -42.6251 -42.6251 -42.6251 -42.6251 -42.5553 -42.5553 -42.5553 -42.5553 -1.8035 -1.8035 -1.8035 -1.8035 8.5456 8.5456 8.5457 8.5457 9.2979 9.2979 9.2984 9.2984 9.4155 9.4155 9.4163 9.4163 11.5792 11.5792 11.5879 11.5879 11.5988 11.5988 11.6071 11.6071 12.0464 12.0464 12.0468 12.0468 14.1606 14.1606 14.1623 14.1623 14.3046 14.3046 14.3068 14.3068 18.3323 18.3323 18.3332 18.3332 k = 0.0172 0.0299 0.3424 ( 4940 PWs) bands (ev): -78.6208 -78.6208 -78.6208 -78.6208 -44.3231 -44.3231 -44.3231 -44.3231 -42.6251 -42.6251 -42.6251 -42.6251 -42.5553 -42.5553 -42.5553 -42.5553 -1.8092 -1.8092 -1.8092 -1.8092 8.5724 8.5724 8.5725 8.5725 9.2959 9.2959 9.2960 9.2960 9.4091 9.4091 9.4094 9.4094 11.5844 11.5844 11.5894 11.5894 11.5998 11.5998 11.6046 11.6046 12.0352 12.0352 12.0354 12.0354 14.1827 14.1827 14.1838 14.1838 14.3205 14.3205 14.3218 14.3218 18.2931 18.2931 18.2934 18.2934 k = 0.0115 0.0199 0.3424 ( 4928 PWs) bands (ev): -78.6205 -78.6205 -78.6205 -78.6205 -44.3230 -44.3230 -44.3230 -44.3230 -42.6250 -42.6250 -42.6250 -42.6250 -42.5552 -42.5552 -42.5552 -42.5552 -1.8133 -1.8133 -1.8133 -1.8133 8.5922 8.5922 8.5922 8.5922 9.2939 9.2939 9.2940 9.2940 9.4047 9.4047 9.4049 9.4049 11.5894 11.5894 11.5911 11.5911 11.6011 11.6011 11.6028 11.6028 12.0272 12.0272 12.0272 12.0272 14.1981 14.1981 14.1983 14.1983 14.3340 14.3340 14.3342 14.3342 18.2641 18.2641 18.2642 18.2642 k = 0.0057 0.0100 0.3424 ( 4932 PWs) bands (ev): -78.6206 -78.6206 -78.6206 -78.6206 -44.3231 -44.3231 -44.3230 -44.3230 -42.6250 -42.6250 -42.6250 -42.6250 -42.5552 -42.5552 -42.5552 -42.5552 -1.8158 -1.8158 -1.8158 -1.8158 8.6043 8.6043 8.6043 8.6043 9.2921 9.2921 9.2922 9.2922 9.4019 9.4019 9.4021 9.4021 11.5920 11.5920 11.5920 11.5920 11.6010 11.6010 11.6011 11.6011 12.0221 12.0221 12.0221 12.0221 14.2061 14.2061 14.2063 14.2063 14.3420 14.3420 14.3422 14.3422 18.2463 18.2463 18.2463 18.2463 k = 0.0000 0.0000 0.3424 ( 4924 PWs) bands (ev): -78.6204 -78.6204 -78.6204 -78.6204 -44.3230 -44.3230 -44.3230 -44.3230 -42.6250 -42.6250 -42.6250 -42.6250 -42.5552 -42.5552 -42.5552 -42.5552 -1.8166 -1.8166 -1.8166 -1.8166 8.6085 8.6085 8.6085 8.6085 9.2917 9.2917 9.2917 9.2917 9.4012 9.4012 9.4012 9.4012 11.5931 11.5931 11.5931 11.5931 11.6011 11.6011 11.6011 11.6011 12.0206 12.0206 12.0206 12.0206 14.2091 14.2091 14.2091 14.2091 14.3452 14.3452 14.3452 14.3452 18.2405 18.2405 18.2405 18.2405 k = 0.5000 0.2887 0.3424 ( 4936 PWs) bands (ev): -78.6202 -78.6202 -78.6202 -78.6202 -44.3241 -44.3241 -44.3241 -44.3241 -42.6255 -42.6255 -42.6255 -42.6255 -42.5577 -42.5577 -42.5577 -42.5577 -0.7891 -0.7891 -0.7891 -0.7891 5.9853 5.9853 5.9853 5.9853 8.9731 8.9731 8.9731 8.9731 9.4238 9.4238 9.4238 9.4238 11.3825 11.3825 11.3825 11.3825 12.0322 12.0322 12.0322 12.0322 12.1382 12.1382 12.1382 12.1382 13.2727 13.2727 13.2727 13.2727 14.0103 14.0103 14.0103 14.0103 17.0734 17.0734 17.0734 17.0734 k = 0.5000 0.2887 0.3309 ( 4936 PWs) bands (ev): -78.6204 -78.6204 -78.6199 -78.6199 -44.3249 -44.3249 -44.3233 -44.3233 -42.6272 -42.6272 -42.6237 -42.6237 -42.5580 -42.5580 -42.5574 -42.5574 -0.7997 -0.7997 -0.7786 -0.7786 5.9502 5.9502 6.0234 6.0234 8.9593 8.9593 8.9866 8.9866 9.3959 9.3959 9.4493 9.4493 11.3335 11.3335 11.4306 11.4306 12.0240 12.0240 12.0399 12.0399 12.1253 12.1253 12.1515 12.1515 13.2025 13.2025 13.3450 13.3450 13.9409 13.9409 14.0792 14.0792 16.9653 16.9653 17.1822 17.1822 k = 0.5000 0.2887 0.3195 ( 4934 PWs) bands (ev): -78.6208 -78.6208 -78.6194 -78.6194 -44.3256 -44.3256 -44.3226 -44.3226 -42.6289 -42.6289 -42.6220 -42.6220 -42.5583 -42.5583 -42.5570 -42.5570 -0.8104 -0.8104 -0.7685 -0.7685 5.9183 5.9183 6.0647 6.0647 8.9455 8.9455 8.9999 8.9999 9.3661 9.3661 9.4721 9.4721 11.2833 11.2833 11.4771 11.4771 12.0154 12.0154 12.0480 12.0480 12.1129 12.1129 12.1655 12.1655 13.1349 13.1349 13.4194 13.4194 13.8717 13.8717 14.1468 14.1468 16.8598 16.8598 17.2896 17.2896 k = 0.5000 0.2887 0.3081 ( 4942 PWs) bands (ev): -78.6210 -78.6210 -78.6196 -78.6196 -44.3265 -44.3265 -44.3219 -44.3219 -42.6307 -42.6307 -42.6203 -42.6203 -42.5586 -42.5586 -42.5568 -42.5568 -0.8214 -0.8214 -0.7585 -0.7585 5.8895 5.8895 6.1090 6.1090 8.9315 8.9315 9.0123 9.0123 9.3347 9.3347 9.4918 9.4918 11.2325 11.2325 11.5219 11.5219 12.0064 12.0064 12.0535 12.0535 12.1013 12.1013 12.1777 12.1777 13.0693 13.0693 13.4952 13.4952 13.8029 13.8029 14.2126 14.2126 16.7585 16.7585 17.3939 17.3939 k = 0.5000 0.2887 0.2967 ( 4934 PWs) bands (ev): -78.6213 -78.6213 -78.6189 -78.6189 -44.3271 -44.3271 -44.3211 -44.3211 -42.6323 -42.6323 -42.6185 -42.6185 -42.5589 -42.5589 -42.5564 -42.5564 -0.8324 -0.8324 -0.7489 -0.7489 5.8638 5.8638 6.1564 6.1564 8.9179 8.9179 9.0238 9.0238 9.3026 9.3026 9.5084 9.5084 11.1815 11.1815 11.5658 11.5658 11.9974 11.9974 12.0587 12.0587 12.0913 12.0913 12.1920 12.1920 13.0063 13.0063 13.5744 13.5744 13.7360 13.7360 14.2763 14.2763 16.6635 16.6635 17.4933 17.4933 k = 0.5000 0.2887 0.2853 ( 4936 PWs) bands (ev): -78.6216 -78.6216 -78.6187 -78.6187 -44.3278 -44.3278 -44.3204 -44.3204 -42.6340 -42.6340 -42.6168 -42.6168 -42.5592 -42.5592 -42.5561 -42.5561 -0.8434 -0.8434 -0.7396 -0.7396 5.8411 5.8411 6.2069 6.2069 8.9042 8.9042 9.0335 9.0335 9.2704 9.2704 9.5211 9.5211 11.1298 11.1298 11.6071 11.6071 11.9884 11.9884 12.0601 12.0601 12.0843 12.0843 12.2060 12.2060 12.9456 12.9456 13.6492 13.6492 13.6743 13.6743 14.3360 14.3360 16.5764 16.5764 17.5856 17.5856 k = 0.5000 0.2887 0.2739 ( 4930 PWs) bands (ev): -78.6217 -78.6217 -78.6183 -78.6183 -44.3286 -44.3286 -44.3196 -44.3196 -42.6357 -42.6357 -42.6151 -42.6151 -42.5594 -42.5594 -42.5558 -42.5558 -0.8544 -0.8544 -0.7307 -0.7307 5.8213 5.8213 6.2603 6.2603 8.8907 8.8907 9.0405 9.0405 9.2395 9.2395 9.5302 9.5302 11.0779 11.0779 11.6475 11.6475 11.9795 11.9795 12.0563 12.0563 12.0824 12.0824 12.2209 12.2209 12.8883 12.8883 13.6027 13.6027 13.7374 13.7374 14.3917 14.3917 16.4992 16.4992 17.6697 17.6697 k = 0.5000 0.2887 0.2625 ( 4930 PWs) bands (ev): -78.6219 -78.6219 -78.6181 -78.6181 -44.3293 -44.3293 -44.3189 -44.3189 -42.6373 -42.6373 -42.6134 -42.6134 -42.5597 -42.5597 -42.5555 -42.5555 -0.8655 -0.8655 -0.7221 -0.7221 5.8045 5.8045 6.3167 6.3167 8.8774 8.8774 9.0424 9.0424 9.2122 9.2122 9.5350 9.5350 11.0258 11.0258 11.6850 11.6850 11.9706 11.9706 12.0486 12.0486 12.0836 12.0836 12.2352 12.2352 12.8334 12.8334 13.5400 13.5400 13.8199 13.8199 14.4414 14.4414 16.4335 16.4335 17.7441 17.7441 k = 0.5000 0.2887 0.2511 ( 4932 PWs) bands (ev): -78.6225 -78.6225 -78.6177 -78.6177 -44.3300 -44.3300 -44.3183 -44.3183 -42.6388 -42.6388 -42.6118 -42.6118 -42.5601 -42.5601 -42.5552 -42.5552 -0.8764 -0.8764 -0.7139 -0.7139 5.7904 5.7904 6.3759 6.3759 8.8644 8.8644 9.0366 9.0366 9.1914 9.1914 9.5355 9.5355 10.9741 10.9741 11.7199 11.7199 11.9617 11.9617 12.0393 12.0393 12.0857 12.0857 12.2494 12.2494 12.7810 12.7810 13.4790 13.4790 13.9041 13.9041 14.4845 14.4845 16.3810 16.3810 17.8084 17.8084 k = 0.5000 0.2887 0.2397 ( 4932 PWs) bands (ev): -78.6229 -78.6229 -78.6172 -78.6172 -44.3306 -44.3306 -44.3177 -44.3177 -42.6403 -42.6403 -42.6103 -42.6103 -42.5604 -42.5604 -42.5549 -42.5549 -0.8872 -0.8872 -0.7061 -0.7061 5.7791 5.7791 6.4380 6.4380 8.8512 8.8512 9.0209 9.0209 9.1797 9.1797 9.5314 9.5314 10.9228 10.9228 11.7519 11.7519 11.9537 11.9537 12.0300 12.0300 12.0872 12.0872 12.2637 12.2637 12.7318 12.7318 13.4213 13.4213 13.9886 13.9886 14.5201 14.5201 16.3433 16.3433 17.8625 17.8625 k = 0.5000 0.2887 0.2282 ( 4928 PWs) bands (ev): -78.6229 -78.6229 -78.6170 -78.6170 -44.3313 -44.3313 -44.3170 -44.3170 -42.6418 -42.6418 -42.6087 -42.6087 -42.5607 -42.5607 -42.5547 -42.5547 -0.8979 -0.8979 -0.6987 -0.6987 5.7703 5.7703 6.5027 6.5027 8.8387 8.8387 8.9958 8.9958 9.1767 9.1767 9.5226 9.5226 10.8718 10.8718 11.7803 11.7803 11.9478 11.9478 12.0216 12.0216 12.0877 12.0877 12.2777 12.2777 12.6868 12.6868 13.3650 13.3650 14.0747 14.0747 14.5474 14.5474 16.3211 16.3211 17.9064 17.9064 k = 0.5000 0.2887 0.2168 ( 4928 PWs) bands (ev): -78.6231 -78.6231 -78.6168 -78.6168 -44.3320 -44.3320 -44.3163 -44.3163 -42.6433 -42.6433 -42.6071 -42.6071 -42.5609 -42.5609 -42.5544 -42.5544 -0.9083 -0.9083 -0.6917 -0.6917 5.7641 5.7641 6.5700 6.5700 8.8265 8.8265 8.9641 8.9641 9.1795 9.1795 9.5088 9.5088 10.8213 10.8213 11.8042 11.8042 11.9436 11.9436 12.0133 12.0133 12.0870 12.0870 12.2915 12.2915 12.6448 12.6448 13.3111 13.3111 14.1615 14.1615 14.5662 14.5662 16.3151 16.3151 17.9409 17.9409 k = 0.5000 0.2887 0.2054 ( 4940 PWs) bands (ev): -78.6237 -78.6237 -78.6167 -78.6167 -44.3327 -44.3327 -44.3158 -44.3158 -42.6448 -42.6448 -42.6058 -42.6058 -42.5612 -42.5612 -42.5542 -42.5542 -0.9185 -0.9185 -0.6851 -0.6851 5.7601 5.7601 6.6398 6.6398 8.8142 8.8142 8.9287 8.9287 9.1855 9.1855 9.4900 9.4900 10.7716 10.7716 11.8217 11.8217 11.9418 11.9418 12.0049 12.0049 12.0847 12.0847 12.3045 12.3045 12.6049 12.6049 13.2598 13.2598 14.2480 14.2480 14.5765 14.5765 16.3253 16.3253 17.9671 17.9671 k = 0.5000 0.2887 0.1940 ( 4936 PWs) bands (ev): -78.6237 -78.6237 -78.6165 -78.6165 -44.3333 -44.3333 -44.3152 -44.3152 -42.6461 -42.6461 -42.6043 -42.6043 -42.5614 -42.5614 -42.5539 -42.5539 -0.9284 -0.9284 -0.6789 -0.6789 5.7583 5.7583 6.7120 6.7120 8.8024 8.8024 8.8917 8.8917 9.1931 9.1931 9.4665 9.4665 10.7234 10.7234 11.8342 11.8342 11.9447 11.9447 11.9981 11.9981 12.0812 12.0812 12.3177 12.3177 12.5704 12.5704 13.2114 13.2114 14.3350 14.3350 14.5807 14.5807 16.3508 16.3508 17.9864 17.9864 k = 0.5000 0.2887 0.1826 ( 4932 PWs) bands (ev): -78.6237 -78.6237 -78.6163 -78.6163 -44.3339 -44.3339 -44.3146 -44.3146 -42.6474 -42.6474 -42.6029 -42.6029 -42.5617 -42.5617 -42.5537 -42.5537 -0.9379 -0.9379 -0.6732 -0.6732 5.7585 5.7585 6.7864 6.7864 8.7902 8.7902 8.8544 8.8544 9.2012 9.2012 9.4382 9.4382 10.6769 10.6769 11.8403 11.8403 11.9505 11.9505 11.9929 11.9929 12.0763 12.0763 12.3303 12.3303 12.5398 12.5398 13.1657 13.1657 14.4207 14.4207 14.5798 14.5798 16.3906 16.3906 17.9998 17.9998 k = 0.5000 0.2887 0.1712 ( 4948 PWs) bands (ev): -78.6239 -78.6239 -78.6169 -78.6169 -44.3347 -44.3347 -44.3140 -44.3140 -42.6488 -42.6488 -42.6016 -42.6016 -42.5619 -42.5619 -42.5536 -42.5536 -0.9471 -0.9471 -0.6679 -0.6679 5.7605 5.7605 6.8627 6.8627 8.7762 8.7762 8.8189 8.8189 9.2089 9.2089 9.4052 9.4052 10.6312 10.6312 11.8410 11.8410 11.9561 11.9561 11.9898 11.9898 12.0680 12.0680 12.3412 12.3412 12.5127 12.5127 13.1219 13.1219 14.4993 14.4993 14.5786 14.5786 16.4429 16.4429 18.0079 18.0079 k = 0.5000 0.2887 0.1598 ( 4948 PWs) bands (ev): -78.6243 -78.6243 -78.6165 -78.6165 -44.3352 -44.3352 -44.3136 -44.3136 -42.6499 -42.6499 -42.6004 -42.6004 -42.5621 -42.5621 -42.5534 -42.5534 -0.9559 -0.9559 -0.6629 -0.6629 5.7640 5.7640 6.9410 6.9410 8.7565 8.7565 8.7905 8.7905 9.2149 9.2149 9.3692 9.3692 10.5871 10.5871 11.8384 11.8384 11.9588 11.9588 11.9915 11.9915 12.0608 12.0608 12.3533 12.3533 12.4890 12.4890 13.0818 13.0818 14.5383 14.5383 14.6157 14.6157 16.5066 16.5066 18.0121 18.0121 k = 0.5000 0.2887 0.1484 ( 4944 PWs) bands (ev): -78.6241 -78.6241 -78.6165 -78.6165 -44.3358 -44.3358 -44.3130 -44.3130 -42.6511 -42.6511 -42.5991 -42.5991 -42.5623 -42.5623 -42.5533 -42.5533 -0.9643 -0.9643 -0.6584 -0.6584 5.7689 5.7689 7.0210 7.0210 8.7267 8.7267 8.7729 8.7729 9.2170 9.2170 9.3323 9.3323 10.5458 10.5458 11.8352 11.8352 11.9565 11.9565 11.9980 11.9980 12.0532 12.0532 12.3634 12.3634 12.4709 12.4709 13.0445 13.0445 14.5339 14.5339 14.6918 14.6918 16.5799 16.5799 18.0139 18.0139 k = 0.5000 0.2887 0.1369 ( 4940 PWs) bands (ev): -78.6241 -78.6241 -78.6164 -78.6164 -44.3363 -44.3363 -44.3125 -44.3125 -42.6521 -42.6521 -42.5980 -42.5980 -42.5625 -42.5625 -42.5531 -42.5531 -0.9721 -0.9721 -0.6543 -0.6543 5.7750 5.7750 7.1024 7.1024 8.6928 8.6928 8.7613 8.7613 9.2082 9.2082 9.3012 9.3012 10.5063 10.5063 11.8305 11.8305 11.9523 11.9523 12.0039 12.0039 12.0466 12.0466 12.3731 12.3731 12.4561 12.4561 13.0102 13.0102 14.5221 14.5221 14.7734 14.7734 16.6613 16.6613 18.0130 18.0130 k = 0.5000 0.2887 0.1255 ( 4942 PWs) bands (ev): -78.6243 -78.6243 -78.6162 -78.6162 -44.3367 -44.3367 -44.3121 -44.3121 -42.6531 -42.6531 -42.5970 -42.5970 -42.5626 -42.5626 -42.5529 -42.5529 -0.9795 -0.9795 -0.6506 -0.6506 5.7818 5.7818 7.1850 7.1850 8.6588 8.6588 8.7518 8.7518 9.1793 9.1793 9.2855 9.2855 10.4689 10.4689 11.8249 11.8249 11.9472 11.9472 12.0059 12.0059 12.0434 12.0434 12.3816 12.3816 12.4433 12.4433 12.9787 12.9787 14.5088 14.5088 14.8541 14.8541 16.7494 16.7494 18.0104 18.0104 k = 0.5000 0.2887 0.1141 ( 4940 PWs) bands (ev): -78.6245 -78.6245 -78.6160 -78.6160 -44.3371 -44.3371 -44.3118 -44.3118 -42.6540 -42.6540 -42.5960 -42.5960 -42.5628 -42.5628 -42.5527 -42.5527 -0.9863 -0.9863 -0.6472 -0.6472 5.7893 5.7893 7.2684 7.2684 8.6260 8.6260 8.7434 8.7434 9.1329 9.1329 9.2829 9.2829 10.4344 10.4344 11.8196 11.8196 11.9419 11.9419 12.0023 12.0023 12.0450 12.0450 12.3885 12.3885 12.4341 12.4341 12.9506 12.9506 14.4959 14.4959 14.9324 14.9324 16.8430 16.8430 18.0069 18.0069 k = 0.5000 0.2887 0.1027 ( 4944 PWs) bands (ev): -78.6246 -78.6246 -78.6161 -78.6161 -44.3375 -44.3375 -44.3114 -44.3114 -42.6548 -42.6548 -42.5952 -42.5952 -42.5629 -42.5629 -42.5526 -42.5526 -0.9926 -0.9926 -0.6442 -0.6442 5.7972 5.7972 7.3522 7.3522 8.5950 8.5950 8.7353 8.7353 9.0774 9.0774 9.2856 9.2856 10.4026 10.4026 11.8143 11.8143 11.9364 11.9364 11.9950 11.9950 12.0495 12.0495 12.3928 12.3928 12.4284 12.4284 12.9245 12.9245 14.4836 14.4836 15.0067 15.0067 16.9408 16.9408 18.0026 18.0026 k = 0.5000 0.2887 0.0913 ( 4944 PWs) bands (ev): -78.6245 -78.6245 -78.6161 -78.6161 -44.3379 -44.3379 -44.3110 -44.3110 -42.6556 -42.6556 -42.5944 -42.5944 -42.5630 -42.5630 -42.5525 -42.5525 -0.9982 -0.9982 -0.6415 -0.6415 5.8051 5.8051 7.4358 7.4358 8.5664 8.5664 8.7277 8.7277 9.0172 9.0172 9.2900 9.2900 10.3737 10.3737 11.8098 11.8098 11.9310 11.9310 11.9867 11.9867 12.0555 12.0555 12.3940 12.3940 12.4265 12.4265 12.9016 12.9016 14.4722 14.4722 15.0771 15.0771 17.0415 17.0415 17.9983 17.9983 k = 0.5000 0.2887 0.0799 ( 4954 PWs) bands (ev): -78.6250 -78.6250 -78.6161 -78.6161 -44.3383 -44.3383 -44.3109 -44.3109 -42.6563 -42.6563 -42.5938 -42.5938 -42.5632 -42.5632 -42.5524 -42.5524 -1.0033 -1.0033 -0.6392 -0.6392 5.8128 5.8128 7.5187 7.5187 8.5404 8.5404 8.7202 8.7202 8.9545 8.9545 9.2947 9.2947 10.3476 10.3476 11.8045 11.8045 11.9253 11.9253 11.9782 11.9782 12.0605 12.0605 12.3922 12.3922 12.4271 12.4271 12.8806 12.8806 14.4622 14.4622 15.1429 15.1429 17.1435 17.1435 17.9934 17.9934 k = 0.5000 0.2887 0.0685 ( 4954 PWs) bands (ev): -78.6251 -78.6251 -78.6160 -78.6160 -44.3385 -44.3385 -44.3106 -44.3106 -42.6569 -42.6569 -42.5932 -42.5932 -42.5633 -42.5633 -42.5523 -42.5523 -1.0077 -1.0077 -0.6372 -0.6372 5.8201 5.8201 7.5999 7.5999 8.5175 8.5175 8.7118 8.7118 8.8917 8.8917 9.2993 9.2993 10.3250 10.3250 11.8006 11.8006 11.9200 11.9200 11.9708 11.9708 12.0652 12.0652 12.3902 12.3902 12.4302 12.4302 12.8632 12.8632 14.4538 14.4538 15.2024 15.2024 17.2452 17.2452 17.9890 17.9890 k = 0.5000 0.2887 0.0571 ( 4950 PWs) bands (ev): -78.6252 -78.6252 -78.6158 -78.6158 -44.3387 -44.3387 -44.3104 -44.3104 -42.6573 -42.6573 -42.5927 -42.5927 -42.5633 -42.5633 -42.5521 -42.5521 -1.0115 -1.0115 -0.6356 -0.6356 5.8268 5.8268 7.6781 7.6781 8.4979 8.4979 8.7007 8.7007 8.8326 8.8326 9.3035 9.3035 10.3051 10.3051 11.7971 11.7971 11.9152 11.9152 11.9650 11.9650 12.0696 12.0696 12.3883 12.3883 12.4337 12.4337 12.8493 12.8493 14.4469 14.4469 15.2552 15.2552 17.3443 17.3443 17.9852 17.9852 k = 0.5000 0.2887 0.0456 ( 4948 PWs) bands (ev): -78.6251 -78.6251 -78.6157 -78.6157 -44.3389 -44.3389 -44.3102 -44.3102 -42.6577 -42.6577 -42.5923 -42.5923 -42.5634 -42.5634 -42.5521 -42.5521 -1.0146 -1.0146 -0.6342 -0.6342 5.8326 5.8326 7.7513 7.7513 8.4821 8.4821 8.6817 8.6817 8.7838 8.7838 9.3070 9.3070 10.2895 10.2895 11.7948 11.7948 11.9108 11.9108 11.9601 11.9601 12.0724 12.0724 12.3867 12.3867 12.4367 12.4367 12.8373 12.8373 14.4413 14.4413 15.2998 15.2998 17.4375 17.4375 17.9818 17.9818 k = 0.5000 0.2887 0.0342 ( 4942 PWs) bands (ev): -78.6249 -78.6249 -78.6156 -78.6156 -44.3390 -44.3390 -44.3100 -44.3100 -42.6580 -42.6580 -42.5919 -42.5919 -42.5634 -42.5634 -42.5520 -42.5520 -1.0170 -1.0170 -0.6332 -0.6332 5.8373 5.8373 7.8167 7.8167 8.4705 8.4705 8.6497 8.6497 8.7537 8.7537 9.3098 9.3098 10.2771 10.2771 11.7928 11.7928 11.9071 11.9071 11.9565 11.9565 12.0758 12.0758 12.3859 12.3859 12.4394 12.4394 12.8283 12.8283 14.4371 14.4371 15.3356 15.3356 17.5207 17.5207 17.9794 17.9794 k = 0.5000 0.2887 0.0228 ( 4950 PWs) bands (ev): -78.6250 -78.6250 -78.6160 -78.6160 -44.3392 -44.3392 -44.3099 -44.3099 -42.6583 -42.6583 -42.5916 -42.5916 -42.5635 -42.5635 -42.5521 -42.5521 -1.0187 -1.0187 -0.6325 -0.6325 5.8407 5.8407 7.8701 7.8701 8.4633 8.4633 8.6113 8.6113 8.7397 8.7397 9.3118 9.3118 10.2681 10.2681 11.7911 11.7911 11.9037 11.9037 11.9531 11.9531 12.0774 12.0774 12.3843 12.3843 12.4409 12.4409 12.8207 12.8207 14.4334 14.4334 15.3624 15.3624 17.5879 17.5879 17.9770 17.9770 k = 0.5000 0.2887 0.0114 ( 4946 PWs) bands (ev): -78.6251 -78.6251 -78.6157 -78.6157 -44.3392 -44.3392 -44.3099 -44.3099 -42.6583 -42.6583 -42.5915 -42.5915 -42.5635 -42.5635 -42.5521 -42.5521 -1.0198 -1.0198 -0.6320 -0.6320 5.8429 5.8429 7.9059 7.9059 8.4603 8.4603 8.5808 8.5808 8.7339 8.7339 9.3131 9.3131 10.2624 10.2624 11.7899 11.7899 11.9019 11.9019 11.9516 11.9516 12.0787 12.0787 12.3839 12.3839 12.4430 12.4430 12.8171 12.8171 14.4321 14.4321 15.3790 15.3790 17.6325 17.6325 17.9756 17.9756 k = 0.5000 0.2887-0.0000 ( 4954 PWs) bands (ev): -78.6251 -78.6251 -78.6160 -78.6160 -44.3393 -44.3393 -44.3099 -44.3099 -42.6584 -42.6584 -42.5915 -42.5915 -42.5635 -42.5635 -42.5521 -42.5521 -1.0201 -1.0201 -0.6319 -0.6319 5.8435 5.8435 7.9187 7.9187 8.4598 8.4598 8.5689 8.5689 8.7319 8.7319 9.3135 9.3135 10.2605 10.2605 11.7895 11.7895 11.9009 11.9009 11.9507 11.9507 12.0790 12.0790 12.3834 12.3834 12.4431 12.4431 12.8150 12.8150 14.4310 14.4310 15.3835 15.3835 17.6482 17.6482 17.9750 17.9750 k = 0.3333 0.5774-0.0000 ( 4902 PWs) bands (ev): -78.6246 -78.6246 -78.6141 -78.6141 -44.3390 -44.3390 -44.3099 -44.3099 -42.6582 -42.6582 -42.5915 -42.5915 -42.5637 -42.5637 -42.5520 -42.5520 -0.6856 -0.6856 -0.6795 -0.6795 6.0583 6.0583 7.3676 7.3676 7.4986 7.4986 8.7153 8.7153 8.7300 8.7300 9.1962 9.1962 11.0708 11.0708 11.7765 11.7765 11.9220 11.9220 12.2071 12.2071 12.2468 12.2468 12.2694 12.2694 12.8793 12.8793 12.9876 12.9876 13.3559 13.3559 13.3728 13.3728 16.6923 16.6923 20.8743 20.8743 k = 0.3333 0.5774 0.0114 ( 4914 PWs) bands (ev): -78.6248 -78.6248 -78.6144 -78.6144 -44.3390 -44.3390 -44.3100 -44.3100 -42.6582 -42.6582 -42.5916 -42.5916 -42.5637 -42.5637 -42.5521 -42.5521 -0.6855 -0.6855 -0.6794 -0.6794 6.0597 6.0597 7.3647 7.3647 7.4953 7.4953 8.7183 8.7183 8.7327 8.7327 9.1926 9.1926 11.0715 11.0715 11.7764 11.7764 11.9216 11.9216 12.2054 12.2054 12.2465 12.2465 12.2677 12.2677 12.8757 12.8757 12.9833 12.9833 13.3620 13.3620 13.3778 13.3778 16.6973 16.6973 20.8742 20.8742 k = 0.3333 0.5774 0.0228 ( 4914 PWs) bands (ev): -78.6245 -78.6245 -78.6147 -78.6147 -44.3391 -44.3391 -44.3100 -44.3100 -42.6581 -42.6581 -42.5916 -42.5916 -42.5637 -42.5637 -42.5521 -42.5521 -0.6852 -0.6852 -0.6792 -0.6792 6.0641 6.0641 7.3562 7.3562 7.4858 7.4858 8.7272 8.7272 8.7410 8.7410 9.1819 9.1819 11.0761 11.0761 11.7768 11.7768 11.9213 11.9213 12.2041 12.2041 12.2441 12.2441 12.2663 12.2663 12.8670 12.8670 12.9725 12.9725 13.3811 13.3811 13.3945 13.3945 16.7127 16.7127 20.8751 20.8751 k = 0.3333 0.5774 0.0342 ( 4914 PWs) bands (ev): -78.6245 -78.6245 -78.6148 -78.6148 -44.3390 -44.3390 -44.3101 -44.3101 -42.6579 -42.6579 -42.5918 -42.5918 -42.5636 -42.5636 -42.5521 -42.5521 -0.6848 -0.6848 -0.6787 -0.6787 6.0713 6.0713 7.3425 7.3425 7.4705 7.4705 8.7416 8.7416 8.7546 8.7546 9.1643 9.1643 11.0801 11.0801 11.7775 11.7775 11.9206 11.9206 12.2019 12.2019 12.2429 12.2429 12.2638 12.2638 12.8536 12.8536 12.9565 12.9565 13.4119 13.4119 13.4220 13.4220 16.7387 16.7387 20.8754 20.8754 k = 0.3333 0.5774 0.0456 ( 4917 PWs) bands (ev): -78.6246 -78.6246 -78.6148 -78.6148 -44.3388 -44.3388 -44.3102 -44.3102 -42.6576 -42.6576 -42.5922 -42.5922 -42.5636 -42.5636 -42.5522 -42.5522 -0.6842 -0.6842 -0.6781 -0.6781 6.0814 6.0814 7.3240 7.3240 7.4499 7.4499 8.7607 8.7607 8.7730 8.7730 9.1402 9.1402 11.0862 11.0862 11.7780 11.7780 11.9193 11.9193 12.1986 12.1986 12.2411 12.2411 12.2598 12.2598 12.8369 12.8369 12.9374 12.9374 13.4516 13.4516 13.4583 13.4583 16.7749 16.7749 20.8758 20.8758 k = 0.3333 0.5774 0.0571 ( 4917 PWs) bands (ev): -78.6245 -78.6245 -78.6149 -78.6149 -44.3386 -44.3386 -44.3104 -44.3104 -42.6572 -42.6572 -42.5926 -42.5926 -42.5636 -42.5636 -42.5523 -42.5523 -0.6835 -0.6835 -0.6774 -0.6774 6.0944 6.0944 7.3013 7.3013 7.4247 7.4247 8.7834 8.7834 8.7956 8.7956 9.1102 9.1102 11.0935 11.0935 11.7790 11.7790 11.9177 11.9177 12.1955 12.1955 12.2385 12.2385 12.2556 12.2556 12.8181 12.8181 12.9167 12.9167 13.4986 13.4986 13.5022 13.5022 16.8211 16.8211 20.8762 20.8762 k = 0.3333 0.5774 0.0685 ( 4917 PWs) bands (ev): -78.6245 -78.6245 -78.6149 -78.6149 -44.3384 -44.3384 -44.3106 -44.3106 -42.6567 -42.6567 -42.5931 -42.5931 -42.5635 -42.5635 -42.5523 -42.5523 -0.6825 -0.6825 -0.6765 -0.6765 6.1103 6.1103 7.2749 7.2749 7.3956 7.3956 8.8084 8.8084 8.8218 8.8218 9.0754 9.0754 11.1023 11.1023 11.7801 11.7801 11.9154 11.9154 12.1923 12.1923 12.2350 12.2350 12.2508 12.2508 12.7982 12.7982 12.8954 12.8954 13.5517 13.5517 13.5525 13.5525 16.8772 16.8772 20.8764 20.8764 k = 0.3333 0.5774 0.0799 ( 4911 PWs) bands (ev): -78.6244 -78.6244 -78.6147 -78.6147 -44.3380 -44.3380 -44.3108 -44.3108 -42.6561 -42.6561 -42.5937 -42.5937 -42.5634 -42.5634 -42.5524 -42.5524 -0.6815 -0.6815 -0.6754 -0.6754 6.1290 6.1290 7.2456 7.2456 7.3637 7.3637 8.8329 8.8329 8.8510 8.8510 9.0382 9.0382 11.1128 11.1128 11.7811 11.7811 11.9124 11.9124 12.1893 12.1893 12.2306 12.2306 12.2457 12.2457 12.7782 12.7782 12.8745 12.8745 13.6092 13.6092 13.6108 13.6108 16.9429 16.9429 20.8764 20.8764 k = 0.3333 0.5774 0.0913 ( 4902 PWs) bands (ev): -78.6239 -78.6239 -78.6148 -78.6148 -44.3377 -44.3377 -44.3110 -44.3110 -42.6554 -42.6554 -42.5943 -42.5943 -42.5632 -42.5632 -42.5525 -42.5525 -0.6803 -0.6803 -0.6742 -0.6742 6.1507 6.1507 7.2139 7.2139 7.3292 7.3292 8.8507 8.8507 8.8825 8.8825 9.0044 9.0044 11.1260 11.1260 11.7828 11.7828 11.9091 11.9091 12.1868 12.1868 12.2254 12.2254 12.2409 12.2409 12.7580 12.7580 12.8537 12.8537 13.6699 13.6699 13.6737 13.6737 17.0179 17.0179 20.8763 20.8763 k = 0.3333 0.5774 0.1027 ( 4908 PWs) bands (ev): -78.6240 -78.6240 -78.6149 -78.6149 -44.3374 -44.3374 -44.3114 -44.3114 -42.6547 -42.6547 -42.5952 -42.5952 -42.5631 -42.5631 -42.5526 -42.5526 -0.6790 -0.6790 -0.6729 -0.6729 6.1750 6.1750 7.1803 7.1803 7.2931 7.2931 8.8477 8.8477 8.9156 8.9156 8.9879 8.9879 11.1394 11.1394 11.7830 11.7830 11.9033 11.9033 12.1837 12.1837 12.2193 12.2193 12.2348 12.2348 12.7381 12.7381 12.8335 12.8335 13.7347 13.7347 13.7406 13.7406 17.1018 17.1018 20.8751 20.8751 k = 0.3333 0.5774 0.1141 ( 4908 PWs) bands (ev): -78.6239 -78.6239 -78.6150 -78.6150 -44.3370 -44.3370 -44.3117 -44.3117 -42.6539 -42.6539 -42.5960 -42.5960 -42.5630 -42.5630 -42.5528 -42.5528 -0.6776 -0.6776 -0.6715 -0.6715 6.2022 6.2022 7.1456 7.1456 7.2559 7.2559 8.8146 8.8146 8.9499 8.9499 8.9980 8.9980 11.1545 11.1545 11.7833 11.7833 11.8968 11.8968 12.1806 12.1806 12.2135 12.2135 12.2297 12.2297 12.7187 12.7187 12.8140 12.8140 13.8035 13.8035 13.8114 13.8114 17.1943 17.1943 20.8726 20.8726 k = 0.3333 0.5774 0.1255 ( 4938 PWs) bands (ev): -78.6246 -78.6246 -78.6157 -78.6157 -44.3367 -44.3367 -44.3124 -44.3124 -42.6531 -42.6531 -42.5972 -42.5972 -42.5629 -42.5629 -42.5530 -42.5530 -0.6761 -0.6761 -0.6700 -0.6700 6.2320 6.2320 7.1101 7.1101 7.2180 7.2180 8.7622 8.7622 8.9846 8.9846 9.0235 9.0235 11.1679 11.1679 11.7824 11.7824 11.8885 11.8885 12.1742 12.1742 12.2075 12.2075 12.2232 12.2232 12.6994 12.6994 12.7947 12.7947 13.8741 13.8741 13.8841 13.8841 17.2950 17.2950 20.8663 20.8663 k = 0.3333 0.5774 0.1369 ( 4929 PWs) bands (ev): -78.6244 -78.6244 -78.6155 -78.6155 -44.3362 -44.3362 -44.3128 -44.3128 -42.6521 -42.6521 -42.5982 -42.5982 -42.5627 -42.5627 -42.5532 -42.5532 -0.6746 -0.6746 -0.6684 -0.6684 6.2647 6.2647 7.0745 7.0745 7.1802 7.1802 8.7004 8.7004 9.0199 9.0199 9.0553 9.0553 11.1857 11.1857 11.7818 11.7818 11.8798 11.8798 12.1676 12.1676 12.2069 12.2069 12.2199 12.2199 12.6813 12.6813 12.7767 12.7767 13.9499 13.9499 13.9619 13.9619 17.4037 17.4037 20.8508 20.8508 k = 0.3333 0.5774 0.1484 ( 4941 PWs) bands (ev): -78.6242 -78.6242 -78.6162 -78.6162 -44.3358 -44.3358 -44.3132 -44.3132 -42.6512 -42.6512 -42.5993 -42.5993 -42.5625 -42.5625 -42.5535 -42.5535 -0.6730 -0.6730 -0.6668 -0.6668 6.3001 6.3001 7.0388 7.0388 7.1426 7.1426 8.6328 8.6328 9.0546 9.0546 9.0890 9.0890 11.2049 11.2049 11.7803 11.7803 11.8697 11.8697 12.1560 12.1560 12.2083 12.2083 12.2168 12.2168 12.6625 12.6625 12.7578 12.7578 14.0269 14.0269 14.0409 14.0409 17.5195 17.5195 20.7826 20.7826 k = 0.3333 0.5774 0.1598 ( 4938 PWs) bands (ev): -78.6239 -78.6239 -78.6164 -78.6164 -44.3353 -44.3353 -44.3136 -44.3136 -42.6501 -42.6501 -42.6004 -42.6004 -42.5624 -42.5624 -42.5536 -42.5536 -0.6713 -0.6713 -0.6652 -0.6652 6.3381 6.3381 7.0038 7.0038 7.1058 7.1058 8.5614 8.5614 9.0891 9.0891 9.1233 9.1233 11.2266 11.2266 11.7782 11.7782 11.8590 11.8590 12.1414 12.1414 12.2125 12.2125 12.2149 12.2149 12.6455 12.6455 12.7409 12.7409 14.1073 14.1073 14.1235 14.1235 17.6422 17.6422 20.6360 20.6360 k = 0.3333 0.5774 0.1712 ( 4944 PWs) bands (ev): -78.6240 -78.6240 -78.6166 -78.6166 -44.3348 -44.3348 -44.3142 -44.3142 -42.6489 -42.6489 -42.6017 -42.6017 -42.5622 -42.5622 -42.5539 -42.5539 -0.6696 -0.6696 -0.6635 -0.6635 6.3787 6.3787 6.9696 6.9696 7.0700 7.0700 8.4869 8.4869 9.1226 9.1226 9.1573 9.1573 11.2484 11.2484 11.7747 11.7747 11.8468 11.8468 12.1244 12.1244 12.2136 12.2136 12.2182 12.2182 12.6292 12.6292 12.7245 12.7245 14.1896 14.1896 14.2080 14.2080 17.7713 17.7713 20.4881 20.4881 k = 0.3333 0.5774 0.1826 ( 4944 PWs) bands (ev): -78.6238 -78.6238 -78.6168 -78.6168 -44.3342 -44.3342 -44.3148 -44.3148 -42.6477 -42.6477 -42.6030 -42.6030 -42.5620 -42.5620 -42.5540 -42.5540 -0.6679 -0.6679 -0.6618 -0.6618 6.4219 6.4219 6.9366 6.9366 7.0356 7.0356 8.4102 8.4102 9.1550 9.1550 9.1903 9.1903 11.2715 11.2715 11.7712 11.7712 11.8348 11.8348 12.1038 12.1038 12.2140 12.2140 12.2258 12.2258 12.6142 12.6142 12.7094 12.7094 14.2734 14.2734 14.2942 14.2942 17.9064 17.9064 20.3393 20.3414 k = 0.3333 0.5774 0.1940 ( 4941 PWs) bands (ev): -78.6235 -78.6235 -78.6170 -78.6170 -44.3336 -44.3336 -44.3153 -44.3153 -42.6464 -42.6464 -42.6043 -42.6043 -42.5617 -42.5617 -42.5543 -42.5543 -0.6663 -0.6663 -0.6601 -0.6601 6.4675 6.4675 6.9048 6.9048 7.0027 7.0027 8.3317 8.3317 9.1861 9.1861 9.2223 9.2223 11.2950 11.2950 11.7672 11.7672 11.8228 11.8228 12.0830 12.0830 12.2167 12.2167 12.2355 12.2355 12.5989 12.5989 12.6939 12.6939 14.3582 14.3582 14.3816 14.3816 18.0468 18.0468 20.1876 20.1876 k = 0.3333 0.5774 0.2054 ( 4935 PWs) bands (ev): -78.6233 -78.6233 -78.6169 -78.6169 -44.3329 -44.3329 -44.3159 -44.3159 -42.6449 -42.6449 -42.6058 -42.6058 -42.5615 -42.5615 -42.5545 -42.5545 -0.6646 -0.6646 -0.6585 -0.6585 6.5156 6.5156 6.8747 6.8747 6.9717 6.9717 8.2519 8.2519 9.2157 9.2157 9.2527 9.2527 11.3202 11.3202 11.7628 11.7628 11.8109 11.8109 12.0624 12.0624 12.2194 12.2194 12.2451 12.2451 12.5843 12.5843 12.6790 12.6790 14.4435 14.4435 14.4695 14.4695 18.1923 18.1923 20.0354 20.0354 k = 0.3333 0.5774 0.2168 ( 4935 PWs) bands (ev): -78.6231 -78.6231 -78.6171 -78.6171 -44.3322 -44.3322 -44.3165 -44.3165 -42.6435 -42.6435 -42.6072 -42.6072 -42.5612 -42.5612 -42.5547 -42.5547 -0.6631 -0.6631 -0.6569 -0.6569 6.5659 6.5659 6.8463 6.8463 6.9427 6.9427 8.1710 8.1710 9.2435 9.2435 9.2813 9.2813 11.3465 11.3465 11.7579 11.7579 11.7990 11.7990 12.0384 12.0384 12.2231 12.2231 12.2553 12.2553 12.5700 12.5700 12.6643 12.6643 14.5281 14.5281 14.5570 14.5570 18.3418 18.3418 19.8868 19.8868 k = 0.3333 0.5774 0.2282 ( 4929 PWs) bands (ev): -78.6229 -78.6229 -78.6170 -78.6170 -44.3315 -44.3315 -44.3171 -44.3171 -42.6420 -42.6420 -42.6087 -42.6087 -42.5610 -42.5610 -42.5550 -42.5550 -0.6616 -0.6616 -0.6553 -0.6553 6.6182 6.6182 6.8199 6.8199 6.9162 6.9162 8.0896 8.0896 9.2695 9.2695 9.3082 9.3082 11.3738 11.3738 11.7530 11.7530 11.7877 11.7877 12.0138 12.0138 12.2279 12.2279 12.2661 12.2661 12.5563 12.5563 12.6502 12.6502 14.6121 14.6121 14.6439 14.6439 18.4949 18.4949 19.7434 19.7434 k = 0.3333 0.5774 0.2397 ( 4923 PWs) bands (ev): -78.6224 -78.6224 -78.6173 -78.6173 -44.3308 -44.3308 -44.3177 -44.3177 -42.6404 -42.6404 -42.6102 -42.6102 -42.5606 -42.5606 -42.5552 -42.5552 -0.6601 -0.6601 -0.6539 -0.6539 6.6721 6.6721 6.7955 6.7955 6.8927 6.8927 8.0079 8.0079 9.2933 9.2933 9.3328 9.3328 11.4019 11.4019 11.7479 11.7479 11.7767 11.7767 11.9875 11.9875 12.2346 12.2346 12.2783 12.2783 12.5432 12.5432 12.6366 12.6366 14.6933 14.6933 14.7282 14.7282 18.6509 18.6509 19.6065 19.6065 k = 0.3333 0.5774 0.2511 ( 4929 PWs) bands (ev): -78.6224 -78.6224 -78.6175 -78.6175 -44.3301 -44.3301 -44.3185 -44.3185 -42.6389 -42.6389 -42.6119 -42.6119 -42.5604 -42.5604 -42.5555 -42.5555 -0.6588 -0.6588 -0.6526 -0.6526 6.7260 6.7260 6.7734 6.7734 6.8735 6.8735 7.9261 7.9261 9.3148 9.3148 9.3550 9.3550 11.4306 11.4306 11.7421 11.7421 11.7656 11.7656 11.9602 11.9602 12.2404 12.2404 12.2891 12.2891 12.5306 12.5306 12.6234 12.6234 14.7710 14.7710 14.8090 14.8090 18.8088 18.8088 19.4776 19.4776 k = 0.3333 0.5774 0.2625 ( 4923 PWs) bands (ev): -78.6222 -78.6222 -78.6174 -78.6174 -44.3293 -44.3293 -44.3191 -44.3191 -42.6372 -42.6372 -42.6135 -42.6135 -42.5602 -42.5602 -42.5557 -42.5557 -0.6576 -0.6576 -0.6514 -0.6514 6.7536 6.7536 6.7750 6.7750 6.8639 6.8639 7.8448 7.8448 9.3341 9.3341 9.3750 9.3750 11.4600 11.4600 11.7373 11.7373 11.7559 11.7559 11.9323 11.9323 12.2470 12.2470 12.3001 12.3001 12.5197 12.5197 12.6119 12.6119 14.8446 14.8446 14.8858 14.8858 18.9676 18.9676 19.3590 19.3590 k = 0.3333 0.5774 0.2739 ( 4929 PWs) bands (ev): -78.6222 -78.6222 -78.6177 -78.6177 -44.3285 -44.3285 -44.3199 -44.3199 -42.6356 -42.6356 -42.6153 -42.6153 -42.5599 -42.5599 -42.5560 -42.5560 -0.6565 -0.6565 -0.6503 -0.6503 6.7363 6.7363 6.7996 6.7996 6.8833 6.8833 7.7639 7.7639 9.3510 9.3510 9.3925 9.3925 11.4878 11.4878 11.7327 11.7327 11.7466 11.7466 11.9041 11.9041 12.2534 12.2534 12.3105 12.3105 12.5086 12.5086 12.6001 12.6001 14.9123 14.9123 14.9566 14.9566 19.1225 19.1225 19.2556 19.2556 k = 0.3333 0.5774 0.2853 ( 4917 PWs) bands (ev): -78.6217 -78.6217 -78.6176 -78.6176 -44.3277 -44.3277 -44.3206 -44.3206 -42.6339 -42.6339 -42.6169 -42.6169 -42.5596 -42.5596 -42.5562 -42.5562 -0.6556 -0.6556 -0.6494 -0.6494 6.7215 6.7215 6.7971 6.7971 6.9341 6.9341 7.6841 7.6841 9.3655 9.3655 9.4075 9.4075 11.5189 11.5189 11.7289 11.7289 11.7386 11.7386 11.8769 11.8769 12.2605 12.2605 12.3209 12.3209 12.4991 12.4991 12.5898 12.5898 14.9733 14.9733 15.0205 15.0205 19.1457 19.1457 19.1971 19.1971 k = 0.3333 0.5774 0.2967 ( 4920 PWs) bands (ev): -78.6216 -78.6216 -78.6179 -78.6179 -44.3269 -44.3269 -44.3213 -44.3213 -42.6322 -42.6322 -42.6186 -42.6186 -42.5593 -42.5593 -42.5565 -42.5565 -0.6548 -0.6548 -0.6486 -0.6486 6.7092 6.7092 6.7887 6.7887 6.9950 6.9950 7.6056 7.6056 9.3773 9.3773 9.4197 9.4197 11.5483 11.5483 11.7251 11.7251 11.7301 11.7301 11.8495 11.8495 12.2668 12.2668 12.3301 12.3301 12.4903 12.4903 12.5803 12.5803 15.0252 15.0252 15.0751 15.0751 19.0683 19.0683 19.1192 19.1192 k = 0.3333 0.5774 0.3081 ( 4935 PWs) bands (ev): -78.6213 -78.6213 -78.6188 -78.6188 -44.3264 -44.3264 -44.3221 -44.3221 -42.6306 -42.6306 -42.6204 -42.6204 -42.5590 -42.5590 -42.5570 -42.5570 -0.6542 -0.6542 -0.6480 -0.6480 6.6996 6.6996 6.7806 6.7806 7.0590 7.0590 7.5292 7.5292 9.3862 9.3862 9.4290 9.4290 11.5775 11.5775 11.7211 11.7211 11.7216 11.7216 11.8237 11.8237 12.2715 12.2715 12.3372 12.3372 12.4817 12.4817 12.5711 12.5711 15.0666 15.0666 15.1187 15.1187 19.0039 19.0039 19.0569 19.0569 k = 0.3333 0.5774 0.3195 ( 4923 PWs) bands (ev): -78.6208 -78.6208 -78.6188 -78.6188 -44.3255 -44.3255 -44.3228 -44.3228 -42.6288 -42.6288 -42.6221 -42.6221 -42.5586 -42.5586 -42.5572 -42.5572 -0.6538 -0.6538 -0.6475 -0.6475 6.6928 6.6928 6.7744 6.7744 7.1231 7.1231 7.4566 7.4566 9.3931 9.3931 9.4360 9.4360 11.6052 11.6052 11.7121 11.7121 11.7200 11.7200 11.8029 11.8029 12.2766 12.2766 12.3439 12.3439 12.4768 12.4768 12.5657 12.5657 15.0983 15.0983 15.1521 15.1521 18.9565 18.9565 19.0113 19.0113 k = 0.3333 0.5774 0.3309 ( 4926 PWs) bands (ev): -78.6203 -78.6203 -78.6195 -78.6195 -44.3249 -44.3249 -44.3234 -44.3234 -42.6272 -42.6272 -42.6238 -42.6238 -42.5583 -42.5583 -42.5576 -42.5576 -0.6535 -0.6535 -0.6473 -0.6473 6.6887 6.6887 6.7706 6.7706 7.1817 7.1817 7.3931 7.3931 9.3971 9.3971 9.4402 9.4402 11.6289 11.6289 11.7001 11.7001 11.7188 11.7188 11.7876 11.7876 12.2792 12.2792 12.3477 12.3477 12.4732 12.4732 12.5618 12.5618 15.1172 15.1172 15.1721 15.1721 18.9275 18.9275 18.9835 18.9835 k = 0.3333 0.5774 0.3424 ( 4932 PWs) bands (ev): -78.6200 -78.6200 -78.6200 -78.6200 -44.3242 -44.3242 -44.3242 -44.3242 -42.6255 -42.6255 -42.6255 -42.6255 -42.5580 -42.5580 -42.5579 -42.5579 -0.6534 -0.6534 -0.6472 -0.6472 6.6873 6.6873 6.7693 6.7693 7.2116 7.2116 7.3615 7.3615 9.3983 9.3983 9.4414 9.4414 11.6397 11.6397 11.6933 11.6933 11.7181 11.7181 11.7824 11.7824 12.2798 12.2798 12.3487 12.3487 12.4717 12.4717 12.5601 12.5601 15.1234 15.1234 15.1787 15.1787 18.9177 18.9177 18.9742 18.9742 Writing output data file CoSe.save init_run : 0.15s CPU 0.43s WALL ( 1 calls) electrons : 137.78s CPU 141.04s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.01s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 137.77s CPU 141.02s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.02s CPU 0.02s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.08s WALL ( 373 calls) cegterg : 126.58s CPU 128.40s WALL ( 412 calls) Called by sum_band: Called by *egterg: h_psi : 65.42s CPU 66.86s WALL ( 5850 calls) s_psi : 1.57s CPU 1.63s WALL ( 5850 calls) g_psi : 0.25s CPU 0.23s WALL ( 5065 calls) cdiaghg : 50.95s CPU 51.78s WALL ( 5438 calls) cegterg:over : 6.21s CPU 6.07s WALL ( 5065 calls) cegterg:upda : 5.68s CPU 5.69s WALL ( 5065 calls) cegterg:last : 2.83s CPU 2.86s WALL ( 986 calls) cdiaghg:chol : 3.02s CPU 2.95s WALL ( 5438 calls) cdiaghg:inve : 1.78s CPU 2.04s WALL ( 5438 calls) cdiaghg:para : 3.61s CPU 3.57s WALL ( 10876 calls) Called by h_psi: h_psi:vloc : 58.29s CPU 59.54s WALL ( 5850 calls) h_psi:vnl : 6.86s CPU 7.06s WALL ( 5850 calls) add_vuspsi : 3.35s CPU 3.41s WALL ( 5850 calls) General routines calbec : 3.49s CPU 3.64s WALL ( 5850 calls) fft : 0.00s CPU 0.00s WALL ( 15 calls) fftw : 55.27s CPU 56.46s WALL ( 691972 calls) davcio : 0.20s CPU 0.20s WALL ( 746 calls) Parallel routines fft_scatter : 20.74s CPU 21.02s WALL ( 691987 calls) PWSCF : 2m38.78s CPU 3m12.18s WALL This run was terminated on: 17:23:14 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=