Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 18:30:48 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: ./Al2Pd.save/ file Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 62 26 7 1963 547 85 Max 63 27 8 1968 569 90 Sum 2245 967 283 70721 20107 3143 bravais-lattice index = 14 lattice parameter (alat) = 7.7502 a.u. unit-cell volume = 329.1702 (a.u.)^3 number of atoms/cell = 3 number of atomic types = 2 number of electrons = 24.00 number of Kohn-Sham states= 32 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 545.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.750181 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 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) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Pd read from file: /users/gautes/Pseudo/Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 7926b04c0aa9b348bf6cb39d90ce6236 Pseudo is Ultrasoft + core correction, Zval = 18.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1235 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Al 3.00 26.98150 Al( 1.00) Pd 18.00 106.42000 Pd( 1.00) 12 Sym. Ops., with inversion, found 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 [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( 1 -1 0 ) ( 1 0 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( -1 1 0 ) ( -1 0 0 ) ( -1 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) ( 1 -1 0 ) ( 0 -1 1 ) cart. s( 4) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( -1 1 0 ) ( 0 1 0 ) ( 0 1 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inversion cryst. s( 7) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 7) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( -1 1 0 ) ( -1 0 1 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 1 -1 0 ) ( 1 0 0 ) ( 1 0 -1 ) cart. s( 9) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 1 0 ) ( 0 1 -1 ) cart. s(10) = ( 0.5000000 -0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 0 1 0 ) ( 1 0 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 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 1 -1 0 ) ( 0 -1 0 ) ( 0 -1 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 365 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 2) = ( 0.0090909 -0.0052486 0.0074227), wk = 0.0027397 k( 3) = ( 0.0181818 -0.0104973 0.0148454), wk = 0.0027397 k( 4) = ( 0.0272727 -0.0157459 0.0222681), wk = 0.0027397 k( 5) = ( 0.0363636 -0.0209946 0.0296908), wk = 0.0027397 k( 6) = ( 0.0454546 -0.0262432 0.0371135), wk = 0.0027397 k( 7) = ( 0.0545455 -0.0314918 0.0445362), wk = 0.0027397 k( 8) = ( 0.0636364 -0.0367405 0.0519589), wk = 0.0027397 k( 9) = ( 0.0727273 -0.0419891 0.0593816), wk = 0.0027397 k( 10) = ( 0.0818182 -0.0472377 0.0668043), wk = 0.0027397 k( 11) = ( 0.0909091 -0.0524864 0.0742270), wk = 0.0027397 k( 12) = ( 0.1000000 -0.0577350 0.0816497), wk = 0.0027397 k( 13) = ( 0.1090909 -0.0629837 0.0890724), wk = 0.0027397 k( 14) = ( 0.1181818 -0.0682323 0.0964951), wk = 0.0027397 k( 15) = ( 0.1272727 -0.0734809 0.1039177), wk = 0.0027397 k( 16) = ( 0.1363636 -0.0787296 0.1113404), wk = 0.0027397 k( 17) = ( 0.1454545 -0.0839782 0.1187631), wk = 0.0027397 k( 18) = ( 0.1545455 -0.0892269 0.1261858), wk = 0.0027397 k( 19) = ( 0.1636364 -0.0944755 0.1336085), wk = 0.0027397 k( 20) = ( 0.1727273 -0.0997241 0.1410312), wk = 0.0027397 k( 21) = ( 0.1818182 -0.1049728 0.1484539), wk = 0.0027397 k( 22) = ( 0.1909091 -0.1102214 0.1558766), wk = 0.0027397 k( 23) = ( 0.2000000 -0.1154701 0.1632993), wk = 0.0027397 k( 24) = ( 0.2090909 -0.1207187 0.1707220), wk = 0.0027397 k( 25) = ( 0.2181818 -0.1259673 0.1781447), wk = 0.0027397 k( 26) = ( 0.2272727 -0.1312160 0.1855674), wk = 0.0027397 k( 27) = ( 0.2363636 -0.1364646 0.1929901), wk = 0.0027397 k( 28) = ( 0.2454545 -0.1417133 0.2004128), wk = 0.0027397 k( 29) = ( 0.2545455 -0.1469619 0.2078355), wk = 0.0027397 k( 30) = ( 0.2636364 -0.1522105 0.2152582), wk = 0.0027397 k( 31) = ( 0.2727273 -0.1574592 0.2226809), wk = 0.0027397 k( 32) = ( 0.2818182 -0.1627078 0.2301036), wk = 0.0027397 k( 33) = ( 0.2909091 -0.1679564 0.2375263), wk = 0.0027397 k( 34) = ( 0.3000000 -0.1732051 0.2449490), wk = 0.0027397 k( 35) = ( 0.3090909 -0.1784537 0.2523717), wk = 0.0027397 k( 36) = ( 0.3181818 -0.1837024 0.2597944), wk = 0.0027397 k( 37) = ( 0.3272727 -0.1889510 0.2672171), wk = 0.0027397 k( 38) = ( 0.3363636 -0.1941996 0.2746398), wk = 0.0027397 k( 39) = ( 0.3454546 -0.1994483 0.2820625), wk = 0.0027397 k( 40) = ( 0.3545454 -0.2046969 0.2894851), wk = 0.0027397 k( 41) = ( 0.3636364 -0.2099456 0.2969078), wk = 0.0027397 k( 42) = ( 0.3727273 -0.2151942 0.3043305), wk = 0.0027397 k( 43) = ( 0.3818182 -0.2204428 0.3117532), wk = 0.0027397 k( 44) = ( 0.3909091 -0.2256915 0.3191759), wk = 0.0027397 k( 45) = ( 0.4000000 -0.2309401 0.3265986), wk = 0.0027397 k( 46) = ( 0.4090909 -0.2361887 0.3340213), wk = 0.0027397 k( 47) = ( 0.4181818 -0.2414374 0.3414440), wk = 0.0027397 k( 48) = ( 0.4272727 -0.2466860 0.3488667), wk = 0.0027397 k( 49) = ( 0.4363636 -0.2519347 0.3562894), wk = 0.0027397 k( 50) = ( 0.4454546 -0.2571833 0.3637121), wk = 0.0027397 k( 51) = ( 0.4545455 -0.2624319 0.3711348), wk = 0.0027397 k( 52) = ( 0.4636364 -0.2676806 0.3785575), wk = 0.0027397 k( 53) = ( 0.4727273 -0.2729292 0.3859802), wk = 0.0027397 k( 54) = ( 0.4818182 -0.2781779 0.3934029), wk = 0.0027397 k( 55) = ( 0.4909091 -0.2834265 0.4008256), wk = 0.0027397 k( 56) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0027397 k( 57) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0027397 k( 58) = ( 0.5000000 -0.2783653 0.4155384), wk = 0.0027397 k( 59) = ( 0.5000000 -0.2680555 0.4228286), wk = 0.0027397 k( 60) = ( 0.5000000 -0.2577457 0.4301187), wk = 0.0027397 k( 61) = ( 0.5000000 -0.2474358 0.4374089), wk = 0.0027397 k( 62) = ( 0.5000000 -0.2371260 0.4446990), wk = 0.0027397 k( 63) = ( 0.5000000 -0.2268162 0.4519892), wk = 0.0027397 k( 64) = ( 0.5000000 -0.2165064 0.4592793), wk = 0.0027397 k( 65) = ( 0.5000000 -0.2061965 0.4665695), wk = 0.0027397 k( 66) = ( 0.5000000 -0.1958867 0.4738596), wk = 0.0027397 k( 67) = ( 0.5000000 -0.1855769 0.4811498), wk = 0.0027397 k( 68) = ( 0.5000000 -0.1752670 0.4884399), wk = 0.0027397 k( 69) = ( 0.5000000 -0.1649572 0.4957301), wk = 0.0027397 k( 70) = ( 0.5000000 -0.1546474 0.5030202), wk = 0.0027397 k( 71) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0027397 k( 72) = ( 0.5000000 -0.1340277 0.5176005), wk = 0.0027397 k( 73) = ( 0.5000000 -0.1237179 0.5248907), wk = 0.0027397 k( 74) = ( 0.5000000 -0.1134081 0.5321808), wk = 0.0027397 k( 75) = ( 0.5000000 -0.1030983 0.5394710), wk = 0.0027397 k( 76) = ( 0.5000000 -0.0927884 0.5467611), wk = 0.0027397 k( 77) = ( 0.5000000 -0.0824786 0.5540513), wk = 0.0027397 k( 78) = ( 0.5000000 -0.0721688 0.5613414), wk = 0.0027397 k( 79) = ( 0.5000000 -0.0618590 0.5686315), wk = 0.0027397 k( 80) = ( 0.5000000 -0.0515491 0.5759217), wk = 0.0027397 k( 81) = ( 0.5000000 -0.0412393 0.5832118), wk = 0.0027397 k( 82) = ( 0.5000000 -0.0309295 0.5905020), wk = 0.0027397 k( 83) = ( 0.5000000 -0.0206196 0.5977921), wk = 0.0027397 k( 84) = ( 0.5000000 -0.0103098 0.6050823), wk = 0.0027397 k( 85) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0027397 k( 86) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0027397 k( 87) = ( 0.4937500 0.0108253 0.6123724), wk = 0.0027397 k( 88) = ( 0.4875000 0.0216506 0.6123724), wk = 0.0027397 k( 89) = ( 0.4812500 0.0324760 0.6123724), wk = 0.0027397 k( 90) = ( 0.4750000 0.0433013 0.6123724), wk = 0.0027397 k( 91) = ( 0.4687500 0.0541266 0.6123724), wk = 0.0027397 k( 92) = ( 0.4625000 0.0649519 0.6123724), wk = 0.0027397 k( 93) = ( 0.4562500 0.0757772 0.6123724), wk = 0.0027397 k( 94) = ( 0.4500000 0.0866025 0.6123724), wk = 0.0027397 k( 95) = ( 0.4437500 0.0974279 0.6123724), wk = 0.0027397 k( 96) = ( 0.4375000 0.1082532 0.6123724), wk = 0.0027397 k( 97) = ( 0.4312500 0.1190785 0.6123724), wk = 0.0027397 k( 98) = ( 0.4250000 0.1299038 0.6123724), wk = 0.0027397 k( 99) = ( 0.4187500 0.1407291 0.6123724), wk = 0.0027397 k( 100) = ( 0.4125000 0.1515544 0.6123724), wk = 0.0027397 k( 101) = ( 0.4062500 0.1623798 0.6123724), wk = 0.0027397 k( 102) = ( 0.4000000 0.1732051 0.6123724), wk = 0.0027397 k( 103) = ( 0.3937500 0.1840304 0.6123724), wk = 0.0027397 k( 104) = ( 0.3875000 0.1948557 0.6123724), wk = 0.0027397 k( 105) = ( 0.3812500 0.2056810 0.6123724), wk = 0.0027397 k( 106) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0027397 k( 107) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0027397 k( 108) = ( 0.3685345 0.2127735 0.6018143), wk = 0.0027397 k( 109) = ( 0.3620690 0.2090406 0.5912561), wk = 0.0027397 k( 110) = ( 0.3556034 0.2053077 0.5806980), wk = 0.0027397 k( 111) = ( 0.3491379 0.2015749 0.5701399), wk = 0.0027397 k( 112) = ( 0.3426724 0.1978420 0.5595817), wk = 0.0027397 k( 113) = ( 0.3362069 0.1941091 0.5490236), wk = 0.0027397 k( 114) = ( 0.3297414 0.1903763 0.5384654), wk = 0.0027397 k( 115) = ( 0.3232759 0.1866434 0.5279073), wk = 0.0027397 k( 116) = ( 0.3168103 0.1829105 0.5173491), wk = 0.0027397 k( 117) = ( 0.3103448 0.1791777 0.5067910), wk = 0.0027397 k( 118) = ( 0.3038793 0.1754448 0.4962328), wk = 0.0027397 k( 119) = ( 0.2974138 0.1717119 0.4856747), wk = 0.0027397 k( 120) = ( 0.2909483 0.1679791 0.4751165), wk = 0.0027397 k( 121) = ( 0.2844828 0.1642462 0.4645584), wk = 0.0027397 k( 122) = ( 0.2780172 0.1605133 0.4540003), wk = 0.0027397 k( 123) = ( 0.2715517 0.1567805 0.4434421), wk = 0.0027397 k( 124) = ( 0.2650862 0.1530476 0.4328840), wk = 0.0027397 k( 125) = ( 0.2586207 0.1493147 0.4223258), wk = 0.0027397 k( 126) = ( 0.2521552 0.1455819 0.4117677), wk = 0.0027397 k( 127) = ( 0.2456897 0.1418490 0.4012095), wk = 0.0027397 k( 128) = ( 0.2392241 0.1381161 0.3906514), wk = 0.0027397 k( 129) = ( 0.2327586 0.1343833 0.3800932), wk = 0.0027397 k( 130) = ( 0.2262931 0.1306504 0.3695351), wk = 0.0027397 k( 131) = ( 0.2198276 0.1269175 0.3589769), wk = 0.0027397 k( 132) = ( 0.2133621 0.1231846 0.3484188), wk = 0.0027397 k( 133) = ( 0.2068966 0.1194518 0.3378607), wk = 0.0027397 k( 134) = ( 0.2004310 0.1157189 0.3273025), wk = 0.0027397 k( 135) = ( 0.1939655 0.1119860 0.3167444), wk = 0.0027397 k( 136) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0027397 k( 137) = ( 0.1810345 0.1045203 0.2956281), wk = 0.0027397 k( 138) = ( 0.1745690 0.1007874 0.2850699), wk = 0.0027397 k( 139) = ( 0.1681034 0.0970546 0.2745118), wk = 0.0027397 k( 140) = ( 0.1616379 0.0933217 0.2639536), wk = 0.0027397 k( 141) = ( 0.1551724 0.0895888 0.2533955), wk = 0.0027397 k( 142) = ( 0.1487069 0.0858560 0.2428373), wk = 0.0027397 k( 143) = ( 0.1422414 0.0821231 0.2322792), wk = 0.0027397 k( 144) = ( 0.1357759 0.0783902 0.2217211), wk = 0.0027397 k( 145) = ( 0.1293103 0.0746574 0.2111629), wk = 0.0027397 k( 146) = ( 0.1228448 0.0709245 0.2006048), wk = 0.0027397 k( 147) = ( 0.1163793 0.0671916 0.1900466), wk = 0.0027397 k( 148) = ( 0.1099138 0.0634588 0.1794885), wk = 0.0027397 k( 149) = ( 0.1034483 0.0597259 0.1689303), wk = 0.0027397 k( 150) = ( 0.0969828 0.0559930 0.1583722), wk = 0.0027397 k( 151) = ( 0.0905172 0.0522602 0.1478140), wk = 0.0027397 k( 152) = ( 0.0840517 0.0485273 0.1372559), wk = 0.0027397 k( 153) = ( 0.0775862 0.0447944 0.1266977), wk = 0.0027397 k( 154) = ( 0.0711207 0.0410615 0.1161396), wk = 0.0027397 k( 155) = ( 0.0646552 0.0373287 0.1055815), wk = 0.0027397 k( 156) = ( 0.0581897 0.0335958 0.0950233), wk = 0.0027397 k( 157) = ( 0.0517241 0.0298629 0.0844652), wk = 0.0027397 k( 158) = ( 0.0452586 0.0261301 0.0739070), wk = 0.0027397 k( 159) = ( 0.0387931 0.0223972 0.0633489), wk = 0.0027397 k( 160) = ( 0.0323276 0.0186643 0.0527907), wk = 0.0027397 k( 161) = ( 0.0258621 0.0149315 0.0422326), wk = 0.0027397 k( 162) = ( 0.0193965 0.0111986 0.0316744), wk = 0.0027397 k( 163) = ( 0.0129310 0.0074657 0.0211163), wk = 0.0027397 k( 164) = ( 0.0064655 0.0037329 0.0105581), wk = 0.0027397 k( 165) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 166) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 167) = ( 0.0106383 0.0061420 0.0043431), wk = 0.0027397 k( 168) = ( 0.0212766 0.0122841 0.0086861), wk = 0.0027397 k( 169) = ( 0.0319149 0.0184261 0.0130292), wk = 0.0027397 k( 170) = ( 0.0425532 0.0245681 0.0173723), wk = 0.0027397 k( 171) = ( 0.0531915 0.0307101 0.0217153), wk = 0.0027397 k( 172) = ( 0.0638298 0.0368521 0.0260584), wk = 0.0027397 k( 173) = ( 0.0744681 0.0429942 0.0304015), wk = 0.0027397 k( 174) = ( 0.0851064 0.0491362 0.0347445), wk = 0.0027397 k( 175) = ( 0.0957447 0.0552782 0.0390876), wk = 0.0027397 k( 176) = ( 0.1063830 0.0614202 0.0434307), wk = 0.0027397 k( 177) = ( 0.1170213 0.0675623 0.0477737), wk = 0.0027397 k( 178) = ( 0.1276596 0.0737043 0.0521168), wk = 0.0027397 k( 179) = ( 0.1382979 0.0798463 0.0564599), wk = 0.0027397 k( 180) = ( 0.1489362 0.0859883 0.0608029), wk = 0.0027397 k( 181) = ( 0.1595745 0.0921304 0.0651460), wk = 0.0027397 k( 182) = ( 0.1702128 0.0982724 0.0694891), wk = 0.0027397 k( 183) = ( 0.1808511 0.1044144 0.0738321), wk = 0.0027397 k( 184) = ( 0.1914894 0.1105564 0.0781752), wk = 0.0027397 k( 185) = ( 0.2021277 0.1166985 0.0825183), wk = 0.0027397 k( 186) = ( 0.2127660 0.1228405 0.0868613), wk = 0.0027397 k( 187) = ( 0.2234043 0.1289825 0.0912044), wk = 0.0027397 k( 188) = ( 0.2340425 0.1351245 0.0955475), wk = 0.0027397 k( 189) = ( 0.2446809 0.1412666 0.0998905), wk = 0.0027397 k( 190) = ( 0.2553191 0.1474086 0.1042336), wk = 0.0027397 k( 191) = ( 0.2659574 0.1535506 0.1085767), wk = 0.0027397 k( 192) = ( 0.2765957 0.1596926 0.1129197), wk = 0.0027397 k( 193) = ( 0.2872340 0.1658347 0.1172628), wk = 0.0027397 k( 194) = ( 0.2978723 0.1719767 0.1216059), wk = 0.0027397 k( 195) = ( 0.3085106 0.1781187 0.1259489), wk = 0.0027397 k( 196) = ( 0.3191489 0.1842607 0.1302920), wk = 0.0027397 k( 197) = ( 0.3297872 0.1904027 0.1346351), wk = 0.0027397 k( 198) = ( 0.3404255 0.1965448 0.1389781), wk = 0.0027397 k( 199) = ( 0.3510638 0.2026868 0.1433212), wk = 0.0027397 k( 200) = ( 0.3617021 0.2088288 0.1476643), wk = 0.0027397 k( 201) = ( 0.3723404 0.2149708 0.1520073), wk = 0.0027397 k( 202) = ( 0.3829787 0.2211129 0.1563504), wk = 0.0027397 k( 203) = ( 0.3936170 0.2272549 0.1606935), wk = 0.0027397 k( 204) = ( 0.4042553 0.2333969 0.1650365), wk = 0.0027397 k( 205) = ( 0.4148936 0.2395389 0.1693796), wk = 0.0027397 k( 206) = ( 0.4255319 0.2456810 0.1737227), wk = 0.0027397 k( 207) = ( 0.4361702 0.2518230 0.1780657), wk = 0.0027397 k( 208) = ( 0.4468085 0.2579650 0.1824088), wk = 0.0027397 k( 209) = ( 0.4574468 0.2641070 0.1867519), wk = 0.0027397 k( 210) = ( 0.4680851 0.2702491 0.1910949), wk = 0.0027397 k( 211) = ( 0.4787234 0.2763911 0.1954380), wk = 0.0027397 k( 212) = ( 0.4893617 0.2825331 0.1997811), wk = 0.0027397 k( 213) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0027397 k( 214) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0027397 k( 215) = ( 0.5036765 0.2780621 0.2101278), wk = 0.0027397 k( 216) = ( 0.5073529 0.2674490 0.2161314), wk = 0.0027397 k( 217) = ( 0.5110294 0.2568360 0.2221351), wk = 0.0027397 k( 218) = ( 0.5147059 0.2462229 0.2281387), wk = 0.0027397 k( 219) = ( 0.5183823 0.2356098 0.2341424), wk = 0.0027397 k( 220) = ( 0.5220588 0.2249968 0.2401461), wk = 0.0027397 k( 221) = ( 0.5257353 0.2143837 0.2461497), wk = 0.0027397 k( 222) = ( 0.5294118 0.2037707 0.2521534), wk = 0.0027397 k( 223) = ( 0.5330882 0.1931576 0.2581570), wk = 0.0027397 k( 224) = ( 0.5367647 0.1825446 0.2641607), wk = 0.0027397 k( 225) = ( 0.5404412 0.1719315 0.2701643), wk = 0.0027397 k( 226) = ( 0.5441177 0.1613185 0.2761680), wk = 0.0027397 k( 227) = ( 0.5477941 0.1507054 0.2821716), wk = 0.0027397 k( 228) = ( 0.5514706 0.1400923 0.2881753), wk = 0.0027397 k( 229) = ( 0.5551471 0.1294793 0.2941789), wk = 0.0027397 k( 230) = ( 0.5588235 0.1188662 0.3001826), wk = 0.0027397 k( 231) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0027397 k( 232) = ( 0.5661765 0.0976401 0.3121899), wk = 0.0027397 k( 233) = ( 0.5698529 0.0870271 0.3181935), wk = 0.0027397 k( 234) = ( 0.5735294 0.0764140 0.3241972), wk = 0.0027397 k( 235) = ( 0.5772059 0.0658010 0.3302008), wk = 0.0027397 k( 236) = ( 0.5808823 0.0551879 0.3362045), wk = 0.0027397 k( 237) = ( 0.5845588 0.0445748 0.3422081), wk = 0.0027397 k( 238) = ( 0.5882353 0.0339618 0.3482118), wk = 0.0027397 k( 239) = ( 0.5919118 0.0233487 0.3542154), wk = 0.0027397 k( 240) = ( 0.5955882 0.0127357 0.3602191), wk = 0.0027397 k( 241) = ( 0.5992647 0.0021226 0.3662227), wk = 0.0027397 k( 242) = ( 0.6029412 -0.0084904 0.3722264), wk = 0.0027397 k( 243) = ( 0.6066177 -0.0191035 0.3782300), wk = 0.0027397 k( 244) = ( 0.6102941 -0.0297166 0.3842337), wk = 0.0027397 k( 245) = ( 0.6139706 -0.0403296 0.3902373), wk = 0.0027397 k( 246) = ( 0.6176471 -0.0509427 0.3962410), wk = 0.0027397 k( 247) = ( 0.6213235 -0.0615557 0.4022446), wk = 0.0027397 k( 248) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0027397 k( 249) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0027397 k( 250) = ( 0.6187500 -0.0685603 0.4184545), wk = 0.0027397 k( 251) = ( 0.6125000 -0.0649519 0.4286607), wk = 0.0027397 k( 252) = ( 0.6062500 -0.0613435 0.4388669), wk = 0.0027397 k( 253) = ( 0.6000000 -0.0577350 0.4490731), wk = 0.0027397 k( 254) = ( 0.5937500 -0.0541266 0.4592793), wk = 0.0027397 k( 255) = ( 0.5875000 -0.0505181 0.4694855), wk = 0.0027397 k( 256) = ( 0.5812500 -0.0469097 0.4796917), wk = 0.0027397 k( 257) = ( 0.5750000 -0.0433013 0.4898979), wk = 0.0027397 k( 258) = ( 0.5687500 -0.0396928 0.5001042), wk = 0.0027397 k( 259) = ( 0.5625000 -0.0360844 0.5103104), wk = 0.0027397 k( 260) = ( 0.5562500 -0.0324760 0.5205166), wk = 0.0027397 k( 261) = ( 0.5500000 -0.0288675 0.5307228), wk = 0.0027397 k( 262) = ( 0.5437500 -0.0252591 0.5409290), wk = 0.0027397 k( 263) = ( 0.5375000 -0.0216506 0.5511352), wk = 0.0027397 k( 264) = ( 0.5312500 -0.0180422 0.5613414), wk = 0.0027397 k( 265) = ( 0.5250000 -0.0144338 0.5715476), wk = 0.0027397 k( 266) = ( 0.5187500 -0.0108253 0.5817538), wk = 0.0027397 k( 267) = ( 0.5125000 -0.0072169 0.5919600), wk = 0.0027397 k( 268) = ( 0.5062500 -0.0036084 0.6021662), wk = 0.0027397 k( 269) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0027397 k( 270) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0027397 k( 271) = ( 0.5000000 0.0074019 0.6019045), wk = 0.0027397 k( 272) = ( 0.5000000 0.0148038 0.5914366), wk = 0.0027397 k( 273) = ( 0.5000000 0.0222058 0.5809687), wk = 0.0027397 k( 274) = ( 0.5000000 0.0296077 0.5705008), wk = 0.0027397 k( 275) = ( 0.5000000 0.0370096 0.5600329), wk = 0.0027397 k( 276) = ( 0.5000000 0.0444116 0.5495650), wk = 0.0027397 k( 277) = ( 0.5000000 0.0518135 0.5390971), wk = 0.0027397 k( 278) = ( 0.5000000 0.0592154 0.5286292), wk = 0.0027397 k( 279) = ( 0.5000000 0.0666173 0.5181613), wk = 0.0027397 k( 280) = ( 0.5000000 0.0740193 0.5076934), wk = 0.0027397 k( 281) = ( 0.5000000 0.0814212 0.4972255), wk = 0.0027397 k( 282) = ( 0.5000000 0.0888231 0.4867576), wk = 0.0027397 k( 283) = ( 0.5000000 0.0962250 0.4762897), wk = 0.0027397 k( 284) = ( 0.5000000 0.1036270 0.4658218), wk = 0.0027397 k( 285) = ( 0.5000000 0.1110289 0.4553539), wk = 0.0027397 k( 286) = ( 0.5000000 0.1184308 0.4448860), wk = 0.0027397 k( 287) = ( 0.5000000 0.1258328 0.4344181), wk = 0.0027397 k( 288) = ( 0.5000000 0.1332347 0.4239501), wk = 0.0027397 k( 289) = ( 0.5000000 0.1406366 0.4134822), wk = 0.0027397 k( 290) = ( 0.5000000 0.1480385 0.4030143), wk = 0.0027397 k( 291) = ( 0.5000000 0.1554405 0.3925464), wk = 0.0027397 k( 292) = ( 0.5000000 0.1628424 0.3820785), wk = 0.0027397 k( 293) = ( 0.5000000 0.1702443 0.3716106), wk = 0.0027397 k( 294) = ( 0.5000000 0.1776462 0.3611427), wk = 0.0027397 k( 295) = ( 0.5000000 0.1850482 0.3506748), wk = 0.0027397 k( 296) = ( 0.5000000 0.1924501 0.3402069), wk = 0.0027397 k( 297) = ( 0.5000000 0.1998520 0.3297390), wk = 0.0027397 k( 298) = ( 0.5000000 0.2072539 0.3192711), wk = 0.0027397 k( 299) = ( 0.5000000 0.2146559 0.3088032), wk = 0.0027397 k( 300) = ( 0.5000000 0.2220578 0.2983353), wk = 0.0027397 k( 301) = ( 0.5000000 0.2294597 0.2878674), wk = 0.0027397 k( 302) = ( 0.5000000 0.2368617 0.2773995), wk = 0.0027397 k( 303) = ( 0.5000000 0.2442636 0.2669316), wk = 0.0027397 k( 304) = ( 0.5000000 0.2516655 0.2564637), wk = 0.0027397 k( 305) = ( 0.5000000 0.2590674 0.2459958), wk = 0.0027397 k( 306) = ( 0.5000000 0.2664694 0.2355279), wk = 0.0027397 k( 307) = ( 0.5000000 0.2738713 0.2250600), wk = 0.0027397 k( 308) = ( 0.5000000 0.2812732 0.2145921), wk = 0.0027397 k( 309) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0027397 k( 310) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0027397 k( 311) = ( 0.4963235 0.2865525 0.2161314), wk = 0.0027397 k( 312) = ( 0.4926471 0.2844299 0.2281387), wk = 0.0027397 k( 313) = ( 0.4889706 0.2823073 0.2401460), wk = 0.0027397 k( 314) = ( 0.4852941 0.2801847 0.2521533), wk = 0.0027397 k( 315) = ( 0.4816177 0.2780621 0.2641607), wk = 0.0027397 k( 316) = ( 0.4779412 0.2759395 0.2761680), wk = 0.0027397 k( 317) = ( 0.4742647 0.2738169 0.2881753), wk = 0.0027397 k( 318) = ( 0.4705882 0.2716942 0.3001826), wk = 0.0027397 k( 319) = ( 0.4669118 0.2695716 0.3121899), wk = 0.0027397 k( 320) = ( 0.4632353 0.2674490 0.3241972), wk = 0.0027397 k( 321) = ( 0.4595588 0.2653264 0.3362045), wk = 0.0027397 k( 322) = ( 0.4558823 0.2632038 0.3482118), wk = 0.0027397 k( 323) = ( 0.4522059 0.2610812 0.3602191), wk = 0.0027397 k( 324) = ( 0.4485294 0.2589586 0.3722264), wk = 0.0027397 k( 325) = ( 0.4448529 0.2568360 0.3842337), wk = 0.0027397 k( 326) = ( 0.4411765 0.2547134 0.3962410), wk = 0.0027397 k( 327) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0027397 k( 328) = ( 0.4338235 0.2504681 0.4202556), wk = 0.0027397 k( 329) = ( 0.4301471 0.2483455 0.4322629), wk = 0.0027397 k( 330) = ( 0.4264706 0.2462229 0.4442702), wk = 0.0027397 k( 331) = ( 0.4227941 0.2441003 0.4562775), wk = 0.0027397 k( 332) = ( 0.4191177 0.2419777 0.4682848), wk = 0.0027397 k( 333) = ( 0.4154412 0.2398551 0.4802921), wk = 0.0027397 k( 334) = ( 0.4117647 0.2377325 0.4922994), wk = 0.0027397 k( 335) = ( 0.4080882 0.2356099 0.5043067), wk = 0.0027397 k( 336) = ( 0.4044118 0.2334872 0.5163140), wk = 0.0027397 k( 337) = ( 0.4007353 0.2313646 0.5283213), wk = 0.0027397 k( 338) = ( 0.3970588 0.2292420 0.5403286), wk = 0.0027397 k( 339) = ( 0.3933823 0.2271194 0.5523359), wk = 0.0027397 k( 340) = ( 0.3897059 0.2249968 0.5643432), wk = 0.0027397 k( 341) = ( 0.3860294 0.2228742 0.5763505), wk = 0.0027397 k( 342) = ( 0.3823529 0.2207516 0.5883578), wk = 0.0027397 k( 343) = ( 0.3786765 0.2186290 0.6003651), wk = 0.0027397 k( 344) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0027397 k( 345) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0027397 k( 346) = ( 0.6187500 -0.0829941 0.4082483), wk = 0.0027397 k( 347) = ( 0.6125000 -0.0938194 0.4082483), wk = 0.0027397 k( 348) = ( 0.6062500 -0.1046447 0.4082483), wk = 0.0027397 k( 349) = ( 0.6000000 -0.1154701 0.4082483), wk = 0.0027397 k( 350) = ( 0.5937500 -0.1262954 0.4082483), wk = 0.0027397 k( 351) = ( 0.5875000 -0.1371207 0.4082483), wk = 0.0027397 k( 352) = ( 0.5812500 -0.1479460 0.4082483), wk = 0.0027397 k( 353) = ( 0.5750000 -0.1587713 0.4082483), wk = 0.0027397 k( 354) = ( 0.5687500 -0.1695966 0.4082483), wk = 0.0027397 k( 355) = ( 0.5625000 -0.1804220 0.4082483), wk = 0.0027397 k( 356) = ( 0.5562500 -0.1912473 0.4082483), wk = 0.0027397 k( 357) = ( 0.5500000 -0.2020726 0.4082483), wk = 0.0027397 k( 358) = ( 0.5437500 -0.2128979 0.4082483), wk = 0.0027397 k( 359) = ( 0.5375000 -0.2237232 0.4082483), wk = 0.0027397 k( 360) = ( 0.5312500 -0.2345485 0.4082483), wk = 0.0027397 k( 361) = ( 0.5250000 -0.2453739 0.4082483), wk = 0.0027397 k( 362) = ( 0.5187500 -0.2561992 0.4082483), wk = 0.0027397 k( 363) = ( 0.5125000 -0.2670245 0.4082483), wk = 0.0027397 k( 364) = ( 0.5062500 -0.2778498 0.4082483), wk = 0.0027397 k( 365) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0027397 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 2) = ( 0.0090909 -0.0000000 0.0090909), wk = 0.0027397 k( 3) = ( 0.0181818 -0.0000000 0.0181818), wk = 0.0027397 k( 4) = ( 0.0272727 -0.0000000 0.0272727), wk = 0.0027397 k( 5) = ( 0.0363636 -0.0000000 0.0363636), wk = 0.0027397 k( 6) = ( 0.0454546 -0.0000000 0.0454546), wk = 0.0027397 k( 7) = ( 0.0545455 -0.0000000 0.0545455), wk = 0.0027397 k( 8) = ( 0.0636364 -0.0000000 0.0636364), wk = 0.0027397 k( 9) = ( 0.0727273 -0.0000000 0.0727273), wk = 0.0027397 k( 10) = ( 0.0818182 -0.0000000 0.0818182), wk = 0.0027397 k( 11) = ( 0.0909091 -0.0000000 0.0909091), wk = 0.0027397 k( 12) = ( 0.1000000 -0.0000000 0.1000000), wk = 0.0027397 k( 13) = ( 0.1090909 -0.0000000 0.1090909), wk = 0.0027397 k( 14) = ( 0.1181818 -0.0000000 0.1181818), wk = 0.0027397 k( 15) = ( 0.1272727 -0.0000000 0.1272727), wk = 0.0027397 k( 16) = ( 0.1363636 -0.0000000 0.1363636), wk = 0.0027397 k( 17) = ( 0.1454545 -0.0000000 0.1454546), wk = 0.0027397 k( 18) = ( 0.1545455 -0.0000000 0.1545455), wk = 0.0027397 k( 19) = ( 0.1636364 -0.0000000 0.1636364), wk = 0.0027397 k( 20) = ( 0.1727273 -0.0000000 0.1727273), wk = 0.0027397 k( 21) = ( 0.1818182 -0.0000000 0.1818182), wk = 0.0027397 k( 22) = ( 0.1909091 -0.0000000 0.1909091), wk = 0.0027397 k( 23) = ( 0.2000000 -0.0000000 0.2000000), wk = 0.0027397 k( 24) = ( 0.2090909 -0.0000000 0.2090909), wk = 0.0027397 k( 25) = ( 0.2181818 -0.0000000 0.2181818), wk = 0.0027397 k( 26) = ( 0.2272727 -0.0000000 0.2272727), wk = 0.0027397 k( 27) = ( 0.2363636 -0.0000000 0.2363636), wk = 0.0027397 k( 28) = ( 0.2454545 -0.0000000 0.2454546), wk = 0.0027397 k( 29) = ( 0.2545455 0.0000000 0.2545455), wk = 0.0027397 k( 30) = ( 0.2636364 -0.0000000 0.2636364), wk = 0.0027397 k( 31) = ( 0.2727273 0.0000000 0.2727273), wk = 0.0027397 k( 32) = ( 0.2818182 -0.0000000 0.2818182), wk = 0.0027397 k( 33) = ( 0.2909091 0.0000000 0.2909091), wk = 0.0027397 k( 34) = ( 0.3000000 -0.0000000 0.3000000), wk = 0.0027397 k( 35) = ( 0.3090909 0.0000000 0.3090909), wk = 0.0027397 k( 36) = ( 0.3181818 -0.0000000 0.3181818), wk = 0.0027397 k( 37) = ( 0.3272727 0.0000000 0.3272727), wk = 0.0027397 k( 38) = ( 0.3363636 -0.0000000 0.3363636), wk = 0.0027397 k( 39) = ( 0.3454546 -0.0000000 0.3454546), wk = 0.0027397 k( 40) = ( 0.3545454 -0.0000000 0.3545455), wk = 0.0027397 k( 41) = ( 0.3636364 -0.0000000 0.3636364), wk = 0.0027397 k( 42) = ( 0.3727273 -0.0000000 0.3727273), wk = 0.0027397 k( 43) = ( 0.3818182 -0.0000000 0.3818182), wk = 0.0027397 k( 44) = ( 0.3909091 -0.0000000 0.3909091), wk = 0.0027397 k( 45) = ( 0.4000000 -0.0000000 0.4000000), wk = 0.0027397 k( 46) = ( 0.4090909 -0.0000000 0.4090909), wk = 0.0027397 k( 47) = ( 0.4181818 -0.0000000 0.4181818), wk = 0.0027397 k( 48) = ( 0.4272727 -0.0000000 0.4272727), wk = 0.0027397 k( 49) = ( 0.4363636 -0.0000000 0.4363636), wk = 0.0027397 k( 50) = ( 0.4454546 -0.0000000 0.4454546), wk = 0.0027397 k( 51) = ( 0.4545455 -0.0000000 0.4545455), wk = 0.0027397 k( 52) = ( 0.4636364 -0.0000000 0.4636364), wk = 0.0027397 k( 53) = ( 0.4727273 -0.0000000 0.4727273), wk = 0.0027397 k( 54) = ( 0.4818182 -0.0000000 0.4818182), wk = 0.0027397 k( 55) = ( 0.4909091 -0.0000000 0.4909091), wk = 0.0027397 k( 56) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027397 k( 57) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027397 k( 58) = ( 0.5000000 0.0089286 0.5089286), wk = 0.0027397 k( 59) = ( 0.5000000 0.0178571 0.5178571), wk = 0.0027397 k( 60) = ( 0.5000000 0.0267857 0.5267857), wk = 0.0027397 k( 61) = ( 0.5000000 0.0357143 0.5357143), wk = 0.0027397 k( 62) = ( 0.5000000 0.0446429 0.5446429), wk = 0.0027397 k( 63) = ( 0.5000000 0.0535714 0.5535714), wk = 0.0027397 k( 64) = ( 0.5000000 0.0625000 0.5625000), wk = 0.0027397 k( 65) = ( 0.5000000 0.0714286 0.5714286), wk = 0.0027397 k( 66) = ( 0.5000000 0.0803571 0.5803571), wk = 0.0027397 k( 67) = ( 0.5000000 0.0892857 0.5892857), wk = 0.0027397 k( 68) = ( 0.5000000 0.0982143 0.5982143), wk = 0.0027397 k( 69) = ( 0.5000000 0.1071429 0.6071429), wk = 0.0027397 k( 70) = ( 0.5000000 0.1160714 0.6160714), wk = 0.0027397 k( 71) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0027397 k( 72) = ( 0.5000000 0.1339286 0.6339286), wk = 0.0027397 k( 73) = ( 0.5000000 0.1428571 0.6428571), wk = 0.0027397 k( 74) = ( 0.5000000 0.1517857 0.6517857), wk = 0.0027397 k( 75) = ( 0.5000000 0.1607143 0.6607143), wk = 0.0027397 k( 76) = ( 0.5000000 0.1696429 0.6696429), wk = 0.0027397 k( 77) = ( 0.5000000 0.1785714 0.6785714), wk = 0.0027397 k( 78) = ( 0.5000000 0.1875000 0.6875000), wk = 0.0027397 k( 79) = ( 0.5000000 0.1964286 0.6964286), wk = 0.0027397 k( 80) = ( 0.5000000 0.2053571 0.7053571), wk = 0.0027397 k( 81) = ( 0.5000000 0.2142857 0.7142857), wk = 0.0027397 k( 82) = ( 0.5000000 0.2232143 0.7232143), wk = 0.0027397 k( 83) = ( 0.5000000 0.2321429 0.7321429), wk = 0.0027397 k( 84) = ( 0.5000000 0.2410714 0.7410714), wk = 0.0027397 k( 85) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0027397 k( 86) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0027397 k( 87) = ( 0.4937500 0.2562500 0.7500000), wk = 0.0027397 k( 88) = ( 0.4875000 0.2625000 0.7500000), wk = 0.0027397 k( 89) = ( 0.4812500 0.2687500 0.7500000), wk = 0.0027397 k( 90) = ( 0.4750000 0.2750000 0.7500000), wk = 0.0027397 k( 91) = ( 0.4687500 0.2812500 0.7500000), wk = 0.0027397 k( 92) = ( 0.4625000 0.2875000 0.7500000), wk = 0.0027397 k( 93) = ( 0.4562500 0.2937500 0.7500000), wk = 0.0027397 k( 94) = ( 0.4500000 0.3000000 0.7500000), wk = 0.0027397 k( 95) = ( 0.4437500 0.3062500 0.7500000), wk = 0.0027397 k( 96) = ( 0.4375000 0.3125000 0.7500000), wk = 0.0027397 k( 97) = ( 0.4312500 0.3187500 0.7500000), wk = 0.0027397 k( 98) = ( 0.4250000 0.3250000 0.7500000), wk = 0.0027397 k( 99) = ( 0.4187500 0.3312500 0.7500000), wk = 0.0027397 k( 100) = ( 0.4125000 0.3375000 0.7500000), wk = 0.0027397 k( 101) = ( 0.4062500 0.3437500 0.7500000), wk = 0.0027397 k( 102) = ( 0.4000000 0.3500000 0.7500000), wk = 0.0027397 k( 103) = ( 0.3937500 0.3562500 0.7500000), wk = 0.0027397 k( 104) = ( 0.3875000 0.3625000 0.7500000), wk = 0.0027397 k( 105) = ( 0.3812500 0.3687500 0.7500000), wk = 0.0027397 k( 106) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0027397 k( 107) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0027397 k( 108) = ( 0.3685345 0.3685345 0.7370690), wk = 0.0027397 k( 109) = ( 0.3620690 0.3620690 0.7241379), wk = 0.0027397 k( 110) = ( 0.3556034 0.3556034 0.7112069), wk = 0.0027397 k( 111) = ( 0.3491379 0.3491379 0.6982759), wk = 0.0027397 k( 112) = ( 0.3426724 0.3426724 0.6853448), wk = 0.0027397 k( 113) = ( 0.3362069 0.3362069 0.6724138), wk = 0.0027397 k( 114) = ( 0.3297414 0.3297414 0.6594828), wk = 0.0027397 k( 115) = ( 0.3232759 0.3232759 0.6465517), wk = 0.0027397 k( 116) = ( 0.3168103 0.3168103 0.6336207), wk = 0.0027397 k( 117) = ( 0.3103448 0.3103448 0.6206897), wk = 0.0027397 k( 118) = ( 0.3038793 0.3038793 0.6077586), wk = 0.0027397 k( 119) = ( 0.2974138 0.2974138 0.5948276), wk = 0.0027397 k( 120) = ( 0.2909483 0.2909483 0.5818966), wk = 0.0027397 k( 121) = ( 0.2844828 0.2844828 0.5689655), wk = 0.0027397 k( 122) = ( 0.2780172 0.2780172 0.5560345), wk = 0.0027397 k( 123) = ( 0.2715517 0.2715517 0.5431035), wk = 0.0027397 k( 124) = ( 0.2650862 0.2650862 0.5301724), wk = 0.0027397 k( 125) = ( 0.2586207 0.2586207 0.5172414), wk = 0.0027397 k( 126) = ( 0.2521552 0.2521552 0.5043103), wk = 0.0027397 k( 127) = ( 0.2456897 0.2456897 0.4913793), wk = 0.0027397 k( 128) = ( 0.2392241 0.2392241 0.4784483), wk = 0.0027397 k( 129) = ( 0.2327586 0.2327586 0.4655172), wk = 0.0027397 k( 130) = ( 0.2262931 0.2262931 0.4525862), wk = 0.0027397 k( 131) = ( 0.2198276 0.2198276 0.4396552), wk = 0.0027397 k( 132) = ( 0.2133621 0.2133621 0.4267241), wk = 0.0027397 k( 133) = ( 0.2068966 0.2068966 0.4137931), wk = 0.0027397 k( 134) = ( 0.2004310 0.2004310 0.4008621), wk = 0.0027397 k( 135) = ( 0.1939655 0.1939655 0.3879310), wk = 0.0027397 k( 136) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0027397 k( 137) = ( 0.1810345 0.1810345 0.3620690), wk = 0.0027397 k( 138) = ( 0.1745690 0.1745690 0.3491379), wk = 0.0027397 k( 139) = ( 0.1681034 0.1681035 0.3362069), wk = 0.0027397 k( 140) = ( 0.1616379 0.1616379 0.3232759), wk = 0.0027397 k( 141) = ( 0.1551724 0.1551724 0.3103448), wk = 0.0027397 k( 142) = ( 0.1487069 0.1487069 0.2974138), wk = 0.0027397 k( 143) = ( 0.1422414 0.1422414 0.2844828), wk = 0.0027397 k( 144) = ( 0.1357759 0.1357759 0.2715517), wk = 0.0027397 k( 145) = ( 0.1293103 0.1293103 0.2586207), wk = 0.0027397 k( 146) = ( 0.1228448 0.1228448 0.2456897), wk = 0.0027397 k( 147) = ( 0.1163793 0.1163793 0.2327586), wk = 0.0027397 k( 148) = ( 0.1099138 0.1099138 0.2198276), wk = 0.0027397 k( 149) = ( 0.1034483 0.1034483 0.2068966), wk = 0.0027397 k( 150) = ( 0.0969828 0.0969828 0.1939655), wk = 0.0027397 k( 151) = ( 0.0905172 0.0905172 0.1810345), wk = 0.0027397 k( 152) = ( 0.0840517 0.0840517 0.1681035), wk = 0.0027397 k( 153) = ( 0.0775862 0.0775862 0.1551724), wk = 0.0027397 k( 154) = ( 0.0711207 0.0711207 0.1422414), wk = 0.0027397 k( 155) = ( 0.0646552 0.0646552 0.1293103), wk = 0.0027397 k( 156) = ( 0.0581897 0.0581897 0.1163793), wk = 0.0027397 k( 157) = ( 0.0517241 0.0517241 0.1034483), wk = 0.0027397 k( 158) = ( 0.0452586 0.0452586 0.0905172), wk = 0.0027397 k( 159) = ( 0.0387931 0.0387931 0.0775862), wk = 0.0027397 k( 160) = ( 0.0323276 0.0323276 0.0646552), wk = 0.0027397 k( 161) = ( 0.0258621 0.0258621 0.0517241), wk = 0.0027397 k( 162) = ( 0.0193965 0.0193966 0.0387931), wk = 0.0027397 k( 163) = ( 0.0129310 0.0129310 0.0258621), wk = 0.0027397 k( 164) = ( 0.0064655 0.0064655 0.0129310), wk = 0.0027397 k( 165) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 166) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 167) = ( 0.0106383 0.0106383 0.0106383), wk = 0.0027397 k( 168) = ( 0.0212766 0.0212766 0.0212766), wk = 0.0027397 k( 169) = ( 0.0319149 0.0319149 0.0319149), wk = 0.0027397 k( 170) = ( 0.0425532 0.0425532 0.0425532), wk = 0.0027397 k( 171) = ( 0.0531915 0.0531915 0.0531915), wk = 0.0027397 k( 172) = ( 0.0638298 0.0638298 0.0638298), wk = 0.0027397 k( 173) = ( 0.0744681 0.0744681 0.0744681), wk = 0.0027397 k( 174) = ( 0.0851064 0.0851064 0.0851064), wk = 0.0027397 k( 175) = ( 0.0957447 0.0957447 0.0957447), wk = 0.0027397 k( 176) = ( 0.1063830 0.1063830 0.1063830), wk = 0.0027397 k( 177) = ( 0.1170213 0.1170213 0.1170213), wk = 0.0027397 k( 178) = ( 0.1276596 0.1276596 0.1276596), wk = 0.0027397 k( 179) = ( 0.1382979 0.1382979 0.1382979), wk = 0.0027397 k( 180) = ( 0.1489362 0.1489362 0.1489362), wk = 0.0027397 k( 181) = ( 0.1595745 0.1595745 0.1595745), wk = 0.0027397 k( 182) = ( 0.1702128 0.1702128 0.1702128), wk = 0.0027397 k( 183) = ( 0.1808511 0.1808511 0.1808511), wk = 0.0027397 k( 184) = ( 0.1914894 0.1914894 0.1914894), wk = 0.0027397 k( 185) = ( 0.2021277 0.2021277 0.2021277), wk = 0.0027397 k( 186) = ( 0.2127660 0.2127660 0.2127660), wk = 0.0027397 k( 187) = ( 0.2234043 0.2234043 0.2234043), wk = 0.0027397 k( 188) = ( 0.2340425 0.2340426 0.2340426), wk = 0.0027397 k( 189) = ( 0.2446809 0.2446809 0.2446809), wk = 0.0027397 k( 190) = ( 0.2553191 0.2553192 0.2553192), wk = 0.0027397 k( 191) = ( 0.2659574 0.2659575 0.2659575), wk = 0.0027397 k( 192) = ( 0.2765957 0.2765957 0.2765957), wk = 0.0027397 k( 193) = ( 0.2872340 0.2872340 0.2872340), wk = 0.0027397 k( 194) = ( 0.2978723 0.2978723 0.2978723), wk = 0.0027397 k( 195) = ( 0.3085106 0.3085106 0.3085106), wk = 0.0027397 k( 196) = ( 0.3191489 0.3191489 0.3191489), wk = 0.0027397 k( 197) = ( 0.3297872 0.3297872 0.3297872), wk = 0.0027397 k( 198) = ( 0.3404255 0.3404255 0.3404255), wk = 0.0027397 k( 199) = ( 0.3510638 0.3510638 0.3510638), wk = 0.0027397 k( 200) = ( 0.3617021 0.3617021 0.3617021), wk = 0.0027397 k( 201) = ( 0.3723404 0.3723404 0.3723404), wk = 0.0027397 k( 202) = ( 0.3829787 0.3829787 0.3829787), wk = 0.0027397 k( 203) = ( 0.3936170 0.3936170 0.3936170), wk = 0.0027397 k( 204) = ( 0.4042553 0.4042553 0.4042553), wk = 0.0027397 k( 205) = ( 0.4148936 0.4148936 0.4148936), wk = 0.0027397 k( 206) = ( 0.4255319 0.4255319 0.4255319), wk = 0.0027397 k( 207) = ( 0.4361702 0.4361702 0.4361702), wk = 0.0027397 k( 208) = ( 0.4468085 0.4468085 0.4468085), wk = 0.0027397 k( 209) = ( 0.4574468 0.4574468 0.4574468), wk = 0.0027397 k( 210) = ( 0.4680851 0.4680851 0.4680851), wk = 0.0027397 k( 211) = ( 0.4787234 0.4787234 0.4787234), wk = 0.0027397 k( 212) = ( 0.4893617 0.4893617 0.4893617), wk = 0.0027397 k( 213) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027397 k( 214) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027397 k( 215) = ( 0.5036765 0.4926471 0.5036765), wk = 0.0027397 k( 216) = ( 0.5073529 0.4852941 0.5073529), wk = 0.0027397 k( 217) = ( 0.5110294 0.4779412 0.5110294), wk = 0.0027397 k( 218) = ( 0.5147059 0.4705882 0.5147059), wk = 0.0027397 k( 219) = ( 0.5183823 0.4632353 0.5183824), wk = 0.0027397 k( 220) = ( 0.5220588 0.4558824 0.5220588), wk = 0.0027397 k( 221) = ( 0.5257353 0.4485294 0.5257353), wk = 0.0027397 k( 222) = ( 0.5294118 0.4411765 0.5294118), wk = 0.0027397 k( 223) = ( 0.5330882 0.4338235 0.5330882), wk = 0.0027397 k( 224) = ( 0.5367647 0.4264706 0.5367647), wk = 0.0027397 k( 225) = ( 0.5404412 0.4191177 0.5404412), wk = 0.0027397 k( 226) = ( 0.5441177 0.4117647 0.5441177), wk = 0.0027397 k( 227) = ( 0.5477941 0.4044118 0.5477941), wk = 0.0027397 k( 228) = ( 0.5514706 0.3970588 0.5514706), wk = 0.0027397 k( 229) = ( 0.5551471 0.3897059 0.5551471), wk = 0.0027397 k( 230) = ( 0.5588235 0.3823529 0.5588235), wk = 0.0027397 k( 231) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0027397 k( 232) = ( 0.5661765 0.3676471 0.5661765), wk = 0.0027397 k( 233) = ( 0.5698529 0.3602941 0.5698529), wk = 0.0027397 k( 234) = ( 0.5735294 0.3529412 0.5735294), wk = 0.0027397 k( 235) = ( 0.5772059 0.3455882 0.5772059), wk = 0.0027397 k( 236) = ( 0.5808823 0.3382353 0.5808824), wk = 0.0027397 k( 237) = ( 0.5845588 0.3308823 0.5845588), wk = 0.0027397 k( 238) = ( 0.5882353 0.3235294 0.5882353), wk = 0.0027397 k( 239) = ( 0.5919118 0.3161765 0.5919118), wk = 0.0027397 k( 240) = ( 0.5955882 0.3088235 0.5955882), wk = 0.0027397 k( 241) = ( 0.5992647 0.3014706 0.5992647), wk = 0.0027397 k( 242) = ( 0.6029412 0.2941177 0.6029412), wk = 0.0027397 k( 243) = ( 0.6066177 0.2867647 0.6066177), wk = 0.0027397 k( 244) = ( 0.6102941 0.2794118 0.6102941), wk = 0.0027397 k( 245) = ( 0.6139706 0.2720588 0.6139706), wk = 0.0027397 k( 246) = ( 0.6176471 0.2647059 0.6176471), wk = 0.0027397 k( 247) = ( 0.6213235 0.2573529 0.6213235), wk = 0.0027397 k( 248) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0027397 k( 249) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0027397 k( 250) = ( 0.6187500 0.2500000 0.6312500), wk = 0.0027397 k( 251) = ( 0.6125000 0.2500000 0.6375000), wk = 0.0027397 k( 252) = ( 0.6062500 0.2500000 0.6437500), wk = 0.0027397 k( 253) = ( 0.6000000 0.2500000 0.6500000), wk = 0.0027397 k( 254) = ( 0.5937500 0.2500000 0.6562500), wk = 0.0027397 k( 255) = ( 0.5875000 0.2500000 0.6625000), wk = 0.0027397 k( 256) = ( 0.5812500 0.2500000 0.6687500), wk = 0.0027397 k( 257) = ( 0.5750000 0.2500000 0.6750000), wk = 0.0027397 k( 258) = ( 0.5687500 0.2500000 0.6812500), wk = 0.0027397 k( 259) = ( 0.5625000 0.2500000 0.6875000), wk = 0.0027397 k( 260) = ( 0.5562500 0.2500000 0.6937500), wk = 0.0027397 k( 261) = ( 0.5500000 0.2500000 0.7000000), wk = 0.0027397 k( 262) = ( 0.5437500 0.2500000 0.7062500), wk = 0.0027397 k( 263) = ( 0.5375000 0.2500000 0.7125000), wk = 0.0027397 k( 264) = ( 0.5312500 0.2500000 0.7187500), wk = 0.0027397 k( 265) = ( 0.5250000 0.2500000 0.7250000), wk = 0.0027397 k( 266) = ( 0.5187500 0.2500000 0.7312500), wk = 0.0027397 k( 267) = ( 0.5125000 0.2500000 0.7375000), wk = 0.0027397 k( 268) = ( 0.5062500 0.2500000 0.7437500), wk = 0.0027397 k( 269) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0027397 k( 270) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0027397 k( 271) = ( 0.5000000 0.2564103 0.7435897), wk = 0.0027397 k( 272) = ( 0.5000000 0.2628205 0.7371795), wk = 0.0027397 k( 273) = ( 0.5000000 0.2692308 0.7307692), wk = 0.0027397 k( 274) = ( 0.5000000 0.2756410 0.7243590), wk = 0.0027397 k( 275) = ( 0.5000000 0.2820513 0.7179487), wk = 0.0027397 k( 276) = ( 0.5000000 0.2884615 0.7115385), wk = 0.0027397 k( 277) = ( 0.5000000 0.2948718 0.7051282), wk = 0.0027397 k( 278) = ( 0.5000000 0.3012821 0.6987180), wk = 0.0027397 k( 279) = ( 0.5000000 0.3076923 0.6923077), wk = 0.0027397 k( 280) = ( 0.5000000 0.3141026 0.6858974), wk = 0.0027397 k( 281) = ( 0.5000000 0.3205128 0.6794872), wk = 0.0027397 k( 282) = ( 0.5000000 0.3269231 0.6730769), wk = 0.0027397 k( 283) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0027397 k( 284) = ( 0.5000000 0.3397436 0.6602564), wk = 0.0027397 k( 285) = ( 0.5000000 0.3461538 0.6538462), wk = 0.0027397 k( 286) = ( 0.5000000 0.3525641 0.6474359), wk = 0.0027397 k( 287) = ( 0.5000000 0.3589744 0.6410256), wk = 0.0027397 k( 288) = ( 0.5000000 0.3653846 0.6346154), wk = 0.0027397 k( 289) = ( 0.5000000 0.3717949 0.6282051), wk = 0.0027397 k( 290) = ( 0.5000000 0.3782051 0.6217949), wk = 0.0027397 k( 291) = ( 0.5000000 0.3846154 0.6153846), wk = 0.0027397 k( 292) = ( 0.5000000 0.3910256 0.6089744), wk = 0.0027397 k( 293) = ( 0.5000000 0.3974359 0.6025641), wk = 0.0027397 k( 294) = ( 0.5000000 0.4038462 0.5961539), wk = 0.0027397 k( 295) = ( 0.5000000 0.4102564 0.5897436), wk = 0.0027397 k( 296) = ( 0.5000000 0.4166667 0.5833333), wk = 0.0027397 k( 297) = ( 0.5000000 0.4230769 0.5769231), wk = 0.0027397 k( 298) = ( 0.5000000 0.4294872 0.5705128), wk = 0.0027397 k( 299) = ( 0.5000000 0.4358974 0.5641026), wk = 0.0027397 k( 300) = ( 0.5000000 0.4423077 0.5576923), wk = 0.0027397 k( 301) = ( 0.5000000 0.4487180 0.5512821), wk = 0.0027397 k( 302) = ( 0.5000000 0.4551282 0.5448718), wk = 0.0027397 k( 303) = ( 0.5000000 0.4615385 0.5384615), wk = 0.0027397 k( 304) = ( 0.5000000 0.4679487 0.5320513), wk = 0.0027397 k( 305) = ( 0.5000000 0.4743590 0.5256410), wk = 0.0027397 k( 306) = ( 0.5000000 0.4807692 0.5192308), wk = 0.0027397 k( 307) = ( 0.5000000 0.4871795 0.5128205), wk = 0.0027397 k( 308) = ( 0.5000000 0.4935897 0.5064103), wk = 0.0027397 k( 309) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027397 k( 310) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027397 k( 311) = ( 0.4963235 0.4963235 0.5073529), wk = 0.0027397 k( 312) = ( 0.4926471 0.4926471 0.5147059), wk = 0.0027397 k( 313) = ( 0.4889706 0.4889706 0.5220588), wk = 0.0027397 k( 314) = ( 0.4852941 0.4852941 0.5294118), wk = 0.0027397 k( 315) = ( 0.4816177 0.4816177 0.5367647), wk = 0.0027397 k( 316) = ( 0.4779412 0.4779412 0.5441177), wk = 0.0027397 k( 317) = ( 0.4742647 0.4742647 0.5514706), wk = 0.0027397 k( 318) = ( 0.4705882 0.4705882 0.5588235), wk = 0.0027397 k( 319) = ( 0.4669118 0.4669118 0.5661765), wk = 0.0027397 k( 320) = ( 0.4632353 0.4632353 0.5735294), wk = 0.0027397 k( 321) = ( 0.4595588 0.4595588 0.5808824), wk = 0.0027397 k( 322) = ( 0.4558823 0.4558824 0.5882353), wk = 0.0027397 k( 323) = ( 0.4522059 0.4522059 0.5955882), wk = 0.0027397 k( 324) = ( 0.4485294 0.4485294 0.6029412), wk = 0.0027397 k( 325) = ( 0.4448529 0.4448529 0.6102941), wk = 0.0027397 k( 326) = ( 0.4411765 0.4411765 0.6176471), wk = 0.0027397 k( 327) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0027397 k( 328) = ( 0.4338235 0.4338235 0.6323529), wk = 0.0027397 k( 329) = ( 0.4301471 0.4301471 0.6397059), wk = 0.0027397 k( 330) = ( 0.4264706 0.4264706 0.6470588), wk = 0.0027397 k( 331) = ( 0.4227941 0.4227941 0.6544118), wk = 0.0027397 k( 332) = ( 0.4191177 0.4191177 0.6617647), wk = 0.0027397 k( 333) = ( 0.4154412 0.4154412 0.6691177), wk = 0.0027397 k( 334) = ( 0.4117647 0.4117647 0.6764706), wk = 0.0027397 k( 335) = ( 0.4080882 0.4080882 0.6838235), wk = 0.0027397 k( 336) = ( 0.4044118 0.4044118 0.6911765), wk = 0.0027397 k( 337) = ( 0.4007353 0.4007353 0.6985294), wk = 0.0027397 k( 338) = ( 0.3970588 0.3970588 0.7058824), wk = 0.0027397 k( 339) = ( 0.3933823 0.3933823 0.7132353), wk = 0.0027397 k( 340) = ( 0.3897059 0.3897059 0.7205882), wk = 0.0027397 k( 341) = ( 0.3860294 0.3860294 0.7279412), wk = 0.0027397 k( 342) = ( 0.3823529 0.3823529 0.7352941), wk = 0.0027397 k( 343) = ( 0.3786765 0.3786765 0.7426471), wk = 0.0027397 k( 344) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0027397 k( 345) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0027397 k( 346) = ( 0.6187500 0.2375000 0.6187500), wk = 0.0027397 k( 347) = ( 0.6125000 0.2250000 0.6125000), wk = 0.0027397 k( 348) = ( 0.6062500 0.2125000 0.6062500), wk = 0.0027397 k( 349) = ( 0.6000000 0.2000000 0.6000000), wk = 0.0027397 k( 350) = ( 0.5937500 0.1875000 0.5937500), wk = 0.0027397 k( 351) = ( 0.5875000 0.1750000 0.5875000), wk = 0.0027397 k( 352) = ( 0.5812500 0.1625000 0.5812500), wk = 0.0027397 k( 353) = ( 0.5750000 0.1500000 0.5750000), wk = 0.0027397 k( 354) = ( 0.5687500 0.1375000 0.5687500), wk = 0.0027397 k( 355) = ( 0.5625000 0.1250000 0.5625000), wk = 0.0027397 k( 356) = ( 0.5562500 0.1125000 0.5562500), wk = 0.0027397 k( 357) = ( 0.5500000 0.1000000 0.5500000), wk = 0.0027397 k( 358) = ( 0.5437500 0.0875000 0.5437500), wk = 0.0027397 k( 359) = ( 0.5375000 0.0750000 0.5375000), wk = 0.0027397 k( 360) = ( 0.5312500 0.0625000 0.5312500), wk = 0.0027397 k( 361) = ( 0.5250000 0.0500000 0.5250000), wk = 0.0027397 k( 362) = ( 0.5187500 0.0375000 0.5187500), wk = 0.0027397 k( 363) = ( 0.5125000 0.0250000 0.5125000), wk = 0.0027397 k( 364) = ( 0.5062500 0.0125000 0.5062500), wk = 0.0027397 k( 365) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027397 Dense grid: 70721 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 20107 G-vectors FFT dimensions: ( 40, 40, 40) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.07 Mb ( 144, 32) NL pseudopotentials 0.11 Mb ( 72, 102) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.01 Mb ( 1966) G-vector shells 0.00 Mb ( 485) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.28 Mb ( 144, 128) Each subspace H/S matrix 0.02 Mb ( 32, 32) Each matrix 0.10 Mb ( 102, 2, 32) The potential is recalculated from file : ./Al2Pd.save/charge-density.dat Starting wfc are 36 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.2 secs Computing kpt #: 2 total cpu time spent up to now is 2.5 secs Computing kpt #: 3 total cpu time spent up to now is 2.8 secs Computing kpt #: 4 total cpu time spent up to now is 3.2 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 3.6 secs Computing kpt #: 7 total cpu time spent up to now is 3.8 secs Computing kpt #: 8 total cpu time spent up to now is 4.0 secs Computing kpt #: 9 total cpu time spent up to now is 4.3 secs Computing kpt #: 10 total cpu time spent up to now is 4.5 secs Computing kpt #: 11 total cpu time spent up to now is 4.7 secs Computing kpt #: 12 total cpu time spent up to now is 4.9 secs Computing kpt #: 13 total cpu time spent up to now is 5.1 secs Computing kpt #: 14 total cpu time spent up to now is 5.2 secs Computing kpt #: 15 total cpu time spent up to now is 5.4 secs Computing kpt #: 16 total cpu time spent up to now is 5.6 secs Computing kpt #: 17 total cpu time spent up to now is 5.8 secs Computing kpt #: 18 total cpu time spent up to now is 6.0 secs Computing kpt #: 19 total cpu time spent up to now is 6.2 secs Computing kpt #: 20 total cpu time spent up to now is 6.3 secs Computing kpt #: 21 total cpu time spent up to now is 6.5 secs Computing kpt #: 22 total cpu time spent up to now is 6.7 secs Computing kpt #: 23 total cpu time spent up to now is 6.9 secs Computing kpt #: 24 total cpu time spent up to now is 7.1 secs Computing kpt #: 25 total cpu time spent up to now is 7.3 secs Computing kpt #: 26 total cpu time spent up to now is 7.5 secs Computing kpt #: 27 total cpu time spent up to now is 7.7 secs Computing kpt #: 28 total cpu time spent up to now is 7.9 secs Computing kpt #: 29 total cpu time spent up to now is 8.1 secs Computing kpt #: 30 total cpu time spent up to now is 8.4 secs Computing kpt #: 31 total cpu time spent up to now is 8.8 secs Computing kpt #: 32 total cpu time spent up to now is 9.2 secs Computing kpt #: 33 total cpu time spent up to now is 9.6 secs Computing kpt #: 34 total cpu time spent up to now is 10.1 secs Computing kpt #: 35 total cpu time spent up to now is 10.6 secs Computing kpt #: 36 total cpu time spent up to now is 10.9 secs Computing kpt #: 37 total cpu time spent up to now is 11.3 secs Computing kpt #: 38 total cpu time spent up to now is 11.6 secs Computing kpt #: 39 total cpu time spent up to now is 11.9 secs Computing kpt #: 40 total cpu time spent up to now is 12.1 secs Computing kpt #: 41 total cpu time spent up to now is 12.4 secs Computing kpt #: 42 total cpu time spent up to now is 12.7 secs Computing kpt #: 43 total cpu time spent up to now is 12.9 secs Computing kpt #: 44 total cpu time spent up to now is 13.1 secs Computing kpt #: 45 total cpu time spent up to now is 13.4 secs Computing kpt #: 46 total cpu time spent up to now is 13.6 secs Computing kpt #: 47 total cpu time spent up to now is 13.8 secs Computing kpt #: 48 total cpu time spent up to now is 14.1 secs Computing kpt #: 49 total cpu time spent up to now is 14.3 secs Computing kpt #: 50 total cpu time spent up to now is 14.4 secs Computing kpt #: 51 total cpu time spent up to now is 14.6 secs Computing kpt #: 52 total cpu time spent up to now is 14.8 secs Computing kpt #: 53 total cpu time spent up to now is 15.0 secs Computing kpt #: 54 total cpu time spent up to now is 15.2 secs Computing kpt #: 55 total cpu time spent up to now is 15.4 secs Computing kpt #: 56 total cpu time spent up to now is 15.5 secs Computing kpt #: 57 total cpu time spent up to now is 15.7 secs Computing kpt #: 58 total cpu time spent up to now is 15.9 secs Computing kpt #: 59 total cpu time spent up to now is 16.1 secs Computing kpt #: 60 total cpu time spent up to now is 16.2 secs Computing kpt #: 61 total cpu time spent up to now is 16.4 secs Computing kpt #: 62 total cpu time spent up to now is 16.6 secs Computing kpt #: 63 total cpu time spent up to now is 16.7 secs Computing kpt #: 64 total cpu time spent up to now is 16.9 secs Computing kpt #: 65 total cpu time spent up to now is 17.0 secs Computing kpt #: 66 total cpu time spent up to now is 17.2 secs Computing kpt #: 67 total cpu time spent up to now is 17.4 secs Computing kpt #: 68 total cpu time spent up to now is 17.5 secs Computing kpt #: 69 total cpu time spent up to now is 17.7 secs Computing kpt #: 70 total cpu time spent up to now is 17.8 secs Computing kpt #: 71 total cpu time spent up to now is 18.0 secs Computing kpt #: 72 total cpu time spent up to now is 18.2 secs Computing kpt #: 73 total cpu time spent up to now is 18.3 secs Computing kpt #: 74 total cpu time spent up to now is 18.5 secs Computing kpt #: 75 total cpu time spent up to now is 18.6 secs Computing kpt #: 76 total cpu time spent up to now is 18.8 secs Computing kpt #: 77 total cpu time spent up to now is 19.0 secs Computing kpt #: 78 total cpu time spent up to now is 19.1 secs Computing kpt #: 79 total cpu time spent up to now is 19.3 secs Computing kpt #: 80 total cpu time spent up to now is 19.5 secs Computing kpt #: 81 total cpu time spent up to now is 19.6 secs Computing kpt #: 82 total cpu time spent up to now is 19.8 secs Computing kpt #: 83 total cpu time spent up to now is 20.0 secs Computing kpt #: 84 total cpu time spent up to now is 20.1 secs Computing kpt #: 85 total cpu time spent up to now is 20.3 secs Computing kpt #: 86 total cpu time spent up to now is 20.5 secs Computing kpt #: 87 total cpu time spent up to now is 20.7 secs Computing kpt #: 88 total cpu time spent up to now is 20.8 secs Computing kpt #: 89 total cpu time spent up to now is 21.0 secs Computing kpt #: 90 total cpu time spent up to now is 21.2 secs Computing kpt #: 91 total cpu time spent up to now is 21.4 secs Computing kpt #: 92 total cpu time spent up to now is 21.5 secs Computing kpt #: 93 total cpu time spent up to now is 21.7 secs Computing kpt #: 94 total cpu time spent up to now is 21.9 secs Computing kpt #: 95 total cpu time spent up to now is 22.0 secs Computing kpt #: 96 total cpu time spent up to now is 22.2 secs Computing kpt #: 97 total cpu time spent up to now is 22.4 secs Computing kpt #: 98 total cpu time spent up to now is 22.6 secs Computing kpt #: 99 total cpu time spent up to now is 22.7 secs Computing kpt #: 100 total cpu time spent up to now is 22.9 secs Computing kpt #: 101 total cpu time spent up to now is 23.1 secs Computing kpt #: 102 total cpu time spent up to now is 23.2 secs Computing kpt #: 103 total cpu time spent up to now is 23.4 secs Computing kpt #: 104 total cpu time spent up to now is 23.6 secs Computing kpt #: 105 total cpu time spent up to now is 23.8 secs Computing kpt #: 106 total cpu time spent up to now is 23.9 secs Computing kpt #: 107 total cpu time spent up to now is 24.1 secs Computing kpt #: 108 total cpu time spent up to now is 24.3 secs Computing kpt #: 109 total cpu time spent up to now is 24.4 secs Computing kpt #: 110 total cpu time spent up to now is 24.6 secs Computing kpt #: 111 total cpu time spent up to now is 24.8 secs Computing kpt #: 112 total cpu time spent up to now is 25.0 secs Computing kpt #: 113 total cpu time spent up to now is 25.2 secs Computing kpt #: 114 total cpu time spent up to now is 25.5 secs Computing kpt #: 115 total cpu time spent up to now is 25.7 secs Computing kpt #: 116 total cpu time spent up to now is 25.9 secs Computing kpt #: 117 total cpu time spent up to now is 26.2 secs Computing kpt #: 118 total cpu time spent up to now is 26.4 secs Computing kpt #: 119 total cpu time spent up to now is 26.6 secs Computing kpt #: 120 total cpu time spent up to now is 26.7 secs Computing kpt #: 121 total cpu time spent up to now is 26.9 secs Computing kpt #: 122 total cpu time spent up to now is 27.1 secs Computing kpt #: 123 total cpu time spent up to now is 27.3 secs Computing kpt #: 124 total cpu time spent up to now is 27.4 secs Computing kpt #: 125 total cpu time spent up to now is 27.6 secs Computing kpt #: 126 total cpu time spent up to now is 27.8 secs Computing kpt #: 127 total cpu time spent up to now is 27.9 secs Computing kpt #: 128 total cpu time spent up to now is 28.1 secs Computing kpt #: 129 total cpu time spent up to now is 28.3 secs Computing kpt #: 130 total cpu time spent up to now is 28.4 secs Computing kpt #: 131 total cpu time spent up to now is 28.6 secs Computing kpt #: 132 total cpu time spent up to now is 28.8 secs Computing kpt #: 133 total cpu time spent up to now is 29.0 secs Computing kpt #: 134 total cpu time spent up to now is 29.1 secs Computing kpt #: 135 total cpu time spent up to now is 29.3 secs Computing kpt #: 136 total cpu time spent up to now is 29.5 secs Computing kpt #: 137 total cpu time spent up to now is 29.7 secs Computing kpt #: 138 total cpu time spent up to now is 29.8 secs Computing kpt #: 139 total cpu time spent up to now is 30.0 secs Computing kpt #: 140 total cpu time spent up to now is 30.2 secs Computing kpt #: 141 total cpu time spent up to now is 30.4 secs Computing kpt #: 142 total cpu time spent up to now is 30.6 secs Computing kpt #: 143 total cpu time spent up to now is 30.7 secs Computing kpt #: 144 total cpu time spent up to now is 30.9 secs Computing kpt #: 145 total cpu time spent up to now is 31.1 secs Computing kpt #: 146 total cpu time spent up to now is 31.3 secs Computing kpt #: 147 total cpu time spent up to now is 31.5 secs Computing kpt #: 148 total cpu time spent up to now is 31.7 secs Computing kpt #: 149 total cpu time spent up to now is 31.9 secs Computing kpt #: 150 total cpu time spent up to now is 32.0 secs Computing kpt #: 151 total cpu time spent up to now is 32.3 secs Computing kpt #: 152 total cpu time spent up to now is 32.5 secs Computing kpt #: 153 total cpu time spent up to now is 32.7 secs Computing kpt #: 154 total cpu time spent up to now is 32.9 secs Computing kpt #: 155 total cpu time spent up to now is 33.1 secs Computing kpt #: 156 total cpu time spent up to now is 33.3 secs Computing kpt #: 157 total cpu time spent up to now is 33.5 secs Computing kpt #: 158 total cpu time spent up to now is 33.8 secs Computing kpt #: 159 total cpu time spent up to now is 34.0 secs Computing kpt #: 160 total cpu time spent up to now is 34.3 secs Computing kpt #: 161 total cpu time spent up to now is 34.6 secs Computing kpt #: 162 total cpu time spent up to now is 34.9 secs Computing kpt #: 163 total cpu time spent up to now is 35.2 secs Computing kpt #: 164 total cpu time spent up to now is 35.5 secs Computing kpt #: 165 total cpu time spent up to now is 35.7 secs Computing kpt #: 166 total cpu time spent up to now is 35.9 secs Computing kpt #: 167 total cpu time spent up to now is 36.1 secs Computing kpt #: 168 total cpu time spent up to now is 36.3 secs Computing kpt #: 169 total cpu time spent up to now is 36.5 secs Computing kpt #: 170 total cpu time spent up to now is 36.7 secs Computing kpt #: 171 total cpu time spent up to now is 36.9 secs Computing kpt #: 172 total cpu time spent up to now is 37.1 secs Computing kpt #: 173 total cpu time spent up to now is 37.3 secs Computing kpt #: 174 total cpu time spent up to now is 37.5 secs Computing kpt #: 175 total cpu time spent up to now is 37.7 secs Computing kpt #: 176 total cpu time spent up to now is 37.9 secs Computing kpt #: 177 total cpu time spent up to now is 38.1 secs Computing kpt #: 178 total cpu time spent up to now is 38.3 secs Computing kpt #: 179 total cpu time spent up to now is 38.5 secs Computing kpt #: 180 total cpu time spent up to now is 38.7 secs Computing kpt #: 181 total cpu time spent up to now is 38.9 secs Computing kpt #: 182 total cpu time spent up to now is 39.1 secs Computing kpt #: 183 total cpu time spent up to now is 39.3 secs Computing kpt #: 184 total cpu time spent up to now is 39.5 secs Computing kpt #: 185 total cpu time spent up to now is 39.7 secs Computing kpt #: 186 total cpu time spent up to now is 39.9 secs Computing kpt #: 187 total cpu time spent up to now is 40.1 secs Computing kpt #: 188 total cpu time spent up to now is 40.2 secs Computing kpt #: 189 total cpu time spent up to now is 40.4 secs Computing kpt #: 190 total cpu time spent up to now is 40.6 secs Computing kpt #: 191 total cpu time spent up to now is 40.8 secs Computing kpt #: 192 total cpu time spent up to now is 41.0 secs Computing kpt #: 193 total cpu time spent up to now is 41.2 secs Computing kpt #: 194 total cpu time spent up to now is 41.4 secs Computing kpt #: 195 total cpu time spent up to now is 41.6 secs Computing kpt #: 196 total cpu time spent up to now is 41.7 secs Computing kpt #: 197 total cpu time spent up to now is 41.9 secs Computing kpt #: 198 total cpu time spent up to now is 42.1 secs Computing kpt #: 199 total cpu time spent up to now is 42.3 secs Computing kpt #: 200 total cpu time spent up to now is 42.5 secs Computing kpt #: 201 total cpu time spent up to now is 42.7 secs Computing kpt #: 202 total cpu time spent up to now is 42.9 secs Computing kpt #: 203 total cpu time spent up to now is 43.1 secs Computing kpt #: 204 total cpu time spent up to now is 43.2 secs Computing kpt #: 205 total cpu time spent up to now is 43.4 secs Computing kpt #: 206 total cpu time spent up to now is 43.6 secs Computing kpt #: 207 total cpu time spent up to now is 43.8 secs Computing kpt #: 208 total cpu time spent up to now is 44.0 secs Computing kpt #: 209 total cpu time spent up to now is 44.2 secs Computing kpt #: 210 total cpu time spent up to now is 44.4 secs Computing kpt #: 211 total cpu time spent up to now is 44.5 secs Computing kpt #: 212 total cpu time spent up to now is 44.7 secs Computing kpt #: 213 total cpu time spent up to now is 44.9 secs Computing kpt #: 214 total cpu time spent up to now is 45.1 secs Computing kpt #: 215 total cpu time spent up to now is 45.3 secs Computing kpt #: 216 total cpu time spent up to now is 45.4 secs Computing kpt #: 217 total cpu time spent up to now is 45.6 secs Computing kpt #: 218 total cpu time spent up to now is 45.8 secs Computing kpt #: 219 total cpu time spent up to now is 46.0 secs Computing kpt #: 220 total cpu time spent up to now is 46.2 secs Computing kpt #: 221 total cpu time spent up to now is 46.4 secs Computing kpt #: 222 total cpu time spent up to now is 46.6 secs Computing kpt #: 223 total cpu time spent up to now is 46.8 secs Computing kpt #: 224 total cpu time spent up to now is 47.0 secs Computing kpt #: 225 total cpu time spent up to now is 47.2 secs Computing kpt #: 226 total cpu time spent up to now is 47.4 secs Computing kpt #: 227 total cpu time spent up to now is 47.6 secs Computing kpt #: 228 total cpu time spent up to now is 47.7 secs Computing kpt #: 229 total cpu time spent up to now is 47.9 secs Computing kpt #: 230 total cpu time spent up to now is 48.1 secs Computing kpt #: 231 total cpu time spent up to now is 48.3 secs Computing kpt #: 232 total cpu time spent up to now is 48.5 secs Computing kpt #: 233 total cpu time spent up to now is 48.7 secs Computing kpt #: 234 total cpu time spent up to now is 48.9 secs Computing kpt #: 235 total cpu time spent up to now is 49.1 secs Computing kpt #: 236 total cpu time spent up to now is 49.3 secs Computing kpt #: 237 total cpu time spent up to now is 49.5 secs Computing kpt #: 238 total cpu time spent up to now is 49.8 secs Computing kpt #: 239 total cpu time spent up to now is 50.0 secs Computing kpt #: 240 total cpu time spent up to now is 50.2 secs Computing kpt #: 241 total cpu time spent up to now is 50.4 secs Computing kpt #: 242 total cpu time spent up to now is 50.6 secs Computing kpt #: 243 total cpu time spent up to now is 50.8 secs Computing kpt #: 244 total cpu time spent up to now is 50.9 secs Computing kpt #: 245 total cpu time spent up to now is 51.1 secs Computing kpt #: 246 total cpu time spent up to now is 51.3 secs Computing kpt #: 247 total cpu time spent up to now is 51.5 secs Computing kpt #: 248 total cpu time spent up to now is 51.6 secs Computing kpt #: 249 total cpu time spent up to now is 51.8 secs Computing kpt #: 250 total cpu time spent up to now is 52.0 secs Computing kpt #: 251 total cpu time spent up to now is 52.1 secs Computing kpt #: 252 total cpu time spent up to now is 52.3 secs Computing kpt #: 253 total cpu time spent up to now is 52.5 secs Computing kpt #: 254 total cpu time spent up to now is 52.7 secs Computing kpt #: 255 total cpu time spent up to now is 52.8 secs Computing kpt #: 256 total cpu time spent up to now is 53.0 secs Computing kpt #: 257 total cpu time spent up to now is 53.2 secs Computing kpt #: 258 total cpu time spent up to now is 53.3 secs Computing kpt #: 259 total cpu time spent up to now is 53.5 secs Computing kpt #: 260 total cpu time spent up to now is 53.7 secs Computing kpt #: 261 total cpu time spent up to now is 53.9 secs Computing kpt #: 262 total cpu time spent up to now is 54.0 secs Computing kpt #: 263 total cpu time spent up to now is 54.2 secs Computing kpt #: 264 total cpu time spent up to now is 54.4 secs Computing kpt #: 265 total cpu time spent up to now is 54.5 secs Computing kpt #: 266 total cpu time spent up to now is 54.7 secs Computing kpt #: 267 total cpu time spent up to now is 54.9 secs Computing kpt #: 268 total cpu time spent up to now is 55.1 secs Computing kpt #: 269 total cpu time spent up to now is 55.2 secs Computing kpt #: 270 total cpu time spent up to now is 55.4 secs Computing kpt #: 271 total cpu time spent up to now is 55.6 secs Computing kpt #: 272 total cpu time spent up to now is 55.8 secs Computing kpt #: 273 total cpu time spent up to now is 55.9 secs Computing kpt #: 274 total cpu time spent up to now is 56.1 secs Computing kpt #: 275 total cpu time spent up to now is 56.3 secs Computing kpt #: 276 total cpu time spent up to now is 56.5 secs Computing kpt #: 277 total cpu time spent up to now is 56.7 secs Computing kpt #: 278 total cpu time spent up to now is 56.9 secs Computing kpt #: 279 total cpu time spent up to now is 57.1 secs Computing kpt #: 280 total cpu time spent up to now is 57.3 secs Computing kpt #: 281 total cpu time spent up to now is 57.5 secs Computing kpt #: 282 total cpu time spent up to now is 57.7 secs Computing kpt #: 283 total cpu time spent up to now is 57.9 secs Computing kpt #: 284 total cpu time spent up to now is 58.2 secs Computing kpt #: 285 total cpu time spent up to now is 58.4 secs Computing kpt #: 286 total cpu time spent up to now is 58.6 secs Computing kpt #: 287 total cpu time spent up to now is 58.9 secs Computing kpt #: 288 total cpu time spent up to now is 59.1 secs Computing kpt #: 289 total cpu time spent up to now is 59.4 secs Computing kpt #: 290 total cpu time spent up to now is 59.6 secs Computing kpt #: 291 total cpu time spent up to now is 59.7 secs Computing kpt #: 292 total cpu time spent up to now is 59.9 secs Computing kpt #: 293 total cpu time spent up to now is 60.1 secs Computing kpt #: 294 total cpu time spent up to now is 60.3 secs Computing kpt #: 295 total cpu time spent up to now is 60.5 secs Computing kpt #: 296 total cpu time spent up to now is 60.7 secs Computing kpt #: 297 total cpu time spent up to now is 60.9 secs Computing kpt #: 298 total cpu time spent up to now is 61.1 secs Computing kpt #: 299 total cpu time spent up to now is 61.3 secs Computing kpt #: 300 total cpu time spent up to now is 61.5 secs Computing kpt #: 301 total cpu time spent up to now is 61.6 secs Computing kpt #: 302 total cpu time spent up to now is 61.8 secs Computing kpt #: 303 total cpu time spent up to now is 62.0 secs Computing kpt #: 304 total cpu time spent up to now is 62.2 secs Computing kpt #: 305 total cpu time spent up to now is 62.4 secs Computing kpt #: 306 total cpu time spent up to now is 62.6 secs Computing kpt #: 307 total cpu time spent up to now is 62.8 secs Computing kpt #: 308 total cpu time spent up to now is 62.9 secs Computing kpt #: 309 total cpu time spent up to now is 63.1 secs Computing kpt #: 310 total cpu time spent up to now is 63.3 secs Computing kpt #: 311 total cpu time spent up to now is 63.5 secs Computing kpt #: 312 total cpu time spent up to now is 63.6 secs Computing kpt #: 313 total cpu time spent up to now is 63.8 secs Computing kpt #: 314 total cpu time spent up to now is 64.0 secs Computing kpt #: 315 total cpu time spent up to now is 64.2 secs Computing kpt #: 316 total cpu time spent up to now is 64.4 secs Computing kpt #: 317 total cpu time spent up to now is 64.6 secs Computing kpt #: 318 total cpu time spent up to now is 64.8 secs Computing kpt #: 319 total cpu time spent up to now is 65.0 secs Computing kpt #: 320 total cpu time spent up to now is 65.2 secs Computing kpt #: 321 total cpu time spent up to now is 65.4 secs Computing kpt #: 322 total cpu time spent up to now is 65.6 secs Computing kpt #: 323 total cpu time spent up to now is 65.7 secs Computing kpt #: 324 total cpu time spent up to now is 65.9 secs Computing kpt #: 325 total cpu time spent up to now is 66.1 secs Computing kpt #: 326 total cpu time spent up to now is 66.3 secs Computing kpt #: 327 total cpu time spent up to now is 66.5 secs Computing kpt #: 328 total cpu time spent up to now is 66.7 secs Computing kpt #: 329 total cpu time spent up to now is 66.9 secs Computing kpt #: 330 total cpu time spent up to now is 67.1 secs Computing kpt #: 331 total cpu time spent up to now is 67.3 secs Computing kpt #: 332 total cpu time spent up to now is 67.5 secs Computing kpt #: 333 total cpu time spent up to now is 67.8 secs Computing kpt #: 334 total cpu time spent up to now is 68.0 secs Computing kpt #: 335 total cpu time spent up to now is 68.2 secs Computing kpt #: 336 total cpu time spent up to now is 68.4 secs Computing kpt #: 337 total cpu time spent up to now is 68.6 secs Computing kpt #: 338 total cpu time spent up to now is 68.9 secs Computing kpt #: 339 total cpu time spent up to now is 69.1 secs Computing kpt #: 340 total cpu time spent up to now is 69.2 secs Computing kpt #: 341 total cpu time spent up to now is 69.4 secs Computing kpt #: 342 total cpu time spent up to now is 69.6 secs Computing kpt #: 343 total cpu time spent up to now is 69.8 secs Computing kpt #: 344 total cpu time spent up to now is 69.9 secs Computing kpt #: 345 total cpu time spent up to now is 70.1 secs Computing kpt #: 346 total cpu time spent up to now is 70.2 secs Computing kpt #: 347 total cpu time spent up to now is 70.4 secs Computing kpt #: 348 total cpu time spent up to now is 70.6 secs Computing kpt #: 349 total cpu time spent up to now is 70.7 secs Computing kpt #: 350 total cpu time spent up to now is 70.9 secs Computing kpt #: 351 total cpu time spent up to now is 71.1 secs Computing kpt #: 352 total cpu time spent up to now is 71.2 secs Computing kpt #: 353 total cpu time spent up to now is 71.4 secs Computing kpt #: 354 total cpu time spent up to now is 71.6 secs Computing kpt #: 355 total cpu time spent up to now is 71.7 secs Computing kpt #: 356 total cpu time spent up to now is 71.9 secs Computing kpt #: 357 total cpu time spent up to now is 72.1 secs Computing kpt #: 358 total cpu time spent up to now is 72.2 secs Computing kpt #: 359 total cpu time spent up to now is 72.4 secs Computing kpt #: 360 total cpu time spent up to now is 72.6 secs Computing kpt #: 361 total cpu time spent up to now is 72.7 secs Computing kpt #: 362 total cpu time spent up to now is 72.9 secs Computing kpt #: 363 total cpu time spent up to now is 73.1 secs Computing kpt #: 364 total cpu time spent up to now is 73.3 secs Computing kpt #: 365 total cpu time spent up to now is 73.4 secs ethr = 4.17E-08, avg # of iterations = 16.3 total cpu time spent up to now is 73.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2565 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3466 1.3466 6.0652 6.0652 6.0652 6.0652 6.2869 6.2869 7.3478 7.3478 7.3478 7.3478 14.8531 14.8531 15.0769 15.0769 15.4540 15.4540 15.4540 15.4540 15.9840 15.9840 15.9840 15.9840 k = 0.0091-0.0052 0.0074 ( 2565 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3481 1.3481 6.0648 6.0648 6.0657 6.0657 6.2869 6.2869 7.3471 7.3471 7.3481 7.3481 14.8480 14.8480 15.0554 15.0554 15.4117 15.4117 15.4353 15.4353 16.0034 16.0034 16.0207 16.0207 k = 0.0182-0.0105 0.0148 ( 2565 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3527 1.3527 6.0637 6.0637 6.0670 6.0670 6.2871 6.2871 7.3455 7.3455 7.3489 7.3489 14.8333 14.8333 14.9934 14.9934 15.3093 15.3093 15.3933 15.3933 16.0402 16.0402 16.1146 16.1146 k = 0.0273-0.0157 0.0223 ( 2553 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3604 1.3604 6.0618 6.0618 6.0695 6.0695 6.2875 6.2875 7.3423 7.3423 7.3504 7.3504 14.8100 14.8100 14.8983 14.8983 15.1791 15.1791 15.3452 15.3452 16.0848 16.0848 16.2408 16.2408 k = 0.0364-0.0210 0.0297 ( 2561 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3711 1.3711 6.0588 6.0588 6.0728 6.0728 6.2881 6.2881 7.3379 7.3379 7.3524 7.3524 14.7795 14.7795 14.7809 14.7809 15.0372 15.0372 15.2954 15.2954 16.1394 16.1394 16.3843 16.3843 k = 0.0455-0.0262 0.0371 ( 2545 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3849 1.3849 6.0551 6.0551 6.0771 6.0771 6.2893 6.2893 7.3324 7.3324 7.3553 7.3553 14.6503 14.6503 14.7432 14.7432 14.8906 14.8906 15.2420 15.2420 16.2043 16.2043 16.5380 16.5380 k = 0.0545-0.0315 0.0445 ( 2545 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.4017 1.4017 6.0500 6.0500 6.0823 6.0823 6.2910 6.2910 7.3256 7.3256 7.3585 7.3585 14.5123 14.5123 14.6985 14.6985 14.7463 14.7463 15.1829 15.1829 16.2787 16.2787 16.6982 16.6982 k = 0.0636-0.0367 0.0520 ( 2545 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5856 -38.5856 -38.5855 -38.5855 1.4216 1.4216 6.0437 6.0437 6.0885 6.0885 6.2935 6.2935 7.3175 7.3175 7.3623 7.3623 14.3701 14.3701 14.5843 14.5843 14.6681 14.6681 15.1166 15.1166 16.3614 16.3614 16.8628 16.8628 k = 0.0727-0.0420 0.0594 ( 2545 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5856 -38.5856 -38.5855 -38.5855 1.4445 1.4445 6.0360 6.0360 6.0956 6.0956 6.2969 6.2969 7.3083 7.3083 7.3666 7.3666 14.2258 14.2258 14.4359 14.4359 14.6227 14.6227 15.0423 15.0423 16.4516 16.4516 17.0274 17.0274 k = 0.0818-0.0472 0.0668 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5856 -38.5856 -38.5856 -38.5856 1.4705 1.4705 6.0269 6.0269 6.1037 6.1037 6.3014 6.3014 7.2980 7.2980 7.3715 7.3715 14.0805 14.0805 14.2864 14.2864 14.5781 14.5781 14.9592 14.9592 16.5483 16.5483 16.8756 16.8756 k = 0.0909-0.0525 0.0742 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5857 -38.5857 -38.5856 -38.5856 1.4995 1.4995 6.0162 6.0162 6.1127 6.1127 6.3070 6.3070 7.2865 7.2865 7.3770 7.3770 13.9351 13.9351 14.1374 14.1374 14.5338 14.5338 14.8668 14.8668 16.6511 16.6511 16.7066 16.7066 k = 0.1000-0.0577 0.0816 ( 2549 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5857 -38.5857 -38.5856 -38.5856 1.5315 1.5315 6.0039 6.0039 6.1225 6.1225 6.3138 6.3138 7.2737 7.2737 7.3829 7.3829 13.7901 13.7901 13.9894 13.9894 14.4900 14.4900 14.7646 14.7646 16.5418 16.5418 16.7592 16.7592 k = 0.1091-0.0630 0.0891 ( 2549 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5858 -38.5858 -38.5856 -38.5856 1.5665 1.5665 5.9902 5.9902 6.1334 6.1334 6.3221 6.3221 7.2600 7.2600 7.3894 7.3894 13.6457 13.6457 13.8425 13.8425 14.4470 14.4470 14.6522 14.6522 16.3831 16.3831 16.8723 16.8723 k = 0.1182-0.0682 0.0965 ( 2549 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5859 -38.5859 -38.5856 -38.5856 1.6045 1.6045 5.9749 5.9749 6.1451 6.1451 6.3316 6.3316 7.2452 7.2452 7.3964 7.3964 13.5022 13.5022 13.6969 13.6969 14.4050 14.4050 14.5293 14.5293 16.2320 16.2320 16.9901 16.9901 k = 0.1273-0.0735 0.1039 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5859 -38.5859 -38.5857 -38.5857 1.6455 1.6455 5.9584 5.9584 6.1578 6.1578 6.3425 6.3425 7.2295 7.2295 7.4041 7.4041 13.3598 13.3598 13.5527 13.5527 14.3642 14.3642 14.3959 14.3959 16.0896 16.0896 17.1122 17.1122 k = 0.1364-0.0787 0.1113 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5860 -38.5860 -38.5857 -38.5857 1.6895 1.6895 5.9404 5.9404 6.1713 6.1713 6.3547 6.3547 7.2127 7.2127 7.4120 7.4120 13.2186 13.2186 13.4099 13.4099 14.2522 14.2522 14.3247 14.3247 15.9566 15.9566 17.2385 17.2385 k = 0.1455-0.0840 0.1188 ( 2545 PWs) bands (ev): -74.2249 -74.2249 -43.0530 -43.0530 -38.5860 -38.5860 -38.5857 -38.5857 1.7365 1.7365 5.9213 5.9213 6.1858 6.1858 6.3682 6.3682 7.1950 7.1950 7.4204 7.4204 13.0787 13.0787 13.2687 13.2687 14.0988 14.0988 14.2866 14.2866 15.8332 15.8332 17.3687 17.3687 k = 0.1545-0.0892 0.1262 ( 2545 PWs) bands (ev): -74.2249 -74.2249 -43.0530 -43.0530 -38.5861 -38.5861 -38.5858 -38.5858 1.7863 1.7863 5.9010 5.9010 6.2011 6.2011 6.3830 6.3830 7.1764 7.1764 7.4293 7.4293 12.9402 12.9402 13.1291 13.1291 13.9364 13.9364 14.2500 14.2500 15.7194 15.7194 17.5027 17.5027 k = 0.1636-0.0945 0.1336 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0530 -43.0530 -38.5862 -38.5862 -38.5858 -38.5858 1.8392 1.8392 5.8798 5.8798 6.2172 6.2172 6.3990 6.3990 7.1572 7.1572 7.4385 7.4385 12.8031 12.8031 12.9912 12.9912 13.7663 13.7663 14.2149 14.2149 15.6147 15.6147 17.6403 17.6403 k = 0.1727-0.0997 0.1410 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0531 -43.0531 -38.5863 -38.5863 -38.5858 -38.5858 1.8949 1.8949 5.8577 5.8577 6.2341 6.2341 6.4163 6.4163 7.1371 7.1371 7.4481 7.4481 12.6676 12.6676 12.8549 12.8549 13.5894 13.5894 14.1813 14.1813 15.5183 15.5183 17.7813 17.7813 k = 0.1818-0.1050 0.1485 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0531 -43.0531 -38.5863 -38.5863 -38.5859 -38.5859 1.9535 1.9535 5.8349 5.8349 6.2519 6.2519 6.4348 6.4348 7.1163 7.1163 7.4581 7.4581 12.5336 12.5336 12.7204 12.7204 13.4070 13.4070 14.1491 14.1491 15.4298 15.4298 17.9257 17.9257 k = 0.1909-0.1102 0.1559 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0531 -43.0531 -38.5864 -38.5864 -38.5859 -38.5859 2.0150 2.0150 5.8114 5.8114 6.2704 6.2704 6.4545 6.4545 7.0950 7.0950 7.4684 7.4684 12.4012 12.4012 12.5877 12.5877 13.2202 13.2202 14.1185 14.1185 15.3483 15.3483 18.0733 18.0733 k = 0.2000-0.1155 0.1633 ( 2533 PWs) bands (ev): -74.2248 -74.2248 -43.0532 -43.0532 -38.5865 -38.5865 -38.5859 -38.5859 2.0793 2.0793 5.7874 5.7874 6.2895 6.2895 6.4752 6.4752 7.0730 7.0730 7.4788 7.4788 12.2703 12.2703 12.4568 12.4568 13.0301 13.0301 14.0894 14.0894 15.2732 15.2732 18.2240 18.2240 k = 0.2091-0.1207 0.1707 ( 2533 PWs) bands (ev): -74.2248 -74.2248 -43.0532 -43.0532 -38.5866 -38.5866 -38.5860 -38.5860 2.1464 2.1464 5.7630 5.7630 6.3091 6.3091 6.4971 6.4971 7.0506 7.0506 7.4897 7.4897 12.1409 12.1409 12.3278 12.3278 12.8378 12.8378 14.0617 14.0617 15.2038 15.2038 18.3778 18.3778 k = 0.2182-0.1260 0.1781 ( 2533 PWs) bands (ev): -74.2248 -74.2248 -43.0532 -43.0532 -38.5867 -38.5867 -38.5860 -38.5860 2.2163 2.2163 5.7382 5.7382 6.3292 6.3292 6.5200 6.5200 7.0279 7.0279 7.5009 7.5009 12.0129 12.0129 12.2007 12.2007 12.6441 12.6441 14.0353 14.0353 15.1396 15.1396 18.5344 18.5344 k = 0.2273-0.1312 0.1856 ( 2533 PWs) bands (ev): -74.2248 -74.2248 -43.0533 -43.0533 -38.5867 -38.5867 -38.5861 -38.5861 2.2890 2.2890 5.7132 5.7132 6.3497 6.3497 6.5439 6.5439 7.0050 7.0050 7.5122 7.5122 11.8863 11.8863 12.0756 12.0756 12.4501 12.4501 14.0104 14.0104 15.0801 15.0801 18.6937 18.6937 k = 0.2364-0.1365 0.1930 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0533 -43.0533 -38.5868 -38.5868 -38.5861 -38.5861 2.3644 2.3644 5.6882 5.6882 6.3705 6.3705 6.5690 6.5690 6.9821 6.9821 7.5236 7.5236 11.7607 11.7607 11.9526 11.9526 12.2566 12.2566 13.9868 13.9868 15.0250 15.0250 18.8557 18.8557 k = 0.2455-0.1417 0.2004 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0533 -43.0533 -38.5869 -38.5869 -38.5861 -38.5861 2.4425 2.4425 5.6630 5.6630 6.3912 6.3912 6.5949 6.5949 6.9593 6.9593 7.5352 7.5352 11.6357 11.6357 11.8316 11.8316 12.0646 12.0646 13.9645 13.9645 14.9738 14.9738 19.0203 19.0203 k = 0.2545-0.1470 0.2078 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0534 -43.0534 -38.5870 -38.5870 -38.5862 -38.5862 2.5233 2.5233 5.6380 5.6380 6.4115 6.4115 6.6217 6.6217 6.9369 6.9369 7.5469 7.5469 11.5105 11.5105 11.7128 11.7128 11.8757 11.8757 13.9435 13.9435 14.9263 14.9263 19.1872 19.1872 k = 0.2636-0.1522 0.2153 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0534 -43.0534 -38.5871 -38.5871 -38.5862 -38.5862 2.6066 2.6066 5.6131 5.6131 6.4312 6.4312 6.6495 6.6495 6.9153 6.9153 7.5587 7.5587 11.3837 11.3837 11.5961 11.5961 11.6916 11.6916 13.9236 13.9236 14.8822 14.8822 19.3560 19.3560 k = 0.2727-0.1575 0.2227 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0534 -43.0534 -38.5872 -38.5872 -38.5863 -38.5863 2.6926 2.6926 5.5884 5.5884 6.4497 6.4497 6.6780 6.6780 6.8950 6.8950 7.5705 7.5705 11.2527 11.2527 11.4818 11.4818 11.5156 11.5156 13.9049 13.9049 14.8413 14.8413 19.4521 19.4521 k = 0.2818-0.1627 0.2301 ( 2517 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5873 -38.5873 -38.5863 -38.5863 2.7810 2.7810 5.5641 5.5641 6.4662 6.4662 6.7074 6.7074 6.8766 6.8766 7.5823 7.5823 11.1138 11.1138 11.3517 11.3517 11.3698 11.3698 13.8874 13.8874 14.8033 14.8033 19.5509 19.5509 k = 0.2909-0.1680 0.2375 ( 2517 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5873 -38.5873 -38.5863 -38.5863 2.8719 2.8719 5.5402 5.5402 6.4799 6.4799 6.7374 6.7374 6.8608 6.8608 7.5940 7.5940 10.9638 10.9638 11.2035 11.2035 11.2602 11.2602 13.8709 13.8709 14.7681 14.7681 19.6524 19.6524 k = 0.3000-0.1732 0.2449 ( 2501 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5874 -38.5874 -38.5864 -38.5864 2.9652 2.9652 5.5168 5.5168 6.4897 6.4897 6.7683 6.7683 6.8488 6.8488 7.6058 7.6058 10.8033 10.8033 11.0712 11.0712 11.1532 11.1532 13.8554 13.8554 14.7355 14.7355 19.7563 19.7563 k = 0.3091-0.1785 0.2524 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0536 -43.0536 -38.5875 -38.5875 -38.5864 -38.5864 3.0608 3.0608 5.4939 5.4939 6.4942 6.4942 6.7994 6.7994 6.8412 6.8412 7.6174 7.6174 10.6360 10.6360 10.9512 10.9512 11.0488 11.0488 13.8410 13.8410 14.7053 14.7053 19.8290 19.8290 k = 0.3182-0.1837 0.2598 ( 2502 PWs) bands (ev): -74.2247 -74.2247 -43.0536 -43.0536 -38.5876 -38.5876 -38.5864 -38.5864 3.1588 3.1588 5.4717 5.4717 6.4929 6.4929 6.8312 6.8312 6.8393 6.8393 7.6288 7.6288 10.4660 10.4660 10.8400 10.8400 10.9471 10.9471 13.8274 13.8274 14.6775 14.6775 19.8157 19.8157 k = 0.3273-0.1890 0.2672 ( 2502 PWs) bands (ev): -74.2247 -74.2247 -43.0536 -43.0536 -38.5877 -38.5877 -38.5865 -38.5865 3.2589 3.2589 5.4501 5.4501 6.4848 6.4848 6.8431 6.8431 6.8632 6.8632 7.6400 7.6400 10.2963 10.2963 10.7353 10.7353 10.8482 10.8482 13.8148 13.8148 14.6519 14.6519 19.8023 19.8023 k = 0.3364-0.1942 0.2746 ( 2502 PWs) bands (ev): -74.2247 -74.2247 -43.0537 -43.0537 -38.5877 -38.5877 -38.5865 -38.5865 3.3611 3.3611 5.4293 5.4293 6.4701 6.4701 6.8522 6.8522 6.8955 6.8955 7.6510 7.6510 10.1285 10.1285 10.6357 10.6357 10.7522 10.7522 13.8031 13.8031 14.6283 14.6283 19.7892 19.7892 k = 0.3455-0.1994 0.2821 ( 2502 PWs) bands (ev): -74.2247 -74.2247 -43.0537 -43.0537 -38.5878 -38.5878 -38.5865 -38.5865 3.4653 3.4653 5.4092 5.4092 6.4495 6.4495 6.8660 6.8660 6.9280 6.9280 7.6618 7.6618 9.9641 9.9641 10.5406 10.5406 10.6594 10.6594 13.7922 13.7922 14.6066 14.6066 19.7764 19.7764 k = 0.3545-0.2047 0.2895 ( 2502 PWs) bands (ev): -74.2247 -74.2247 -43.0537 -43.0537 -38.5879 -38.5879 -38.5866 -38.5866 3.5714 3.5714 5.3900 5.3900 6.4233 6.4233 6.8833 6.8833 6.9604 6.9604 7.6724 7.6724 9.8038 9.8038 10.4498 10.4498 10.5698 10.5698 13.7820 13.7820 14.5868 14.5868 19.7641 19.7641 k = 0.3636-0.2099 0.2969 ( 2510 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5880 -38.5880 -38.5866 -38.5866 3.6792 3.6792 5.3718 5.3718 6.3923 6.3923 6.9032 6.9032 6.9925 6.9925 7.6826 7.6826 9.6486 9.6486 10.3630 10.3630 10.4836 10.4836 13.7727 13.7727 14.5686 14.5686 19.7521 19.7521 k = 0.3727-0.2152 0.3043 ( 2510 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5880 -38.5880 -38.5866 -38.5866 3.7887 3.7887 5.3544 5.3544 6.3570 6.3570 6.9248 6.9248 7.0244 7.0244 7.6924 7.6924 9.4992 9.4992 10.2803 10.2803 10.4011 10.4011 13.7641 13.7641 14.5522 14.5522 19.7407 19.7407 k = 0.3818-0.2204 0.3118 ( 2510 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5867 -38.5867 3.8997 3.8997 5.3381 5.3381 6.3172 6.3172 6.9475 6.9475 7.0558 7.0558 7.7019 7.7019 9.3563 9.3563 10.2018 10.2018 10.3224 10.3224 13.7562 13.7562 14.5372 14.5372 19.7298 19.7298 k = 0.3909-0.2257 0.3192 ( 2510 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5867 -38.5867 4.0120 4.0120 5.3229 5.3229 6.2734 6.2734 6.9705 6.9705 7.0863 7.0863 7.7110 7.7110 9.2207 9.2207 10.1276 10.1276 10.2477 10.2477 13.7490 13.7490 14.5237 14.5237 19.7196 19.7196 k = 0.4000-0.2309 0.3266 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5882 -38.5882 -38.5867 -38.5867 4.1255 4.1255 5.3087 5.3087 6.2252 6.2252 6.9934 6.9934 7.1159 7.1159 7.7198 7.7198 9.0930 9.0930 10.0579 10.0579 10.1774 10.1774 13.7426 13.7426 14.5116 14.5116 19.7099 19.7099 k = 0.4091-0.2362 0.3340 ( 2502 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5882 -38.5882 -38.5867 -38.5867 4.2398 4.2398 5.2956 5.2956 6.1725 6.1725 7.0157 7.0157 7.1441 7.1441 7.7280 7.7280 8.9740 8.9740 9.9929 9.9929 10.1117 10.1117 13.7366 13.7366 14.5008 14.5008 19.7010 19.7010 k = 0.4182-0.2414 0.3414 ( 2506 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5883 -38.5883 -38.5868 -38.5868 4.3549 4.3549 5.2837 5.2837 6.1151 6.1151 7.0369 7.0369 7.1708 7.1708 7.7357 7.7357 8.8644 8.8644 9.9328 9.9328 10.0508 10.0508 13.7314 13.7314 14.4912 14.4912 19.6928 19.6928 k = 0.4273-0.2467 0.3489 ( 2506 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5883 -38.5883 -38.5868 -38.5868 4.4703 4.4703 5.2729 5.2729 6.0527 6.0527 7.0567 7.0567 7.1958 7.1958 7.7428 7.7428 8.7648 8.7648 9.8780 9.8780 9.9951 9.9951 13.7267 13.7267 14.4828 14.4828 19.6854 19.6854 k = 0.4364-0.2519 0.3563 ( 2506 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5883 -38.5883 -38.5868 -38.5868 4.5858 4.5858 5.2634 5.2634 5.9852 5.9852 7.0749 7.0749 7.2186 7.2186 7.7493 7.7493 8.6759 8.6759 9.8287 9.8287 9.9449 9.9449 13.7226 13.7226 14.4755 14.4755 19.6787 19.6787 k = 0.4455-0.2572 0.3637 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5884 -38.5884 -38.5868 -38.5868 4.7011 4.7011 5.2551 5.2551 5.9124 5.9124 7.0912 7.0912 7.2392 7.2392 7.7552 7.7552 8.5981 8.5981 9.7853 9.7853 9.9006 9.9006 13.7192 13.7192 14.4693 14.4693 19.6729 19.6729 k = 0.4545-0.2624 0.3711 ( 2502 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5868 -38.5868 4.8157 4.8157 5.2480 5.2480 5.8344 5.8344 7.1053 7.1053 7.2570 7.2570 7.7603 7.7603 8.5318 8.5318 9.7479 9.7479 9.8624 9.8624 13.7162 13.7162 14.4641 14.4641 19.6679 19.6679 k = 0.4636-0.2677 0.3786 ( 2490 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5868 -38.5868 4.9292 4.9292 5.2423 5.2423 5.7512 5.7512 7.1171 7.1171 7.2722 7.2722 7.7647 7.7647 8.4774 8.4774 9.7168 9.7168 9.8307 9.8307 13.7139 13.7139 14.4599 14.4599 19.6639 19.6639 k = 0.4727-0.2729 0.3860 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5868 -38.5868 5.0410 5.0410 5.2377 5.2377 5.6632 5.6632 7.1262 7.1262 7.2840 7.2840 7.7681 7.7681 8.4350 8.4350 9.6924 9.6924 9.8057 9.8057 13.7120 13.7120 14.4566 14.4566 19.6606 19.6606 k = 0.4818-0.2782 0.3934 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5885 -38.5885 -38.5868 -38.5868 5.1502 5.1502 5.2345 5.2345 5.5712 5.5712 7.1327 7.1327 7.2926 7.2926 7.7706 7.7706 8.4047 8.4047 9.6748 9.6748 9.7876 9.7876 13.7107 13.7107 14.4544 14.4544 19.6583 19.6583 k = 0.4909-0.2834 0.4008 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5885 -38.5885 -38.5868 -38.5868 5.2326 5.2326 5.2545 5.2545 5.4772 5.4772 7.1367 7.1367 7.2978 7.2978 7.7722 7.7722 8.3865 8.3865 9.6642 9.6642 9.7767 9.7767 13.7099 13.7099 14.4530 14.4530 19.6570 19.6570 k = 0.5000-0.2887 0.4082 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5885 -38.5885 -38.5868 -38.5868 5.2319 5.2319 5.3264 5.3264 5.4087 5.4087 7.1380 7.1380 7.2996 7.2996 7.7727 7.7727 8.3805 8.3805 9.6606 9.6606 9.7731 9.7731 13.7097 13.7097 14.4525 14.4525 19.6565 19.6565 k = 0.5000-0.2887 0.4082 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5885 -38.5885 -38.5868 -38.5868 5.2319 5.2319 5.3264 5.3264 5.4087 5.4087 7.1380 7.1380 7.2996 7.2996 7.7727 7.7727 8.3805 8.3805 9.6606 9.6606 9.7731 9.7731 13.7097 13.7097 14.4525 14.4525 19.6565 19.6565 k = 0.5000-0.2784 0.4155 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5885 -38.5885 -38.5868 -38.5868 5.2319 5.2319 5.3276 5.3276 5.4084 5.4084 7.1389 7.1389 7.3002 7.3002 7.7713 7.7713 8.3773 8.3773 9.6602 9.6602 9.7722 9.7722 13.7143 13.7143 14.4577 14.4577 19.6478 19.6478 k = 0.5000-0.2681 0.4228 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5885 -38.5885 -38.5869 -38.5869 5.2319 5.2319 5.3313 5.3313 5.4075 5.4075 7.1413 7.1413 7.3022 7.3022 7.7673 7.7673 8.3680 8.3680 9.6584 9.6584 9.7704 9.7704 13.7283 13.7283 14.4733 14.4733 19.6220 19.6220 k = 0.5000-0.2577 0.4301 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5885 -38.5885 -38.5869 -38.5869 5.2319 5.2319 5.3373 5.3373 5.4060 5.4060 7.1452 7.1452 7.3056 7.3056 7.7604 7.7604 8.3531 8.3531 9.6531 9.6531 9.7694 9.7694 13.7513 13.7513 14.4991 14.4991 19.5798 19.5798 k = 0.5000-0.2474 0.4374 ( 2500 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2319 5.2319 5.3456 5.3456 5.4041 5.4041 7.1504 7.1504 7.3107 7.3107 7.7504 7.7504 8.3335 8.3335 9.6416 9.6416 9.7717 9.7717 13.7833 13.7833 14.5351 14.5351 19.5221 19.5221 k = 0.5000-0.2371 0.4447 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2320 5.2320 5.3558 5.3558 5.4021 5.4021 7.1563 7.1563 7.3176 7.3176 7.7370 7.7370 8.3102 8.3102 9.6225 9.6225 9.7785 9.7785 13.8240 13.8240 14.5811 14.5811 19.4503 19.4503 k = 0.5000-0.2268 0.4520 ( 2506 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2321 5.2321 5.3671 5.3671 5.4009 5.4009 7.1626 7.1626 7.3266 7.3266 7.7198 7.7198 8.2845 8.2845 9.5957 9.5957 9.7896 9.7896 13.8729 13.8729 14.6368 14.6368 19.3656 19.3656 k = 0.5000-0.2165 0.4593 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2321 5.2321 5.3763 5.3763 5.4037 5.4037 7.1688 7.1688 7.3380 7.3380 7.6986 7.6986 8.2576 8.2576 9.5623 9.5623 9.8038 9.8038 13.9296 13.9296 14.7021 14.7021 19.2696 19.2696 k = 0.5000-0.2062 0.4666 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2323 5.2323 5.3787 5.3787 5.4153 5.4153 7.1744 7.1744 7.3518 7.3518 7.6732 7.6732 8.2310 8.2310 9.5230 9.5230 9.8201 9.8201 13.9939 13.9939 14.7768 14.7768 19.1637 19.1637 k = 0.5000-0.1959 0.4739 ( 2514 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2325 5.2325 5.3763 5.3763 5.4338 5.4338 7.1793 7.1793 7.3681 7.3681 7.6440 7.6440 8.2055 8.2055 9.4790 9.4790 9.8375 9.8375 14.0653 14.0653 14.8604 14.8604 19.0492 19.0492 k = 0.5000-0.1856 0.4811 ( 2514 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5870 -38.5870 5.2328 5.2328 5.3719 5.3719 5.4561 5.4561 7.1828 7.1828 7.3856 7.3856 7.6118 7.6118 8.1820 8.1820 9.4307 9.4307 9.8554 9.8554 14.1433 14.1433 14.9526 14.9526 18.9273 18.9273 k = 0.5000-0.1753 0.4884 ( 2514 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5870 -38.5870 5.2331 5.2331 5.3667 5.3667 5.4813 5.4813 7.1848 7.1848 7.4022 7.4022 7.5795 7.5795 8.1610 8.1610 9.3789 9.3789 9.8733 9.8733 14.2275 14.2275 15.0532 15.0532 18.7991 18.7991 k = 0.5000-0.1650 0.4957 ( 2510 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5883 -38.5883 -38.5870 -38.5870 5.2335 5.2335 5.3610 5.3610 5.5089 5.5089 7.1847 7.1847 7.4118 7.4118 7.5537 7.5537 8.1429 8.1429 9.3241 9.3241 9.8907 9.8907 14.3175 14.3175 15.1617 15.1617 18.6656 18.6656 k = 0.5000-0.1546 0.5030 ( 2514 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5883 -38.5883 -38.5870 -38.5870 5.2340 5.2340 5.3550 5.3550 5.5390 5.5390 7.1820 7.1820 7.4039 7.4039 7.5459 7.5459 8.1274 8.1274 9.2667 9.2667 9.9075 9.9075 14.4129 14.4129 15.2779 15.2779 18.5277 18.5277 k = 0.5000-0.1443 0.5103 ( 2504 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5883 -38.5883 -38.5870 -38.5870 5.2347 5.2347 5.3489 5.3489 5.5712 5.5712 7.1753 7.1753 7.3770 7.3770 7.5597 7.5597 8.1147 8.1147 9.2072 9.2072 9.9235 9.9235 14.5134 14.5134 15.4012 15.4012 18.3862 18.3862 k = 0.5000-0.1340 0.5176 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5883 -38.5883 -38.5871 -38.5871 5.2354 5.2354 5.3426 5.3426 5.6054 5.6054 7.1622 7.1622 7.3422 7.3422 7.5866 7.5866 8.1044 8.1044 9.1459 9.1459 9.9385 9.9385 14.6185 14.6185 15.5314 15.5314 18.2417 18.2417 k = 0.5000-0.1237 0.5249 ( 2516 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5883 -38.5883 -38.5871 -38.5871 5.2363 5.2363 5.3363 5.3363 5.6416 5.6416 7.1392 7.1392 7.3100 7.3100 7.6204 7.6204 8.0964 8.0964 9.0832 9.0832 9.9524 9.9524 14.7281 14.7281 15.6680 15.6680 18.0949 18.0949 k = 0.5000-0.1134 0.5322 ( 2524 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.2372 5.2372 5.3300 5.3300 5.6795 5.6795 7.1042 7.1042 7.2861 7.2861 7.6581 7.6581 8.0904 8.0904 9.0194 9.0194 9.9651 9.9651 14.8418 14.8418 15.8107 15.8107 17.9462 17.9462 k = 0.5000-0.1031 0.5395 ( 2524 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.2384 5.2384 5.3239 5.3239 5.7189 5.7189 7.0585 7.0585 7.2707 7.2707 7.6985 7.6985 8.0867 8.0867 8.9548 8.9548 9.9768 9.9768 14.9593 14.9593 15.9589 15.9589 17.7963 17.7963 k = 0.5000-0.0928 0.5468 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.2398 5.2398 5.3179 5.3179 5.7597 5.7597 7.0059 7.0059 7.2614 7.2614 7.7404 7.7404 8.0852 8.0852 8.8897 8.8897 9.9872 9.9872 15.0804 15.0804 16.1123 16.1123 17.6455 17.6455 k = 0.5000-0.0825 0.5541 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5872 -38.5872 5.2412 5.2412 5.3120 5.3120 5.8013 5.8013 6.9498 6.9498 7.2557 7.2557 7.7828 7.7828 8.0865 8.0865 8.8243 8.8243 9.9965 9.9965 15.2049 15.2049 16.2703 16.2703 17.4941 17.4941 k = 0.5000-0.0722 0.5613 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5872 -38.5872 5.2428 5.2428 5.3065 5.3065 5.8434 5.8434 6.8928 6.8928 7.2521 7.2521 7.8246 7.8246 8.0912 8.0912 8.7589 8.7589 10.0046 10.0046 15.3325 15.3325 16.4322 16.4322 17.3426 17.3426 k = 0.5000-0.0619 0.5686 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.2446 5.2446 5.3013 5.3013 5.8854 5.8854 6.8365 6.8365 7.2497 7.2497 7.8640 7.8640 8.1007 8.1007 8.6938 8.6938 10.0117 10.0117 15.4630 15.4630 16.5972 16.5972 17.1912 17.1912 k = 0.5000-0.0515 0.5759 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.2465 5.2465 5.2964 5.2964 5.9262 5.9262 6.7827 6.7827 7.2481 7.2481 7.8987 7.8987 8.1170 8.1170 8.6292 8.6292 10.0176 10.0176 15.5963 15.5963 16.7638 16.7638 17.0405 17.0405 k = 0.5000-0.0412 0.5832 ( 2510 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.2483 5.2483 5.2921 5.2921 5.9647 5.9647 6.7331 6.7331 7.2470 7.2470 7.9265 7.9265 8.1420 8.1420 8.5653 8.5653 10.0224 10.0224 15.7320 15.7320 16.8844 16.8844 16.9362 16.9362 k = 0.5000-0.0309 0.5905 ( 2508 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.2501 5.2501 5.2883 5.2883 5.9989 5.9989 6.6900 6.6900 7.2463 7.2463 7.9464 7.9464 8.1765 8.1765 8.5025 8.5025 10.0260 10.0260 15.8701 15.8701 16.7390 16.7390 17.0945 17.0945 k = 0.5000-0.0206 0.5978 ( 2508 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2517 5.2517 5.2853 5.2853 6.0266 6.0266 6.6558 6.6558 7.2458 7.2458 7.9589 7.9589 8.2191 8.2191 8.4411 8.4411 10.0287 10.0287 16.0102 16.0102 16.5909 16.5909 17.2442 17.2442 k = 0.5000-0.0103 0.6051 ( 2516 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2527 5.2527 5.2834 5.2834 6.0448 6.0448 6.6336 6.6336 7.2454 7.2454 7.9657 7.9657 8.2678 8.2678 8.3820 8.3820 10.0302 10.0302 16.1519 16.1519 16.4443 16.4443 17.3621 17.3621 k = 0.5000-0.0000 0.6124 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2531 5.2531 5.2827 5.2827 6.0512 6.0512 6.6258 6.6258 7.2453 7.2453 7.9677 7.9677 8.3104 8.3104 8.3360 8.3360 10.0307 10.0307 16.2784 16.2784 16.3162 16.3162 17.4104 17.4104 k = 0.5000-0.0000 0.6124 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2531 5.2531 5.2827 5.2827 6.0512 6.0512 6.6258 6.6258 7.2453 7.2453 7.9677 7.9677 8.3104 8.3104 8.3360 8.3360 10.0307 10.0307 16.2784 16.2784 16.3162 16.3162 17.4104 17.4104 k = 0.4938 0.0108 0.6124 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2514 5.2514 5.2821 5.2821 6.0483 6.0483 6.6314 6.6314 7.2445 7.2445 7.9634 7.9634 8.2810 8.2810 8.3717 8.3717 10.0328 10.0328 16.1886 16.1886 16.4013 16.4013 17.3927 17.3927 k = 0.4875 0.0217 0.6124 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2455 5.2455 5.2819 5.2819 6.0398 6.0398 6.6474 6.6474 7.2419 7.2419 7.9520 7.9520 8.2443 8.2443 8.4249 8.4249 10.0392 10.0392 16.0719 16.0719 16.5043 16.5043 17.3484 17.3484 k = 0.4813 0.0325 0.6124 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.2351 5.2351 5.2832 5.2832 6.0265 6.0265 6.6719 6.6719 7.2376 7.2376 7.9361 7.9361 8.2097 8.2097 8.4833 8.4833 10.0500 10.0500 15.9454 15.9454 16.6093 16.6093 17.2914 17.2914 k = 0.4750 0.0433 0.6124 ( 2517 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.2213 5.2213 5.2858 5.2858 6.0097 6.0097 6.7029 6.7029 7.2319 7.2319 7.9171 7.9171 8.1774 8.1774 8.5442 8.5442 10.0656 10.0656 15.8111 15.8111 16.7157 16.7157 17.2316 17.2316 k = 0.4688 0.0541 0.6124 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.2052 5.2052 5.2893 5.2893 5.9908 5.9908 6.7384 6.7384 7.2248 7.2248 7.8961 7.8961 8.1475 8.1475 8.6060 8.6060 10.0861 10.0861 15.6711 15.6711 16.8230 16.8230 17.1740 17.1740 k = 0.4625 0.0650 0.6124 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.1878 5.1878 5.2933 5.2933 5.9709 5.9709 6.7769 6.7769 7.2168 7.2168 7.8736 7.8736 8.1200 8.1200 8.6670 8.6670 10.1117 10.1117 15.5271 15.5271 16.9310 16.9310 17.1211 17.1211 k = 0.4562 0.0758 0.6124 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.1697 5.1697 5.2977 5.2977 5.9508 5.9508 6.8169 6.8169 7.2081 7.2081 7.8498 7.8498 8.0948 8.0948 8.7262 8.7262 10.1424 10.1424 15.3813 15.3813 17.0360 17.0360 17.0766 17.0766 k = 0.4500 0.0866 0.6124 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.1514 5.1514 5.3022 5.3022 5.9312 5.9312 6.8574 6.8574 7.1994 7.1994 7.8249 7.8249 8.0721 8.0721 8.7824 8.7824 10.1782 10.1782 15.2355 15.2355 17.0275 17.0275 17.1509 17.1509 k = 0.4437 0.0974 0.6124 ( 2528 PWs) bands (ev): -74.2248 -74.2248 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.1334 5.1334 5.3067 5.3067 5.9125 5.9125 6.8973 6.8973 7.1912 7.1912 7.7987 7.7987 8.0518 8.0518 8.8348 8.8348 10.2186 10.2186 15.0914 15.0914 16.9900 16.9900 17.2586 17.2586 k = 0.4375 0.1083 0.6124 ( 2524 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5871 -38.5871 5.1160 5.1160 5.3112 5.3112 5.8950 5.8950 6.9355 6.9355 7.1847 7.1847 7.7714 7.7714 8.0340 8.0340 8.8829 8.8829 10.2633 10.2633 14.9509 14.9509 16.9566 16.9566 17.3658 17.3658 k = 0.4313 0.1191 0.6124 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0994 5.0994 5.3156 5.3156 5.8789 5.8789 6.9706 6.9706 7.1812 7.1812 7.7430 7.7430 8.0186 8.0186 8.9261 8.9261 10.3113 10.3113 14.8156 14.8156 16.9272 16.9272 17.4712 17.4712 k = 0.4250 0.1299 0.6124 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0841 5.0841 5.3198 5.3198 5.8644 5.8644 7.0007 7.0007 7.1826 7.1826 7.7133 7.7133 8.0055 8.0055 8.9643 8.9643 10.3614 10.3614 14.6873 14.6873 16.9016 16.9016 17.5738 17.5738 k = 0.4188 0.1407 0.6124 ( 2521 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0700 5.0700 5.3236 5.3236 5.8514 5.8514 7.0234 7.0234 7.1913 7.1913 7.6827 7.6827 7.9945 7.9945 8.9974 8.9974 10.4122 10.4122 14.5678 14.5678 16.8795 16.8795 17.6723 17.6723 k = 0.4125 0.1516 0.6124 ( 2521 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0576 5.0576 5.3271 5.3271 5.8401 5.8401 7.0378 7.0378 7.2084 7.2084 7.6513 7.6513 7.9855 7.9855 9.0255 9.0255 10.4620 10.4620 14.4588 14.4588 16.8608 16.8608 17.7651 17.7651 k = 0.4062 0.1624 0.6124 ( 2521 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0467 5.0467 5.3302 5.3302 5.8305 5.8305 7.0449 7.0449 7.2325 7.2325 7.6195 7.6195 7.9782 7.9782 9.0487 9.0487 10.5089 10.5089 14.3622 14.3622 16.8453 16.8453 17.8502 17.8502 k = 0.4000 0.1732 0.6124 ( 2524 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0377 5.0377 5.3328 5.3328 5.8227 5.8227 7.0474 7.0474 7.2611 7.2611 7.5876 7.5876 7.9725 7.9725 9.0673 9.0673 10.5508 10.5508 14.2798 14.2798 16.8327 16.8327 17.9254 17.9254 k = 0.3937 0.1840 0.6124 ( 2524 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0307 5.0307 5.3349 5.3349 5.8166 5.8166 7.0475 7.0475 7.2910 7.2910 7.5567 7.5567 7.9682 7.9682 9.0815 9.0815 10.5860 10.5860 14.2135 14.2135 16.8231 16.8231 17.9881 17.9881 k = 0.3875 0.1949 0.6124 ( 2524 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0255 5.0255 5.3364 5.3364 5.8122 5.8122 7.0467 7.0467 7.3193 7.3193 7.5285 7.5285 7.9652 7.9652 9.0915 9.0915 10.6125 10.6125 14.1648 14.1648 16.8163 16.8163 18.0355 18.0355 k = 0.3812 0.2057 0.6124 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 5.0225 5.0225 5.3373 5.3373 5.8096 5.8096 7.0460 7.0460 7.3414 7.3414 7.5066 7.5066 7.9635 7.9635 9.0975 9.0975 10.6291 10.6291 14.1350 14.1350 16.8122 16.8122 18.0651 18.0651 k = 0.3750 0.2165 0.6124 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 5.0214 5.0214 5.3376 5.3376 5.8087 5.8087 7.0458 7.0458 7.3504 7.3504 7.4977 7.4977 7.9629 7.9629 9.0994 9.0994 10.6347 10.6347 14.1250 14.1250 16.8108 16.8108 18.0752 18.0752 k = 0.3750 0.2165 0.6124 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 5.0214 5.0214 5.3376 5.3376 5.8087 5.8087 7.0458 7.0458 7.3504 7.3504 7.4977 7.4977 7.9629 7.9629 9.0994 9.0994 10.6347 10.6347 14.1250 14.1250 16.8108 16.8108 18.0752 18.0752 k = 0.3685 0.2128 0.6018 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 4.9795 4.9795 5.3364 5.3364 5.8487 5.8487 7.0296 7.0296 7.3157 7.3157 7.4670 7.4670 8.0286 8.0286 9.0732 9.0732 10.7175 10.7175 14.1443 14.1443 17.0203 17.0203 17.9836 17.9836 k = 0.3621 0.2090 0.5913 ( 2536 PWs) bands (ev): -74.2248 -74.2248 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 4.9319 4.9319 5.3359 5.3359 5.8877 5.8877 7.0135 7.0135 7.2821 7.2821 7.4420 7.4420 8.0975 8.0975 9.0484 9.0484 10.8025 10.8025 14.1645 14.1645 17.2324 17.2324 17.8942 17.8942 k = 0.3556 0.2053 0.5807 ( 2536 PWs) bands (ev): -74.2248 -74.2248 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 4.8787 4.8787 5.3363 5.3363 5.9254 5.9254 6.9981 6.9981 7.2516 7.2516 7.4216 7.4216 8.1695 8.1695 9.0255 9.0255 10.8899 10.8899 14.1858 14.1858 17.4463 17.4463 17.8072 17.8072 k = 0.3491 0.2016 0.5701 ( 2534 PWs) bands (ev): -74.2248 -74.2248 -43.0540 -43.0540 -38.5881 -38.5881 -38.5870 -38.5870 4.8198 4.8198 5.3374 5.3374 5.9614 5.9614 6.9837 6.9837 7.2250 7.2250 7.4053 7.4053 8.2443 8.2443 9.0045 9.0045 10.9794 10.9794 14.2084 14.2084 17.6610 17.6610 17.7228 17.7228 k = 0.3427 0.1978 0.5596 ( 2534 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5870 -38.5870 4.7553 4.7553 5.3395 5.3395 5.9951 5.9951 6.9705 6.9705 7.2027 7.2027 7.3930 7.3930 8.3217 8.3217 8.9857 8.9857 11.0710 11.0710 14.2323 14.2323 17.6399 17.6399 17.8768 17.8768 k = 0.3362 0.1941 0.5490 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5870 -38.5870 4.6855 4.6855 5.3425 5.3425 6.0265 6.0265 6.9581 6.9581 7.1848 7.1848 7.3848 7.3848 8.4016 8.4016 8.9696 8.9696 11.1646 11.1646 14.2578 14.2578 17.5601 17.5601 18.0912 18.0912 k = 0.3297 0.1904 0.5385 ( 2516 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5870 -38.5870 4.6107 4.6107 5.3464 5.3464 6.0552 6.0552 6.9462 6.9462 7.1707 7.1707 7.3810 7.3810 8.4837 8.4837 8.9566 8.9566 11.2602 11.2602 14.2848 14.2848 17.4827 17.4827 18.3034 18.3034 k = 0.3233 0.1866 0.5279 ( 2516 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5869 -38.5869 4.5314 4.5314 5.3512 5.3512 6.0813 6.0813 6.9342 6.9342 7.1601 7.1601 7.3823 7.3823 8.5678 8.5678 8.9473 8.9473 11.3577 11.3577 14.3135 14.3135 17.4078 17.4078 18.5114 18.5114 k = 0.3168 0.1829 0.5173 ( 2528 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5880 -38.5880 -38.5869 -38.5869 4.4481 4.4481 5.3570 5.3570 6.1048 6.1048 6.9214 6.9214 7.1520 7.1520 7.3888 7.3888 8.6533 8.6533 8.9429 8.9429 11.4569 11.4569 14.3440 14.3440 17.3353 17.3353 18.7122 18.7122 k = 0.3103 0.1792 0.5068 ( 2526 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5880 -38.5880 -38.5869 -38.5869 4.3612 4.3612 5.3637 5.3637 6.1259 6.1259 6.9077 6.9077 7.1457 7.1457 7.4006 7.4006 8.7393 8.7393 8.9453 8.9453 11.5580 11.5580 14.3764 14.3764 17.2654 17.2654 18.9001 18.9001 k = 0.3039 0.1754 0.4962 ( 2524 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5880 -38.5880 -38.5868 -38.5868 4.2714 4.2714 5.3715 5.3715 6.1449 6.1449 6.8931 6.8931 7.1404 7.1404 7.4171 7.4171 8.8221 8.8221 8.9584 8.9584 11.6609 11.6609 14.4109 14.4109 17.1980 17.1980 18.8013 18.8013 k = 0.2974 0.1717 0.4857 ( 2520 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5880 -38.5880 -38.5868 -38.5868 4.1791 4.1791 5.3802 5.3802 6.1620 6.1620 6.8773 6.8773 7.1357 7.1357 7.4374 7.4374 8.8907 8.8907 8.9944 8.9944 11.7654 11.7654 14.4474 14.4474 17.1330 17.1330 18.6707 18.6707 k = 0.2909 0.1680 0.4751 ( 2518 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5880 -38.5880 -38.5868 -38.5868 4.0848 4.0848 5.3899 5.3899 6.1775 6.1775 6.8607 6.8607 7.1312 7.1312 7.4599 7.4599 8.9349 8.9349 9.0642 9.0642 11.8716 11.8716 14.4861 14.4861 17.0704 17.0704 18.5411 18.5411 k = 0.2845 0.1642 0.4646 ( 2514 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5879 -38.5879 -38.5867 -38.5867 3.9891 3.9891 5.4005 5.4005 6.1914 6.1914 6.8433 6.8433 7.1270 7.1270 7.4832 7.4832 8.9698 8.9698 9.1537 9.1537 11.9794 11.9794 14.5270 14.5270 17.0103 17.0103 18.4128 18.4128 k = 0.2780 0.1605 0.4540 ( 2514 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5879 -38.5879 -38.5867 -38.5867 3.8924 3.8924 5.4121 5.4121 6.2041 6.2041 6.8253 6.8253 7.1232 7.1232 7.5058 7.5058 9.0078 9.0078 9.2510 9.2510 12.0887 12.0887 14.5703 14.5703 16.9525 16.9525 18.2858 18.2858 k = 0.2716 0.1568 0.4434 ( 2518 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5879 -38.5879 -38.5866 -38.5866 3.7950 3.7950 5.4245 5.4245 6.2156 6.2156 6.8068 6.8068 7.1197 7.1197 7.5263 7.5263 9.0532 9.0532 9.3524 9.3524 12.1996 12.1996 14.6160 14.6160 16.8971 16.8971 18.1601 18.1601 k = 0.2651 0.1530 0.4329 ( 2522 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5878 -38.5878 -38.5866 -38.5866 3.6974 3.6974 5.4379 5.4379 6.2259 6.2259 6.7879 6.7879 7.1168 7.1168 7.5438 7.5438 9.1076 9.1076 9.4570 9.4570 12.3119 12.3119 14.6641 14.6641 16.8440 16.8440 18.0357 18.0357 k = 0.2586 0.1493 0.4223 ( 2521 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5878 -38.5878 -38.5866 -38.5866 3.5998 3.5998 5.4522 5.4522 6.2352 6.2352 6.7688 6.7688 7.1146 7.1146 7.5576 7.5576 9.1716 9.1716 9.5644 9.5644 12.4257 12.4257 14.7148 14.7148 16.7931 16.7931 17.9128 17.9128 k = 0.2522 0.1456 0.4118 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5877 -38.5877 -38.5865 -38.5865 3.5025 3.5025 5.4674 5.4674 6.2435 6.2435 6.7494 6.7494 7.1131 7.1131 7.5674 7.5674 9.2453 9.2453 9.6741 9.6741 12.5408 12.5408 14.7681 14.7681 16.7444 16.7444 17.7912 17.7912 k = 0.2457 0.1418 0.4012 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5877 -38.5877 -38.5865 -38.5865 3.4059 3.4059 5.4834 5.4834 6.2507 6.2507 6.7300 6.7300 7.1123 7.1123 7.5733 7.5733 9.3285 9.3285 9.7863 9.7863 12.6573 12.6573 14.8240 14.8240 16.6979 16.6979 17.6712 17.6712 k = 0.2392 0.1381 0.3907 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0536 -43.0536 -38.5877 -38.5877 -38.5864 -38.5864 3.3101 3.3101 5.5002 5.5002 6.2569 6.2569 6.7105 6.7105 7.1124 7.1124 7.5753 7.5753 9.4208 9.4208 9.9006 9.9006 12.7750 12.7750 14.8826 14.8826 16.6536 16.6536 17.5527 17.5527 k = 0.2328 0.1344 0.3801 ( 2527 PWs) bands (ev): -74.2248 -74.2248 -43.0536 -43.0536 -38.5876 -38.5876 -38.5864 -38.5864 3.2153 3.2153 5.5178 5.5178 6.2620 6.2620 6.6911 6.6911 7.1132 7.1132 7.5739 7.5739 9.5216 9.5216 10.0172 10.0172 12.8939 12.8939 14.9439 14.9439 16.6113 16.6113 17.4358 17.4358 k = 0.2263 0.1307 0.3695 ( 2531 PWs) bands (ev): -74.2248 -74.2248 -43.0536 -43.0536 -38.5875 -38.5875 -38.5863 -38.5863 3.1218 3.1218 5.5360 5.5360 6.2660 6.2660 6.6717 6.6717 7.1149 7.1149 7.5695 7.5695 9.6305 9.6305 10.1360 10.1360 13.0140 13.0140 15.0080 15.0080 16.5709 16.5709 17.3205 17.3205 k = 0.2198 0.1269 0.3590 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5875 -38.5875 -38.5863 -38.5863 3.0298 3.0298 5.5550 5.5550 6.2689 6.2689 6.6525 6.6525 7.1175 7.1175 7.5627 7.5627 9.7467 9.7467 10.2569 10.2569 13.1350 13.1350 15.0748 15.0748 16.5326 16.5326 17.2069 17.2069 k = 0.2134 0.1232 0.3484 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5874 -38.5874 -38.5862 -38.5862 2.9393 2.9393 5.5745 5.5745 6.2706 6.2706 6.6335 6.6335 7.1208 7.1208 7.5538 7.5538 9.8698 9.8698 10.3800 10.3800 13.2570 13.2570 15.1444 15.1444 16.4961 16.4961 17.0951 17.0951 k = 0.2069 0.1195 0.3379 ( 2527 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5874 -38.5874 -38.5862 -38.5862 2.8505 2.8505 5.5947 5.5947 6.2711 6.2711 6.6147 6.6147 7.1249 7.1249 7.5433 7.5433 9.9990 9.9990 10.5053 10.5053 13.3798 13.3798 15.2168 15.2168 16.4615 16.4615 16.9851 16.9851 k = 0.2004 0.1157 0.3273 ( 2533 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5873 -38.5873 -38.5862 -38.5862 2.7635 2.7635 5.6153 5.6153 6.2703 6.2703 6.5962 6.5962 7.1297 7.1297 7.5317 7.5317 10.1340 10.1340 10.6326 10.6326 13.5033 13.5033 15.2919 15.2919 16.4287 16.4287 16.8769 16.8769 k = 0.1940 0.1120 0.3167 ( 2523 PWs) bands (ev): -74.2248 -74.2248 -43.0534 -43.0534 -38.5872 -38.5872 -38.5861 -38.5861 2.6785 2.6785 5.6364 5.6364 6.2686 6.2686 6.5780 6.5780 7.1353 7.1353 7.5195 7.5195 10.2743 10.2743 10.7621 10.7621 13.6273 13.6273 15.3698 15.3698 16.3975 16.3975 16.7707 16.7707 k = 0.1875 0.1083 0.3062 ( 2523 PWs) bands (ev): -74.2248 -74.2248 -43.0534 -43.0534 -38.5871 -38.5871 -38.5861 -38.5861 2.5956 2.5956 5.6579 5.6579 6.2656 6.2656 6.5600 6.5600 7.1415 7.1415 7.5067 7.5067 10.4195 10.4195 10.8938 10.8938 13.7516 13.7516 15.4504 15.4504 16.3681 16.3681 16.6666 16.6666 k = 0.1810 0.1045 0.2956 ( 2523 PWs) bands (ev): -74.2248 -74.2248 -43.0533 -43.0533 -38.5871 -38.5871 -38.5860 -38.5860 2.5148 2.5148 5.6797 5.6797 6.2614 6.2614 6.5424 6.5424 7.1483 7.1483 7.4939 7.4939 10.5691 10.5691 11.0275 11.0275 13.8760 13.8760 15.5335 15.5335 16.3402 16.3402 16.5647 16.5647 k = 0.1746 0.1008 0.2851 ( 2523 PWs) bands (ev): -74.2248 -74.2248 -43.0533 -43.0533 -38.5870 -38.5870 -38.5860 -38.5860 2.4363 2.4363 5.7017 5.7017 6.2562 6.2562 6.5251 6.5251 7.1557 7.1557 7.4812 7.4812 10.7228 10.7228 11.1634 11.1634 14.0002 14.0002 15.6193 15.6193 16.3137 16.3137 16.4653 16.4653 k = 0.1681 0.0971 0.2745 ( 2535 PWs) bands (ev): -74.2248 -74.2248 -43.0533 -43.0533 -38.5869 -38.5869 -38.5860 -38.5860 2.3600 2.3600 5.7238 5.7238 6.2501 6.2501 6.5081 6.5081 7.1634 7.1634 7.4687 7.4687 10.8804 10.8804 11.3014 11.3014 14.1238 14.1238 15.7074 15.7074 16.2878 16.2878 16.3691 16.3691 k = 0.1616 0.0933 0.2640 ( 2535 PWs) bands (ev): -74.2248 -74.2248 -43.0533 -43.0533 -38.5868 -38.5868 -38.5859 -38.5859 2.2862 2.2862 5.7460 5.7460 6.2430 6.2430 6.4915 6.4915 7.1717 7.1717 7.4567 7.4567 11.0414 11.0414 11.4416 11.4416 14.2465 14.2465 15.7978 15.7978 16.2538 16.2538 16.2851 16.2851 k = 0.1552 0.0896 0.2534 ( 2539 PWs) bands (ev): -74.2248 -74.2248 -43.0532 -43.0532 -38.5868 -38.5868 -38.5859 -38.5859 2.2148 2.2148 5.7683 5.7683 6.2352 6.2352 6.4752 6.4752 7.1805 7.1805 7.4453 7.4453 11.2057 11.2057 11.5839 11.5839 14.3677 14.3677 15.8900 15.8900 16.1747 16.1747 16.2507 16.2507 k = 0.1487 0.0859 0.2428 ( 2545 PWs) bands (ev): -74.2249 -74.2249 -43.0532 -43.0532 -38.5867 -38.5867 -38.5859 -38.5859 2.1460 2.1460 5.7904 5.7904 6.2267 6.2267 6.4592 6.4592 7.1894 7.1894 7.4345 7.4345 11.3729 11.3729 11.7284 11.7284 14.4867 14.4867 15.9832 15.9832 16.0863 16.0863 16.2308 16.2308 k = 0.1422 0.0821 0.2323 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0532 -43.0532 -38.5866 -38.5866 -38.5858 -38.5858 2.0797 2.0797 5.8124 5.8124 6.2176 6.2176 6.4437 6.4437 7.1987 7.1987 7.4245 7.4245 11.5429 11.5429 11.8752 11.8752 14.6028 14.6028 15.9990 15.9990 16.0752 16.0752 16.2171 16.2171 k = 0.1358 0.0784 0.2217 ( 2537 PWs) bands (ev): -74.2249 -74.2249 -43.0531 -43.0531 -38.5865 -38.5865 -38.5858 -38.5858 2.0160 2.0160 5.8341 5.8341 6.2082 6.2082 6.4286 6.4286 7.2083 7.2083 7.4152 7.4152 11.7152 11.7152 12.0242 12.0242 14.7149 14.7149 15.9150 15.9150 16.1449 16.1449 16.2285 16.2285 k = 0.1293 0.0747 0.2112 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0531 -43.0531 -38.5864 -38.5864 -38.5858 -38.5858 1.9551 1.9551 5.8553 5.8553 6.1984 6.1984 6.4138 6.4138 7.2179 7.2179 7.4067 7.4067 11.8896 11.8896 12.1755 12.1755 14.8219 14.8219 15.8338 15.8338 16.1549 16.1549 16.3026 16.3026 k = 0.1228 0.0709 0.2006 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0531 -43.0531 -38.5863 -38.5863 -38.5857 -38.5857 1.8968 1.8968 5.8761 5.8761 6.1884 6.1884 6.3997 6.3997 7.2277 7.2277 7.3989 7.3989 12.0659 12.0659 12.3292 12.3292 14.9223 14.9223 15.7559 15.7559 16.1449 16.1449 16.3995 16.3995 k = 0.1164 0.0672 0.1900 ( 2543 PWs) bands (ev): -74.2249 -74.2249 -43.0530 -43.0530 -38.5863 -38.5863 -38.5857 -38.5857 1.8413 1.8413 5.8962 5.8962 6.1782 6.1782 6.3860 6.3860 7.2375 7.2375 7.3919 7.3919 12.2436 12.2436 12.4854 12.4854 15.0144 15.0144 15.6814 15.6814 16.1323 16.1323 16.5011 16.5011 k = 0.1099 0.0635 0.1795 ( 2543 PWs) bands (ev): -74.2249 -74.2249 -43.0530 -43.0530 -38.5862 -38.5862 -38.5857 -38.5857 1.7886 1.7886 5.9156 5.9156 6.1682 6.1682 6.3730 6.3730 7.2473 7.2473 7.3856 7.3856 12.4223 12.4223 12.6442 12.6442 15.0964 15.0964 15.6109 15.6109 16.1198 16.1198 16.6044 16.6044 k = 0.1034 0.0597 0.1689 ( 2547 PWs) bands (ev): -74.2249 -74.2249 -43.0530 -43.0530 -38.5861 -38.5861 -38.5857 -38.5857 1.7388 1.7388 5.9341 5.9341 6.1581 6.1581 6.3607 6.3607 7.2569 7.2569 7.3799 7.3799 12.6018 12.6018 12.8057 12.8057 15.1663 15.1663 15.5450 15.5450 16.1077 16.1077 16.7082 16.7082 k = 0.0970 0.0560 0.1584 ( 2547 PWs) bands (ev): -74.2249 -74.2249 -43.0530 -43.0530 -38.5860 -38.5860 -38.5856 -38.5856 1.6918 1.6918 5.9517 5.9517 6.1483 6.1483 6.3492 6.3492 7.2663 7.2663 7.3750 7.3750 12.7814 12.7814 12.9701 12.9701 15.2218 15.2218 15.4851 15.4851 16.0965 16.0965 16.8110 16.8110 k = 0.0905 0.0523 0.1478 ( 2547 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5860 -38.5860 -38.5856 -38.5856 1.6477 1.6477 5.9682 5.9682 6.1388 6.1388 6.3386 6.3386 7.2755 7.2755 7.3706 7.3706 12.9607 12.9607 13.1376 13.1376 15.2591 15.2591 15.4347 15.4347 16.0861 16.0861 16.9099 16.9099 k = 0.0841 0.0485 0.1373 ( 2547 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5859 -38.5859 -38.5856 -38.5856 1.6066 1.6066 5.9835 5.9835 6.1296 6.1296 6.3289 6.3289 7.2844 7.2844 7.3667 7.3667 13.1393 13.1393 13.3082 13.3082 15.2707 15.2707 15.4017 15.4017 16.0765 16.0765 16.9853 16.9853 k = 0.0776 0.0448 0.1267 ( 2543 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5858 -38.5858 -38.5856 -38.5856 1.5684 1.5684 5.9976 5.9976 6.1209 6.1209 6.3203 6.3203 7.2930 7.2930 7.3634 7.3634 13.3168 13.3168 13.4817 13.4817 15.2525 15.2525 15.3917 15.3917 16.0677 16.0677 17.0491 17.0491 k = 0.0711 0.0411 0.1161 ( 2543 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5858 -38.5858 -38.5856 -38.5856 1.5331 1.5331 6.0102 6.0102 6.1125 6.1125 6.3127 6.3127 7.3011 7.3011 7.3605 7.3605 13.4929 13.4929 13.6578 13.6578 15.2179 15.2179 15.3929 15.3929 16.0597 16.0597 17.1035 17.1035 k = 0.0647 0.0373 0.1056 ( 2543 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5857 -38.5857 -38.5855 -38.5855 1.5009 1.5009 6.0214 6.0214 6.1048 6.1048 6.3063 6.3063 7.3088 7.3088 7.3580 7.3580 13.6677 13.6677 13.8357 13.8357 15.1799 15.1799 15.3946 15.3946 16.0524 16.0524 17.0849 17.0849 k = 0.0582 0.0336 0.0950 ( 2543 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5857 -38.5857 -38.5855 -38.5855 1.4717 1.4717 6.0312 6.0312 6.0976 6.0976 6.3009 6.3009 7.3159 7.3159 7.3557 7.3557 13.8408 13.8408 14.0147 14.0147 15.1438 15.1438 15.3940 15.3940 16.0458 16.0458 17.0067 17.0067 k = 0.0517 0.0299 0.0845 ( 2547 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5856 -38.5856 -38.5855 -38.5855 1.4455 1.4455 6.0395 6.0395 6.0910 6.0910 6.2966 6.2966 7.3223 7.3223 7.3539 7.3539 14.0121 14.0121 14.1933 14.1933 15.1120 15.1120 15.3911 15.3911 16.0400 16.0400 16.9035 16.9035 k = 0.0453 0.0261 0.0739 ( 2547 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5856 -38.5856 -38.5855 -38.5855 1.4224 1.4224 6.0464 6.0464 6.0851 6.0851 6.2933 6.2933 7.3282 7.3282 7.3524 7.3524 14.1809 14.1809 14.3697 14.3697 15.0864 15.0864 15.3872 15.3872 16.0348 16.0348 16.7868 16.7868 k = 0.0388 0.0224 0.0633 ( 2547 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5856 -38.5856 -38.5855 -38.5855 1.4023 1.4023 6.0520 6.0520 6.0800 6.0800 6.2909 6.2909 7.3333 7.3333 7.3511 7.3511 14.3457 14.3457 14.5408 14.5408 15.0701 15.0701 15.3835 15.3835 16.0302 16.0302 16.6610 16.6610 k = 0.0323 0.0187 0.0528 ( 2559 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3853 1.3853 6.0564 6.0564 6.0754 6.0754 6.2892 6.2892 7.3377 7.3377 7.3500 7.3500 14.5033 14.5033 14.6999 14.6999 15.0699 15.0699 15.3815 15.3815 16.0260 16.0260 16.5282 16.5283 k = 0.0259 0.0149 0.0422 ( 2555 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3714 1.3714 6.0598 6.0598 6.0718 6.0718 6.2881 6.2881 7.3414 7.3414 7.3492 7.3492 14.6468 14.6468 14.8318 14.8318 15.1028 15.1028 15.3835 15.3835 16.0221 16.0221 16.3911 16.3911 k = 0.0194 0.0112 0.0317 ( 2545 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3605 1.3605 6.0623 6.0623 6.0690 6.0690 6.2875 6.2875 7.3443 7.3443 7.3487 7.3487 14.7602 14.7602 14.9236 14.9236 15.1878 15.1878 15.3924 15.3924 16.0178 16.0178 16.2538 16.2538 k = 0.0129 0.0075 0.0211 ( 2557 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3528 1.3528 6.0639 6.0639 6.0669 6.0669 6.2871 6.2871 7.3463 7.3463 7.3482 7.3482 14.8237 14.8237 14.9975 14.9975 15.3043 15.3043 15.4116 15.4116 16.0113 16.0113 16.1254 16.1254 k = 0.0065 0.0037 0.0106 ( 2565 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3481 1.3481 6.0649 6.0649 6.0656 6.0656 6.2869 6.2869 7.3473 7.3473 7.3479 7.3479 14.8475 14.8475 15.0554 15.0554 15.4089 15.4089 15.4388 15.4388 15.9975 15.9975 16.0248 16.0248 k = 0.0000 0.0000 0.0000 ( 2565 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3466 1.3466 6.0652 6.0652 6.0652 6.0652 6.2869 6.2869 7.3478 7.3478 7.3478 7.3478 14.8531 14.8531 15.0769 15.0769 15.4540 15.4540 15.4540 15.4540 15.9840 15.9840 15.9840 15.9840 k = 0.0000 0.0000 0.0000 ( 2565 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3466 1.3466 6.0652 6.0652 6.0652 6.0652 6.2869 6.2869 7.3478 7.3478 7.3478 7.3478 14.8531 14.8531 15.0769 15.0769 15.4540 15.4540 15.4540 15.4540 15.9840 15.9840 15.9840 15.9840 k = 0.0106 0.0061 0.0043 ( 2571 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3481 1.3481 6.0648 6.0648 6.0656 6.0656 6.2869 6.2869 7.3475 7.3475 7.3477 7.3477 14.8472 14.8472 15.0552 15.0552 15.4095 15.4095 15.4376 15.4376 16.0017 16.0017 16.0200 16.0200 k = 0.0213 0.0123 0.0087 ( 2556 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3529 1.3529 6.0640 6.0640 6.0668 6.0668 6.2871 6.2871 7.3468 7.3468 7.3477 7.3477 14.8184 14.8184 15.0000 15.0000 15.3199 15.3199 15.3939 15.3939 16.0496 16.0496 16.0762 16.0762 k = 0.0319 0.0184 0.0130 ( 2538 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3607 1.3607 6.0625 6.0625 6.0689 6.0689 6.2876 6.2876 7.3456 7.3456 7.3476 7.3476 14.7304 14.7304 14.9520 14.9520 15.2323 15.2323 15.3325 15.3325 16.1178 16.1178 16.1353 16.1353 k = 0.0426 0.0246 0.0174 ( 2544 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3717 1.3717 6.0601 6.0601 6.0716 6.0716 6.2882 6.2882 7.3437 7.3437 7.3471 7.3471 14.5767 14.5767 14.9322 14.9322 15.1564 15.1564 15.2612 15.2612 16.1985 16.1985 16.2035 16.2035 k = 0.0532 0.0307 0.0217 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5855 -38.5855 -38.5855 -38.5855 1.3859 1.3859 6.0569 6.0569 6.0751 6.0751 6.2893 6.2893 7.3412 7.3412 7.3467 7.3467 14.3891 14.3891 14.9197 14.9197 15.0933 15.0933 15.1844 15.1844 16.2806 16.2806 16.2872 16.2872 k = 0.0638 0.0369 0.0261 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5856 -38.5856 -38.5855 -38.5855 1.4031 1.4031 6.0526 6.0526 6.0793 6.0793 6.2910 6.2910 7.3384 7.3384 7.3462 7.3462 14.1855 14.1855 14.8941 14.8941 15.0513 15.0513 15.1047 15.1047 16.3647 16.3647 16.3812 16.3812 k = 0.0745 0.0430 0.0304 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5856 -38.5856 -38.5855 -38.5855 1.4235 1.4235 6.0471 6.0471 6.0842 6.0842 6.2935 6.2935 7.3350 7.3350 7.3457 7.3457 13.9736 13.9736 14.8442 14.8442 15.0233 15.0233 15.0375 15.0375 16.4542 16.4542 16.4789 16.4789 k = 0.0851 0.0491 0.0347 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5856 -38.5856 -38.5855 -38.5855 1.4470 1.4470 6.0403 6.0403 6.0898 6.0898 6.2968 6.2968 7.3313 7.3313 7.3452 7.3452 13.7572 13.7572 14.7775 14.7775 14.9410 14.9410 15.0432 15.0432 16.5476 16.5476 16.5791 16.5791 k = 0.0957 0.0553 0.0391 ( 2538 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5857 -38.5857 -38.5855 -38.5855 1.4735 1.4735 6.0321 6.0321 6.0959 6.0959 6.3012 6.3012 7.3273 7.3273 7.3449 7.3449 13.5384 13.5384 14.7030 14.7030 14.8582 14.8582 15.0585 15.0585 16.6436 16.6436 16.6805 16.6805 k = 0.1064 0.0614 0.0434 ( 2538 PWs) bands (ev): -74.2249 -74.2249 -43.0528 -43.0528 -38.5857 -38.5857 -38.5855 -38.5855 1.5031 1.5031 6.0223 6.0223 6.1027 6.1027 6.3066 6.3066 7.3230 7.3230 7.3446 7.3446 13.3182 13.3182 14.6249 14.6249 14.7752 14.7752 15.0791 15.0791 16.7404 16.7404 16.7811 16.7811 k = 0.1170 0.0676 0.0478 ( 2544 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5858 -38.5858 -38.5855 -38.5855 1.5358 1.5358 6.0110 6.0110 6.1099 6.1099 6.3131 6.3131 7.3183 7.3183 7.3446 7.3446 13.0977 13.0977 14.5448 14.5448 14.6923 14.6923 15.1031 15.1031 16.8348 16.8348 16.8769 16.8769 k = 0.1277 0.0737 0.0521 ( 2544 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5859 -38.5859 -38.5855 -38.5855 1.5715 1.5715 5.9982 5.9982 6.1175 6.1175 6.3207 6.3207 7.3136 7.3136 7.3448 7.3448 12.8775 12.8775 14.4635 14.4635 14.6093 14.6093 15.1292 15.1292 16.9190 16.9190 16.9572 16.9572 k = 0.1383 0.0798 0.0565 ( 2550 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5859 -38.5859 -38.5856 -38.5856 1.6101 1.6101 5.9839 5.9839 6.1255 6.1255 6.3293 6.3293 7.3088 7.3088 7.3453 7.3453 12.6580 12.6580 14.3814 14.3814 14.5265 14.5265 15.1569 15.1569 16.9740 16.9740 16.9985 16.9985 k = 0.1489 0.0860 0.0608 ( 2550 PWs) bands (ev): -74.2249 -74.2249 -43.0529 -43.0529 -38.5860 -38.5860 -38.5856 -38.5856 1.6517 1.6517 5.9682 5.9682 6.1338 6.1338 6.3390 6.3390 7.3040 7.3040 7.3463 7.3463 12.4396 12.4396 14.2989 14.2989 14.4439 14.4439 15.1855 15.1855 16.9766 16.9766 16.9830 16.9830 k = 0.1596 0.0921 0.0651 ( 2550 PWs) bands (ev): -74.2249 -74.2249 -43.0530 -43.0530 -38.5861 -38.5861 -38.5856 -38.5856 1.6963 1.6963 5.9512 5.9512 6.1424 6.1424 6.3495 6.3495 7.2993 7.2993 7.3477 7.3477 12.2227 12.2227 14.2160 14.2160 14.3615 14.3615 15.2146 15.2146 16.9310 16.9310 16.9373 16.9373 k = 0.1702 0.0983 0.0695 ( 2550 PWs) bands (ev): -74.2249 -74.2249 -43.0530 -43.0530 -38.5862 -38.5862 -38.5856 -38.5856 1.7437 1.7437 5.9330 5.9330 6.1511 6.1511 6.3608 6.3608 7.2947 7.2947 7.3496 7.3496 12.0076 12.0076 14.1330 14.1330 14.2793 14.2793 15.2436 15.2436 16.8649 16.8649 16.8806 16.8806 k = 0.1809 0.1044 0.0738 ( 2550 PWs) bands (ev): -74.2249 -74.2249 -43.0530 -43.0530 -38.5862 -38.5862 -38.5856 -38.5856 1.7940 1.7940 5.9136 5.9136 6.1600 6.1600 6.3727 6.3727 7.2904 7.2904 7.3521 7.3521 11.7944 11.7944 14.0500 14.0500 14.1975 14.1975 15.2721 15.2721 16.7943 16.7943 16.8181 16.8181 k = 0.1915 0.1106 0.0782 ( 2550 PWs) bands (ev): -74.2249 -74.2249 -43.0530 -43.0530 -38.5863 -38.5863 -38.5856 -38.5856 1.8471 1.8471 5.8931 5.8931 6.1688 6.1688 6.3851 6.3851 7.2865 7.2865 7.3552 7.3552 11.5835 11.5835 13.9672 13.9672 14.1159 14.1159 15.2996 15.2996 16.7230 16.7230 16.7543 16.7543 k = 0.2021 0.1167 0.0825 ( 2547 PWs) bands (ev): -74.2249 -74.2249 -43.0531 -43.0531 -38.5864 -38.5864 -38.5857 -38.5857 1.9029 1.9029 5.8717 5.8717 6.1776 6.1776 6.3979 6.3979 7.2829 7.2829 7.3591 7.3591 11.3752 11.3752 13.8845 13.8845 14.0348 14.0348 15.3257 15.3257 16.6527 16.6527 16.6912 16.6912 k = 0.2128 0.1228 0.0869 ( 2541 PWs) bands (ev): -74.2249 -74.2249 -43.0531 -43.0531 -38.5865 -38.5865 -38.5857 -38.5857 1.9615 1.9615 5.8493 5.8493 6.1863 6.1863 6.4109 6.4109 7.2800 7.2800 7.3637 7.3637 11.1695 11.1695 13.8022 13.8022 13.9542 13.9542 15.3500 15.3500 16.5843 16.5843 16.6297 16.6297 k = 0.2234 0.1290 0.0912 ( 2535 PWs) bands (ev): -74.2249 -74.2249 -43.0531 -43.0531 -38.5866 -38.5866 -38.5857 -38.5857 2.0226 2.0226 5.8261 5.8261 6.1947 6.1947 6.4241 6.4241 7.2776 7.2776 7.3691 7.3691 10.9668 10.9668 13.7205 13.7205 13.8742 13.8742 15.3720 15.3720 16.5181 16.5181 16.5703 16.5703 k = 0.2340 0.1351 0.0955 ( 2535 PWs) bands (ev): -74.2249 -74.2249 -43.0532 -43.0532 -38.5867 -38.5867 -38.5857 -38.5857 2.0863 2.0863 5.8020 5.8020 6.2029 6.2029 6.4371 6.4371 7.2759 7.2759 7.3753 7.3753 10.7673 10.7673 13.6394 13.6394 13.7950 13.7950 15.3914 15.3914 16.4546 16.4546 16.5132 16.5132 k = 0.2447 0.1413 0.0999 ( 2535 PWs) bands (ev): -74.2248 -74.2248 -43.0532 -43.0532 -38.5868 -38.5868 -38.5857 -38.5857 2.1525 2.1525 5.7772 5.7772 6.2107 6.2107 6.4499 6.4499 7.2750 7.2750 7.3823 7.3823 10.5711 10.5711 13.5591 13.5591 13.7165 13.7165 15.4079 15.4079 16.3938 16.3938 16.4587 16.4587 k = 0.2553 0.1474 0.1042 ( 2529 PWs) bands (ev): -74.2248 -74.2248 -43.0532 -43.0532 -38.5869 -38.5869 -38.5858 -38.5858 2.2211 2.2211 5.7516 5.7516 6.2182 6.2182 6.4625 6.4625 7.2749 7.2749 7.3902 7.3902 10.3787 10.3787 13.4799 13.4799 13.6391 13.6391 15.4214 15.4214 16.3359 16.3359 16.4069 16.4069 k = 0.2660 0.1536 0.1086 ( 2530 PWs) bands (ev): -74.2248 -74.2248 -43.0532 -43.0532 -38.5870 -38.5870 -38.5858 -38.5858 2.2919 2.2919 5.7253 5.7253 6.2253 6.2253 6.4746 6.4746 7.2756 7.2756 7.3989 7.3989 10.1901 10.1901 13.4018 13.4018 13.5628 13.5628 15.4316 15.4316 16.2810 16.2810 16.3577 16.3577 k = 0.2766 0.1597 0.1129 ( 2530 PWs) bands (ev): -74.2248 -74.2248 -43.0533 -43.0533 -38.5870 -38.5870 -38.5858 -38.5858 2.3649 2.3649 5.6982 5.6982 6.2319 6.2319 6.4861 6.4861 7.2773 7.2773 7.4084 7.4084 10.0057 10.0057 13.3251 13.3251 13.4878 13.4878 15.4386 15.4386 16.2289 16.2289 16.3112 16.3112 k = 0.2872 0.1658 0.1173 ( 2518 PWs) bands (ev): -74.2248 -74.2248 -43.0533 -43.0533 -38.5871 -38.5871 -38.5858 -38.5858 2.4400 2.4400 5.6706 5.6706 6.2380 6.2380 6.4971 6.4971 7.2799 7.2799 7.4187 7.4187 9.8258 9.8258 13.2499 13.2499 13.4143 13.4143 15.4424 15.4424 16.1799 16.1799 16.2673 16.2673 k = 0.2979 0.1720 0.1216 ( 2533 PWs) bands (ev): -74.2248 -74.2248 -43.0533 -43.0533 -38.5872 -38.5872 -38.5858 -38.5858 2.5169 2.5169 5.6420 5.6420 6.2435 6.2435 6.5072 6.5072 7.2832 7.2832 7.4295 7.4295 9.6506 9.6506 13.1765 13.1765 13.3425 13.3425 15.4432 15.4432 16.1337 16.1337 16.2261 16.2261 k = 0.3085 0.1781 0.1259 ( 2533 PWs) bands (ev): -74.2248 -74.2248 -43.0534 -43.0534 -38.5873 -38.5873 -38.5859 -38.5859 2.5956 2.5956 5.6128 5.6128 6.2486 6.2486 6.5166 6.5166 7.2874 7.2874 7.4410 7.4410 9.4806 9.4806 13.1051 13.1051 13.2726 13.2726 15.4412 15.4412 16.0904 16.0904 16.1874 16.1874 k = 0.3191 0.1843 0.1303 ( 2527 PWs) bands (ev): -74.2248 -74.2248 -43.0534 -43.0534 -38.5874 -38.5874 -38.5859 -38.5859 2.6759 2.6759 5.5827 5.5827 6.2533 6.2533 6.5252 6.5252 7.2924 7.2924 7.4531 7.4531 9.3161 9.3161 13.0358 13.0358 13.2048 13.2048 15.4368 15.4368 16.0499 16.0499 16.1514 16.1514 k = 0.3298 0.1904 0.1346 ( 2527 PWs) bands (ev): -74.2248 -74.2248 -43.0534 -43.0534 -38.5875 -38.5875 -38.5859 -38.5859 2.7574 2.7574 5.5517 5.5517 6.2574 6.2574 6.5329 6.5329 7.2979 7.2979 7.4656 7.4656 9.1576 9.1576 12.9690 12.9690 13.1392 13.1392 15.4302 15.4302 16.0122 16.0122 16.1177 16.1177 k = 0.3404 0.1965 0.1390 ( 2527 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5876 -38.5876 -38.5859 -38.5859 2.8401 2.8401 5.5197 5.5197 6.2610 6.2610 6.5398 6.5398 7.3039 7.3039 7.4784 7.4784 9.0054 9.0054 12.9047 12.9047 13.0762 13.0762 15.4219 15.4219 15.9771 15.9771 16.0865 16.0865 k = 0.3511 0.2027 0.1433 ( 2524 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5876 -38.5876 -38.5859 -38.5859 2.9235 2.9235 5.4868 5.4868 6.2642 6.2642 6.5459 6.5459 7.3102 7.3102 7.4913 7.4913 8.8602 8.8602 12.8434 12.8434 13.0160 13.0160 15.4122 15.4122 15.9447 15.9447 16.0577 16.0577 k = 0.3617 0.2088 0.1477 ( 2518 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5877 -38.5877 -38.5859 -38.5859 3.0074 3.0074 5.4528 5.4528 6.2671 6.2671 6.5513 6.5513 7.3165 7.3165 7.5044 7.5044 8.7223 8.7223 12.7850 12.7850 12.9587 12.9587 15.4014 15.4014 15.9149 15.9149 16.0311 16.0311 k = 0.3723 0.2150 0.1520 ( 2509 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5878 -38.5878 -38.5859 -38.5859 3.0913 3.0913 5.4178 5.4178 6.2695 6.2695 6.5559 6.5559 7.3227 7.3227 7.5173 7.5173 8.5924 8.5924 12.7299 12.7299 12.9046 12.9046 15.3901 15.3901 15.8875 15.8875 16.0068 16.0068 k = 0.3830 0.2211 0.1564 ( 2509 PWs) bands (ev): -74.2248 -74.2248 -43.0535 -43.0535 -38.5878 -38.5878 -38.5860 -38.5860 3.1747 3.1747 5.3818 5.3818 6.2715 6.2715 6.5598 6.5598 7.3283 7.3283 7.5299 7.5299 8.4711 8.4711 12.6783 12.6783 12.8538 12.8538 15.3784 15.3784 15.8626 15.8626 15.9847 15.9847 k = 0.3936 0.2273 0.1607 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0536 -43.0536 -38.5879 -38.5879 -38.5860 -38.5860 3.2572 3.2572 5.3447 5.3447 6.2732 6.2732 6.5630 6.5630 7.3332 7.3332 7.5420 7.5420 8.3590 8.3590 12.6304 12.6304 12.8067 12.8067 15.3668 15.3668 15.8401 15.8401 15.9647 15.9647 k = 0.4043 0.2334 0.1650 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0536 -43.0536 -38.5879 -38.5879 -38.5860 -38.5860 3.3380 3.3380 5.3070 5.3070 6.2746 6.2746 6.5657 6.5657 7.3371 7.3371 7.5535 7.5535 8.2568 8.2568 12.5863 12.5863 12.7633 12.7633 15.3555 15.3555 15.8199 15.8199 15.9467 15.9467 k = 0.4149 0.2395 0.1694 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0536 -43.0536 -38.5880 -38.5880 -38.5860 -38.5860 3.4162 3.4162 5.2688 5.2688 6.2757 6.2757 6.5679 6.5679 7.3397 7.3397 7.5643 7.5643 8.1651 8.1651 12.5463 12.5463 12.7240 12.7240 15.3447 15.3447 15.8020 15.8020 15.9308 15.9308 k = 0.4255 0.2457 0.1737 ( 2503 PWs) bands (ev): -74.2248 -74.2248 -43.0536 -43.0536 -38.5880 -38.5880 -38.5860 -38.5860 3.4910 3.4910 5.2308 5.2308 6.2767 6.2767 6.5697 6.5697 7.3409 7.3409 7.5744 7.5744 8.0844 8.0844 12.5106 12.5106 12.6888 12.6888 15.3347 15.3347 15.7863 15.7863 15.9168 15.9168 k = 0.4362 0.2518 0.1781 ( 2503 PWs) bands (ev): -74.2247 -74.2247 -43.0536 -43.0536 -38.5881 -38.5881 -38.5860 -38.5860 3.5611 3.5611 5.1935 5.1935 6.2774 6.2774 6.5711 6.5711 7.3406 7.3406 7.5833 7.5833 8.0151 8.0151 12.4793 12.4793 12.6579 12.6579 15.3257 15.3257 15.7727 15.7727 15.9048 15.9048 k = 0.4468 0.2580 0.1824 ( 2509 PWs) bands (ev): -74.2248 -74.2248 -43.0536 -43.0536 -38.5881 -38.5881 -38.5860 -38.5860 3.6249 3.6249 5.1581 5.1581 6.2780 6.2780 6.5722 6.5722 7.3389 7.3389 7.5911 7.5911 7.9572 7.9572 12.4525 12.4525 12.6315 12.6315 15.3178 15.3178 15.7613 15.7613 15.8947 15.8947 k = 0.4574 0.2641 0.1868 ( 2509 PWs) bands (ev): -74.2248 -74.2248 -43.0536 -43.0536 -38.5881 -38.5881 -38.5860 -38.5860 3.6811 3.6811 5.1258 5.1258 6.2784 6.2784 6.5730 6.5730 7.3362 7.3362 7.5976 7.5976 7.9109 7.9109 12.4304 12.4304 12.6097 12.6097 15.3111 15.3111 15.7521 15.7521 15.8865 15.8865 k = 0.4681 0.2702 0.1911 ( 2506 PWs) bands (ev): -74.2248 -74.2248 -43.0536 -43.0536 -38.5882 -38.5882 -38.5860 -38.5860 3.7276 3.7276 5.0982 5.0982 6.2787 6.2787 6.5736 6.5736 7.3330 7.3330 7.6028 7.6028 7.8757 7.8757 12.4132 12.4132 12.5927 12.5927 15.3058 15.3058 15.7449 15.7449 15.8801 15.8801 k = 0.4787 0.2764 0.1954 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7626 3.7626 5.0768 5.0768 6.2789 6.2789 6.5740 6.5740 7.3299 7.3299 7.6065 7.6065 7.8512 7.8512 12.4007 12.4007 12.5805 12.5805 15.3020 15.3020 15.7398 15.7398 15.8756 15.8756 k = 0.4894 0.2825 0.1998 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7844 3.7844 5.0633 5.0633 6.2790 6.2790 6.5742 6.5742 7.3278 7.3278 7.6087 7.6087 7.8367 7.8367 12.3933 12.3933 12.5731 12.5731 15.2997 15.2997 15.7367 15.7367 15.8729 15.8729 k = 0.5000 0.2887 0.2041 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7919 3.7919 5.0586 5.0586 6.2790 6.2790 6.5743 6.5743 7.3270 7.3270 7.6095 7.6095 7.8320 7.8320 12.3908 12.3908 12.5706 12.5706 15.2989 15.2989 15.7357 15.7357 15.8719 15.8719 k = 0.5000 0.2887 0.2041 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7919 3.7919 5.0586 5.0586 6.2790 6.2790 6.5743 6.5743 7.3270 7.3270 7.6095 7.6095 7.8320 7.8320 12.3908 12.3908 12.5706 12.5706 15.2989 15.2989 15.7357 15.7357 15.8719 15.8719 k = 0.5037 0.2781 0.2101 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7933 3.7933 5.0589 5.0589 6.2793 6.2793 6.5745 6.5745 7.3272 7.3272 7.6097 7.6097 7.8316 7.8316 12.3840 12.3840 12.5637 12.5637 15.2756 15.2756 15.7541 15.7541 15.8888 15.8888 k = 0.5074 0.2674 0.2161 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7978 3.7978 5.0596 5.0596 6.2799 6.2799 6.5751 6.5751 7.3275 7.3275 7.6101 7.6101 7.8303 7.8303 12.3630 12.3630 12.5439 12.5439 15.2188 15.2188 15.7908 15.7908 15.9444 15.9444 k = 0.5110 0.2568 0.2221 ( 2507 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.8053 3.8053 5.0609 5.0609 6.2809 6.2809 6.5761 6.5761 7.3281 7.3281 7.6110 7.6110 7.8283 7.8283 12.3267 12.3267 12.5135 12.5135 15.1483 15.1483 15.8270 15.8270 16.0365 16.0365 k = 0.5147 0.2462 0.2281 ( 2509 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8157 3.8157 5.0627 5.0627 6.2821 6.2821 6.5776 6.5776 7.3288 7.3288 7.6121 7.6121 7.8254 7.8254 12.2732 12.2732 12.4758 12.4758 15.0753 15.0753 15.8638 15.8638 16.1508 16.1508 k = 0.5184 0.2356 0.2341 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8290 3.8290 5.0649 5.0649 6.2835 6.2835 6.5798 6.5798 7.3296 7.3296 7.6135 7.6135 7.8219 7.8219 12.2020 12.2020 12.4334 12.4334 15.0044 15.0044 15.9050 15.9050 16.2762 16.2762 k = 0.5221 0.2250 0.2401 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8453 3.8453 5.0677 5.0677 6.2849 6.2849 6.5826 6.5826 7.3304 7.3304 7.6154 7.6154 7.8178 7.8178 12.1140 12.1140 12.3877 12.3877 14.9377 14.9377 15.9519 15.9519 16.4068 16.4068 k = 0.5257 0.2144 0.2461 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8645 3.8645 5.0710 5.0710 6.2862 6.2862 6.5863 6.5863 7.3312 7.3312 7.6176 7.6176 7.8132 7.8132 12.0112 12.0112 12.3390 12.3390 14.8756 14.8756 16.0049 16.0049 16.5390 16.5390 k = 0.5294 0.2038 0.2522 ( 2511 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5862 -38.5862 3.8865 3.8865 5.0747 5.0747 6.2872 6.2872 6.5911 6.5911 7.3318 7.3318 7.6201 7.6201 7.8084 7.8084 11.8963 11.8963 12.2873 12.2873 14.8182 14.8182 16.0636 16.0636 16.6706 16.6706 k = 0.5331 0.1932 0.2582 ( 2517 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5862 -38.5862 3.9114 3.9114 5.0789 5.0789 6.2876 6.2876 6.5969 6.5969 7.3320 7.3320 7.6227 7.6227 7.8036 7.8036 11.7714 11.7714 12.2326 12.2326 14.7651 14.7651 16.1276 16.1276 16.8008 16.8008 k = 0.5368 0.1825 0.2642 ( 2515 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5862 -38.5862 3.9391 3.9391 5.0835 5.0835 6.2873 6.2873 6.6042 6.6042 7.3320 7.3320 7.6254 7.6254 7.7993 7.7993 11.6388 11.6388 12.1751 12.1751 14.7160 14.7160 16.1965 16.1965 16.9292 16.9292 k = 0.5404 0.1719 0.2702 ( 2514 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5863 -38.5863 3.9695 3.9695 5.0886 5.0886 6.2862 6.2862 6.6129 6.6129 7.3315 7.3315 7.6276 7.6276 7.7958 7.7958 11.5001 11.5001 12.1148 12.1148 14.6704 14.6704 16.2698 16.2698 17.0562 17.0562 k = 0.5441 0.1613 0.2762 ( 2514 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5863 -38.5863 4.0027 4.0027 5.0942 5.0942 6.2840 6.2840 6.6232 6.6232 7.3304 7.3304 7.6291 7.6291 7.7938 7.7938 11.3570 11.3570 12.0522 12.0522 14.6279 14.6279 16.3468 16.3468 17.1825 17.1825 k = 0.5478 0.1507 0.2822 ( 2516 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5881 -38.5881 -38.5863 -38.5863 4.0384 4.0384 5.1001 5.1001 6.2807 6.2807 6.6352 6.6352 7.3287 7.3287 7.6292 7.6292 7.7940 7.7940 11.2107 11.2107 11.9876 11.9876 14.5883 14.5883 16.4270 16.4270 17.3088 17.3088 k = 0.5515 0.1401 0.2882 ( 2515 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5881 -38.5881 -38.5864 -38.5864 4.0767 4.0767 5.1065 5.1065 6.2760 6.2760 6.6490 6.6490 7.3262 7.3262 7.6274 7.6274 7.7970 7.7970 11.0625 11.0625 11.9212 11.9212 14.5511 14.5511 16.5101 16.5101 17.4358 17.4358 k = 0.5551 0.1295 0.2942 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5864 -38.5864 4.1175 4.1175 5.1133 5.1133 6.2699 6.2699 6.6644 6.6644 7.3230 7.3230 7.6234 7.6234 7.8033 7.8033 10.9134 10.9134 11.8534 11.8534 14.5162 14.5162 16.5953 16.5953 17.5642 17.5642 k = 0.5588 0.1189 0.3002 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5865 -38.5865 4.1606 4.1606 5.1205 5.1205 6.2624 6.2624 6.6815 6.6815 7.3191 7.3191 7.6171 7.6171 7.8130 7.8130 10.7642 10.7642 11.7845 11.7845 14.4833 14.4833 16.6823 16.6823 17.6942 17.6942 k = 0.5625 0.1083 0.3062 ( 2518 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5881 -38.5881 -38.5865 -38.5865 4.2059 4.2059 5.1281 5.1281 6.2533 6.2533 6.7001 6.7001 7.3144 7.3144 7.6085 7.6085 7.8260 7.8260 10.6159 10.6159 11.7147 11.7147 14.4523 14.4523 16.7706 16.7706 17.8260 17.8260 k = 0.5662 0.0976 0.3122 ( 2518 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5881 -38.5881 -38.5866 -38.5866 4.2534 4.2534 5.1361 5.1361 6.2427 6.2427 6.7202 6.7202 7.3091 7.3091 7.5982 7.5982 7.8419 7.8419 10.4692 10.4692 11.6444 11.6444 14.4230 14.4230 16.8597 16.8597 17.9592 17.9592 k = 0.5699 0.0870 0.3182 ( 2521 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5881 -38.5881 -38.5866 -38.5866 4.3028 4.3028 5.1446 5.1446 6.2305 6.2305 6.7415 6.7415 7.3032 7.3032 7.5865 7.5865 7.8604 7.8604 10.3249 10.3249 11.5739 11.5739 14.3953 14.3953 16.9492 16.9492 18.0923 18.0923 k = 0.5735 0.0764 0.3242 ( 2519 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5867 -38.5867 4.3540 4.3540 5.1535 5.1535 6.2166 6.2166 6.7641 6.7641 7.2970 7.2970 7.5737 7.5737 7.8810 7.8810 10.1838 10.1838 11.5033 11.5033 14.3691 14.3691 17.0385 17.0385 18.2201 18.2201 k = 0.5772 0.0658 0.3302 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5867 -38.5867 4.4067 4.4067 5.1629 5.1629 6.2009 6.2009 6.7874 6.7874 7.2905 7.2905 7.5603 7.5603 7.9031 7.9031 10.0466 10.0466 11.4328 11.4328 14.3443 14.3443 17.1273 17.1273 18.3151 18.3151 k = 0.5809 0.0552 0.3362 ( 2527 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5868 -38.5868 4.4607 4.4607 5.1728 5.1728 6.1831 6.1831 6.8116 6.8116 7.2841 7.2841 7.5467 7.5467 7.9262 7.9262 9.9142 9.9142 11.3629 11.3629 14.3209 14.3209 17.2151 17.2151 18.2950 18.2950 k = 0.5846 0.0446 0.3422 ( 2527 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5868 -38.5868 4.5157 4.5157 5.1833 5.1833 6.1632 6.1632 6.8361 6.8361 7.2781 7.2781 7.5331 7.5331 7.9499 7.9499 9.7873 9.7873 11.2935 11.2935 14.2987 14.2987 17.3016 17.3016 18.1939 18.1939 k = 0.5882 0.0340 0.3482 ( 2529 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5869 -38.5869 4.5712 4.5712 5.1945 5.1945 6.1409 6.1409 6.8609 6.8609 7.2728 7.2728 7.5198 7.5198 7.9733 7.9733 9.6670 9.6670 11.2251 11.2251 14.2777 14.2777 17.3862 17.3862 18.0728 18.0728 k = 0.5919 0.0233 0.3542 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5869 -38.5869 4.6269 4.6269 5.2066 5.2066 6.1162 6.1162 6.8854 6.8854 7.2688 7.2688 7.5073 7.5073 7.9957 7.9957 9.5544 9.5544 11.1577 11.1577 14.2579 14.2579 17.4687 17.4687 17.9455 17.9455 k = 0.5956 0.0127 0.3602 ( 2523 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5869 -38.5869 4.6821 4.6821 5.2196 5.2196 6.0887 6.0887 6.9094 6.9094 7.2665 7.2665 7.4958 7.4958 8.0160 8.0160 9.4507 9.4507 11.0916 11.0916 14.2392 14.2392 17.5487 17.5487 17.8161 17.8161 k = 0.5993 0.0021 0.3662 ( 2529 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5870 -38.5870 4.7364 4.7364 5.2337 5.2337 6.0582 6.0582 6.9324 6.9324 7.2666 7.2666 7.4856 7.4856 8.0330 8.0330 9.3573 9.3573 11.0269 11.0269 14.2215 14.2215 17.6254 17.6254 17.6865 17.6865 k = 0.6029-0.0085 0.3722 ( 2529 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5870 -38.5870 4.7889 4.7889 5.2490 5.2490 6.0249 6.0249 6.9541 6.9541 7.2695 7.2695 7.4772 7.4772 8.0454 8.0454 9.2757 9.2757 10.9640 10.9640 14.2049 14.2049 17.5562 17.5562 17.7004 17.7004 k = 0.6066-0.0191 0.3782 ( 2527 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5870 -38.5870 4.8388 4.8388 5.2656 5.2656 5.9888 5.9888 6.9742 6.9742 7.2757 7.2757 7.4710 7.4710 8.0518 8.0518 9.2076 9.2076 10.9030 10.9030 14.1893 14.1893 17.4278 17.4278 17.7712 17.7712 k = 0.6103-0.0297 0.3842 ( 2529 PWs) bands (ev): -74.2248 -74.2248 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 4.8852 4.8852 5.2833 5.2833 5.9506 5.9506 6.9924 6.9924 7.2852 7.2852 7.4676 7.4676 8.0506 8.0506 9.1545 9.1545 10.8442 10.8442 14.1746 14.1746 17.3007 17.3007 17.8387 17.8387 k = 0.6140-0.0403 0.3902 ( 2525 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 4.9274 4.9274 5.3014 5.3014 5.9111 5.9111 7.0088 7.0088 7.2979 7.2979 7.4677 7.4677 8.0410 8.0410 9.1172 9.1172 10.7877 10.7877 14.1609 14.1609 17.1753 17.1753 17.9029 17.9029 k = 0.6176-0.0509 0.3962 ( 2523 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 4.9644 4.9644 5.3184 5.3184 5.8722 5.8722 7.0232 7.0232 7.3135 7.3135 7.4721 7.4721 8.0227 8.0227 9.0961 9.0961 10.7338 10.7338 14.1481 14.1481 17.0517 17.0517 17.9636 17.9636 k = 0.6213-0.0616 0.4022 ( 2521 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 4.9959 4.9959 5.3317 5.3317 5.8368 5.8368 7.0355 7.0355 7.3312 7.3312 7.4818 7.4818 7.9963 7.9963 9.0906 9.0906 10.6827 10.6827 14.1361 14.1361 16.9302 16.9302 18.0210 18.0210 k = 0.6250-0.0722 0.4082 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 5.0214 5.0214 5.3376 5.3376 5.8087 5.8087 7.0458 7.0458 7.3504 7.3504 7.4977 7.4977 7.9629 7.9629 9.0994 9.0994 10.6347 10.6347 14.1250 14.1250 16.8108 16.8108 18.0752 18.0752 k = 0.6250-0.0722 0.4082 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 5.0214 5.0214 5.3376 5.3376 5.8087 5.8087 7.0458 7.0458 7.3504 7.3504 7.4977 7.4977 7.9629 7.9629 9.0994 9.0994 10.6347 10.6347 14.1250 14.1250 16.8108 16.8108 18.0752 18.0752 k = 0.6188-0.0686 0.4185 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 5.0224 5.0224 5.3373 5.3373 5.8096 5.8096 7.0460 7.0460 7.3414 7.3414 7.5066 7.5066 7.9635 7.9635 9.0975 9.0975 10.6291 10.6291 14.1350 14.1350 16.8122 16.8122 18.0651 18.0651 k = 0.6125-0.0650 0.4287 ( 2524 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0255 5.0255 5.3364 5.3364 5.8122 5.8122 7.0467 7.0467 7.3193 7.3193 7.5285 7.5285 7.9652 7.9652 9.0915 9.0915 10.6125 10.6125 14.1648 14.1648 16.8163 16.8163 18.0355 18.0355 k = 0.6062-0.0613 0.4389 ( 2524 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0307 5.0307 5.3349 5.3349 5.8166 5.8166 7.0475 7.0475 7.2910 7.2910 7.5567 7.5567 7.9682 7.9682 9.0815 9.0815 10.5860 10.5860 14.2135 14.2135 16.8231 16.8231 17.9881 17.9881 k = 0.6000-0.0577 0.4491 ( 2524 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0377 5.0377 5.3328 5.3328 5.8227 5.8227 7.0474 7.0474 7.2611 7.2611 7.5876 7.5876 7.9725 7.9725 9.0673 9.0673 10.5508 10.5508 14.2798 14.2798 16.8327 16.8327 17.9254 17.9254 k = 0.5938-0.0541 0.4593 ( 2521 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0467 5.0467 5.3302 5.3302 5.8305 5.8305 7.0449 7.0449 7.2325 7.2325 7.6195 7.6195 7.9782 7.9782 9.0487 9.0487 10.5089 10.5089 14.3622 14.3622 16.8453 16.8453 17.8502 17.8502 k = 0.5875-0.0505 0.4695 ( 2521 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0576 5.0576 5.3271 5.3271 5.8401 5.8401 7.0378 7.0378 7.2084 7.2084 7.6513 7.6513 7.9855 7.9855 9.0255 9.0255 10.4620 10.4620 14.4588 14.4588 16.8608 16.8608 17.7651 17.7651 k = 0.5813-0.0469 0.4797 ( 2521 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0700 5.0700 5.3236 5.3236 5.8514 5.8514 7.0234 7.0234 7.1913 7.1913 7.6827 7.6827 7.9945 7.9945 8.9974 8.9974 10.4122 10.4122 14.5678 14.5678 16.8795 16.8795 17.6723 17.6723 k = 0.5750-0.0433 0.4899 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0841 5.0841 5.3198 5.3198 5.8644 5.8644 7.0007 7.0007 7.1826 7.1826 7.7133 7.7133 8.0055 8.0055 8.9643 8.9643 10.3614 10.3614 14.6873 14.6873 16.9016 16.9016 17.5738 17.5738 k = 0.5687-0.0397 0.5001 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5871 -38.5871 5.0994 5.0994 5.3156 5.3156 5.8789 5.8789 6.9706 6.9706 7.1812 7.1812 7.7430 7.7430 8.0186 8.0186 8.9261 8.9261 10.3113 10.3113 14.8156 14.8156 16.9272 16.9272 17.4712 17.4712 k = 0.5625-0.0361 0.5103 ( 2524 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5871 -38.5871 5.1160 5.1160 5.3112 5.3112 5.8950 5.8950 6.9355 6.9355 7.1847 7.1847 7.7714 7.7714 8.0340 8.0340 8.8829 8.8829 10.2633 10.2633 14.9509 14.9509 16.9566 16.9566 17.3658 17.3658 k = 0.5563-0.0325 0.5205 ( 2528 PWs) bands (ev): -74.2248 -74.2248 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.1334 5.1334 5.3067 5.3067 5.9125 5.9125 6.8973 6.8973 7.1912 7.1912 7.7987 7.7987 8.0518 8.0518 8.8348 8.8348 10.2186 10.2186 15.0914 15.0914 16.9900 16.9900 17.2586 17.2586 k = 0.5500-0.0289 0.5307 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.1514 5.1514 5.3022 5.3022 5.9312 5.9312 6.8574 6.8574 7.1994 7.1994 7.8249 7.8249 8.0721 8.0721 8.7824 8.7824 10.1782 10.1782 15.2355 15.2355 17.0275 17.0275 17.1509 17.1509 k = 0.5437-0.0253 0.5409 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.1697 5.1697 5.2977 5.2977 5.9508 5.9508 6.8169 6.8169 7.2081 7.2081 7.8498 7.8498 8.0948 8.0948 8.7262 8.7262 10.1424 10.1424 15.3813 15.3813 17.0360 17.0360 17.0766 17.0766 k = 0.5375-0.0217 0.5511 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.1878 5.1878 5.2933 5.2933 5.9709 5.9709 6.7769 6.7769 7.2168 7.2168 7.8736 7.8736 8.1200 8.1200 8.6670 8.6670 10.1117 10.1117 15.5271 15.5271 16.9310 16.9310 17.1211 17.1211 k = 0.5312-0.0180 0.5613 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.2052 5.2052 5.2893 5.2893 5.9908 5.9908 6.7384 6.7384 7.2248 7.2248 7.8961 7.8961 8.1475 8.1475 8.6060 8.6060 10.0861 10.0861 15.6711 15.6711 16.8230 16.8230 17.1740 17.1740 k = 0.5250-0.0144 0.5715 ( 2517 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.2213 5.2213 5.2858 5.2858 6.0097 6.0097 6.7029 6.7029 7.2319 7.2319 7.9171 7.9171 8.1774 8.1774 8.5442 8.5442 10.0656 10.0656 15.8111 15.8111 16.7157 16.7157 17.2316 17.2316 k = 0.5188-0.0108 0.5818 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.2351 5.2351 5.2832 5.2832 6.0265 6.0265 6.6719 6.6719 7.2376 7.2376 7.9361 7.9361 8.2097 8.2097 8.4833 8.4833 10.0500 10.0500 15.9454 15.9454 16.6093 16.6093 17.2914 17.2914 k = 0.5125-0.0072 0.5920 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2455 5.2455 5.2819 5.2819 6.0398 6.0398 6.6474 6.6474 7.2419 7.2419 7.9520 7.9520 8.2443 8.2443 8.4249 8.4249 10.0392 10.0392 16.0719 16.0719 16.5043 16.5043 17.3484 17.3484 k = 0.5062-0.0036 0.6022 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2514 5.2514 5.2821 5.2821 6.0483 6.0483 6.6314 6.6314 7.2445 7.2445 7.9634 7.9634 8.2810 8.2810 8.3717 8.3717 10.0328 10.0328 16.1886 16.1886 16.4013 16.4013 17.3927 17.3927 k = 0.5000-0.0000 0.6124 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2531 5.2531 5.2827 5.2827 6.0512 6.0512 6.6258 6.6258 7.2453 7.2453 7.9677 7.9677 8.3104 8.3104 8.3360 8.3360 10.0307 10.0307 16.2784 16.2784 16.3162 16.3162 17.4104 17.4104 k = 0.5000-0.0000 0.6124 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2531 5.2531 5.2827 5.2827 6.0512 6.0512 6.6258 6.6258 7.2453 7.2453 7.9677 7.9677 8.3104 8.3104 8.3360 8.3360 10.0307 10.0307 16.2784 16.2784 16.3162 16.3162 17.4104 17.4104 k = 0.5000 0.0074 0.6019 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2503 5.2503 5.2800 5.2800 6.0520 6.0520 6.6298 6.6298 7.2434 7.2434 7.9599 7.9599 8.3024 8.3024 8.3548 8.3548 10.0356 10.0356 16.2716 16.2716 16.3111 16.3111 17.4238 17.4238 k = 0.5000 0.0148 0.5914 ( 2508 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5873 -38.5873 5.2400 5.2400 5.2741 5.2741 6.0541 6.0541 6.6412 6.6412 7.2377 7.2377 7.9393 7.9393 8.2899 8.2899 8.3964 8.3964 10.0500 10.0500 16.2457 16.2457 16.3031 16.3031 17.4624 17.4624 k = 0.5000 0.0222 0.5810 ( 2508 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.2196 5.2196 5.2681 5.2681 6.0577 6.0577 6.6596 6.6596 7.2281 7.2281 7.9117 7.9117 8.2749 8.2749 8.4535 8.4535 10.0735 10.0735 16.1988 16.1988 16.2977 16.2977 17.5222 17.5222 k = 0.5000 0.0296 0.5705 ( 2508 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.1894 5.1894 5.2629 5.2629 6.0626 6.0626 6.6838 6.6838 7.2150 7.2150 7.8818 7.8818 8.2565 8.2565 8.5225 8.5225 10.1058 10.1058 16.1370 16.1370 16.2935 16.2935 17.5988 17.5988 k = 0.5000 0.0370 0.5600 ( 2510 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.1512 5.1512 5.2578 5.2578 6.0687 6.0687 6.7128 6.7128 7.1986 7.1986 7.8526 7.8526 8.2346 8.2346 8.6007 8.6007 10.1463 10.1463 16.0656 16.0656 16.2893 16.2893 17.6879 17.6879 k = 0.5000 0.0444 0.5496 ( 2514 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.1067 5.1067 5.2524 5.2524 6.0760 6.0760 6.7452 6.7452 7.1793 7.1793 7.8254 7.8254 8.2097 8.2097 8.6866 8.6866 10.1943 10.1943 15.9882 15.9882 16.2847 16.2847 17.7864 17.7864 k = 0.5000 0.0518 0.5391 ( 2514 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.0572 5.0572 5.2464 5.2464 6.0845 6.0845 6.7798 6.7798 7.1579 7.1579 7.8011 7.8011 8.1823 8.1823 8.7791 8.7791 10.2492 10.2492 15.9073 15.9073 16.2796 16.2796 17.8918 17.8918 k = 0.5000 0.0592 0.5286 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5872 -38.5872 5.0040 5.0040 5.2400 5.2400 6.0940 6.0940 6.8151 6.8151 7.1349 7.1349 7.7798 7.7798 8.1529 8.1529 8.8774 8.8774 10.3102 10.3102 15.8246 15.8246 16.2740 16.2740 18.0023 18.0023 k = 0.5000 0.0666 0.5182 ( 2516 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5881 -38.5881 -38.5871 -38.5871 4.9479 4.9479 5.2331 5.2331 6.1043 6.1043 6.8497 6.8497 7.1119 7.1119 7.7615 7.7615 8.1222 8.1222 8.9812 8.9812 10.3768 10.3768 15.7414 15.7414 16.2680 16.2680 18.1162 18.1162 k = 0.5000 0.0740 0.5077 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5871 -38.5871 4.8897 4.8897 5.2258 5.2258 6.1154 6.1154 6.8811 6.8811 7.0908 7.0908 7.7458 7.7458 8.0907 8.0907 9.0899 9.0899 10.4484 10.4484 15.6586 15.6586 16.2615 16.2615 18.2323 18.2323 k = 0.5000 0.0814 0.4972 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5871 -38.5871 4.8303 4.8303 5.2181 5.2181 6.1270 6.1270 6.9057 6.9057 7.0752 7.0752 7.7326 7.7326 8.0588 8.0588 9.2032 9.2032 10.5244 10.5244 15.5769 15.5769 16.2546 16.2546 18.3491 18.3491 k = 0.5000 0.0888 0.4868 ( 2520 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5870 -38.5870 4.7702 4.7702 5.2101 5.2101 6.1392 6.1392 6.9177 6.9177 7.0708 7.0708 7.7215 7.7215 8.0270 8.0270 9.3208 9.3208 10.6043 10.6043 15.4970 15.4970 16.2473 16.2473 18.4649 18.4649 k = 0.5000 0.0962 0.4763 ( 2514 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5870 -38.5870 4.7098 4.7098 5.2019 5.2019 6.1518 6.1518 6.9140 6.9140 7.0808 7.0808 7.7123 7.7123 7.9957 7.9957 9.4425 9.4425 10.6877 10.6877 15.4192 15.4192 16.2397 16.2397 18.5767 18.5767 k = 0.5000 0.1036 0.4658 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5869 -38.5869 4.6497 4.6497 5.1935 5.1935 6.1644 6.1644 6.8981 6.8981 7.1013 7.1013 7.7046 7.7046 7.9652 7.9652 9.5679 9.5679 10.7740 10.7740 15.3441 15.3441 16.2318 16.2318 18.6463 18.6463 k = 0.5000 0.1110 0.4554 ( 2514 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5869 -38.5869 4.5902 4.5902 5.1851 5.1851 6.1772 6.1772 6.8760 6.8760 7.1268 7.1268 7.6983 7.6983 7.9360 7.9360 9.6967 9.6967 10.8630 10.8630 15.2719 15.2719 16.2235 16.2235 18.7060 18.7060 k = 0.5000 0.1184 0.4449 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5868 -38.5868 4.5316 4.5316 5.1766 5.1766 6.1898 6.1898 6.8511 6.8511 7.1536 7.1536 7.6931 7.6931 7.9084 7.9084 9.8287 9.8287 10.9541 10.9541 15.2031 15.2031 16.2149 16.2149 18.7638 18.7638 k = 0.5000 0.1258 0.4344 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5868 -38.5868 4.4741 4.4741 5.1682 5.1682 6.2021 6.2021 6.8252 6.8252 7.1800 7.1800 7.6886 7.6886 7.8827 7.8827 9.9635 9.9635 11.0469 11.0469 15.1380 15.1380 16.2059 16.2059 18.8166 18.8166 k = 0.5000 0.1332 0.4240 ( 2522 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5867 -38.5867 4.4181 4.4181 5.1598 5.1598 6.2141 6.2141 6.7994 6.7994 7.2050 7.2050 7.6848 7.6848 7.8592 7.8592 10.1009 10.1009 11.1411 11.1411 15.0769 15.0769 16.1966 16.1966 18.8125 18.8125 k = 0.5000 0.1406 0.4135 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5867 -38.5867 4.3637 4.3637 5.1515 5.1515 6.2255 6.2255 6.7743 6.7743 7.2280 7.2280 7.6812 7.6812 7.8384 7.8384 10.2404 10.2404 11.2363 11.2363 15.0203 15.0203 16.1868 16.1868 18.7169 18.7169 k = 0.5000 0.1480 0.4030 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5866 -38.5866 4.3112 4.3112 5.1435 5.1435 6.2363 6.2363 6.7502 6.7502 7.2487 7.2487 7.6776 7.6776 7.8207 7.8207 10.3818 10.3818 11.3320 11.3320 14.9685 14.9685 16.1764 16.1764 18.5850 18.5850 k = 0.5000 0.1554 0.3925 ( 2520 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5881 -38.5881 -38.5866 -38.5866 4.2606 4.2606 5.1356 5.1356 6.2463 6.2463 6.7273 6.7273 7.2669 7.2669 7.6735 7.6735 7.8063 7.8063 10.5246 10.5246 11.4277 11.4277 14.9220 14.9220 16.1655 16.1655 18.4326 18.4326 k = 0.5000 0.1628 0.3821 ( 2516 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5865 -38.5865 4.2122 4.2122 5.1280 5.1280 6.2554 6.2554 6.7059 6.7059 7.2826 7.2826 7.6689 7.6689 7.7956 7.7956 10.6684 10.6684 11.5230 11.5230 14.8811 14.8811 16.1538 16.1538 18.2689 18.2689 k = 0.5000 0.1702 0.3716 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5865 -38.5865 4.1660 4.1660 5.1206 5.1206 6.2634 6.2634 6.6861 6.6861 7.2958 7.2958 7.6635 7.6635 7.7886 7.7886 10.8128 10.8128 11.6173 11.6173 14.8464 14.8464 16.1412 16.1412 18.0992 18.0992 k = 0.5000 0.1776 0.3611 ( 2510 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5864 -38.5864 4.1221 4.1221 5.1136 5.1136 6.2703 6.2703 6.6681 6.6681 7.3065 7.3065 7.6575 7.6575 7.7849 7.7849 10.9571 10.9571 11.7100 11.7100 14.8184 14.8184 16.1275 16.1275 17.9266 17.9266 k = 0.5000 0.1850 0.3507 ( 2510 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5864 -38.5864 4.0807 4.0807 5.1069 5.1069 6.2761 6.2761 6.6518 6.6518 7.3149 7.3149 7.6512 7.6512 7.7840 7.7840 11.1008 11.1008 11.8006 11.8006 14.7975 14.7975 16.1126 16.1126 17.7530 17.7530 k = 0.5000 0.1925 0.3402 ( 2516 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5881 -38.5881 -38.5864 -38.5864 4.0418 4.0418 5.1005 5.1005 6.2806 6.2806 6.6374 6.6374 7.3212 7.3212 7.6448 7.6448 7.7854 7.7854 11.2433 11.2433 11.8884 11.8884 14.7844 14.7844 16.0961 16.0961 17.5795 17.5795 k = 0.5000 0.1999 0.3297 ( 2506 PWs) bands (ev): -74.2247 -74.2247 -43.0537 -43.0537 -38.5881 -38.5881 -38.5863 -38.5863 4.0055 4.0055 5.0945 5.0945 6.2840 6.2840 6.6249 6.6249 7.3257 7.3257 7.6390 7.6390 7.7884 7.7884 11.3837 11.3837 11.9729 11.9729 14.7796 14.7796 16.0780 16.0780 17.4072 17.4072 k = 0.5000 0.2073 0.3193 ( 2510 PWs) bands (ev): -74.2247 -74.2247 -43.0537 -43.0537 -38.5882 -38.5882 -38.5863 -38.5863 3.9719 3.9719 5.0890 5.0890 6.2862 6.2862 6.6141 6.6141 7.3287 7.3287 7.6335 7.6335 7.7926 7.7926 11.5210 11.5210 12.0533 12.0533 14.7836 14.7836 16.0577 16.0577 17.2368 17.2368 k = 0.5000 0.2147 0.3088 ( 2514 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5862 -38.5862 3.9411 3.9411 5.0838 5.0838 6.2873 6.2873 6.6050 6.6050 7.3305 7.3305 7.6287 7.6287 7.7974 7.7974 11.6541 11.6541 12.1291 12.1291 14.7969 14.7969 16.0352 16.0352 17.0689 17.0689 k = 0.5000 0.2221 0.2983 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5862 -38.5862 3.9130 3.9130 5.0791 5.0791 6.2876 6.2876 6.5975 6.5975 7.3313 7.3313 7.6245 7.6245 7.8026 7.8026 11.7818 11.7818 12.1999 12.1999 14.8198 14.8198 16.0103 16.0103 16.9041 16.9041 k = 0.5000 0.2295 0.2879 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5862 -38.5862 3.8878 3.8878 5.0749 5.0749 6.2872 6.2872 6.5914 6.5914 7.3314 7.3314 7.6210 7.6210 7.8078 7.8078 11.9024 11.9024 12.2653 12.2653 14.8525 14.8525 15.9830 15.9830 16.7432 16.7432 k = 0.5000 0.2369 0.2774 ( 2508 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8654 3.8654 5.0711 5.0711 6.2863 6.2863 6.5866 6.5866 7.3310 7.3310 7.6181 7.6181 7.8129 7.8129 12.0141 12.0141 12.3252 12.3252 14.8950 14.8950 15.9534 15.9534 16.5870 16.5870 k = 0.5000 0.2443 0.2669 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8460 3.8460 5.0678 5.0678 6.2850 6.2850 6.5828 6.5828 7.3304 7.3304 7.6156 7.6156 7.8175 7.8175 12.1145 12.1145 12.3798 12.3798 14.9470 14.9470 15.9222 15.9222 16.4364 16.4364 k = 0.5000 0.2517 0.2565 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8295 3.8295 5.0650 5.0650 6.2835 6.2835 6.5799 6.5799 7.3296 7.3296 7.6136 7.6136 7.8217 7.8217 12.2013 12.2013 12.4293 12.4293 15.0076 15.0076 15.8901 15.8901 16.2931 16.2931 k = 0.5000 0.2591 0.2460 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8160 3.8160 5.0627 5.0627 6.2821 6.2821 6.5777 6.5777 7.3288 7.3288 7.6121 7.6121 7.8253 7.8253 12.2722 12.2722 12.4739 12.4739 15.0754 15.0754 15.8578 15.8578 16.1594 16.1594 k = 0.5000 0.2665 0.2355 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.8054 3.8054 5.0609 5.0609 6.2809 6.2809 6.5762 6.5762 7.3281 7.3281 7.6109 7.6109 7.8282 7.8282 12.3259 12.3259 12.5127 12.5127 15.1474 15.1474 15.8255 15.8255 16.0403 16.0403 k = 0.5000 0.2739 0.2251 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7979 3.7979 5.0596 5.0596 6.2799 6.2799 6.5751 6.5751 7.3275 7.3275 7.6101 7.6101 7.8303 7.8303 12.3627 12.3627 12.5435 12.5435 15.2180 15.2180 15.7910 15.7910 15.9456 15.9456 k = 0.5000 0.2813 0.2146 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7934 3.7934 5.0589 5.0589 6.2793 6.2793 6.5745 6.5745 7.3272 7.3272 7.6097 7.6097 7.8316 7.8316 12.3839 12.3839 12.5636 12.5636 15.2753 15.2753 15.7543 15.7543 15.8891 15.8891 k = 0.5000 0.2887 0.2041 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7919 3.7919 5.0586 5.0586 6.2790 6.2790 6.5743 6.5743 7.3270 7.3270 7.6095 7.6095 7.8320 7.8320 12.3908 12.3908 12.5706 12.5706 15.2989 15.2989 15.7357 15.7357 15.8719 15.8719 k = 0.5000 0.2887 0.2041 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7919 3.7919 5.0586 5.0586 6.2790 6.2790 6.5743 6.5743 7.3270 7.3270 7.6095 7.6095 7.8320 7.8320 12.3908 12.3908 12.5706 12.5706 15.2989 15.2989 15.7357 15.7357 15.8719 15.8719 k = 0.4963 0.2866 0.2161 ( 2512 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7933 3.7933 5.0589 5.0589 6.2793 6.2793 6.5745 6.5745 7.3272 7.3272 7.6097 7.6097 7.8316 7.8316 12.3840 12.3840 12.5637 12.5637 15.2756 15.2756 15.7541 15.7541 15.8888 15.8888 k = 0.4926 0.2844 0.2281 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.7978 3.7978 5.0596 5.0596 6.2799 6.2799 6.5751 6.5751 7.3275 7.3275 7.6101 7.6101 7.8303 7.8303 12.3630 12.3630 12.5439 12.5439 15.2188 15.2188 15.7908 15.7908 15.9444 15.9444 k = 0.4890 0.2823 0.2401 ( 2507 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5860 -38.5860 3.8053 3.8053 5.0609 5.0609 6.2809 6.2809 6.5761 6.5761 7.3281 7.3281 7.6110 7.6110 7.8283 7.8283 12.3267 12.3267 12.5135 12.5135 15.1483 15.1483 15.8270 15.8270 16.0365 16.0365 k = 0.4853 0.2802 0.2522 ( 2509 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8157 3.8157 5.0627 5.0627 6.2821 6.2821 6.5776 6.5776 7.3288 7.3288 7.6121 7.6121 7.8254 7.8254 12.2732 12.2732 12.4758 12.4758 15.0753 15.0753 15.8638 15.8638 16.1508 16.1508 k = 0.4816 0.2781 0.2642 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8290 3.8290 5.0649 5.0649 6.2835 6.2835 6.5798 6.5798 7.3296 7.3296 7.6135 7.6135 7.8219 7.8219 12.2020 12.2020 12.4334 12.4334 15.0044 15.0044 15.9050 15.9050 16.2762 16.2762 k = 0.4779 0.2759 0.2762 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8453 3.8453 5.0677 5.0677 6.2849 6.2849 6.5826 6.5826 7.3304 7.3304 7.6154 7.6154 7.8178 7.8178 12.1140 12.1140 12.3877 12.3877 14.9377 14.9377 15.9519 15.9519 16.4068 16.4068 k = 0.4743 0.2738 0.2882 ( 2510 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5861 -38.5861 3.8645 3.8645 5.0710 5.0710 6.2862 6.2862 6.5863 6.5863 7.3312 7.3312 7.6176 7.6176 7.8132 7.8132 12.0112 12.0112 12.3390 12.3390 14.8756 14.8756 16.0049 16.0049 16.5390 16.5390 k = 0.4706 0.2717 0.3002 ( 2511 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5862 -38.5862 3.8865 3.8865 5.0747 5.0747 6.2872 6.2872 6.5911 6.5911 7.3318 7.3318 7.6201 7.6201 7.8084 7.8084 11.8963 11.8963 12.2873 12.2873 14.8182 14.8182 16.0636 16.0636 16.6706 16.6706 k = 0.4669 0.2696 0.3122 ( 2517 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5862 -38.5862 3.9114 3.9114 5.0789 5.0789 6.2876 6.2876 6.5969 6.5969 7.3320 7.3320 7.6227 7.6227 7.8036 7.8036 11.7714 11.7714 12.2326 12.2326 14.7651 14.7651 16.1276 16.1276 16.8008 16.8008 k = 0.4632 0.2674 0.3242 ( 2515 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5862 -38.5862 3.9391 3.9391 5.0835 5.0835 6.2873 6.2873 6.6042 6.6042 7.3320 7.3320 7.6254 7.6254 7.7993 7.7993 11.6388 11.6388 12.1751 12.1751 14.7160 14.7160 16.1965 16.1965 16.9292 16.9292 k = 0.4596 0.2653 0.3362 ( 2514 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5863 -38.5863 3.9695 3.9695 5.0886 5.0886 6.2862 6.2862 6.6129 6.6129 7.3315 7.3315 7.6276 7.6276 7.7958 7.7958 11.5001 11.5001 12.1148 12.1148 14.6704 14.6704 16.2698 16.2698 17.0562 17.0562 k = 0.4559 0.2632 0.3482 ( 2514 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5882 -38.5882 -38.5863 -38.5863 4.0027 4.0027 5.0942 5.0942 6.2840 6.2840 6.6232 6.6232 7.3304 7.3304 7.6291 7.6291 7.7938 7.7938 11.3570 11.3570 12.0522 12.0522 14.6279 14.6279 16.3468 16.3468 17.1825 17.1825 k = 0.4522 0.2611 0.3602 ( 2516 PWs) bands (ev): -74.2248 -74.2248 -43.0537 -43.0537 -38.5881 -38.5881 -38.5863 -38.5863 4.0384 4.0384 5.1001 5.1001 6.2807 6.2807 6.6352 6.6352 7.3287 7.3287 7.6292 7.6292 7.7940 7.7940 11.2107 11.2107 11.9876 11.9876 14.5883 14.5883 16.4270 16.4270 17.3088 17.3088 k = 0.4485 0.2590 0.3722 ( 2515 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5881 -38.5881 -38.5864 -38.5864 4.0767 4.0767 5.1065 5.1065 6.2760 6.2760 6.6490 6.6490 7.3262 7.3262 7.6274 7.6274 7.7970 7.7970 11.0625 11.0625 11.9212 11.9212 14.5511 14.5511 16.5101 16.5101 17.4358 17.4358 k = 0.4449 0.2568 0.3842 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5864 -38.5864 4.1175 4.1175 5.1133 5.1133 6.2699 6.2699 6.6644 6.6644 7.3230 7.3230 7.6234 7.6234 7.8033 7.8033 10.9134 10.9134 11.8534 11.8534 14.5162 14.5162 16.5953 16.5953 17.5642 17.5642 k = 0.4412 0.2547 0.3962 ( 2512 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5865 -38.5865 4.1606 4.1606 5.1205 5.1205 6.2624 6.2624 6.6815 6.6815 7.3191 7.3191 7.6171 7.6171 7.8130 7.8130 10.7642 10.7642 11.7845 11.7845 14.4833 14.4833 16.6823 16.6823 17.6942 17.6942 k = 0.4375 0.2526 0.4082 ( 2518 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5881 -38.5881 -38.5865 -38.5865 4.2059 4.2059 5.1281 5.1281 6.2533 6.2533 6.7001 6.7001 7.3144 7.3144 7.6085 7.6085 7.8260 7.8260 10.6159 10.6159 11.7147 11.7147 14.4523 14.4523 16.7706 16.7706 17.8260 17.8260 k = 0.4338 0.2505 0.4203 ( 2518 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5881 -38.5881 -38.5866 -38.5866 4.2534 4.2534 5.1361 5.1361 6.2427 6.2427 6.7202 6.7202 7.3091 7.3091 7.5982 7.5982 7.8419 7.8419 10.4692 10.4692 11.6444 11.6444 14.4230 14.4230 16.8597 16.8597 17.9592 17.9592 k = 0.4301 0.2483 0.4323 ( 2521 PWs) bands (ev): -74.2248 -74.2248 -43.0538 -43.0538 -38.5881 -38.5881 -38.5866 -38.5866 4.3028 4.3028 5.1446 5.1446 6.2305 6.2305 6.7415 6.7415 7.3032 7.3032 7.5865 7.5865 7.8604 7.8604 10.3249 10.3249 11.5739 11.5739 14.3953 14.3953 16.9492 16.9492 18.0923 18.0923 k = 0.4265 0.2462 0.4443 ( 2519 PWs) bands (ev): -74.2247 -74.2247 -43.0538 -43.0538 -38.5881 -38.5881 -38.5867 -38.5867 4.3540 4.3540 5.1535 5.1535 6.2166 6.2166 6.7641 6.7641 7.2970 7.2970 7.5737 7.5737 7.8810 7.8810 10.1838 10.1838 11.5033 11.5033 14.3691 14.3691 17.0385 17.0385 18.2201 18.2201 k = 0.4228 0.2441 0.4563 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5867 -38.5867 4.4067 4.4067 5.1629 5.1629 6.2009 6.2009 6.7874 6.7874 7.2905 7.2905 7.5603 7.5603 7.9031 7.9031 10.0466 10.0466 11.4328 11.4328 14.3443 14.3443 17.1273 17.1273 18.3151 18.3151 k = 0.4191 0.2420 0.4683 ( 2527 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5868 -38.5868 4.4607 4.4607 5.1728 5.1728 6.1831 6.1831 6.8116 6.8116 7.2841 7.2841 7.5467 7.5467 7.9262 7.9262 9.9142 9.9142 11.3629 11.3629 14.3209 14.3209 17.2151 17.2151 18.2950 18.2950 k = 0.4154 0.2399 0.4803 ( 2527 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5868 -38.5868 4.5157 4.5157 5.1833 5.1833 6.1632 6.1632 6.8361 6.8361 7.2781 7.2781 7.5331 7.5331 7.9499 7.9499 9.7873 9.7873 11.2935 11.2935 14.2987 14.2987 17.3016 17.3016 18.1939 18.1939 k = 0.4118 0.2377 0.4923 ( 2529 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5869 -38.5869 4.5712 4.5712 5.1945 5.1945 6.1409 6.1409 6.8609 6.8609 7.2728 7.2728 7.5198 7.5198 7.9733 7.9733 9.6670 9.6670 11.2251 11.2251 14.2777 14.2777 17.3862 17.3862 18.0728 18.0728 k = 0.4081 0.2356 0.5043 ( 2525 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5869 -38.5869 4.6269 4.6269 5.2066 5.2066 6.1162 6.1162 6.8854 6.8854 7.2688 7.2688 7.5073 7.5073 7.9957 7.9957 9.5544 9.5544 11.1577 11.1577 14.2579 14.2579 17.4687 17.4687 17.9455 17.9455 k = 0.4044 0.2335 0.5163 ( 2523 PWs) bands (ev): -74.2247 -74.2247 -43.0539 -43.0539 -38.5881 -38.5881 -38.5869 -38.5869 4.6821 4.6821 5.2196 5.2196 6.0887 6.0887 6.9094 6.9094 7.2665 7.2665 7.4958 7.4958 8.0160 8.0160 9.4507 9.4507 11.0916 11.0916 14.2392 14.2392 17.5487 17.5487 17.8161 17.8161 k = 0.4007 0.2314 0.5283 ( 2529 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5870 -38.5870 4.7364 4.7364 5.2337 5.2337 6.0582 6.0582 6.9324 6.9324 7.2666 7.2666 7.4856 7.4856 8.0330 8.0330 9.3573 9.3573 11.0269 11.0269 14.2215 14.2215 17.6254 17.6254 17.6865 17.6865 k = 0.3971 0.2292 0.5403 ( 2529 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5870 -38.5870 4.7889 4.7889 5.2490 5.2490 6.0249 6.0249 6.9541 6.9541 7.2695 7.2695 7.4772 7.4772 8.0454 8.0454 9.2757 9.2757 10.9640 10.9640 14.2049 14.2049 17.5562 17.5562 17.7004 17.7004 k = 0.3934 0.2271 0.5523 ( 2527 PWs) bands (ev): -74.2248 -74.2248 -43.0539 -43.0539 -38.5881 -38.5881 -38.5870 -38.5870 4.8388 4.8388 5.2656 5.2656 5.9888 5.9888 6.9742 6.9742 7.2757 7.2757 7.4710 7.4710 8.0518 8.0518 9.2076 9.2076 10.9030 10.9030 14.1893 14.1893 17.4278 17.4278 17.7712 17.7712 k = 0.3897 0.2250 0.5643 ( 2529 PWs) bands (ev): -74.2248 -74.2248 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 4.8852 4.8852 5.2833 5.2833 5.9506 5.9506 6.9924 6.9924 7.2852 7.2852 7.4676 7.4676 8.0506 8.0506 9.1545 9.1545 10.8442 10.8442 14.1746 14.1746 17.3007 17.3007 17.8387 17.8387 k = 0.3860 0.2229 0.5764 ( 2525 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 4.9274 4.9274 5.3014 5.3014 5.9111 5.9111 7.0088 7.0088 7.2979 7.2979 7.4677 7.4677 8.0410 8.0410 9.1172 9.1172 10.7877 10.7877 14.1609 14.1609 17.1753 17.1753 17.9029 17.9029 k = 0.3824 0.2208 0.5884 ( 2523 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 4.9644 4.9644 5.3184 5.3184 5.8722 5.8722 7.0232 7.0232 7.3135 7.3135 7.4721 7.4721 8.0227 8.0227 9.0961 9.0961 10.7338 10.7338 14.1481 14.1481 17.0517 17.0517 17.9636 17.9636 k = 0.3787 0.2186 0.6004 ( 2521 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 4.9959 4.9959 5.3317 5.3317 5.8368 5.8368 7.0355 7.0355 7.3312 7.3312 7.4818 7.4818 7.9963 7.9963 9.0906 9.0906 10.6827 10.6827 14.1361 14.1361 16.9302 16.9302 18.0210 18.0210 k = 0.3750 0.2165 0.6124 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 5.0214 5.0214 5.3376 5.3376 5.8087 5.8087 7.0458 7.0458 7.3504 7.3504 7.4977 7.4977 7.9629 7.9629 9.0994 9.0994 10.6347 10.6347 14.1250 14.1250 16.8108 16.8108 18.0752 18.0752 k = 0.6250-0.0722 0.4082 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 5.0214 5.0214 5.3376 5.3376 5.8087 5.8087 7.0458 7.0458 7.3504 7.3504 7.4977 7.4977 7.9629 7.9629 9.0994 9.0994 10.6347 10.6347 14.1250 14.1250 16.8108 16.8108 18.0752 18.0752 k = 0.6188-0.0830 0.4082 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 5.0569 5.0569 5.3395 5.3395 5.7698 5.7698 7.0612 7.0612 7.3831 7.3831 7.5339 7.5339 7.9029 7.9029 9.1263 9.1263 10.5570 10.5570 14.1071 14.1071 16.6115 16.6115 18.1657 18.1657 k = 0.6125-0.0938 0.4082 ( 2526 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5882 -38.5882 -38.5870 -38.5870 5.0878 5.0878 5.3419 5.3419 5.7308 5.7308 7.0761 7.0761 7.4130 7.4130 7.5770 7.5770 7.8473 7.8473 9.1545 9.1545 10.4817 10.4817 14.0898 14.0898 16.4158 16.4158 18.2581 18.2581 k = 0.6062-0.1046 0.4082 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5883 -38.5883 -38.5870 -38.5870 5.1144 5.1144 5.3449 5.3449 5.6924 5.6924 7.0902 7.0902 7.4391 7.4391 7.6252 7.6252 7.7980 7.7980 9.1842 9.1842 10.4089 10.4089 14.0730 14.0730 16.2244 16.2244 18.3521 18.3521 k = 0.6000-0.1155 0.4082 ( 2522 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5883 -38.5883 -38.5870 -38.5870 5.1371 5.1371 5.3484 5.3484 5.6547 5.6547 7.1033 7.1033 7.4605 7.4605 7.6700 7.6700 7.7633 7.7633 9.2152 9.2152 10.3387 10.3387 14.0563 14.0563 16.0380 16.0380 18.4475 18.4475 k = 0.5938-0.1263 0.4082 ( 2526 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5883 -38.5883 -38.5870 -38.5870 5.1563 5.1563 5.3523 5.3523 5.6182 5.6182 7.1152 7.1152 7.4756 7.4756 7.6789 7.6789 7.7760 7.7760 9.2478 9.2478 10.2713 10.2713 14.0397 14.0397 15.8574 15.8574 18.5442 18.5442 k = 0.5875-0.1371 0.4082 ( 2526 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5883 -38.5883 -38.5870 -38.5870 5.1724 5.1724 5.3564 5.3564 5.5831 5.5831 7.1260 7.1260 7.4820 7.4820 7.6604 7.6604 7.8293 7.8293 9.2818 9.2818 10.2068 10.2068 14.0227 14.0227 15.6834 15.6834 18.6418 18.6418 k = 0.5813-0.1479 0.4082 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5883 -38.5883 -38.5870 -38.5870 5.1859 5.1859 5.3609 5.3609 5.5498 5.5498 7.1356 7.1356 7.4766 7.4766 7.6484 7.6484 7.8912 7.8912 9.3173 9.3173 10.1455 10.1455 14.0051 14.0051 15.5169 15.5169 18.7400 18.7400 k = 0.5750-0.1588 0.4082 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5870 -38.5870 5.1969 5.1969 5.3654 5.3654 5.5183 5.5183 7.1437 7.1437 7.4598 7.4598 7.6481 7.6481 7.9543 7.9543 9.3541 9.3541 10.0874 10.0874 13.9865 13.9865 15.3589 15.3589 18.8382 18.8382 k = 0.5687-0.1696 0.4082 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5870 -38.5870 5.2058 5.2058 5.3698 5.3698 5.4891 5.4891 7.1504 7.1504 7.4365 7.4365 7.6566 7.6566 8.0162 8.0162 9.3923 9.3923 10.0329 10.0329 13.9665 13.9665 15.2107 15.2107 18.9361 18.9361 k = 0.5625-0.1804 0.4082 ( 2518 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2130 5.2130 5.3741 5.3741 5.4624 5.4624 7.1553 7.1553 7.4111 7.4111 7.6696 7.6696 8.0756 8.0756 9.4313 9.4313 9.9823 9.9823 13.9447 13.9447 15.0734 15.0734 19.0328 19.0328 k = 0.5563-0.1912 0.4082 ( 2506 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2188 5.2188 5.3777 5.3777 5.4386 5.4386 7.1586 7.1586 7.3868 7.3868 7.6847 7.6847 8.1313 8.1313 9.4707 9.4707 9.9357 9.9357 13.9208 13.9208 14.9484 14.9484 19.1276 19.1276 k = 0.5500-0.2021 0.4082 ( 2506 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2231 5.2231 5.3797 5.3797 5.4187 5.4187 7.1598 7.1598 7.3648 7.3648 7.7002 7.7002 8.1823 8.1823 9.5096 9.5096 9.8937 9.8937 13.8943 13.8943 14.8369 14.8369 19.2195 19.2195 k = 0.5437-0.2129 0.4082 ( 2510 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2264 5.2264 5.3772 5.3772 5.4056 5.4056 7.1592 7.1592 7.3461 7.3461 7.7152 7.7152 8.2281 8.2281 9.5472 9.5472 9.8566 9.8566 13.8656 13.8656 14.7400 14.7400 19.3071 19.3071 k = 0.5375-0.2237 0.4082 ( 2506 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2287 5.2287 5.3678 5.3678 5.4018 5.4018 7.1569 7.1569 7.3311 7.3311 7.7293 7.7293 8.2683 8.2683 9.5819 9.5819 9.8252 9.8252 13.8351 13.8351 14.6581 14.6581 19.3891 19.3891 k = 0.5312-0.2345 0.4082 ( 2502 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2303 5.2303 5.3562 5.3562 5.4025 5.4025 7.1533 7.1533 7.3198 7.3198 7.7418 7.7418 8.3025 8.3025 9.6120 9.6120 9.8002 9.8002 13.8040 13.8040 14.5913 14.5913 19.4637 19.4637 k = 0.5250-0.2454 0.4082 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5884 -38.5884 -38.5869 -38.5869 5.2312 5.2312 5.3456 5.3456 5.4043 5.4043 7.1490 7.1490 7.3115 7.3115 7.7526 7.7526 8.3306 8.3306 9.6354 9.6354 9.7828 9.7828 13.7743 13.7743 14.5389 14.5389 19.5289 19.5289 k = 0.5188-0.2562 0.4082 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5885 -38.5885 -38.5869 -38.5869 5.2317 5.2317 5.3372 5.3372 5.4061 5.4061 7.1447 7.1447 7.3058 7.3058 7.7612 7.7612 8.3524 8.3524 9.6506 9.6506 9.7736 9.7736 13.7480 13.7480 14.4999 14.4999 19.5827 19.5827 k = 0.5125-0.2670 0.4082 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5885 -38.5885 -38.5869 -38.5869 5.2319 5.2319 5.3312 5.3312 5.4075 5.4075 7.1412 7.1412 7.3022 7.3022 7.7675 7.7675 8.3680 8.3680 9.6579 9.6579 9.7713 9.7713 13.7274 13.7274 14.4732 14.4732 19.6230 19.6230 k = 0.5062-0.2778 0.4082 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5885 -38.5885 -38.5868 -38.5868 5.2319 5.2319 5.3276 5.3276 5.4084 5.4084 7.1388 7.1388 7.3002 7.3002 7.7714 7.7714 8.3773 8.3773 9.6602 9.6602 9.7723 9.7723 13.7142 13.7142 14.4576 14.4576 19.6480 19.6480 k = 0.5000-0.2887 0.4082 ( 2498 PWs) bands (ev): -74.2247 -74.2247 -43.0540 -43.0540 -38.5885 -38.5885 -38.5868 -38.5868 5.2319 5.2319 5.3264 5.3264 5.4087 5.4087 7.1380 7.1380 7.2996 7.2996 7.7727 7.7727 8.3805 8.3805 9.6606 9.6606 9.7731 9.7731 13.7097 13.7097 14.4525 14.4525 19.6565 19.6565 Writing output data file Al2Pd.save init_run : 0.22s CPU 0.35s WALL ( 1 calls) electrons : 70.04s CPU 71.44s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 70.04s CPU 71.44s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.05s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.03s WALL ( 365 calls) cegterg : 63.23s CPU 64.29s WALL ( 412 calls) Called by sum_band: Called by *egterg: h_psi : 40.62s CPU 41.44s WALL ( 6719 calls) s_psi : 1.88s CPU 1.79s WALL ( 6719 calls) g_psi : 0.10s CPU 0.08s WALL ( 5942 calls) cdiaghg : 21.23s CPU 21.63s WALL ( 6307 calls) cegterg:over : 1.60s CPU 1.72s WALL ( 5942 calls) cegterg:upda : 1.20s CPU 1.23s WALL ( 5942 calls) cegterg:last : 0.81s CPU 0.81s WALL ( 1153 calls) cdiaghg:chol : 1.10s CPU 1.13s WALL ( 6307 calls) cdiaghg:inve : 0.45s CPU 0.47s WALL ( 6307 calls) cdiaghg:para : 1.28s CPU 1.31s WALL ( 12614 calls) Called by h_psi: h_psi:vloc : 36.68s CPU 37.38s WALL ( 6719 calls) h_psi:vnl : 3.89s CPU 4.01s WALL ( 6719 calls) add_vuspsi : 2.26s CPU 2.26s WALL ( 6719 calls) General routines calbec : 1.60s CPU 1.74s WALL ( 6719 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 33.94s CPU 34.64s WALL ( 462848 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.10s CPU 0.11s WALL ( 730 calls) Parallel routines fft_scatter : 11.80s CPU 12.07s WALL ( 462871 calls) PWSCF : 1m19.94s CPU 1m32.09s WALL This run was terminated on: 18:32:20 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=