Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:16: 0 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: ./GaFe2Co.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized file Ga.rel-pbe-dnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D 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 35 35 10 855 855 135 Max 36 36 11 863 863 139 Sum 1285 1285 379 30923 30923 4909 bravais-lattice index = 14 lattice parameter (alat) = 7.7061 a.u. unit-cell volume = 323.5835 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 46.00 number of Kohn-Sham states= 56 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.706085 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 Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 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 Co read from file: /users/gautes/Pseudo/Co.rel-pbe-oncvpsp.UPF MD5 check sum: 638ceb3e57836b9ea4bada7149e48805 Pseudo is Norm-conserving, Zval = 17.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1388 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 PseudoPot. # 3 for Ga read from file: /users/gautes/Pseudo/Ga.rel-pbe-dnl-rrkjus_psl.1.0.0.UPF MD5 check sum: a45069c11dc40ba088a6a50723da268c Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1205 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 Fe 8.00 55.84500 Fe( 1.00) Co 17.00 58.93320 Co( 1.00) Ga 13.00 69.72300 Ga( 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= 366 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 2) = ( 0.0090909 -0.0052486 0.0074227), wk = 0.0027322 k( 3) = ( 0.0181818 -0.0104973 0.0148454), wk = 0.0027322 k( 4) = ( 0.0272727 -0.0157459 0.0222681), wk = 0.0027322 k( 5) = ( 0.0363636 -0.0209946 0.0296908), wk = 0.0027322 k( 6) = ( 0.0454546 -0.0262432 0.0371135), wk = 0.0027322 k( 7) = ( 0.0545455 -0.0314918 0.0445362), wk = 0.0027322 k( 8) = ( 0.0636364 -0.0367405 0.0519589), wk = 0.0027322 k( 9) = ( 0.0727273 -0.0419891 0.0593816), wk = 0.0027322 k( 10) = ( 0.0818182 -0.0472377 0.0668043), wk = 0.0027322 k( 11) = ( 0.0909091 -0.0524864 0.0742270), wk = 0.0027322 k( 12) = ( 0.1000000 -0.0577350 0.0816497), wk = 0.0027322 k( 13) = ( 0.1090909 -0.0629837 0.0890724), wk = 0.0027322 k( 14) = ( 0.1181818 -0.0682323 0.0964951), wk = 0.0027322 k( 15) = ( 0.1272727 -0.0734809 0.1039177), wk = 0.0027322 k( 16) = ( 0.1363636 -0.0787296 0.1113404), wk = 0.0027322 k( 17) = ( 0.1454545 -0.0839782 0.1187631), wk = 0.0027322 k( 18) = ( 0.1545455 -0.0892269 0.1261858), wk = 0.0027322 k( 19) = ( 0.1636364 -0.0944755 0.1336085), wk = 0.0027322 k( 20) = ( 0.1727273 -0.0997241 0.1410312), wk = 0.0027322 k( 21) = ( 0.1818182 -0.1049728 0.1484539), wk = 0.0027322 k( 22) = ( 0.1909091 -0.1102214 0.1558766), wk = 0.0027322 k( 23) = ( 0.2000000 -0.1154701 0.1632993), wk = 0.0027322 k( 24) = ( 0.2090909 -0.1207187 0.1707220), wk = 0.0027322 k( 25) = ( 0.2181818 -0.1259673 0.1781447), wk = 0.0027322 k( 26) = ( 0.2272727 -0.1312160 0.1855674), wk = 0.0027322 k( 27) = ( 0.2363636 -0.1364646 0.1929901), wk = 0.0027322 k( 28) = ( 0.2454545 -0.1417133 0.2004128), wk = 0.0027322 k( 29) = ( 0.2545455 -0.1469619 0.2078355), wk = 0.0027322 k( 30) = ( 0.2636364 -0.1522105 0.2152582), wk = 0.0027322 k( 31) = ( 0.2727273 -0.1574592 0.2226809), wk = 0.0027322 k( 32) = ( 0.2818182 -0.1627078 0.2301036), wk = 0.0027322 k( 33) = ( 0.2909091 -0.1679564 0.2375263), wk = 0.0027322 k( 34) = ( 0.3000000 -0.1732051 0.2449490), wk = 0.0027322 k( 35) = ( 0.3090909 -0.1784537 0.2523717), wk = 0.0027322 k( 36) = ( 0.3181818 -0.1837024 0.2597944), wk = 0.0027322 k( 37) = ( 0.3272727 -0.1889510 0.2672171), wk = 0.0027322 k( 38) = ( 0.3363636 -0.1941996 0.2746398), wk = 0.0027322 k( 39) = ( 0.3454546 -0.1994483 0.2820625), wk = 0.0027322 k( 40) = ( 0.3545454 -0.2046969 0.2894851), wk = 0.0027322 k( 41) = ( 0.3636364 -0.2099456 0.2969078), wk = 0.0027322 k( 42) = ( 0.3727273 -0.2151942 0.3043305), wk = 0.0027322 k( 43) = ( 0.3818182 -0.2204428 0.3117532), wk = 0.0027322 k( 44) = ( 0.3909091 -0.2256915 0.3191759), wk = 0.0027322 k( 45) = ( 0.4000000 -0.2309401 0.3265986), wk = 0.0027322 k( 46) = ( 0.4090909 -0.2361887 0.3340213), wk = 0.0027322 k( 47) = ( 0.4181818 -0.2414374 0.3414440), wk = 0.0027322 k( 48) = ( 0.4272727 -0.2466860 0.3488667), wk = 0.0027322 k( 49) = ( 0.4363636 -0.2519347 0.3562894), wk = 0.0027322 k( 50) = ( 0.4454546 -0.2571833 0.3637121), wk = 0.0027322 k( 51) = ( 0.4545455 -0.2624319 0.3711348), wk = 0.0027322 k( 52) = ( 0.4636364 -0.2676806 0.3785575), wk = 0.0027322 k( 53) = ( 0.4727273 -0.2729292 0.3859802), wk = 0.0027322 k( 54) = ( 0.4818182 -0.2781779 0.3934029), wk = 0.0027322 k( 55) = ( 0.4909091 -0.2834265 0.4008256), wk = 0.0027322 k( 56) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0027322 k( 57) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0027322 k( 58) = ( 0.5000000 -0.2783653 0.4155384), wk = 0.0027322 k( 59) = ( 0.5000000 -0.2680555 0.4228286), wk = 0.0027322 k( 60) = ( 0.5000000 -0.2577457 0.4301187), wk = 0.0027322 k( 61) = ( 0.5000000 -0.2474358 0.4374089), wk = 0.0027322 k( 62) = ( 0.5000000 -0.2371260 0.4446990), wk = 0.0027322 k( 63) = ( 0.5000000 -0.2268162 0.4519892), wk = 0.0027322 k( 64) = ( 0.5000000 -0.2165064 0.4592793), wk = 0.0027322 k( 65) = ( 0.5000000 -0.2061965 0.4665695), wk = 0.0027322 k( 66) = ( 0.5000000 -0.1958867 0.4738596), wk = 0.0027322 k( 67) = ( 0.5000000 -0.1855769 0.4811498), wk = 0.0027322 k( 68) = ( 0.5000000 -0.1752670 0.4884399), wk = 0.0027322 k( 69) = ( 0.5000000 -0.1649572 0.4957301), wk = 0.0027322 k( 70) = ( 0.5000000 -0.1546474 0.5030202), wk = 0.0027322 k( 71) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0027322 k( 72) = ( 0.5000000 -0.1340277 0.5176005), wk = 0.0027322 k( 73) = ( 0.5000000 -0.1237179 0.5248907), wk = 0.0027322 k( 74) = ( 0.5000000 -0.1134081 0.5321808), wk = 0.0027322 k( 75) = ( 0.5000000 -0.1030983 0.5394710), wk = 0.0027322 k( 76) = ( 0.5000000 -0.0927884 0.5467611), wk = 0.0027322 k( 77) = ( 0.5000000 -0.0824786 0.5540513), wk = 0.0027322 k( 78) = ( 0.5000000 -0.0721688 0.5613414), wk = 0.0027322 k( 79) = ( 0.5000000 -0.0618590 0.5686315), wk = 0.0027322 k( 80) = ( 0.5000000 -0.0515491 0.5759217), wk = 0.0027322 k( 81) = ( 0.5000000 -0.0412393 0.5832118), wk = 0.0027322 k( 82) = ( 0.5000000 -0.0309295 0.5905020), wk = 0.0027322 k( 83) = ( 0.5000000 -0.0206196 0.5977921), wk = 0.0027322 k( 84) = ( 0.5000000 -0.0103098 0.6050823), wk = 0.0027322 k( 85) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0027322 k( 86) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0027322 k( 87) = ( 0.4937500 0.0108253 0.6123724), wk = 0.0027322 k( 88) = ( 0.4875000 0.0216506 0.6123724), wk = 0.0027322 k( 89) = ( 0.4812500 0.0324760 0.6123724), wk = 0.0027322 k( 90) = ( 0.4750000 0.0433013 0.6123724), wk = 0.0027322 k( 91) = ( 0.4687500 0.0541266 0.6123724), wk = 0.0027322 k( 92) = ( 0.4625000 0.0649519 0.6123724), wk = 0.0027322 k( 93) = ( 0.4562500 0.0757772 0.6123724), wk = 0.0027322 k( 94) = ( 0.4500000 0.0866025 0.6123724), wk = 0.0027322 k( 95) = ( 0.4437500 0.0974279 0.6123724), wk = 0.0027322 k( 96) = ( 0.4375000 0.1082532 0.6123724), wk = 0.0027322 k( 97) = ( 0.4312500 0.1190785 0.6123724), wk = 0.0027322 k( 98) = ( 0.4250000 0.1299038 0.6123724), wk = 0.0027322 k( 99) = ( 0.4187500 0.1407291 0.6123724), wk = 0.0027322 k( 100) = ( 0.4125000 0.1515544 0.6123724), wk = 0.0027322 k( 101) = ( 0.4062500 0.1623798 0.6123724), wk = 0.0027322 k( 102) = ( 0.4000000 0.1732051 0.6123724), wk = 0.0027322 k( 103) = ( 0.3937500 0.1840304 0.6123724), wk = 0.0027322 k( 104) = ( 0.3875000 0.1948557 0.6123724), wk = 0.0027322 k( 105) = ( 0.3812500 0.2056810 0.6123724), wk = 0.0027322 k( 106) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0027322 k( 107) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0027322 k( 108) = ( 0.3685345 0.2127735 0.6018143), wk = 0.0027322 k( 109) = ( 0.3620690 0.2090406 0.5912561), wk = 0.0027322 k( 110) = ( 0.3556034 0.2053077 0.5806980), wk = 0.0027322 k( 111) = ( 0.3491379 0.2015749 0.5701399), wk = 0.0027322 k( 112) = ( 0.3426724 0.1978420 0.5595817), wk = 0.0027322 k( 113) = ( 0.3362069 0.1941091 0.5490236), wk = 0.0027322 k( 114) = ( 0.3297414 0.1903763 0.5384654), wk = 0.0027322 k( 115) = ( 0.3232759 0.1866434 0.5279073), wk = 0.0027322 k( 116) = ( 0.3168103 0.1829105 0.5173491), wk = 0.0027322 k( 117) = ( 0.3103448 0.1791777 0.5067910), wk = 0.0027322 k( 118) = ( 0.3038793 0.1754448 0.4962328), wk = 0.0027322 k( 119) = ( 0.2974138 0.1717119 0.4856747), wk = 0.0027322 k( 120) = ( 0.2909483 0.1679791 0.4751165), wk = 0.0027322 k( 121) = ( 0.2844828 0.1642462 0.4645584), wk = 0.0027322 k( 122) = ( 0.2780172 0.1605133 0.4540003), wk = 0.0027322 k( 123) = ( 0.2715517 0.1567805 0.4434421), wk = 0.0027322 k( 124) = ( 0.2650862 0.1530476 0.4328840), wk = 0.0027322 k( 125) = ( 0.2586207 0.1493147 0.4223258), wk = 0.0027322 k( 126) = ( 0.2521552 0.1455819 0.4117677), wk = 0.0027322 k( 127) = ( 0.2456897 0.1418490 0.4012095), wk = 0.0027322 k( 128) = ( 0.2392241 0.1381161 0.3906514), wk = 0.0027322 k( 129) = ( 0.2327586 0.1343833 0.3800932), wk = 0.0027322 k( 130) = ( 0.2262931 0.1306504 0.3695351), wk = 0.0027322 k( 131) = ( 0.2198276 0.1269175 0.3589769), wk = 0.0027322 k( 132) = ( 0.2133621 0.1231846 0.3484188), wk = 0.0027322 k( 133) = ( 0.2068966 0.1194518 0.3378607), wk = 0.0027322 k( 134) = ( 0.2004310 0.1157189 0.3273025), wk = 0.0027322 k( 135) = ( 0.1939655 0.1119860 0.3167444), wk = 0.0027322 k( 136) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0027322 k( 137) = ( 0.1810345 0.1045203 0.2956281), wk = 0.0027322 k( 138) = ( 0.1745690 0.1007874 0.2850699), wk = 0.0027322 k( 139) = ( 0.1681034 0.0970546 0.2745118), wk = 0.0027322 k( 140) = ( 0.1616379 0.0933217 0.2639536), wk = 0.0027322 k( 141) = ( 0.1551724 0.0895888 0.2533955), wk = 0.0027322 k( 142) = ( 0.1487069 0.0858560 0.2428373), wk = 0.0027322 k( 143) = ( 0.1422414 0.0821231 0.2322792), wk = 0.0027322 k( 144) = ( 0.1357759 0.0783902 0.2217211), wk = 0.0027322 k( 145) = ( 0.1293103 0.0746574 0.2111629), wk = 0.0027322 k( 146) = ( 0.1228448 0.0709245 0.2006048), wk = 0.0027322 k( 147) = ( 0.1163793 0.0671916 0.1900466), wk = 0.0027322 k( 148) = ( 0.1099138 0.0634588 0.1794885), wk = 0.0027322 k( 149) = ( 0.1034483 0.0597259 0.1689303), wk = 0.0027322 k( 150) = ( 0.0969828 0.0559930 0.1583722), wk = 0.0027322 k( 151) = ( 0.0905172 0.0522602 0.1478140), wk = 0.0027322 k( 152) = ( 0.0840517 0.0485273 0.1372559), wk = 0.0027322 k( 153) = ( 0.0775862 0.0447944 0.1266977), wk = 0.0027322 k( 154) = ( 0.0711207 0.0410615 0.1161396), wk = 0.0027322 k( 155) = ( 0.0646552 0.0373287 0.1055815), wk = 0.0027322 k( 156) = ( 0.0581897 0.0335958 0.0950233), wk = 0.0027322 k( 157) = ( 0.0517241 0.0298629 0.0844652), wk = 0.0027322 k( 158) = ( 0.0452586 0.0261301 0.0739070), wk = 0.0027322 k( 159) = ( 0.0387931 0.0223972 0.0633489), wk = 0.0027322 k( 160) = ( 0.0323276 0.0186643 0.0527907), wk = 0.0027322 k( 161) = ( 0.0258621 0.0149315 0.0422326), wk = 0.0027322 k( 162) = ( 0.0193965 0.0111986 0.0316744), wk = 0.0027322 k( 163) = ( 0.0129310 0.0074657 0.0211163), wk = 0.0027322 k( 164) = ( 0.0064655 0.0037329 0.0105581), wk = 0.0027322 k( 165) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 166) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 167) = ( 0.0104167 0.0060141 0.0042526), wk = 0.0027322 k( 168) = ( 0.0208333 0.0120281 0.0085052), wk = 0.0027322 k( 169) = ( 0.0312500 0.0180422 0.0127578), wk = 0.0027322 k( 170) = ( 0.0416667 0.0240563 0.0170103), wk = 0.0027322 k( 171) = ( 0.0520833 0.0300703 0.0212629), wk = 0.0027322 k( 172) = ( 0.0625000 0.0360844 0.0255155), wk = 0.0027322 k( 173) = ( 0.0729167 0.0420985 0.0297681), wk = 0.0027322 k( 174) = ( 0.0833333 0.0481125 0.0340207), wk = 0.0027322 k( 175) = ( 0.0937500 0.0541266 0.0382733), wk = 0.0027322 k( 176) = ( 0.1041667 0.0601407 0.0425259), wk = 0.0027322 k( 177) = ( 0.1145833 0.0661547 0.0467784), wk = 0.0027322 k( 178) = ( 0.1250000 0.0721688 0.0510310), wk = 0.0027322 k( 179) = ( 0.1354167 0.0781829 0.0552836), wk = 0.0027322 k( 180) = ( 0.1458333 0.0841969 0.0595362), wk = 0.0027322 k( 181) = ( 0.1562500 0.0902110 0.0637888), wk = 0.0027322 k( 182) = ( 0.1666667 0.0962250 0.0680414), wk = 0.0027322 k( 183) = ( 0.1770833 0.1022391 0.0722940), wk = 0.0027322 k( 184) = ( 0.1875000 0.1082532 0.0765466), wk = 0.0027322 k( 185) = ( 0.1979167 0.1142672 0.0807991), wk = 0.0027322 k( 186) = ( 0.2083333 0.1202813 0.0850517), wk = 0.0027322 k( 187) = ( 0.2187500 0.1262954 0.0893043), wk = 0.0027322 k( 188) = ( 0.2291667 0.1323094 0.0935569), wk = 0.0027322 k( 189) = ( 0.2395833 0.1383235 0.0978095), wk = 0.0027322 k( 190) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0027322 k( 191) = ( 0.2604167 0.1503516 0.1063147), wk = 0.0027322 k( 192) = ( 0.2708333 0.1563657 0.1105672), wk = 0.0027322 k( 193) = ( 0.2812500 0.1623798 0.1148198), wk = 0.0027322 k( 194) = ( 0.2916667 0.1683938 0.1190724), wk = 0.0027322 k( 195) = ( 0.3020833 0.1744079 0.1233250), wk = 0.0027322 k( 196) = ( 0.3125000 0.1804220 0.1275776), wk = 0.0027322 k( 197) = ( 0.3229167 0.1864360 0.1318302), wk = 0.0027322 k( 198) = ( 0.3333333 0.1924501 0.1360828), wk = 0.0027322 k( 199) = ( 0.3437500 0.1984642 0.1403353), wk = 0.0027322 k( 200) = ( 0.3541667 0.2044782 0.1445879), wk = 0.0027322 k( 201) = ( 0.3645833 0.2104923 0.1488405), wk = 0.0027322 k( 202) = ( 0.3750000 0.2165064 0.1530931), wk = 0.0027322 k( 203) = ( 0.3854167 0.2225204 0.1573457), wk = 0.0027322 k( 204) = ( 0.3958333 0.2285345 0.1615983), wk = 0.0027322 k( 205) = ( 0.4062500 0.2345485 0.1658509), wk = 0.0027322 k( 206) = ( 0.4166667 0.2405626 0.1701035), wk = 0.0027322 k( 207) = ( 0.4270833 0.2465767 0.1743560), wk = 0.0027322 k( 208) = ( 0.4375000 0.2525907 0.1786086), wk = 0.0027322 k( 209) = ( 0.4479167 0.2586048 0.1828612), wk = 0.0027322 k( 210) = ( 0.4583333 0.2646189 0.1871138), wk = 0.0027322 k( 211) = ( 0.4687500 0.2706329 0.1913664), wk = 0.0027322 k( 212) = ( 0.4791667 0.2766470 0.1956190), wk = 0.0027322 k( 213) = ( 0.4895833 0.2826611 0.1998716), wk = 0.0027322 k( 214) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0027322 k( 215) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0027322 k( 216) = ( 0.5036765 0.2780621 0.2101278), wk = 0.0027322 k( 217) = ( 0.5073529 0.2674490 0.2161314), wk = 0.0027322 k( 218) = ( 0.5110294 0.2568360 0.2221351), wk = 0.0027322 k( 219) = ( 0.5147059 0.2462229 0.2281387), wk = 0.0027322 k( 220) = ( 0.5183823 0.2356098 0.2341424), wk = 0.0027322 k( 221) = ( 0.5220588 0.2249968 0.2401461), wk = 0.0027322 k( 222) = ( 0.5257353 0.2143837 0.2461497), wk = 0.0027322 k( 223) = ( 0.5294118 0.2037707 0.2521534), wk = 0.0027322 k( 224) = ( 0.5330882 0.1931576 0.2581570), wk = 0.0027322 k( 225) = ( 0.5367647 0.1825446 0.2641607), wk = 0.0027322 k( 226) = ( 0.5404412 0.1719315 0.2701643), wk = 0.0027322 k( 227) = ( 0.5441177 0.1613185 0.2761680), wk = 0.0027322 k( 228) = ( 0.5477941 0.1507054 0.2821716), wk = 0.0027322 k( 229) = ( 0.5514706 0.1400923 0.2881753), wk = 0.0027322 k( 230) = ( 0.5551471 0.1294793 0.2941789), wk = 0.0027322 k( 231) = ( 0.5588235 0.1188662 0.3001826), wk = 0.0027322 k( 232) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0027322 k( 233) = ( 0.5661765 0.0976401 0.3121899), wk = 0.0027322 k( 234) = ( 0.5698529 0.0870271 0.3181935), wk = 0.0027322 k( 235) = ( 0.5735294 0.0764140 0.3241972), wk = 0.0027322 k( 236) = ( 0.5772059 0.0658010 0.3302008), wk = 0.0027322 k( 237) = ( 0.5808823 0.0551879 0.3362045), wk = 0.0027322 k( 238) = ( 0.5845588 0.0445748 0.3422081), wk = 0.0027322 k( 239) = ( 0.5882353 0.0339618 0.3482118), wk = 0.0027322 k( 240) = ( 0.5919118 0.0233487 0.3542154), wk = 0.0027322 k( 241) = ( 0.5955882 0.0127357 0.3602191), wk = 0.0027322 k( 242) = ( 0.5992647 0.0021226 0.3662227), wk = 0.0027322 k( 243) = ( 0.6029412 -0.0084904 0.3722264), wk = 0.0027322 k( 244) = ( 0.6066177 -0.0191035 0.3782300), wk = 0.0027322 k( 245) = ( 0.6102941 -0.0297166 0.3842337), wk = 0.0027322 k( 246) = ( 0.6139706 -0.0403296 0.3902373), wk = 0.0027322 k( 247) = ( 0.6176471 -0.0509427 0.3962410), wk = 0.0027322 k( 248) = ( 0.6213235 -0.0615557 0.4022446), wk = 0.0027322 k( 249) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0027322 k( 250) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0027322 k( 251) = ( 0.6187500 -0.0685603 0.4184545), wk = 0.0027322 k( 252) = ( 0.6125000 -0.0649519 0.4286607), wk = 0.0027322 k( 253) = ( 0.6062500 -0.0613435 0.4388669), wk = 0.0027322 k( 254) = ( 0.6000000 -0.0577350 0.4490731), wk = 0.0027322 k( 255) = ( 0.5937500 -0.0541266 0.4592793), wk = 0.0027322 k( 256) = ( 0.5875000 -0.0505181 0.4694855), wk = 0.0027322 k( 257) = ( 0.5812500 -0.0469097 0.4796917), wk = 0.0027322 k( 258) = ( 0.5750000 -0.0433013 0.4898979), wk = 0.0027322 k( 259) = ( 0.5687500 -0.0396928 0.5001042), wk = 0.0027322 k( 260) = ( 0.5625000 -0.0360844 0.5103104), wk = 0.0027322 k( 261) = ( 0.5562500 -0.0324760 0.5205166), wk = 0.0027322 k( 262) = ( 0.5500000 -0.0288675 0.5307228), wk = 0.0027322 k( 263) = ( 0.5437500 -0.0252591 0.5409290), wk = 0.0027322 k( 264) = ( 0.5375000 -0.0216506 0.5511352), wk = 0.0027322 k( 265) = ( 0.5312500 -0.0180422 0.5613414), wk = 0.0027322 k( 266) = ( 0.5250000 -0.0144338 0.5715476), wk = 0.0027322 k( 267) = ( 0.5187500 -0.0108253 0.5817538), wk = 0.0027322 k( 268) = ( 0.5125000 -0.0072169 0.5919600), wk = 0.0027322 k( 269) = ( 0.5062500 -0.0036084 0.6021662), wk = 0.0027322 k( 270) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0027322 k( 271) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0027322 k( 272) = ( 0.5000000 0.0074019 0.6019045), wk = 0.0027322 k( 273) = ( 0.5000000 0.0148038 0.5914366), wk = 0.0027322 k( 274) = ( 0.5000000 0.0222058 0.5809687), wk = 0.0027322 k( 275) = ( 0.5000000 0.0296077 0.5705008), wk = 0.0027322 k( 276) = ( 0.5000000 0.0370096 0.5600329), wk = 0.0027322 k( 277) = ( 0.5000000 0.0444116 0.5495650), wk = 0.0027322 k( 278) = ( 0.5000000 0.0518135 0.5390971), wk = 0.0027322 k( 279) = ( 0.5000000 0.0592154 0.5286292), wk = 0.0027322 k( 280) = ( 0.5000000 0.0666173 0.5181613), wk = 0.0027322 k( 281) = ( 0.5000000 0.0740193 0.5076934), wk = 0.0027322 k( 282) = ( 0.5000000 0.0814212 0.4972255), wk = 0.0027322 k( 283) = ( 0.5000000 0.0888231 0.4867576), wk = 0.0027322 k( 284) = ( 0.5000000 0.0962250 0.4762897), wk = 0.0027322 k( 285) = ( 0.5000000 0.1036270 0.4658218), wk = 0.0027322 k( 286) = ( 0.5000000 0.1110289 0.4553539), wk = 0.0027322 k( 287) = ( 0.5000000 0.1184308 0.4448860), wk = 0.0027322 k( 288) = ( 0.5000000 0.1258328 0.4344181), wk = 0.0027322 k( 289) = ( 0.5000000 0.1332347 0.4239501), wk = 0.0027322 k( 290) = ( 0.5000000 0.1406366 0.4134822), wk = 0.0027322 k( 291) = ( 0.5000000 0.1480385 0.4030143), wk = 0.0027322 k( 292) = ( 0.5000000 0.1554405 0.3925464), wk = 0.0027322 k( 293) = ( 0.5000000 0.1628424 0.3820785), wk = 0.0027322 k( 294) = ( 0.5000000 0.1702443 0.3716106), wk = 0.0027322 k( 295) = ( 0.5000000 0.1776462 0.3611427), wk = 0.0027322 k( 296) = ( 0.5000000 0.1850482 0.3506748), wk = 0.0027322 k( 297) = ( 0.5000000 0.1924501 0.3402069), wk = 0.0027322 k( 298) = ( 0.5000000 0.1998520 0.3297390), wk = 0.0027322 k( 299) = ( 0.5000000 0.2072539 0.3192711), wk = 0.0027322 k( 300) = ( 0.5000000 0.2146559 0.3088032), wk = 0.0027322 k( 301) = ( 0.5000000 0.2220578 0.2983353), wk = 0.0027322 k( 302) = ( 0.5000000 0.2294597 0.2878674), wk = 0.0027322 k( 303) = ( 0.5000000 0.2368617 0.2773995), wk = 0.0027322 k( 304) = ( 0.5000000 0.2442636 0.2669316), wk = 0.0027322 k( 305) = ( 0.5000000 0.2516655 0.2564637), wk = 0.0027322 k( 306) = ( 0.5000000 0.2590674 0.2459958), wk = 0.0027322 k( 307) = ( 0.5000000 0.2664694 0.2355279), wk = 0.0027322 k( 308) = ( 0.5000000 0.2738713 0.2250600), wk = 0.0027322 k( 309) = ( 0.5000000 0.2812732 0.2145921), wk = 0.0027322 k( 310) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0027322 k( 311) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0027322 k( 312) = ( 0.4963235 0.2865525 0.2161314), wk = 0.0027322 k( 313) = ( 0.4926471 0.2844299 0.2281387), wk = 0.0027322 k( 314) = ( 0.4889706 0.2823073 0.2401460), wk = 0.0027322 k( 315) = ( 0.4852941 0.2801847 0.2521533), wk = 0.0027322 k( 316) = ( 0.4816177 0.2780621 0.2641607), wk = 0.0027322 k( 317) = ( 0.4779412 0.2759395 0.2761680), wk = 0.0027322 k( 318) = ( 0.4742647 0.2738169 0.2881753), wk = 0.0027322 k( 319) = ( 0.4705882 0.2716942 0.3001826), wk = 0.0027322 k( 320) = ( 0.4669118 0.2695716 0.3121899), wk = 0.0027322 k( 321) = ( 0.4632353 0.2674490 0.3241972), wk = 0.0027322 k( 322) = ( 0.4595588 0.2653264 0.3362045), wk = 0.0027322 k( 323) = ( 0.4558823 0.2632038 0.3482118), wk = 0.0027322 k( 324) = ( 0.4522059 0.2610812 0.3602191), wk = 0.0027322 k( 325) = ( 0.4485294 0.2589586 0.3722264), wk = 0.0027322 k( 326) = ( 0.4448529 0.2568360 0.3842337), wk = 0.0027322 k( 327) = ( 0.4411765 0.2547134 0.3962410), wk = 0.0027322 k( 328) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0027322 k( 329) = ( 0.4338235 0.2504681 0.4202556), wk = 0.0027322 k( 330) = ( 0.4301471 0.2483455 0.4322629), wk = 0.0027322 k( 331) = ( 0.4264706 0.2462229 0.4442702), wk = 0.0027322 k( 332) = ( 0.4227941 0.2441003 0.4562775), wk = 0.0027322 k( 333) = ( 0.4191177 0.2419777 0.4682848), wk = 0.0027322 k( 334) = ( 0.4154412 0.2398551 0.4802921), wk = 0.0027322 k( 335) = ( 0.4117647 0.2377325 0.4922994), wk = 0.0027322 k( 336) = ( 0.4080882 0.2356099 0.5043067), wk = 0.0027322 k( 337) = ( 0.4044118 0.2334872 0.5163140), wk = 0.0027322 k( 338) = ( 0.4007353 0.2313646 0.5283213), wk = 0.0027322 k( 339) = ( 0.3970588 0.2292420 0.5403286), wk = 0.0027322 k( 340) = ( 0.3933823 0.2271194 0.5523359), wk = 0.0027322 k( 341) = ( 0.3897059 0.2249968 0.5643432), wk = 0.0027322 k( 342) = ( 0.3860294 0.2228742 0.5763505), wk = 0.0027322 k( 343) = ( 0.3823529 0.2207516 0.5883578), wk = 0.0027322 k( 344) = ( 0.3786765 0.2186290 0.6003651), wk = 0.0027322 k( 345) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0027322 k( 346) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0027322 k( 347) = ( 0.6187500 -0.0829941 0.4082483), wk = 0.0027322 k( 348) = ( 0.6125000 -0.0938194 0.4082483), wk = 0.0027322 k( 349) = ( 0.6062500 -0.1046447 0.4082483), wk = 0.0027322 k( 350) = ( 0.6000000 -0.1154701 0.4082483), wk = 0.0027322 k( 351) = ( 0.5937500 -0.1262954 0.4082483), wk = 0.0027322 k( 352) = ( 0.5875000 -0.1371207 0.4082483), wk = 0.0027322 k( 353) = ( 0.5812500 -0.1479460 0.4082483), wk = 0.0027322 k( 354) = ( 0.5750000 -0.1587713 0.4082483), wk = 0.0027322 k( 355) = ( 0.5687500 -0.1695966 0.4082483), wk = 0.0027322 k( 356) = ( 0.5625000 -0.1804220 0.4082483), wk = 0.0027322 k( 357) = ( 0.5562500 -0.1912473 0.4082483), wk = 0.0027322 k( 358) = ( 0.5500000 -0.2020726 0.4082483), wk = 0.0027322 k( 359) = ( 0.5437500 -0.2128979 0.4082483), wk = 0.0027322 k( 360) = ( 0.5375000 -0.2237232 0.4082483), wk = 0.0027322 k( 361) = ( 0.5312500 -0.2345485 0.4082483), wk = 0.0027322 k( 362) = ( 0.5250000 -0.2453739 0.4082483), wk = 0.0027322 k( 363) = ( 0.5187500 -0.2561992 0.4082483), wk = 0.0027322 k( 364) = ( 0.5125000 -0.2670245 0.4082483), wk = 0.0027322 k( 365) = ( 0.5062500 -0.2778498 0.4082483), wk = 0.0027322 k( 366) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0027322 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 2) = ( 0.0090909 0.0000000 0.0090909), wk = 0.0027322 k( 3) = ( 0.0181818 0.0000000 0.0181818), wk = 0.0027322 k( 4) = ( 0.0272727 0.0000000 0.0272727), wk = 0.0027322 k( 5) = ( 0.0363636 0.0000000 0.0363636), wk = 0.0027322 k( 6) = ( 0.0454546 0.0000000 0.0454546), wk = 0.0027322 k( 7) = ( 0.0545455 0.0000000 0.0545454), wk = 0.0027322 k( 8) = ( 0.0636364 -0.0000000 0.0636364), wk = 0.0027322 k( 9) = ( 0.0727273 0.0000000 0.0727273), wk = 0.0027322 k( 10) = ( 0.0818182 0.0000000 0.0818182), wk = 0.0027322 k( 11) = ( 0.0909091 0.0000000 0.0909091), wk = 0.0027322 k( 12) = ( 0.1000000 0.0000000 0.1000000), wk = 0.0027322 k( 13) = ( 0.1090909 0.0000000 0.1090909), wk = 0.0027322 k( 14) = ( 0.1181818 0.0000000 0.1181818), wk = 0.0027322 k( 15) = ( 0.1272727 0.0000000 0.1272727), wk = 0.0027322 k( 16) = ( 0.1363636 0.0000000 0.1363636), wk = 0.0027322 k( 17) = ( 0.1454545 0.0000000 0.1454545), wk = 0.0027322 k( 18) = ( 0.1545455 0.0000000 0.1545455), wk = 0.0027322 k( 19) = ( 0.1636364 0.0000000 0.1636364), wk = 0.0027322 k( 20) = ( 0.1727273 0.0000000 0.1727273), wk = 0.0027322 k( 21) = ( 0.1818182 0.0000000 0.1818182), wk = 0.0027322 k( 22) = ( 0.1909091 0.0000000 0.1909091), wk = 0.0027322 k( 23) = ( 0.2000000 0.0000000 0.2000000), wk = 0.0027322 k( 24) = ( 0.2090909 0.0000000 0.2090909), wk = 0.0027322 k( 25) = ( 0.2181818 0.0000000 0.2181818), wk = 0.0027322 k( 26) = ( 0.2272727 0.0000000 0.2272727), wk = 0.0027322 k( 27) = ( 0.2363636 0.0000000 0.2363636), wk = 0.0027322 k( 28) = ( 0.2454545 0.0000000 0.2454545), wk = 0.0027322 k( 29) = ( 0.2545455 0.0000000 0.2545455), wk = 0.0027322 k( 30) = ( 0.2636364 0.0000000 0.2636364), wk = 0.0027322 k( 31) = ( 0.2727273 0.0000000 0.2727273), wk = 0.0027322 k( 32) = ( 0.2818182 0.0000000 0.2818182), wk = 0.0027322 k( 33) = ( 0.2909091 0.0000000 0.2909091), wk = 0.0027322 k( 34) = ( 0.3000000 0.0000000 0.3000000), wk = 0.0027322 k( 35) = ( 0.3090909 0.0000000 0.3090909), wk = 0.0027322 k( 36) = ( 0.3181818 0.0000000 0.3181818), wk = 0.0027322 k( 37) = ( 0.3272727 0.0000000 0.3272727), wk = 0.0027322 k( 38) = ( 0.3363636 0.0000000 0.3363636), wk = 0.0027322 k( 39) = ( 0.3454546 0.0000000 0.3454546), wk = 0.0027322 k( 40) = ( 0.3545454 0.0000000 0.3545454), wk = 0.0027322 k( 41) = ( 0.3636364 0.0000000 0.3636364), wk = 0.0027322 k( 42) = ( 0.3727273 0.0000000 0.3727273), wk = 0.0027322 k( 43) = ( 0.3818182 0.0000000 0.3818182), wk = 0.0027322 k( 44) = ( 0.3909091 0.0000000 0.3909091), wk = 0.0027322 k( 45) = ( 0.4000000 0.0000000 0.4000000), wk = 0.0027322 k( 46) = ( 0.4090909 0.0000000 0.4090909), wk = 0.0027322 k( 47) = ( 0.4181818 0.0000000 0.4181818), wk = 0.0027322 k( 48) = ( 0.4272727 0.0000000 0.4272727), wk = 0.0027322 k( 49) = ( 0.4363636 0.0000000 0.4363636), wk = 0.0027322 k( 50) = ( 0.4454546 0.0000000 0.4454546), wk = 0.0027322 k( 51) = ( 0.4545455 0.0000000 0.4545454), wk = 0.0027322 k( 52) = ( 0.4636364 0.0000000 0.4636364), wk = 0.0027322 k( 53) = ( 0.4727273 0.0000000 0.4727273), wk = 0.0027322 k( 54) = ( 0.4818182 0.0000000 0.4818182), wk = 0.0027322 k( 55) = ( 0.4909091 0.0000000 0.4909091), wk = 0.0027322 k( 56) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027322 k( 57) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027322 k( 58) = ( 0.5000000 0.0089286 0.5089286), wk = 0.0027322 k( 59) = ( 0.5000000 0.0178571 0.5178571), wk = 0.0027322 k( 60) = ( 0.5000000 0.0267857 0.5267857), wk = 0.0027322 k( 61) = ( 0.5000000 0.0357143 0.5357143), wk = 0.0027322 k( 62) = ( 0.5000000 0.0446429 0.5446429), wk = 0.0027322 k( 63) = ( 0.5000000 0.0535714 0.5535714), wk = 0.0027322 k( 64) = ( 0.5000000 0.0625000 0.5625000), wk = 0.0027322 k( 65) = ( 0.5000000 0.0714286 0.5714286), wk = 0.0027322 k( 66) = ( 0.5000000 0.0803571 0.5803571), wk = 0.0027322 k( 67) = ( 0.5000000 0.0892857 0.5892857), wk = 0.0027322 k( 68) = ( 0.5000000 0.0982143 0.5982143), wk = 0.0027322 k( 69) = ( 0.5000000 0.1071429 0.6071429), wk = 0.0027322 k( 70) = ( 0.5000000 0.1160714 0.6160714), wk = 0.0027322 k( 71) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0027322 k( 72) = ( 0.5000000 0.1339286 0.6339286), wk = 0.0027322 k( 73) = ( 0.5000000 0.1428571 0.6428571), wk = 0.0027322 k( 74) = ( 0.5000000 0.1517857 0.6517857), wk = 0.0027322 k( 75) = ( 0.5000000 0.1607143 0.6607143), wk = 0.0027322 k( 76) = ( 0.5000000 0.1696429 0.6696429), wk = 0.0027322 k( 77) = ( 0.5000000 0.1785714 0.6785714), wk = 0.0027322 k( 78) = ( 0.5000000 0.1875000 0.6875000), wk = 0.0027322 k( 79) = ( 0.5000000 0.1964286 0.6964286), wk = 0.0027322 k( 80) = ( 0.5000000 0.2053571 0.7053571), wk = 0.0027322 k( 81) = ( 0.5000000 0.2142857 0.7142857), wk = 0.0027322 k( 82) = ( 0.5000000 0.2232143 0.7232143), wk = 0.0027322 k( 83) = ( 0.5000000 0.2321429 0.7321429), wk = 0.0027322 k( 84) = ( 0.5000000 0.2410714 0.7410714), wk = 0.0027322 k( 85) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0027322 k( 86) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0027322 k( 87) = ( 0.4937500 0.2562500 0.7500000), wk = 0.0027322 k( 88) = ( 0.4875000 0.2625000 0.7500000), wk = 0.0027322 k( 89) = ( 0.4812500 0.2687500 0.7500000), wk = 0.0027322 k( 90) = ( 0.4750000 0.2750000 0.7500000), wk = 0.0027322 k( 91) = ( 0.4687500 0.2812500 0.7500000), wk = 0.0027322 k( 92) = ( 0.4625000 0.2875000 0.7500000), wk = 0.0027322 k( 93) = ( 0.4562500 0.2937500 0.7500000), wk = 0.0027322 k( 94) = ( 0.4500000 0.3000000 0.7500000), wk = 0.0027322 k( 95) = ( 0.4437500 0.3062500 0.7500000), wk = 0.0027322 k( 96) = ( 0.4375000 0.3125000 0.7500000), wk = 0.0027322 k( 97) = ( 0.4312500 0.3187500 0.7500000), wk = 0.0027322 k( 98) = ( 0.4250000 0.3250000 0.7500000), wk = 0.0027322 k( 99) = ( 0.4187500 0.3312500 0.7500000), wk = 0.0027322 k( 100) = ( 0.4125000 0.3375000 0.7500000), wk = 0.0027322 k( 101) = ( 0.4062500 0.3437500 0.7500000), wk = 0.0027322 k( 102) = ( 0.4000000 0.3500000 0.7500000), wk = 0.0027322 k( 103) = ( 0.3937500 0.3562500 0.7500000), wk = 0.0027322 k( 104) = ( 0.3875000 0.3625000 0.7500000), wk = 0.0027322 k( 105) = ( 0.3812500 0.3687500 0.7500000), wk = 0.0027322 k( 106) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0027322 k( 107) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0027322 k( 108) = ( 0.3685345 0.3685345 0.7370690), wk = 0.0027322 k( 109) = ( 0.3620690 0.3620690 0.7241379), wk = 0.0027322 k( 110) = ( 0.3556034 0.3556035 0.7112069), wk = 0.0027322 k( 111) = ( 0.3491379 0.3491379 0.6982759), wk = 0.0027322 k( 112) = ( 0.3426724 0.3426724 0.6853448), wk = 0.0027322 k( 113) = ( 0.3362069 0.3362069 0.6724138), wk = 0.0027322 k( 114) = ( 0.3297414 0.3297414 0.6594828), wk = 0.0027322 k( 115) = ( 0.3232759 0.3232759 0.6465517), wk = 0.0027322 k( 116) = ( 0.3168103 0.3168103 0.6336207), wk = 0.0027322 k( 117) = ( 0.3103448 0.3103448 0.6206897), wk = 0.0027322 k( 118) = ( 0.3038793 0.3038793 0.6077586), wk = 0.0027322 k( 119) = ( 0.2974138 0.2974138 0.5948276), wk = 0.0027322 k( 120) = ( 0.2909483 0.2909483 0.5818965), wk = 0.0027322 k( 121) = ( 0.2844828 0.2844828 0.5689655), wk = 0.0027322 k( 122) = ( 0.2780172 0.2780172 0.5560345), wk = 0.0027322 k( 123) = ( 0.2715517 0.2715517 0.5431035), wk = 0.0027322 k( 124) = ( 0.2650862 0.2650862 0.5301724), wk = 0.0027322 k( 125) = ( 0.2586207 0.2586207 0.5172414), wk = 0.0027322 k( 126) = ( 0.2521552 0.2521552 0.5043103), wk = 0.0027322 k( 127) = ( 0.2456897 0.2456897 0.4913793), wk = 0.0027322 k( 128) = ( 0.2392241 0.2392241 0.4784483), wk = 0.0027322 k( 129) = ( 0.2327586 0.2327586 0.4655172), wk = 0.0027322 k( 130) = ( 0.2262931 0.2262931 0.4525862), wk = 0.0027322 k( 131) = ( 0.2198276 0.2198276 0.4396552), wk = 0.0027322 k( 132) = ( 0.2133621 0.2133621 0.4267241), wk = 0.0027322 k( 133) = ( 0.2068966 0.2068966 0.4137931), wk = 0.0027322 k( 134) = ( 0.2004310 0.2004310 0.4008621), wk = 0.0027322 k( 135) = ( 0.1939655 0.1939655 0.3879310), wk = 0.0027322 k( 136) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0027322 k( 137) = ( 0.1810345 0.1810345 0.3620690), wk = 0.0027322 k( 138) = ( 0.1745690 0.1745690 0.3491379), wk = 0.0027322 k( 139) = ( 0.1681034 0.1681034 0.3362069), wk = 0.0027322 k( 140) = ( 0.1616379 0.1616379 0.3232759), wk = 0.0027322 k( 141) = ( 0.1551724 0.1551724 0.3103448), wk = 0.0027322 k( 142) = ( 0.1487069 0.1487069 0.2974138), wk = 0.0027322 k( 143) = ( 0.1422414 0.1422414 0.2844828), wk = 0.0027322 k( 144) = ( 0.1357759 0.1357759 0.2715517), wk = 0.0027322 k( 145) = ( 0.1293103 0.1293103 0.2586207), wk = 0.0027322 k( 146) = ( 0.1228448 0.1228448 0.2456897), wk = 0.0027322 k( 147) = ( 0.1163793 0.1163793 0.2327586), wk = 0.0027322 k( 148) = ( 0.1099138 0.1099138 0.2198276), wk = 0.0027322 k( 149) = ( 0.1034483 0.1034483 0.2068965), wk = 0.0027322 k( 150) = ( 0.0969828 0.0969828 0.1939655), wk = 0.0027322 k( 151) = ( 0.0905172 0.0905172 0.1810345), wk = 0.0027322 k( 152) = ( 0.0840517 0.0840517 0.1681034), wk = 0.0027322 k( 153) = ( 0.0775862 0.0775862 0.1551724), wk = 0.0027322 k( 154) = ( 0.0711207 0.0711207 0.1422414), wk = 0.0027322 k( 155) = ( 0.0646552 0.0646552 0.1293103), wk = 0.0027322 k( 156) = ( 0.0581897 0.0581897 0.1163793), wk = 0.0027322 k( 157) = ( 0.0517241 0.0517241 0.1034483), wk = 0.0027322 k( 158) = ( 0.0452586 0.0452586 0.0905172), wk = 0.0027322 k( 159) = ( 0.0387931 0.0387931 0.0775862), wk = 0.0027322 k( 160) = ( 0.0323276 0.0323276 0.0646552), wk = 0.0027322 k( 161) = ( 0.0258621 0.0258621 0.0517241), wk = 0.0027322 k( 162) = ( 0.0193965 0.0193966 0.0387931), wk = 0.0027322 k( 163) = ( 0.0129310 0.0129310 0.0258621), wk = 0.0027322 k( 164) = ( 0.0064655 0.0064655 0.0129310), wk = 0.0027322 k( 165) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 166) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 167) = ( 0.0104167 0.0104167 0.0104167), wk = 0.0027322 k( 168) = ( 0.0208333 0.0208333 0.0208333), wk = 0.0027322 k( 169) = ( 0.0312500 0.0312500 0.0312500), wk = 0.0027322 k( 170) = ( 0.0416667 0.0416667 0.0416667), wk = 0.0027322 k( 171) = ( 0.0520833 0.0520833 0.0520833), wk = 0.0027322 k( 172) = ( 0.0625000 0.0625000 0.0625000), wk = 0.0027322 k( 173) = ( 0.0729167 0.0729167 0.0729167), wk = 0.0027322 k( 174) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0027322 k( 175) = ( 0.0937500 0.0937500 0.0937500), wk = 0.0027322 k( 176) = ( 0.1041667 0.1041667 0.1041667), wk = 0.0027322 k( 177) = ( 0.1145833 0.1145833 0.1145833), wk = 0.0027322 k( 178) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0027322 k( 179) = ( 0.1354167 0.1354167 0.1354167), wk = 0.0027322 k( 180) = ( 0.1458333 0.1458333 0.1458333), wk = 0.0027322 k( 181) = ( 0.1562500 0.1562500 0.1562500), wk = 0.0027322 k( 182) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0027322 k( 183) = ( 0.1770833 0.1770833 0.1770833), wk = 0.0027322 k( 184) = ( 0.1875000 0.1875000 0.1875000), wk = 0.0027322 k( 185) = ( 0.1979167 0.1979167 0.1979167), wk = 0.0027322 k( 186) = ( 0.2083333 0.2083333 0.2083333), wk = 0.0027322 k( 187) = ( 0.2187500 0.2187500 0.2187500), wk = 0.0027322 k( 188) = ( 0.2291667 0.2291667 0.2291667), wk = 0.0027322 k( 189) = ( 0.2395833 0.2395833 0.2395833), wk = 0.0027322 k( 190) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0027322 k( 191) = ( 0.2604167 0.2604167 0.2604167), wk = 0.0027322 k( 192) = ( 0.2708333 0.2708333 0.2708333), wk = 0.0027322 k( 193) = ( 0.2812500 0.2812500 0.2812500), wk = 0.0027322 k( 194) = ( 0.2916667 0.2916667 0.2916667), wk = 0.0027322 k( 195) = ( 0.3020833 0.3020833 0.3020833), wk = 0.0027322 k( 196) = ( 0.3125000 0.3125000 0.3125000), wk = 0.0027322 k( 197) = ( 0.3229167 0.3229167 0.3229167), wk = 0.0027322 k( 198) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0027322 k( 199) = ( 0.3437500 0.3437500 0.3437500), wk = 0.0027322 k( 200) = ( 0.3541667 0.3541667 0.3541667), wk = 0.0027322 k( 201) = ( 0.3645833 0.3645833 0.3645833), wk = 0.0027322 k( 202) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0027322 k( 203) = ( 0.3854167 0.3854167 0.3854167), wk = 0.0027322 k( 204) = ( 0.3958333 0.3958333 0.3958333), wk = 0.0027322 k( 205) = ( 0.4062500 0.4062500 0.4062500), wk = 0.0027322 k( 206) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0027322 k( 207) = ( 0.4270833 0.4270833 0.4270833), wk = 0.0027322 k( 208) = ( 0.4375000 0.4375000 0.4375000), wk = 0.0027322 k( 209) = ( 0.4479167 0.4479167 0.4479167), wk = 0.0027322 k( 210) = ( 0.4583333 0.4583333 0.4583333), wk = 0.0027322 k( 211) = ( 0.4687500 0.4687500 0.4687500), wk = 0.0027322 k( 212) = ( 0.4791667 0.4791667 0.4791667), wk = 0.0027322 k( 213) = ( 0.4895833 0.4895833 0.4895833), wk = 0.0027322 k( 214) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027322 k( 215) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027322 k( 216) = ( 0.5036765 0.4926471 0.5036765), wk = 0.0027322 k( 217) = ( 0.5073529 0.4852941 0.5073529), wk = 0.0027322 k( 218) = ( 0.5110294 0.4779412 0.5110294), wk = 0.0027322 k( 219) = ( 0.5147059 0.4705882 0.5147059), wk = 0.0027322 k( 220) = ( 0.5183823 0.4632353 0.5183823), wk = 0.0027322 k( 221) = ( 0.5220588 0.4558823 0.5220588), wk = 0.0027322 k( 222) = ( 0.5257353 0.4485294 0.5257353), wk = 0.0027322 k( 223) = ( 0.5294118 0.4411765 0.5294118), wk = 0.0027322 k( 224) = ( 0.5330882 0.4338235 0.5330882), wk = 0.0027322 k( 225) = ( 0.5367647 0.4264706 0.5367647), wk = 0.0027322 k( 226) = ( 0.5404412 0.4191177 0.5404412), wk = 0.0027322 k( 227) = ( 0.5441177 0.4117647 0.5441177), wk = 0.0027322 k( 228) = ( 0.5477941 0.4044118 0.5477941), wk = 0.0027322 k( 229) = ( 0.5514706 0.3970588 0.5514706), wk = 0.0027322 k( 230) = ( 0.5551471 0.3897059 0.5551471), wk = 0.0027322 k( 231) = ( 0.5588235 0.3823529 0.5588235), wk = 0.0027322 k( 232) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0027322 k( 233) = ( 0.5661765 0.3676471 0.5661765), wk = 0.0027322 k( 234) = ( 0.5698529 0.3602941 0.5698529), wk = 0.0027322 k( 235) = ( 0.5735294 0.3529412 0.5735294), wk = 0.0027322 k( 236) = ( 0.5772059 0.3455882 0.5772059), wk = 0.0027322 k( 237) = ( 0.5808823 0.3382353 0.5808823), wk = 0.0027322 k( 238) = ( 0.5845588 0.3308823 0.5845588), wk = 0.0027322 k( 239) = ( 0.5882353 0.3235294 0.5882353), wk = 0.0027322 k( 240) = ( 0.5919118 0.3161765 0.5919118), wk = 0.0027322 k( 241) = ( 0.5955882 0.3088235 0.5955882), wk = 0.0027322 k( 242) = ( 0.5992647 0.3014706 0.5992647), wk = 0.0027322 k( 243) = ( 0.6029412 0.2941177 0.6029412), wk = 0.0027322 k( 244) = ( 0.6066177 0.2867647 0.6066177), wk = 0.0027322 k( 245) = ( 0.6102941 0.2794118 0.6102941), wk = 0.0027322 k( 246) = ( 0.6139706 0.2720588 0.6139706), wk = 0.0027322 k( 247) = ( 0.6176471 0.2647059 0.6176471), wk = 0.0027322 k( 248) = ( 0.6213235 0.2573529 0.6213235), wk = 0.0027322 k( 249) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0027322 k( 250) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0027322 k( 251) = ( 0.6187500 0.2500000 0.6312500), wk = 0.0027322 k( 252) = ( 0.6125000 0.2500000 0.6375000), wk = 0.0027322 k( 253) = ( 0.6062500 0.2500000 0.6437500), wk = 0.0027322 k( 254) = ( 0.6000000 0.2500000 0.6500000), wk = 0.0027322 k( 255) = ( 0.5937500 0.2500000 0.6562500), wk = 0.0027322 k( 256) = ( 0.5875000 0.2500000 0.6625000), wk = 0.0027322 k( 257) = ( 0.5812500 0.2500000 0.6687500), wk = 0.0027322 k( 258) = ( 0.5750000 0.2500000 0.6750000), wk = 0.0027322 k( 259) = ( 0.5687500 0.2500000 0.6812500), wk = 0.0027322 k( 260) = ( 0.5625000 0.2500000 0.6875000), wk = 0.0027322 k( 261) = ( 0.5562500 0.2500000 0.6937500), wk = 0.0027322 k( 262) = ( 0.5500000 0.2500000 0.7000000), wk = 0.0027322 k( 263) = ( 0.5437500 0.2500000 0.7062500), wk = 0.0027322 k( 264) = ( 0.5375000 0.2500000 0.7125000), wk = 0.0027322 k( 265) = ( 0.5312500 0.2500000 0.7187500), wk = 0.0027322 k( 266) = ( 0.5250000 0.2500000 0.7250000), wk = 0.0027322 k( 267) = ( 0.5187500 0.2500000 0.7312500), wk = 0.0027322 k( 268) = ( 0.5125000 0.2500000 0.7375000), wk = 0.0027322 k( 269) = ( 0.5062500 0.2500000 0.7437500), wk = 0.0027322 k( 270) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0027322 k( 271) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0027322 k( 272) = ( 0.5000000 0.2564103 0.7435897), wk = 0.0027322 k( 273) = ( 0.5000000 0.2628205 0.7371795), wk = 0.0027322 k( 274) = ( 0.5000000 0.2692308 0.7307692), wk = 0.0027322 k( 275) = ( 0.5000000 0.2756410 0.7243590), wk = 0.0027322 k( 276) = ( 0.5000000 0.2820513 0.7179487), wk = 0.0027322 k( 277) = ( 0.5000000 0.2884615 0.7115385), wk = 0.0027322 k( 278) = ( 0.5000000 0.2948718 0.7051282), wk = 0.0027322 k( 279) = ( 0.5000000 0.3012821 0.6987180), wk = 0.0027322 k( 280) = ( 0.5000000 0.3076923 0.6923077), wk = 0.0027322 k( 281) = ( 0.5000000 0.3141026 0.6858974), wk = 0.0027322 k( 282) = ( 0.5000000 0.3205128 0.6794872), wk = 0.0027322 k( 283) = ( 0.5000000 0.3269231 0.6730769), wk = 0.0027322 k( 284) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0027322 k( 285) = ( 0.5000000 0.3397436 0.6602564), wk = 0.0027322 k( 286) = ( 0.5000000 0.3461538 0.6538462), wk = 0.0027322 k( 287) = ( 0.5000000 0.3525641 0.6474359), wk = 0.0027322 k( 288) = ( 0.5000000 0.3589744 0.6410256), wk = 0.0027322 k( 289) = ( 0.5000000 0.3653846 0.6346154), wk = 0.0027322 k( 290) = ( 0.5000000 0.3717949 0.6282051), wk = 0.0027322 k( 291) = ( 0.5000000 0.3782051 0.6217949), wk = 0.0027322 k( 292) = ( 0.5000000 0.3846154 0.6153846), wk = 0.0027322 k( 293) = ( 0.5000000 0.3910256 0.6089744), wk = 0.0027322 k( 294) = ( 0.5000000 0.3974359 0.6025641), wk = 0.0027322 k( 295) = ( 0.5000000 0.4038462 0.5961538), wk = 0.0027322 k( 296) = ( 0.5000000 0.4102564 0.5897436), wk = 0.0027322 k( 297) = ( 0.5000000 0.4166667 0.5833333), wk = 0.0027322 k( 298) = ( 0.5000000 0.4230769 0.5769231), wk = 0.0027322 k( 299) = ( 0.5000000 0.4294872 0.5705128), wk = 0.0027322 k( 300) = ( 0.5000000 0.4358974 0.5641026), wk = 0.0027322 k( 301) = ( 0.5000000 0.4423077 0.5576923), wk = 0.0027322 k( 302) = ( 0.5000000 0.4487180 0.5512820), wk = 0.0027322 k( 303) = ( 0.5000000 0.4551282 0.5448718), wk = 0.0027322 k( 304) = ( 0.5000000 0.4615385 0.5384615), wk = 0.0027322 k( 305) = ( 0.5000000 0.4679487 0.5320513), wk = 0.0027322 k( 306) = ( 0.5000000 0.4743590 0.5256410), wk = 0.0027322 k( 307) = ( 0.5000000 0.4807692 0.5192308), wk = 0.0027322 k( 308) = ( 0.5000000 0.4871795 0.5128205), wk = 0.0027322 k( 309) = ( 0.5000000 0.4935897 0.5064103), wk = 0.0027322 k( 310) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027322 k( 311) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027322 k( 312) = ( 0.4963235 0.4963235 0.5073529), wk = 0.0027322 k( 313) = ( 0.4926471 0.4926471 0.5147059), wk = 0.0027322 k( 314) = ( 0.4889706 0.4889706 0.5220588), wk = 0.0027322 k( 315) = ( 0.4852941 0.4852941 0.5294118), wk = 0.0027322 k( 316) = ( 0.4816177 0.4816177 0.5367647), wk = 0.0027322 k( 317) = ( 0.4779412 0.4779412 0.5441177), wk = 0.0027322 k( 318) = ( 0.4742647 0.4742647 0.5514706), wk = 0.0027322 k( 319) = ( 0.4705882 0.4705882 0.5588235), wk = 0.0027322 k( 320) = ( 0.4669118 0.4669118 0.5661765), wk = 0.0027322 k( 321) = ( 0.4632353 0.4632353 0.5735294), wk = 0.0027322 k( 322) = ( 0.4595588 0.4595588 0.5808823), wk = 0.0027322 k( 323) = ( 0.4558823 0.4558824 0.5882353), wk = 0.0027322 k( 324) = ( 0.4522059 0.4522059 0.5955882), wk = 0.0027322 k( 325) = ( 0.4485294 0.4485294 0.6029412), wk = 0.0027322 k( 326) = ( 0.4448529 0.4448529 0.6102941), wk = 0.0027322 k( 327) = ( 0.4411765 0.4411765 0.6176471), wk = 0.0027322 k( 328) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0027322 k( 329) = ( 0.4338235 0.4338235 0.6323529), wk = 0.0027322 k( 330) = ( 0.4301471 0.4301471 0.6397059), wk = 0.0027322 k( 331) = ( 0.4264706 0.4264706 0.6470588), wk = 0.0027322 k( 332) = ( 0.4227941 0.4227941 0.6544118), wk = 0.0027322 k( 333) = ( 0.4191177 0.4191177 0.6617647), wk = 0.0027322 k( 334) = ( 0.4154412 0.4154412 0.6691177), wk = 0.0027322 k( 335) = ( 0.4117647 0.4117647 0.6764706), wk = 0.0027322 k( 336) = ( 0.4080882 0.4080882 0.6838235), wk = 0.0027322 k( 337) = ( 0.4044118 0.4044118 0.6911765), wk = 0.0027322 k( 338) = ( 0.4007353 0.4007353 0.6985294), wk = 0.0027322 k( 339) = ( 0.3970588 0.3970588 0.7058823), wk = 0.0027322 k( 340) = ( 0.3933823 0.3933823 0.7132353), wk = 0.0027322 k( 341) = ( 0.3897059 0.3897059 0.7205882), wk = 0.0027322 k( 342) = ( 0.3860294 0.3860294 0.7279412), wk = 0.0027322 k( 343) = ( 0.3823529 0.3823529 0.7352941), wk = 0.0027322 k( 344) = ( 0.3786765 0.3786765 0.7426471), wk = 0.0027322 k( 345) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0027322 k( 346) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0027322 k( 347) = ( 0.6187500 0.2375000 0.6187500), wk = 0.0027322 k( 348) = ( 0.6125000 0.2250000 0.6125000), wk = 0.0027322 k( 349) = ( 0.6062500 0.2125000 0.6062500), wk = 0.0027322 k( 350) = ( 0.6000000 0.2000000 0.6000000), wk = 0.0027322 k( 351) = ( 0.5937500 0.1875000 0.5937500), wk = 0.0027322 k( 352) = ( 0.5875000 0.1750000 0.5875000), wk = 0.0027322 k( 353) = ( 0.5812500 0.1625000 0.5812500), wk = 0.0027322 k( 354) = ( 0.5750000 0.1500000 0.5750000), wk = 0.0027322 k( 355) = ( 0.5687500 0.1375000 0.5687500), wk = 0.0027322 k( 356) = ( 0.5625000 0.1250000 0.5625000), wk = 0.0027322 k( 357) = ( 0.5562500 0.1125000 0.5562500), wk = 0.0027322 k( 358) = ( 0.5500000 0.1000000 0.5500000), wk = 0.0027322 k( 359) = ( 0.5437500 0.0875000 0.5437500), wk = 0.0027322 k( 360) = ( 0.5375000 0.0750000 0.5375000), wk = 0.0027322 k( 361) = ( 0.5312500 0.0625000 0.5312500), wk = 0.0027322 k( 362) = ( 0.5250000 0.0500000 0.5250000), wk = 0.0027322 k( 363) = ( 0.5187500 0.0375000 0.5187500), wk = 0.0027322 k( 364) = ( 0.5125000 0.0250000 0.5125000), wk = 0.0027322 k( 365) = ( 0.5062500 0.0125000 0.5062500), wk = 0.0027322 k( 366) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027322 Dense grid: 30923 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.19 Mb ( 224, 56) NL pseudopotentials 0.23 Mb ( 112, 136) Each V/rho on FFT grid 0.06 Mb ( 4050) Each G-vector array 0.01 Mb ( 856) G-vector shells 0.00 Mb ( 289) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.77 Mb ( 224, 224) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.23 Mb ( 136, 2, 56) The potential is recalculated from file : ./GaFe2Co.save/charge-density.dat Starting wfc are 74 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.0 secs Computing kpt #: 2 total cpu time spent up to now is 3.7 secs Computing kpt #: 3 total cpu time spent up to now is 4.3 secs Computing kpt #: 4 total cpu time spent up to now is 4.8 secs Computing kpt #: 5 total cpu time spent up to now is 5.4 secs Computing kpt #: 6 total cpu time spent up to now is 5.9 secs Computing kpt #: 7 total cpu time spent up to now is 6.4 secs Computing kpt #: 8 total cpu time spent up to now is 6.8 secs Computing kpt #: 9 total cpu time spent up to now is 7.3 secs Computing kpt #: 10 total cpu time spent up to now is 7.8 secs Computing kpt #: 11 total cpu time spent up to now is 8.2 secs Computing kpt #: 12 total cpu time spent up to now is 8.6 secs Computing kpt #: 13 total cpu time spent up to now is 9.1 secs Computing kpt #: 14 total cpu time spent up to now is 9.5 secs Computing kpt #: 15 total cpu time spent up to now is 9.9 secs Computing kpt #: 16 total cpu time spent up to now is 10.4 secs Computing kpt #: 17 total cpu time spent up to now is 10.8 secs Computing kpt #: 18 total cpu time spent up to now is 11.2 secs Computing kpt #: 19 total cpu time spent up to now is 11.7 secs Computing kpt #: 20 total cpu time spent up to now is 12.1 secs Computing kpt #: 21 total cpu time spent up to now is 12.5 secs Computing kpt #: 22 total cpu time spent up to now is 13.0 secs Computing kpt #: 23 total cpu time spent up to now is 13.4 secs Computing kpt #: 24 total cpu time spent up to now is 13.9 secs Computing kpt #: 25 total cpu time spent up to now is 14.3 secs Computing kpt #: 26 total cpu time spent up to now is 14.7 secs Computing kpt #: 27 total cpu time spent up to now is 15.2 secs Computing kpt #: 28 total cpu time spent up to now is 15.6 secs Computing kpt #: 29 total cpu time spent up to now is 16.1 secs Computing kpt #: 30 total cpu time spent up to now is 16.5 secs Computing kpt #: 31 total cpu time spent up to now is 16.9 secs Computing kpt #: 32 total cpu time spent up to now is 17.3 secs Computing kpt #: 33 total cpu time spent up to now is 17.8 secs Computing kpt #: 34 total cpu time spent up to now is 18.2 secs Computing kpt #: 35 total cpu time spent up to now is 18.6 secs Computing kpt #: 36 total cpu time spent up to now is 19.0 secs Computing kpt #: 37 total cpu time spent up to now is 19.4 secs Computing kpt #: 38 total cpu time spent up to now is 19.8 secs Computing kpt #: 39 total cpu time spent up to now is 20.3 secs Computing kpt #: 40 total cpu time spent up to now is 20.7 secs Computing kpt #: 41 total cpu time spent up to now is 21.2 secs Computing kpt #: 42 total cpu time spent up to now is 21.8 secs Computing kpt #: 43 total cpu time spent up to now is 22.3 secs Computing kpt #: 44 total cpu time spent up to now is 22.7 secs Computing kpt #: 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28.6 secs Computing kpt #: 61 total cpu time spent up to now is 29.0 secs Computing kpt #: 62 total cpu time spent up to now is 29.4 secs Computing kpt #: 63 total cpu time spent up to now is 29.8 secs Computing kpt #: 64 total cpu time spent up to now is 30.1 secs Computing kpt #: 65 total cpu time spent up to now is 30.5 secs Computing kpt #: 66 total cpu time spent up to now is 30.9 secs Computing kpt #: 67 total cpu time spent up to now is 31.3 secs Computing kpt #: 68 total cpu time spent up to now is 31.7 secs Computing kpt #: 69 total cpu time spent up to now is 32.0 secs Computing kpt #: 70 total cpu time spent up to now is 32.4 secs Computing kpt #: 71 total cpu time spent up to now is 32.8 secs Computing kpt #: 72 total cpu time spent up to now is 33.2 secs Computing kpt #: 73 total cpu time spent up to now is 33.6 secs Computing kpt #: 74 total cpu time spent up to now is 34.0 secs Computing kpt #: 75 total cpu time spent up to now is 34.3 secs Computing kpt #: 76 total cpu 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Computing kpt #: 92 total cpu time spent up to now is 40.9 secs Computing kpt #: 93 total cpu time spent up to now is 41.3 secs Computing kpt #: 94 total cpu time spent up to now is 41.7 secs Computing kpt #: 95 total cpu time spent up to now is 42.0 secs Computing kpt #: 96 total cpu time spent up to now is 42.4 secs Computing kpt #: 97 total cpu time spent up to now is 42.8 secs Computing kpt #: 98 total cpu time spent up to now is 43.2 secs Computing kpt #: 99 total cpu time spent up to now is 43.6 secs Computing kpt #: 100 total cpu time spent up to now is 44.0 secs Computing kpt #: 101 total cpu time spent up to now is 44.4 secs Computing kpt #: 102 total cpu time spent up to now is 44.8 secs Computing kpt #: 103 total cpu time spent up to now is 45.2 secs Computing kpt #: 104 total cpu time spent up to now is 45.6 secs Computing kpt #: 105 total cpu time spent up to now is 46.0 secs Computing kpt #: 106 total cpu time spent up to now is 46.3 secs Computing kpt #: 107 total cpu 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52.6 secs Computing kpt #: 123 total cpu time spent up to now is 53.0 secs Computing kpt #: 124 total cpu time spent up to now is 53.4 secs Computing kpt #: 125 total cpu time spent up to now is 53.8 secs Computing kpt #: 126 total cpu time spent up to now is 54.2 secs Computing kpt #: 127 total cpu time spent up to now is 54.6 secs Computing kpt #: 128 total cpu time spent up to now is 55.0 secs Computing kpt #: 129 total cpu time spent up to now is 55.5 secs Computing kpt #: 130 total cpu time spent up to now is 55.9 secs Computing kpt #: 131 total cpu time spent up to now is 56.3 secs Computing kpt #: 132 total cpu time spent up to now is 56.7 secs Computing kpt #: 133 total cpu time spent up to now is 57.1 secs Computing kpt #: 134 total cpu time spent up to now is 57.6 secs Computing kpt #: 135 total cpu time spent up to now is 58.0 secs Computing kpt #: 136 total cpu time spent up to now is 58.4 secs Computing kpt #: 137 total cpu time spent up to now is 58.8 secs Computing kpt 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spent up to now is 67.5 secs Computing kpt #: 154 total cpu time spent up to now is 68.2 secs Computing kpt #: 155 total cpu time spent up to now is 68.8 secs Computing kpt #: 156 total cpu time spent up to now is 69.4 secs Computing kpt #: 157 total cpu time spent up to now is 70.0 secs Computing kpt #: 158 total cpu time spent up to now is 70.6 secs Computing kpt #: 159 total cpu time spent up to now is 71.2 secs Computing kpt #: 160 total cpu time spent up to now is 71.8 secs Computing kpt #: 161 total cpu time spent up to now is 72.4 secs Computing kpt #: 162 total cpu time spent up to now is 73.0 secs Computing kpt #: 163 total cpu time spent up to now is 73.6 secs Computing kpt #: 164 total cpu time spent up to now is 74.2 secs Computing kpt #: 165 total cpu time spent up to now is 74.7 secs Computing kpt #: 166 total cpu time spent up to now is 75.2 secs Computing kpt #: 167 total cpu time spent up to now is 76.0 secs Computing kpt #: 168 total cpu time spent up to now is 76.6 secs Computing kpt #: 169 total cpu time spent up to now is 77.2 secs Computing kpt #: 170 total cpu time spent up to now is 77.8 secs Computing kpt #: 171 total cpu time spent up to now is 78.4 secs Computing kpt #: 172 total cpu time spent up to now is 78.9 secs Computing kpt #: 173 total cpu time spent up to now is 79.5 secs Computing kpt #: 174 total cpu time spent up to now is 80.1 secs Computing kpt #: 175 total cpu time spent up to now is 80.7 secs Computing kpt #: 176 total cpu time spent up to now is 81.3 secs Computing kpt #: 177 total cpu time spent up to now is 81.9 secs Computing kpt #: 178 total cpu time spent up to now is 82.5 secs Computing kpt #: 179 total cpu time spent up to now is 83.1 secs Computing kpt #: 180 total cpu time spent up to now is 83.6 secs Computing kpt #: 181 total cpu time spent up to now is 84.2 secs Computing kpt #: 182 total cpu time spent up to now is 84.8 secs Computing kpt #: 183 total cpu time spent up to now is 85.4 secs Computing kpt #: 184 total cpu time spent up to now is 85.9 secs Computing kpt #: 185 total cpu time spent up to now is 86.4 secs Computing kpt #: 186 total cpu time spent up to now is 86.9 secs Computing kpt #: 187 total cpu time spent up to now is 87.4 secs Computing kpt #: 188 total cpu time spent up to now is 87.9 secs Computing kpt #: 189 total cpu time spent up to now is 88.4 secs Computing kpt #: 190 total cpu time spent up to now is 88.9 secs Computing kpt #: 191 total cpu time spent up to now is 89.4 secs Computing kpt #: 192 total cpu time spent up to now is 89.8 secs Computing kpt #: 193 total cpu time spent up to now is 90.3 secs Computing kpt #: 194 total cpu time spent up to now is 90.8 secs Computing kpt #: 195 total cpu time spent up to now is 91.3 secs Computing kpt #: 196 total cpu time spent up to now is 91.7 secs Computing kpt #: 197 total cpu time spent up to now is 92.2 secs Computing kpt #: 198 total cpu time spent up to now is 92.7 secs Computing kpt #: 199 total cpu time spent up to now is 93.2 secs Computing kpt #: 200 total cpu time spent up to now is 93.7 secs Computing kpt #: 201 total cpu time spent up to now is 94.1 secs Computing kpt #: 202 total cpu time spent up to now is 94.6 secs Computing kpt #: 203 total cpu time spent up to now is 95.1 secs Computing kpt #: 204 total cpu time spent up to now is 95.6 secs Computing kpt #: 205 total cpu time spent up to now is 96.1 secs Computing kpt #: 206 total cpu time spent up to now is 96.6 secs Computing kpt #: 207 total cpu time spent up to now is 97.1 secs Computing kpt #: 208 total cpu time spent up to now is 97.6 secs Computing kpt #: 209 total cpu time spent up to now is 98.1 secs Computing kpt #: 210 total cpu time spent up to now is 98.6 secs Computing kpt #: 211 total cpu time spent up to now is 99.1 secs Computing kpt #: 212 total cpu time spent up to now is 99.6 secs Computing kpt #: 213 total cpu time spent up to now is 100.1 secs Computing kpt #: 214 total cpu time spent up to now is 100.5 secs Computing kpt #: 215 total cpu time spent up to now is 101.0 secs Computing kpt #: 216 total cpu time spent up to now is 101.5 secs Computing kpt #: 217 total cpu time spent up to now is 102.0 secs Computing kpt #: 218 total cpu time spent up to now is 102.5 secs Computing kpt #: 219 total cpu time spent up to now is 103.0 secs Computing kpt #: 220 total cpu time spent up to now is 103.4 secs Computing kpt #: 221 total cpu time spent up to now is 103.9 secs Computing kpt #: 222 total cpu time spent up to now is 104.4 secs Computing kpt #: 223 total cpu time spent up to now is 104.8 secs Computing kpt #: 224 total cpu time spent up to now is 105.3 secs Computing kpt #: 225 total cpu time spent up to now is 105.8 secs Computing kpt #: 226 total cpu time spent up to now is 106.2 secs Computing kpt #: 227 total cpu time spent up to now is 106.6 secs Computing kpt #: 228 total cpu time spent up to now is 107.1 secs Computing kpt #: 229 total cpu time spent up to now is 107.5 secs Computing kpt #: 230 total cpu time spent up to now is 108.0 secs Computing kpt #: 231 total cpu time spent up to now is 108.4 secs Computing kpt #: 232 total cpu time spent up to now is 108.8 secs Computing kpt #: 233 total cpu time spent up to now is 109.2 secs Computing kpt #: 234 total cpu time spent up to now is 109.7 secs Computing kpt #: 235 total cpu time spent up to now is 110.1 secs Computing kpt #: 236 total cpu time spent up to now is 110.5 secs Computing kpt #: 237 total cpu time spent up to now is 110.9 secs Computing kpt #: 238 total cpu time spent up to now is 111.3 secs Computing kpt #: 239 total cpu time spent up to now is 111.7 secs Computing kpt #: 240 total cpu time spent up to now is 112.1 secs Computing kpt #: 241 total cpu time spent up to now is 112.5 secs Computing kpt #: 242 total cpu time spent up to now is 112.9 secs Computing kpt #: 243 total cpu time spent up to now is 113.3 secs Computing kpt #: 244 total cpu time spent up to now is 113.7 secs Computing kpt #: 245 total cpu time spent up to now is 114.1 secs Computing kpt #: 246 total cpu time spent up to now is 114.4 secs Computing kpt #: 247 total cpu time spent up to now is 114.8 secs Computing kpt #: 248 total cpu time spent up to now is 115.2 secs Computing kpt #: 249 total cpu time spent up to now is 115.6 secs Computing kpt #: 250 total cpu time spent up to now is 116.0 secs Computing kpt #: 251 total cpu time spent up to now is 116.4 secs Computing kpt #: 252 total cpu time spent up to now is 116.7 secs Computing kpt #: 253 total cpu time spent up to now is 117.1 secs Computing kpt #: 254 total cpu time spent up to now is 117.5 secs Computing kpt #: 255 total cpu time spent up to now is 117.9 secs Computing kpt #: 256 total cpu time spent up to now is 118.3 secs Computing kpt #: 257 total cpu time spent up to now is 118.7 secs Computing kpt #: 258 total cpu time spent up to now is 119.1 secs Computing kpt #: 259 total cpu time spent up to now is 119.5 secs Computing kpt #: 260 total cpu time spent up to now is 119.9 secs Computing kpt #: 261 total cpu time spent up to now is 120.3 secs Computing kpt #: 262 total cpu time spent up to now is 120.7 secs Computing kpt #: 263 total cpu time spent up to now is 121.0 secs Computing kpt #: 264 total cpu time spent up to now is 121.4 secs Computing kpt #: 265 total cpu time spent up to now is 121.8 secs Computing kpt #: 266 total cpu time spent up to now is 122.2 secs Computing kpt #: 267 total cpu time spent up to now is 122.6 secs Computing kpt #: 268 total cpu time spent up to now is 122.9 secs Computing kpt #: 269 total cpu time spent up to now is 123.3 secs Computing kpt #: 270 total cpu time spent up to now is 123.7 secs Computing kpt #: 271 total cpu time spent up to now is 124.1 secs Computing kpt #: 272 total cpu time spent up to now is 124.5 secs Computing kpt #: 273 total cpu time spent up to now is 124.8 secs Computing kpt #: 274 total cpu time spent up to now is 125.2 secs Computing kpt #: 275 total cpu time spent up to now is 125.6 secs Computing kpt #: 276 total cpu time spent up to now is 126.0 secs Computing kpt #: 277 total cpu time spent up to now is 126.4 secs Computing kpt #: 278 total cpu time spent up to now is 126.7 secs Computing kpt #: 279 total cpu time spent up to now is 127.1 secs Computing kpt #: 280 total cpu time spent up to now is 127.5 secs Computing kpt #: 281 total cpu time spent up to now is 127.9 secs Computing kpt #: 282 total cpu time spent up to now is 128.3 secs Computing kpt #: 283 total cpu time spent up to now is 128.6 secs Computing kpt #: 284 total cpu time spent up to now is 129.0 secs Computing kpt #: 285 total cpu time spent up to now is 129.4 secs Computing kpt #: 286 total cpu time spent up to now is 129.8 secs Computing kpt #: 287 total cpu time spent up to now is 130.2 secs Computing kpt #: 288 total cpu time spent up to now is 130.6 secs Computing kpt #: 289 total cpu time spent up to now is 131.0 secs Computing kpt #: 290 total cpu time spent up to now is 131.5 secs Computing kpt #: 291 total cpu time spent up to now is 131.9 secs Computing kpt #: 292 total cpu time spent up to now is 132.3 secs Computing kpt #: 293 total cpu time spent up to now is 132.7 secs Computing kpt #: 294 total cpu time spent up to now is 133.1 secs Computing kpt #: 295 total cpu time spent up to now is 133.6 secs Computing kpt #: 296 total cpu time spent up to now is 134.0 secs Computing kpt #: 297 total cpu time spent up to now is 134.4 secs Computing kpt #: 298 total cpu time spent up to now is 134.9 secs Computing kpt #: 299 total cpu time spent up to now is 135.3 secs Computing kpt #: 300 total cpu time spent up to now is 135.7 secs Computing kpt #: 301 total cpu time spent up to now is 136.2 secs Computing kpt #: 302 total cpu time spent up to now is 136.6 secs Computing kpt #: 303 total cpu time spent up to now is 137.1 secs Computing kpt #: 304 total cpu time spent up to now is 137.6 secs Computing kpt #: 305 total cpu time spent up to now is 138.0 secs Computing kpt #: 306 total cpu time spent up to now is 138.5 secs Computing kpt #: 307 total cpu time spent up to now is 139.0 secs Computing kpt #: 308 total cpu time spent up to now is 139.4 secs Computing kpt #: 309 total cpu time spent up to now is 139.9 secs Computing kpt #: 310 total cpu time spent up to now is 140.4 secs Computing kpt #: 311 total cpu time spent up to now is 141.0 secs Computing kpt #: 312 total cpu time spent up to now is 141.5 secs Computing kpt #: 313 total cpu time spent up to now is 142.0 secs Computing kpt #: 314 total cpu time spent up to now is 142.5 secs Computing kpt #: 315 total cpu time spent up to now is 142.9 secs Computing kpt #: 316 total cpu time spent up to now is 143.4 secs Computing kpt #: 317 total cpu time spent up to now is 143.9 secs Computing kpt #: 318 total cpu time spent up to now is 144.3 secs Computing kpt #: 319 total cpu time spent up to now is 144.8 secs Computing kpt #: 320 total cpu time spent up to now is 145.3 secs Computing kpt #: 321 total cpu time spent up to now is 145.7 secs Computing kpt #: 322 total cpu time spent up to now is 146.2 secs Computing kpt #: 323 total cpu time spent up to now is 146.6 secs Computing kpt #: 324 total cpu time spent up to now is 147.0 secs Computing kpt #: 325 total cpu time spent up to now is 147.5 secs Computing kpt #: 326 total cpu time spent up to now is 147.9 secs Computing kpt #: 327 total cpu time spent up to now is 148.3 secs Computing kpt #: 328 total cpu time spent up to now is 148.7 secs Computing kpt #: 329 total cpu time spent up to now is 149.2 secs Computing kpt #: 330 total cpu time spent up to now is 149.6 secs Computing kpt #: 331 total cpu time spent up to now is 150.0 secs Computing kpt #: 332 total cpu time spent up to now is 150.4 secs Computing kpt #: 333 total cpu time spent up to now is 150.8 secs Computing kpt #: 334 total cpu time spent up to now is 151.2 secs Computing kpt #: 335 total cpu time spent up to now is 151.6 secs Computing kpt #: 336 total cpu time spent up to now is 152.0 secs Computing kpt #: 337 total cpu time spent up to now is 152.4 secs Computing kpt #: 338 total cpu time spent up to now is 152.8 secs Computing kpt #: 339 total cpu time spent up to now is 153.2 secs Computing kpt #: 340 total cpu time spent up to now is 153.6 secs Computing kpt #: 341 total cpu time spent up to now is 154.0 secs Computing kpt #: 342 total cpu time spent up to now is 154.3 secs Computing kpt #: 343 total cpu time spent up to now is 154.7 secs Computing kpt #: 344 total cpu time spent up to now is 155.1 secs Computing kpt #: 345 total cpu time spent up to now is 155.5 secs Computing kpt #: 346 total cpu time spent up to now is 155.8 secs Computing kpt #: 347 total cpu time spent up to now is 156.2 secs Computing kpt #: 348 total cpu time spent up to now is 156.6 secs Computing kpt #: 349 total cpu time spent up to now is 157.0 secs Computing kpt #: 350 total cpu time spent up to now is 157.4 secs Computing kpt #: 351 total cpu time spent up to now is 157.7 secs Computing kpt #: 352 total cpu time spent up to now is 158.1 secs Computing kpt #: 353 total cpu time spent up to now is 158.5 secs Computing kpt #: 354 total cpu time spent up to now is 158.9 secs Computing kpt #: 355 total cpu time spent up to now is 159.2 secs Computing kpt #: 356 total cpu time spent up to now is 159.6 secs Computing kpt #: 357 total cpu time spent up to now is 160.0 secs Computing kpt #: 358 total cpu time spent up to now is 160.4 secs Computing kpt #: 359 total cpu time spent up to now is 160.8 secs Computing kpt #: 360 total cpu time spent up to now is 161.1 secs Computing kpt #: 361 total cpu time spent up to now is 161.5 secs Computing kpt #: 362 total cpu time spent up to now is 161.9 secs Computing kpt #: 363 total cpu time spent up to now is 162.3 secs Computing kpt #: 364 total cpu time spent up to now is 162.6 secs Computing kpt #: 365 total cpu time spent up to now is 163.0 secs Computing kpt #: 366 total cpu time spent up to now is 163.4 secs ethr = 2.17E-08, avg # of iterations = 13.6 total cpu time spent up to now is 163.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0692 -0.0692 0.3680 0.3680 0.3954 0.3954 0.3954 0.3954 4.3851 4.3851 11.3596 11.3596 11.3715 11.3715 11.3715 11.3715 11.4596 11.4596 11.4596 11.4596 12.3404 12.3404 12.3404 12.3404 12.4103 12.4103 14.4130 14.4130 14.4130 14.4130 14.5161 14.5161 14.5161 14.5161 14.6033 14.6033 14.8722 14.8722 14.8722 14.8722 19.3215 19.3215 20.1536 20.1536 20.3219 20.3219 k = 0.0091-0.0052 0.0074 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0692 -0.0692 0.3680 0.3680 0.3954 0.3954 0.3954 0.3954 4.3866 4.3866 11.3531 11.3531 11.3669 11.3669 11.3722 11.3722 11.4602 11.4602 11.4699 11.4699 12.3400 12.3400 12.3405 12.3405 12.4101 12.4101 14.4125 14.4125 14.4132 14.4132 14.5149 14.5149 14.5149 14.5149 14.6018 14.6018 14.8722 14.8722 14.8724 14.8724 19.3143 19.3143 20.1477 20.1477 20.3032 20.3033 k = 0.0182-0.0105 0.0148 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0692 -0.0692 0.3680 0.3680 0.3955 0.3955 0.3955 0.3955 4.3912 4.3912 11.3285 11.3285 11.3669 11.3669 11.3741 11.3741 11.4619 11.4619 11.4922 11.4922 12.3387 12.3387 12.3411 12.3411 12.4098 12.4098 14.4107 14.4107 14.4135 14.4135 14.5111 14.5111 14.5112 14.5112 14.5973 14.5973 14.8721 14.8721 14.8729 14.8729 19.2933 19.2933 20.1243 20.1243 20.2518 20.2518 k = 0.0273-0.0157 0.0223 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0691 -0.0691 0.3680 0.3680 0.3955 0.3955 0.3955 0.3955 4.3989 4.3989 11.2958 11.2958 11.3699 11.3699 11.3774 11.3774 11.4647 11.4647 11.5181 11.5181 12.3365 12.3365 12.3420 12.3420 12.4093 12.4093 14.4078 14.4078 14.4141 14.4141 14.5049 14.5049 14.5051 14.5051 14.5898 14.5898 14.8719 14.8719 14.8736 14.8736 19.2608 19.2608 20.0761 20.0761 20.1765 20.1765 k = 0.0364-0.0210 0.0297 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0690 -0.0690 0.3681 0.3681 0.3956 0.3956 0.3956 0.3956 4.4096 4.4096 11.2594 11.2594 11.3743 11.3743 11.3820 11.3820 11.4687 11.4687 11.5447 11.5447 12.3332 12.3332 12.3433 12.3433 12.4088 12.4088 14.4036 14.4036 14.4148 14.4148 14.4963 14.4963 14.4968 14.4968 14.5796 14.5796 14.8717 14.8717 14.8745 14.8745 19.2192 19.2192 20.0058 20.0058 20.0853 20.0853 k = 0.0455-0.0262 0.0371 ( 3851 PWs) bands (ev): -77.3106 -77.3106 -42.9853 -42.9853 -41.2492 -41.2492 -41.2491 -41.2491 -0.0691 -0.0691 -0.0689 -0.0689 0.3682 0.3682 0.3956 0.3956 0.3957 0.3957 4.4233 4.4233 11.2203 11.2203 11.3802 11.3802 11.3878 11.3878 11.4737 11.4737 11.5707 11.5707 12.3285 12.3285 12.3444 12.3444 12.4080 12.4080 14.3983 14.3983 14.4142 14.4142 14.4854 14.4854 14.4864 14.4864 14.5667 14.5667 14.8714 14.8714 14.8753 14.8753 19.1708 19.1708 19.9193 19.9193 19.9831 19.9831 k = 0.0545-0.0315 0.0445 ( 3859 PWs) bands (ev): -77.3108 -77.3108 -42.9853 -42.9853 -41.2493 -41.2493 -41.2492 -41.2492 -0.0691 -0.0691 -0.0687 -0.0687 0.3682 0.3682 0.3957 0.3957 0.3959 0.3959 4.4401 4.4401 11.1794 11.1794 11.3873 11.3873 11.3950 11.3950 11.4798 11.4798 11.5963 11.5963 12.3224 12.3224 12.3458 12.3458 12.4075 12.4075 14.3913 14.3913 14.4143 14.4143 14.4730 14.4730 14.4740 14.4740 14.5514 14.5514 14.8711 14.8711 14.8760 14.8760 19.1176 19.1176 19.8214 19.8214 19.8732 19.8732 k = 0.0636-0.0367 0.0520 ( 3859 PWs) bands (ev): -77.3108 -77.3108 -42.9853 -42.9853 -41.2493 -41.2493 -41.2492 -41.2492 -0.0691 -0.0691 -0.0686 -0.0686 0.3683 0.3683 0.3959 0.3959 0.3960 0.3960 4.4599 4.4599 11.1366 11.1366 11.3958 11.3958 11.4034 11.4034 11.4871 11.4871 11.6213 11.6213 12.3148 12.3148 12.3483 12.3483 12.4080 12.4080 14.3833 14.3833 14.4131 14.4131 14.4599 14.4599 14.4601 14.4601 14.5339 14.5339 14.8707 14.8707 14.8763 14.8763 19.0610 19.0610 19.7156 19.7156 19.7581 19.7581 k = 0.0727-0.0420 0.0594 ( 3875 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2494 -41.2494 -41.2492 -41.2492 -0.0690 -0.0690 -0.0684 -0.0684 0.3684 0.3684 0.3960 0.3960 0.3962 0.3962 4.4827 4.4827 11.0921 11.0921 11.4055 11.4055 11.4131 11.4131 11.4955 11.4955 11.6453 11.6453 12.3051 12.3051 12.3500 12.3500 12.4079 12.4079 14.3738 14.3738 14.4080 14.4080 14.4446 14.4446 14.4481 14.4481 14.5142 14.5142 14.8702 14.8702 14.8761 14.8761 19.0016 19.0016 19.6032 19.6032 19.6384 19.6384 k = 0.0818-0.0472 0.0668 ( 3875 PWs) bands (ev): -77.3112 -77.3112 -42.9855 -42.9855 -41.2494 -41.2494 -41.2492 -41.2492 -0.0690 -0.0690 -0.0682 -0.0682 0.3686 0.3686 0.3961 0.3961 0.3965 0.3965 4.5085 4.5085 11.0462 11.0462 11.4165 11.4165 11.4240 11.4240 11.5050 11.5050 11.6687 11.6687 12.2941 12.2941 12.3532 12.3532 12.4095 12.4095 14.3629 14.3629 14.3966 14.3966 14.4282 14.4282 14.4412 14.4412 14.4928 14.4928 14.8697 14.8697 14.8755 14.8755 18.9403 18.9403 19.4866 19.4866 19.5161 19.5161 k = 0.0909-0.0525 0.0742 ( 3879 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2494 -41.2494 -41.2493 -41.2493 -0.0689 -0.0689 -0.0679 -0.0679 0.3687 0.3687 0.3963 0.3963 0.3967 0.3967 4.5373 4.5373 10.9989 10.9989 11.4287 11.4287 11.4361 11.4361 11.5153 11.5153 11.6916 11.6916 12.2810 12.2810 12.3565 12.3565 12.4114 12.4114 14.3498 14.3498 14.3788 14.3788 14.4109 14.4109 14.4399 14.4399 14.4698 14.4698 14.8692 14.8692 14.8741 14.8741 18.8770 18.8770 19.3664 19.3664 19.3912 19.3912 k = 0.1000-0.0577 0.0816 ( 3871 PWs) bands (ev): -77.3111 -77.3111 -42.9854 -42.9854 -41.2493 -41.2493 -41.2493 -41.2493 -0.0688 -0.0688 -0.0677 -0.0677 0.3688 0.3688 0.3964 0.3964 0.3970 0.3970 4.5691 4.5691 10.9503 10.9503 11.4421 11.4421 11.4495 11.4495 11.5270 11.5270 11.7138 11.7138 12.2664 12.2664 12.3607 12.3607 12.4144 12.4144 14.3356 14.3356 14.3567 14.3567 14.3931 14.3931 14.4418 14.4418 14.4455 14.4455 14.8685 14.8685 14.8721 14.8721 18.8120 18.8120 19.2437 19.2437 19.2648 19.2648 k = 0.1091-0.0630 0.0891 ( 3879 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2494 -41.2494 -41.2494 -41.2494 -0.0688 -0.0688 -0.0674 -0.0674 0.3690 0.3690 0.3966 0.3966 0.3973 0.3973 4.6038 4.6038 10.9004 10.9004 11.4568 11.4568 11.4641 11.4641 11.5396 11.5396 11.7349 11.7349 12.2496 12.2496 12.3648 12.3648 12.4175 12.4175 14.3194 14.3194 14.3315 14.3315 14.3748 14.3748 14.4202 14.4202 14.4434 14.4434 14.8679 14.8679 14.8693 14.8693 18.7447 18.7447 19.1187 19.1187 19.1367 19.1367 k = 0.1182-0.0682 0.0965 ( 3871 PWs) bands (ev): -77.3111 -77.3111 -42.9854 -42.9854 -41.2493 -41.2493 -41.2493 -41.2493 -0.0687 -0.0687 -0.0671 -0.0671 0.3691 0.3691 0.3967 0.3967 0.3976 0.3976 4.6414 4.6414 10.8493 10.8493 11.4726 11.4726 11.4798 11.4798 11.5535 11.5535 11.7554 11.7554 12.2318 12.2318 12.3703 12.3703 12.4222 12.4222 14.3016 14.3016 14.3046 14.3046 14.3560 14.3560 14.3945 14.3945 14.4454 14.4454 14.8659 14.8659 14.8671 14.8671 18.6750 18.6750 18.9928 18.9928 19.0083 19.0083 k = 0.1273-0.0735 0.1039 ( 3879 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2494 -41.2494 -41.2494 -41.2494 -0.0686 -0.0686 -0.0669 -0.0669 0.3693 0.3693 0.3969 0.3969 0.3980 0.3980 4.6820 4.6820 10.7973 10.7973 11.4895 11.4895 11.4967 11.4967 11.5682 11.5682 11.7750 11.7750 12.2112 12.2112 12.3756 12.3756 12.4268 12.4268 14.2759 14.2759 14.2818 14.2818 14.3360 14.3360 14.3690 14.3690 14.4475 14.4475 14.8614 14.8614 14.8664 14.8664 18.6025 18.6025 18.8653 18.8653 18.8788 18.8788 k = 0.1364-0.0787 0.1113 ( 3887 PWs) bands (ev): -77.3115 -77.3115 -42.9856 -42.9856 -41.2495 -41.2495 -41.2494 -41.2494 -0.0686 -0.0686 -0.0666 -0.0666 0.3694 0.3694 0.3970 0.3970 0.3984 0.3984 4.7254 4.7254 10.7444 10.7444 11.5075 11.5075 11.5146 11.5146 11.5841 11.5841 11.7939 11.7939 12.1896 12.1896 12.3811 12.3811 12.4317 12.4317 14.2457 14.2457 14.2606 14.2606 14.3143 14.3143 14.3449 14.3449 14.4489 14.4489 14.8564 14.8564 14.8656 14.8656 18.5265 18.5265 18.7371 18.7371 18.7488 18.7488 k = 0.1455-0.0840 0.1188 ( 3895 PWs) bands (ev): -77.3118 -77.3118 -42.9857 -42.9857 -41.2495 -41.2495 -41.2495 -41.2495 -0.0685 -0.0685 -0.0663 -0.0663 0.3696 0.3696 0.3972 0.3972 0.3988 0.3988 4.7716 4.7716 10.6908 10.6908 11.5266 11.5266 11.5337 11.5337 11.6009 11.6009 11.8121 11.8121 12.1657 12.1657 12.3873 12.3873 12.4375 12.4375 14.2144 14.2144 14.2377 14.2377 14.2903 14.2903 14.3230 14.3230 14.4511 14.4511 14.8503 14.8503 14.8647 14.8647 18.4467 18.4467 18.6085 18.6085 18.6188 18.6188 k = 0.1545-0.0892 0.1262 ( 3891 PWs) bands (ev): -77.3116 -77.3116 -42.9856 -42.9856 -41.2495 -41.2495 -41.2495 -41.2495 -0.0684 -0.0684 -0.0659 -0.0659 0.3697 0.3697 0.3973 0.3973 0.3992 0.3992 4.8207 4.8207 10.6368 10.6368 11.5468 11.5468 11.5537 11.5537 11.6188 11.6188 11.8296 11.8296 12.1408 12.1408 12.3945 12.3945 12.4443 12.4443 14.1821 14.1821 14.2130 14.2130 14.2649 14.2649 14.3029 14.3029 14.4540 14.4540 14.8438 14.8438 14.8638 14.8638 18.3625 18.3625 18.4801 18.4801 18.4891 18.4891 k = 0.1636-0.0945 0.1336 ( 3899 PWs) bands (ev): -77.3119 -77.3119 -42.9857 -42.9857 -41.2496 -41.2496 -41.2495 -41.2495 -0.0684 -0.0684 -0.0656 -0.0656 0.3699 0.3699 0.3975 0.3975 0.3997 0.3997 4.8725 4.8725 10.5822 10.5822 11.5679 11.5679 11.5748 11.5748 11.6376 11.6376 11.8460 11.8460 12.1144 12.1144 12.4015 12.4015 12.4509 12.4509 14.1489 14.1489 14.1864 14.1864 14.2392 14.2392 14.2838 14.2838 14.4559 14.4559 14.8365 14.8365 14.8629 14.8629 18.2730 18.2730 18.3515 18.3515 18.3592 18.3592 k = 0.1727-0.0997 0.1410 ( 3899 PWs) bands (ev): -77.3119 -77.3119 -42.9857 -42.9857 -41.2496 -41.2496 -41.2495 -41.2495 -0.0683 -0.0683 -0.0653 -0.0653 0.3700 0.3700 0.3976 0.3976 0.4001 0.4001 4.9270 4.9270 10.5274 10.5274 11.5899 11.5899 11.5968 11.5968 11.6574 11.6574 11.8616 11.8616 12.0865 12.0865 12.4097 12.4097 12.4588 12.4588 14.1151 14.1151 14.1577 14.1577 14.2143 14.2143 14.2654 14.2654 14.4578 14.4578 14.8285 14.8285 14.8619 14.8619 18.1778 18.1778 18.2238 18.2238 18.2300 18.2300 k = 0.1818-0.1050 0.1485 ( 3907 PWs) bands (ev): -77.3121 -77.3121 -42.9858 -42.9858 -41.2497 -41.2497 -41.2495 -41.2495 -0.0682 -0.0682 -0.0650 -0.0650 0.3702 0.3702 0.3977 0.3977 0.4007 0.4007 4.9843 4.9843 10.4723 10.4723 11.6128 11.6128 11.6196 11.6196 11.6782 11.6782 11.8758 11.8758 12.0573 12.0573 12.4184 12.4184 12.4672 12.4672 14.0807 14.0807 14.1273 14.1273 14.1904 14.1904 14.2474 14.2474 14.4581 14.4581 14.8197 14.8197 14.8609 14.8609 18.0749 18.0749 18.0983 18.0983 18.1013 18.1013 k = 0.1909-0.1102 0.1559 ( 3903 PWs) bands (ev): -77.3120 -77.3120 -42.9857 -42.9857 -41.2497 -41.2497 -41.2494 -41.2494 -0.0681 -0.0681 -0.0647 -0.0647 0.3703 0.3703 0.3978 0.3978 0.4012 0.4012 5.0441 5.0441 10.4173 10.4173 11.6364 11.6364 11.6433 11.6433 11.7001 11.7001 11.8892 11.8892 12.0271 12.0271 12.4278 12.4278 12.4765 12.4765 14.0460 14.0460 14.0954 14.0954 14.1675 14.1675 14.2299 14.2299 14.4595 14.4595 14.8106 14.8106 14.8599 14.8599 17.9597 17.9597 17.9732 17.9732 17.9803 17.9803 k = 0.2000-0.1155 0.1633 ( 3903 PWs) bands (ev): -77.3120 -77.3120 -42.9857 -42.9857 -41.2497 -41.2497 -41.2494 -41.2494 -0.0681 -0.0681 -0.0644 -0.0644 0.3705 0.3705 0.3978 0.3978 0.4017 0.4017 5.1066 5.1066 10.3625 10.3625 11.6609 11.6609 11.6677 11.6677 11.7226 11.7226 11.9012 11.9012 11.9954 11.9954 12.4381 12.4381 12.4865 12.4865 14.0111 14.0111 14.0624 14.0624 14.1451 14.1451 14.2127 14.2127 14.4605 14.4605 14.8006 14.8006 14.8589 14.8589 17.8355 17.8355 17.8460 17.8460 17.8664 17.8664 k = 0.2091-0.1207 0.1707 ( 3919 PWs) bands (ev): -77.3124 -77.3124 -42.9859 -42.9859 -41.2498 -41.2498 -41.2495 -41.2495 -0.0680 -0.0680 -0.0641 -0.0641 0.3706 0.3706 0.3979 0.3979 0.4023 0.4023 5.1715 5.1715 10.3077 10.3077 11.6859 11.6859 11.6928 11.6928 11.7454 11.7454 11.9117 11.9117 11.9627 11.9627 12.4485 12.4485 12.4968 12.4968 13.9761 13.9761 14.0287 14.0287 14.1219 14.1219 14.1959 14.1959 14.4601 14.4601 14.7898 14.7898 14.8578 14.8578 17.7096 17.7096 17.7193 17.7193 17.7495 17.7495 k = 0.2182-0.1260 0.1781 ( 3919 PWs) bands (ev): -77.3124 -77.3124 -42.9859 -42.9859 -41.2498 -41.2498 -41.2495 -41.2495 -0.0679 -0.0679 -0.0638 -0.0638 0.3708 0.3708 0.3979 0.3979 0.4029 0.4029 5.2389 5.2389 10.2534 10.2534 11.7115 11.7115 11.7184 11.7184 11.7693 11.7693 11.9207 11.9207 11.9293 11.9293 12.4604 12.4604 12.5084 12.5084 13.9412 13.9412 13.9947 13.9947 14.0995 14.0995 14.1805 14.1805 14.4602 14.4602 14.7786 14.7786 14.8567 14.8567 17.5842 17.5842 17.5939 17.5939 17.6289 17.6289 k = 0.2273-0.1312 0.1856 ( 3911 PWs) bands (ev): -77.3122 -77.3122 -42.9858 -42.9858 -41.2497 -41.2497 -41.2495 -41.2495 -0.0679 -0.0679 -0.0635 -0.0635 0.3709 0.3709 0.3979 0.3979 0.4035 0.4035 5.3087 5.3087 10.1997 10.1997 11.7375 11.7375 11.7446 11.7446 11.7934 11.7934 11.8958 11.8958 11.9284 11.9284 12.4732 12.4732 12.5210 12.5210 13.9065 13.9065 13.9607 13.9607 14.0767 14.0767 14.1663 14.1663 14.4613 14.4613 14.7668 14.7668 14.8556 14.8556 17.4593 17.4593 17.4696 17.4696 17.5053 17.5053 k = 0.2364-0.1365 0.1930 ( 3911 PWs) bands (ev): -77.3122 -77.3122 -42.9858 -42.9858 -41.2497 -41.2497 -41.2495 -41.2495 -0.0678 -0.0678 -0.0632 -0.0632 0.3710 0.3710 0.3979 0.3979 0.4041 0.4041 5.3807 5.3807 10.1464 10.1464 11.7640 11.7640 11.7712 11.7712 11.8151 11.8151 11.8648 11.8648 11.9337 11.9337 12.4868 12.4868 12.5344 12.5344 13.8722 13.8722 13.9269 13.9269 14.0533 14.0533 14.1535 14.1535 14.4603 14.4603 14.7545 14.7545 14.8545 14.8545 17.3349 17.3349 17.3464 17.3464 17.3794 17.3794 k = 0.2455-0.1417 0.2004 ( 3928 PWs) bands (ev): -77.3126 -77.3126 -42.9860 -42.9860 -41.2499 -41.2499 -41.2496 -41.2496 -0.0678 -0.0678 -0.0629 -0.0629 0.3711 0.3711 0.3979 0.3979 0.4047 0.4047 5.4550 5.4550 10.0938 10.0938 11.7905 11.7905 11.7974 11.7974 11.8128 11.8128 11.8581 11.8581 11.9368 11.9368 12.5001 12.5001 12.5475 12.5475 13.8383 13.8383 13.8933 13.8933 14.0289 14.0289 14.1420 14.1420 14.4582 14.4582 14.7415 14.7415 14.8533 14.8533 17.2101 17.2101 17.2236 17.2236 17.2523 17.2523 k = 0.2545-0.1470 0.2078 ( 3928 PWs) bands (ev): -77.3126 -77.3126 -42.9860 -42.9860 -41.2499 -41.2499 -41.2496 -41.2496 -0.0677 -0.0677 -0.0627 -0.0627 0.3712 0.3712 0.3979 0.3979 0.4053 0.4053 5.5313 5.5313 10.0419 10.0419 11.7808 11.7808 11.8172 11.8172 11.8255 11.8255 11.8804 11.8804 11.9377 11.9377 12.5156 12.5156 12.5627 12.5627 13.8052 13.8052 13.8603 13.8603 14.0039 14.0039 14.1323 14.1323 14.4559 14.4559 14.7282 14.7282 14.8522 14.8522 17.0860 17.0860 17.1028 17.1028 17.1259 17.1259 k = 0.2636-0.1522 0.2153 ( 3920 PWs) bands (ev): -77.3124 -77.3124 -42.9859 -42.9859 -41.2498 -41.2498 -41.2496 -41.2496 -0.0677 -0.0677 -0.0624 -0.0624 0.3713 0.3713 0.3978 0.3978 0.4059 0.4059 5.6097 5.6097 9.9910 9.9910 11.7457 11.7457 11.8439 11.8439 11.8527 11.8527 11.9074 11.9074 11.9363 11.9363 12.5324 12.5324 12.5793 12.5793 13.7729 13.7729 13.8281 13.8281 13.9781 13.9781 14.1240 14.1240 14.4536 14.4536 14.7145 14.7145 14.8511 14.8511 16.9618 16.9618 16.9835 16.9835 17.0014 17.0014 k = 0.2727-0.1575 0.2227 ( 3920 PWs) bands (ev): -77.3124 -77.3124 -42.9859 -42.9859 -41.2498 -41.2498 -41.2496 -41.2496 -0.0676 -0.0676 -0.0622 -0.0622 0.3714 0.3714 0.3977 0.3977 0.4066 0.4066 5.6900 5.6900 9.9409 9.9409 11.7097 11.7097 11.8701 11.8701 11.8798 11.8798 11.9323 11.9323 11.9357 11.9357 12.5498 12.5498 12.5965 12.5965 13.7416 13.7416 13.7967 13.7967 13.9515 13.9515 14.1173 14.1173 14.4498 14.4498 14.7004 14.7004 14.8500 14.8500 16.8375 16.8375 16.8654 16.8654 16.8794 16.8794 k = 0.2818-0.1627 0.2301 ( 3920 PWs) bands (ev): -77.3124 -77.3124 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0676 -0.0676 -0.0620 -0.0620 0.3715 0.3715 0.3976 0.3976 0.4072 0.4072 5.7720 5.7720 9.8918 9.8918 11.6734 11.6734 11.8947 11.8947 11.9068 11.9068 11.9266 11.9266 11.9650 11.9650 12.5682 12.5682 12.6145 12.6145 13.7115 13.7115 13.7664 13.7664 13.9241 13.9241 14.1122 14.1122 14.4451 14.4451 14.6858 14.6858 14.8488 14.8488 16.7142 16.7142 16.7487 16.7487 16.7602 16.7602 k = 0.2909-0.1680 0.2375 ( 3920 PWs) bands (ev): -77.3124 -77.3124 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0676 -0.0676 -0.0618 -0.0618 0.3715 0.3715 0.3975 0.3975 0.4078 0.4078 5.8557 5.8557 9.8438 9.8438 11.6373 11.6373 11.9062 11.9062 11.9305 11.9305 11.9335 11.9335 11.9950 11.9950 12.5875 12.5875 12.6335 12.6335 13.6827 13.6827 13.7375 13.7375 13.8960 13.8960 14.1084 14.1084 14.4395 14.4395 14.6710 14.6710 14.8477 14.8477 16.5930 16.5930 16.6336 16.6336 16.6436 16.6436 k = 0.3000-0.1732 0.2449 ( 3936 PWs) bands (ev): -77.3128 -77.3128 -42.9861 -42.9861 -41.2500 -41.2500 -41.2497 -41.2497 -0.0675 -0.0675 -0.0616 -0.0616 0.3716 0.3716 0.3973 0.3973 0.4084 0.4084 5.9408 5.9408 9.7969 9.7969 11.6012 11.6012 11.8957 11.8957 11.9523 11.9523 11.9597 11.9597 12.0253 12.0253 12.6069 12.6069 12.6526 12.6526 13.6556 13.6556 13.7099 13.7099 13.8665 13.8665 14.1060 14.1060 14.4329 14.4329 14.6556 14.6556 14.8466 14.8466 16.4750 16.4750 16.5195 16.5195 16.5289 16.5289 k = 0.3091-0.1785 0.2524 ( 3928 PWs) bands (ev): -77.3126 -77.3126 -42.9860 -42.9860 -41.2499 -41.2499 -41.2497 -41.2497 -0.0675 -0.0675 -0.0615 -0.0615 0.3717 0.3717 0.3972 0.3972 0.4091 0.4091 6.0272 6.0272 9.7511 9.7511 11.5661 11.5661 11.8787 11.8787 11.9768 11.9768 11.9856 11.9856 12.0564 12.0564 12.6287 12.6287 12.6741 12.6741 13.6303 13.6303 13.6841 13.6841 13.8373 13.8373 14.1050 14.1050 14.4248 14.4248 14.6402 14.6402 14.8455 14.8455 16.3612 16.3612 16.4081 16.4081 16.4174 16.4174 k = 0.3182-0.1837 0.2598 ( 3936 PWs) bands (ev): -77.3128 -77.3128 -42.9861 -42.9861 -41.2500 -41.2500 -41.2497 -41.2497 -0.0675 -0.0675 -0.0613 -0.0613 0.3717 0.3717 0.3970 0.3970 0.4097 0.4097 6.1146 6.1146 9.7065 9.7065 11.5314 11.5314 11.8574 11.8574 12.0009 12.0009 12.0108 12.0108 12.0880 12.0880 12.6500 12.6500 12.6951 12.6951 13.6070 13.6070 13.6603 13.6603 13.8075 13.8075 14.1052 14.1052 14.4149 14.4149 14.6244 14.6244 14.8444 14.8444 16.2522 16.2522 16.2978 16.2978 16.3078 16.3078 k = 0.3273-0.1890 0.2672 ( 3944 PWs) bands (ev): -77.3130 -77.3130 -42.9861 -42.9861 -41.2501 -41.2501 -41.2497 -41.2497 -0.0675 -0.0675 -0.0612 -0.0612 0.3718 0.3718 0.3968 0.3968 0.4103 0.4103 6.2029 6.2029 9.6632 9.6632 11.4974 11.4974 11.8323 11.8323 12.0243 12.0243 12.0352 12.0352 12.1197 12.1197 12.6718 12.6718 12.7166 12.7166 13.5861 13.5861 13.6386 13.6386 13.7764 13.7764 14.1065 14.1065 14.4052 14.4052 14.6083 14.6083 14.8434 14.8434 16.1483 16.1483 16.1893 16.1893 16.2011 16.2011 k = 0.3364-0.1942 0.2746 ( 3944 PWs) bands (ev): -77.3130 -77.3130 -42.9861 -42.9861 -41.2501 -41.2501 -41.2497 -41.2497 -0.0675 -0.0675 -0.0611 -0.0611 0.3718 0.3718 0.3966 0.3966 0.4108 0.4108 6.2919 6.2919 9.6212 9.6212 11.4645 11.4645 11.8033 11.8033 12.0471 12.0471 12.0589 12.0589 12.1519 12.1519 12.6939 12.6939 12.7385 12.7385 13.5680 13.5680 13.6194 13.6194 13.7460 13.7460 14.1091 14.1091 14.3948 14.3948 14.5921 14.5921 14.8423 14.8423 16.0494 16.0494 16.0830 16.0830 16.0981 16.0981 k = 0.3455-0.1994 0.2821 ( 3932 PWs) bands (ev): -77.3127 -77.3127 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0675 -0.0675 -0.0610 -0.0610 0.3719 0.3719 0.3964 0.3964 0.4114 0.4114 6.3812 6.3812 9.5805 9.5805 11.4327 11.4327 11.7708 11.7708 12.0693 12.0693 12.0819 12.0819 12.1844 12.1844 12.7163 12.7163 12.7609 12.7609 13.5529 13.5529 13.6030 13.6030 13.7160 13.7160 14.1128 14.1128 14.3842 14.3842 14.5758 14.5758 14.8413 14.8413 15.9543 15.9543 15.9790 15.9790 16.0005 16.0005 k = 0.3545-0.2047 0.2895 ( 3936 PWs) bands (ev): -77.3128 -77.3128 -42.9861 -42.9861 -41.2500 -41.2500 -41.2497 -41.2497 -0.0675 -0.0675 -0.0609 -0.0609 0.3719 0.3719 0.3962 0.3962 0.4119 0.4119 6.4706 6.4706 9.5411 9.5411 11.4021 11.4021 11.7346 11.7346 12.0901 12.0901 12.1037 12.1037 12.2170 12.2170 12.7374 12.7374 12.7820 12.7820 13.5413 13.5413 13.5895 13.5895 13.6856 13.6856 14.1175 14.1175 14.3719 14.3719 14.5592 14.5592 14.8403 14.8403 15.8605 15.8605 15.8767 15.8767 15.9103 15.9103 k = 0.3636-0.2099 0.2969 ( 3944 PWs) bands (ev): -77.3130 -77.3130 -42.9861 -42.9861 -41.2501 -41.2501 -41.2497 -41.2497 -0.0675 -0.0675 -0.0608 -0.0608 0.3720 0.3720 0.3960 0.3960 0.4125 0.4125 6.5596 6.5596 9.5030 9.5030 11.3727 11.3727 11.6951 11.6951 12.1097 12.1097 12.1242 12.1242 12.2495 12.2495 12.7574 12.7574 12.8022 12.8022 13.5335 13.5335 13.5788 13.5788 13.6559 13.6559 14.1231 14.1231 14.3589 14.3589 14.5425 14.5425 14.8394 14.8394 15.7662 15.7662 15.7764 15.7764 15.8300 15.8300 k = 0.3727-0.2152 0.3043 ( 3936 PWs) bands (ev): -77.3128 -77.3128 -42.9861 -42.9861 -41.2501 -41.2501 -41.2497 -41.2497 -0.0675 -0.0675 -0.0608 -0.0608 0.3720 0.3720 0.3958 0.3958 0.4130 0.4130 6.6480 6.6480 9.4662 9.4662 11.3449 11.3449 11.6529 11.6529 12.1288 12.1288 12.1442 12.1442 12.2820 12.2820 12.7767 12.7767 12.8218 12.8218 13.5298 13.5298 13.5701 13.5701 13.6285 13.6285 14.1297 14.1297 14.3460 14.3460 14.5259 14.5259 14.8384 14.8384 15.6727 15.6727 15.6792 15.6792 15.7591 15.7591 k = 0.3818-0.2204 0.3118 ( 3932 PWs) bands (ev): -77.3127 -77.3127 -42.9860 -42.9860 -41.2501 -41.2501 -41.2496 -41.2496 -0.0675 -0.0675 -0.0607 -0.0607 0.3720 0.3720 0.3956 0.3956 0.4134 0.4134 6.7352 6.7352 9.4308 9.4308 11.3188 11.3188 11.6083 11.6083 12.1469 12.1469 12.1630 12.1630 12.3143 12.3143 12.7940 12.7940 12.8396 12.8396 13.5306 13.5306 13.5599 13.5599 13.6071 13.6071 14.1373 14.1373 14.3317 14.3317 14.5093 14.5093 14.8374 14.8374 15.5804 15.5804 15.5846 15.5846 15.6964 15.6964 k = 0.3909-0.2257 0.3192 ( 3940 PWs) bands (ev): -77.3129 -77.3129 -42.9861 -42.9861 -41.2501 -41.2501 -41.2497 -41.2497 -0.0675 -0.0675 -0.0607 -0.0607 0.3720 0.3720 0.3954 0.3954 0.4139 0.4139 6.8207 6.8207 9.3967 9.3967 11.2935 11.2935 11.5619 11.5619 12.1634 12.1634 12.1804 12.1804 12.3462 12.3462 12.8088 12.8088 12.8550 12.8550 13.5360 13.5360 13.5418 13.5418 13.5983 13.5983 14.1453 14.1453 14.3184 14.3184 14.4921 14.4921 14.8365 14.8365 15.4899 15.4899 15.4923 15.4923 15.6412 15.6412 k = 0.4000-0.2309 0.3266 ( 3940 PWs) bands (ev): -77.3129 -77.3129 -42.9861 -42.9861 -41.2501 -41.2501 -41.2497 -41.2497 -0.0675 -0.0675 -0.0606 -0.0606 0.3721 0.3721 0.3952 0.3952 0.4143 0.4143 6.9041 6.9041 9.3641 9.3641 11.2703 11.2703 11.5144 11.5144 12.1790 12.1790 12.1968 12.1968 12.3775 12.3775 12.8213 12.8213 12.8683 12.8683 13.5167 13.5167 13.5461 13.5461 13.6015 13.6015 14.1543 14.1543 14.3055 14.3055 14.4752 14.4752 14.8355 14.8355 15.4024 15.4024 15.4033 15.4033 15.5927 15.5927 k = 0.4091-0.2362 0.3340 ( 3928 PWs) bands (ev): -77.3126 -77.3126 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0675 -0.0675 -0.0606 -0.0606 0.3721 0.3721 0.3950 0.3950 0.4147 0.4147 6.9847 6.9847 9.3331 9.3331 11.2490 11.2490 11.4667 11.4667 12.1939 12.1939 12.2123 12.2123 12.4081 12.4081 12.8316 12.8316 12.8794 12.8794 13.4894 13.4894 13.5606 13.5606 13.6122 13.6122 14.1640 14.1640 14.2948 14.2948 14.4584 14.4584 14.8345 14.8345 15.3181 15.3181 15.3186 15.3186 15.5505 15.5505 k = 0.4182-0.2414 0.3414 ( 3928 PWs) bands (ev): -77.3125 -77.3125 -42.9860 -42.9860 -41.2501 -41.2501 -41.2496 -41.2496 -0.0675 -0.0675 -0.0606 -0.0606 0.3721 0.3721 0.3949 0.3949 0.4150 0.4150 7.0618 7.0618 9.3036 9.3036 11.2294 11.2294 11.4195 11.4195 12.2068 12.2068 12.2259 12.2259 12.4377 12.4377 12.8392 12.8392 12.8879 12.8879 13.4630 13.4630 13.5790 13.5790 13.6282 13.6282 14.1744 14.1744 14.2833 14.2833 14.4415 14.4415 14.8334 14.8334 15.2361 15.2361 15.2380 15.2380 15.5139 15.5139 k = 0.4273-0.2467 0.3489 ( 3928 PWs) bands (ev): -77.3125 -77.3125 -42.9860 -42.9860 -41.2501 -41.2501 -41.2496 -41.2496 -0.0675 -0.0675 -0.0606 -0.0606 0.3721 0.3721 0.3947 0.3947 0.4154 0.4154 7.1345 7.1345 9.2759 9.2759 11.2117 11.2117 11.3738 11.3738 12.2189 12.2189 12.2385 12.2385 12.4660 12.4660 12.8448 12.8448 12.8943 12.8943 13.4361 13.4361 13.6008 13.6008 13.6480 13.6480 14.1854 14.1854 14.2723 14.2723 14.4247 14.4247 14.8321 14.8321 15.1588 15.1588 15.1624 15.1624 15.4826 15.4826 k = 0.4364-0.2519 0.3563 ( 3928 PWs) bands (ev): -77.3125 -77.3125 -42.9860 -42.9860 -41.2501 -41.2501 -41.2497 -41.2497 -0.0675 -0.0675 -0.0605 -0.0605 0.3721 0.3721 0.3946 0.3946 0.4156 0.4156 7.2020 7.2020 9.2502 9.2502 11.1960 11.1960 11.3306 11.3306 12.2294 12.2294 12.2495 12.2495 12.4925 12.4925 12.8485 12.8485 12.8988 12.8988 13.4104 13.4104 13.6250 13.6250 13.6707 13.6707 14.1970 14.1970 14.2632 14.2632 14.4081 14.4081 14.8305 14.8305 15.0862 15.0862 15.0919 15.0919 15.4560 15.4560 k = 0.4455-0.2572 0.3637 ( 3928 PWs) bands (ev): -77.3126 -77.3126 -42.9860 -42.9860 -41.2501 -41.2501 -41.2497 -41.2497 -0.0675 -0.0675 -0.0605 -0.0605 0.3721 0.3721 0.3944 0.3944 0.4159 0.4159 7.2635 7.2635 9.2267 9.2267 11.1823 11.1823 11.2907 11.2907 12.2389 12.2389 12.2594 12.2594 12.5170 12.5170 12.8508 12.8508 12.9018 12.9018 13.3866 13.3866 13.6505 13.6505 13.6952 13.6952 14.2092 14.2092 14.2542 14.2542 14.3917 14.3917 14.8284 14.8284 15.0197 15.0197 15.0281 15.0281 15.4339 15.4339 k = 0.4545-0.2624 0.3711 ( 3928 PWs) bands (ev): -77.3126 -77.3126 -42.9860 -42.9860 -41.2501 -41.2501 -41.2497 -41.2497 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3943 0.3943 0.4161 0.4161 7.3178 7.3178 9.2058 9.2058 11.1706 11.1706 11.2551 11.2551 12.2470 12.2470 12.2679 12.2679 12.5390 12.5390 12.8520 12.8520 12.9035 12.9035 13.3652 13.3652 13.6761 13.6761 13.7200 13.7200 14.2218 14.2218 14.2463 14.2463 14.3754 14.3754 14.8251 14.8251 14.9599 14.9599 14.9723 14.9723 15.4157 15.4157 k = 0.4636-0.2677 0.3786 ( 3920 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3942 0.3942 0.4163 0.4163 7.3641 7.3641 9.1879 9.1879 11.1611 11.1611 11.2247 11.2247 12.2541 12.2541 12.2753 12.2753 12.5581 12.5581 12.8524 12.8524 12.9045 12.9045 13.3474 13.3474 13.7003 13.7003 13.7437 13.7437 14.2348 14.2348 14.2397 14.2397 14.3595 14.3595 14.8198 14.8198 14.9085 14.9085 14.9268 14.9268 15.4013 15.4013 k = 0.4727-0.2729 0.3860 ( 3908 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3942 0.3942 0.4164 0.4164 7.4013 7.4013 9.1733 9.1733 11.1539 11.1539 11.2003 11.2003 12.2597 12.2597 12.2811 12.2811 12.5736 12.5736 12.8524 12.8524 12.9049 12.9049 13.3330 13.3330 13.7215 13.7215 13.7645 13.7645 14.2352 14.2352 14.2484 14.2484 14.3442 14.3442 14.8112 14.8112 14.8663 14.8663 14.8940 14.8940 15.3904 15.3904 k = 0.4818-0.2782 0.3934 ( 3908 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3941 0.3941 0.4165 0.4165 7.4286 7.4286 9.1626 9.1626 11.1486 11.1486 11.1823 11.1823 12.2635 12.2635 12.2851 12.2851 12.5851 12.5851 12.8522 12.8522 12.9050 12.9050 13.3217 13.3217 13.7381 13.7381 13.7810 13.7810 14.2313 14.2313 14.2616 14.2616 14.3294 14.3294 14.7996 14.7996 14.8346 14.8346 14.8746 14.8746 15.3827 15.3827 k = 0.4909-0.2834 0.4008 ( 3908 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3941 0.3941 0.4166 0.4166 7.4453 7.4453 9.1560 9.1560 11.1453 11.1453 11.1713 11.1713 12.2658 12.2658 12.2875 12.2875 12.5922 12.5922 12.8520 12.8520 12.9049 12.9049 13.3147 13.3147 13.7488 13.7488 13.7916 13.7916 14.2290 14.2290 14.2737 14.2737 14.3163 14.3163 14.7894 14.7894 14.8150 14.8150 14.8656 14.8656 15.3782 15.3782 k = 0.5000-0.2887 0.4082 ( 3892 PWs) bands (ev): -77.3115 -77.3115 -42.9857 -42.9857 -41.2498 -41.2498 -41.2495 -41.2495 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3941 0.3941 0.4166 0.4166 7.4510 7.4510 9.1537 9.1537 11.1444 11.1444 11.1676 11.1676 12.2673 12.2673 12.2890 12.2890 12.5946 12.5946 12.8519 12.8519 12.9049 12.9049 13.3129 13.3129 13.7525 13.7525 13.7953 13.7953 14.2296 14.2296 14.2802 14.2802 14.3097 14.3097 14.7858 14.7858 14.8090 14.8090 14.8633 14.8633 15.3767 15.3767 k = 0.5000-0.2887 0.4082 ( 3892 PWs) bands (ev): -77.3115 -77.3115 -42.9857 -42.9857 -41.2498 -41.2498 -41.2495 -41.2495 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3941 0.3941 0.4166 0.4166 7.4510 7.4510 9.1537 9.1537 11.1444 11.1444 11.1676 11.1676 12.2673 12.2673 12.2890 12.2890 12.5946 12.5946 12.8519 12.8519 12.9049 12.9049 13.3129 13.3129 13.7525 13.7525 13.7953 13.7953 14.2296 14.2296 14.2802 14.2802 14.3097 14.3097 14.7858 14.7858 14.8090 14.8090 14.8633 14.8633 15.3767 15.3767 k = 0.5000-0.2784 0.4155 ( 3900 PWs) bands (ev): -77.3117 -77.3117 -42.9858 -42.9858 -41.2499 -41.2499 -41.2495 -41.2495 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3941 0.3941 0.4166 0.4166 7.4513 7.4513 9.1550 9.1550 11.1422 11.1422 11.1671 11.1671 12.2668 12.2668 12.2884 12.2884 12.5963 12.5963 12.8475 12.8475 12.9011 12.9011 13.3201 13.3201 13.7503 13.7503 13.7929 13.7929 14.2298 14.2298 14.2802 14.2802 14.3085 14.3085 14.7869 14.7869 14.8089 14.8090 14.8651 14.8651 15.3767 15.3767 k = 0.5000-0.2681 0.4228 ( 3908 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3941 0.3941 0.4165 0.4165 7.4525 7.4525 9.1589 9.1589 11.1360 11.1360 11.1656 11.1656 12.2657 12.2657 12.2874 12.2874 12.6015 12.6015 12.8317 12.8317 12.8939 12.8939 13.3416 13.3416 13.7430 13.7430 13.7872 13.7872 14.2305 14.2305 14.2808 14.2808 14.3048 14.3048 14.7897 14.7897 14.8098 14.8098 14.8706 14.8706 15.3767 15.3767 k = 0.5000-0.2577 0.4301 ( 3922 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3942 0.3942 0.4165 0.4165 7.4544 7.4544 9.1654 9.1654 11.1260 11.1260 11.1632 11.1632 12.2635 12.2635 12.2861 12.2861 12.6098 12.6098 12.8021 12.8021 12.8894 12.8894 13.3723 13.3723 13.7286 13.7286 13.7807 13.7807 14.2321 14.2321 14.2819 14.2819 14.2989 14.2989 14.7916 14.7916 14.8128 14.8128 14.8803 14.8803 15.3768 15.3768 k = 0.5000-0.2474 0.4374 ( 3924 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0674 -0.0674 -0.0605 -0.0605 0.3723 0.3723 0.3943 0.3943 0.4164 0.4164 7.4570 7.4570 9.1744 9.1744 11.1120 11.1120 11.1599 11.1599 12.2609 12.2609 12.2856 12.2856 12.6208 12.6208 12.7625 12.7625 12.8880 12.8880 13.4104 13.4104 13.7066 13.7066 13.7753 13.7753 14.2350 14.2350 14.2829 14.2829 14.2911 14.2911 14.7910 14.7910 14.8197 14.8197 14.8944 14.8944 15.3769 15.3769 k = 0.5000-0.2371 0.4447 ( 3920 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0673 -0.0673 -0.0605 -0.0605 0.3724 0.3724 0.3944 0.3944 0.4162 0.4162 7.4604 7.4604 9.1860 9.1860 11.0945 11.0945 11.1556 11.1556 12.2573 12.2573 12.2859 12.2859 12.6337 12.6337 12.7179 12.7179 12.8879 12.8879 13.4520 13.4520 13.6787 13.6787 13.7710 13.7710 14.2393 14.2393 14.2800 14.2800 14.2855 14.2855 14.7876 14.7876 14.8293 14.8293 14.9126 14.9126 15.3771 15.3771 k = 0.5000-0.2268 0.4520 ( 3924 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2501 -41.2501 -41.2497 -41.2497 -0.0672 -0.0672 -0.0605 -0.0605 0.3725 0.3725 0.3945 0.3945 0.4161 0.4161 7.4645 7.4645 9.2001 9.2001 11.0732 11.0732 11.1504 11.1504 12.2529 12.2529 12.2866 12.2866 12.6428 12.6428 12.6761 12.6761 12.8881 12.8881 13.4937 13.4937 13.6473 13.6473 13.7672 13.7672 14.2436 14.2436 14.2692 14.2692 14.2861 14.2861 14.7818 14.7818 14.8400 14.8400 14.9342 14.9342 15.3772 15.3772 k = 0.5000-0.2165 0.4593 ( 3920 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0670 -0.0670 -0.0605 -0.0605 0.3726 0.3726 0.3946 0.3946 0.4159 0.4159 7.4692 7.4692 9.2167 9.2167 11.0488 11.0488 11.1442 11.1442 12.2484 12.2484 12.2882 12.2882 12.6114 12.6114 12.6754 12.6754 12.8877 12.8877 13.5324 13.5324 13.6162 13.6162 13.7637 13.7637 14.2479 14.2479 14.2577 14.2577 14.2872 14.2872 14.7747 14.7747 14.8518 14.8518 14.9585 14.9585 15.3773 15.3773 k = 0.5000-0.2062 0.4666 ( 3916 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0669 -0.0669 -0.0606 -0.0606 0.3727 0.3727 0.3948 0.3948 0.4157 0.4157 7.4745 7.4745 9.2359 9.2359 11.0208 11.0208 11.1371 11.1371 12.2440 12.2440 12.2903 12.2903 12.5628 12.5628 12.6935 12.6935 12.8860 12.8860 13.5507 13.5507 13.6039 13.6039 13.7605 13.7605 14.2411 14.2411 14.2569 14.2569 14.2879 14.2879 14.7662 14.7662 14.8641 14.8641 14.9845 14.9845 15.3775 15.3775 k = 0.5000-0.1959 0.4739 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0667 -0.0667 -0.0606 -0.0606 0.3728 0.3728 0.3950 0.3950 0.4155 0.4155 7.4803 7.4803 9.2574 9.2574 10.9898 10.9898 11.1291 11.1291 12.2397 12.2397 12.2928 12.2928 12.5131 12.5131 12.7143 12.7143 12.8824 12.8824 13.5276 13.5276 13.6308 13.6308 13.7579 13.7579 14.2271 14.2271 14.2629 14.2629 14.2887 14.2887 14.7563 14.7563 14.8767 14.8767 15.0113 15.0113 15.3776 15.3776 k = 0.5000-0.1856 0.4811 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0665 -0.0665 -0.0606 -0.0606 0.3729 0.3729 0.3952 0.3952 0.4152 0.4152 7.4866 7.4866 9.2814 9.2814 10.9556 10.9556 11.1201 11.1201 12.2361 12.2361 12.2955 12.2955 12.4642 12.4642 12.7367 12.7367 12.8762 12.8762 13.4957 13.4957 13.6652 13.6652 13.7565 13.7565 14.2122 14.2122 14.2695 14.2695 14.2893 14.2893 14.7451 14.7451 14.8893 14.8893 15.0385 15.0385 15.3776 15.3776 k = 0.5000-0.1753 0.4884 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0663 -0.0663 -0.0606 -0.0606 0.3730 0.3730 0.3954 0.3954 0.4149 0.4149 7.4933 7.4933 9.3077 9.3077 10.9185 10.9185 11.1102 11.1102 12.2336 12.2336 12.2985 12.2985 12.4169 12.4169 12.7603 12.7603 12.8668 12.8668 13.4642 13.4642 13.6957 13.6957 13.7589 13.7589 14.1968 14.1968 14.2758 14.2758 14.2900 14.2900 14.7332 14.7332 14.9020 14.9020 15.0654 15.0654 15.3776 15.3776 k = 0.5000-0.1650 0.4957 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0661 -0.0661 -0.0606 -0.0606 0.3731 0.3731 0.3957 0.3957 0.4146 0.4146 7.5003 7.5003 9.3364 9.3364 10.8790 10.8790 11.0996 11.0996 12.2316 12.2316 12.3016 12.3016 12.3717 12.3717 12.7845 12.7845 12.8540 12.8540 13.4353 13.4353 13.7153 13.7153 13.7706 13.7706 14.1813 14.1813 14.2816 14.2816 14.2924 14.2924 14.7199 14.7199 14.9144 14.9144 15.0916 15.0916 15.3776 15.3776 k = 0.5000-0.1546 0.5030 ( 3920 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0659 -0.0659 -0.0607 -0.0607 0.3732 0.3732 0.3960 0.3960 0.4143 0.4143 7.5076 7.5076 9.3673 9.3673 10.8368 10.8368 11.0882 11.0882 12.2306 12.2306 12.3034 12.3034 12.3297 12.3297 12.8089 12.8089 12.8378 12.8378 13.4096 13.4096 13.7217 13.7217 13.7932 13.7932 14.1658 14.1658 14.2853 14.2853 14.2972 14.2972 14.7057 14.7057 14.9262 14.9262 15.1170 15.1170 15.3774 15.3774 k = 0.5000-0.1443 0.5103 ( 3928 PWs) bands (ev): -77.3125 -77.3125 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0657 -0.0657 -0.0607 -0.0607 0.3733 0.3733 0.3963 0.3963 0.4140 0.4140 7.5150 7.5150 9.4005 9.4005 10.7925 10.7925 11.0761 11.0761 12.2301 12.2301 12.2862 12.2862 12.3101 12.3101 12.8139 12.8139 12.8376 12.8376 13.3873 13.3873 13.7217 13.7217 13.8200 13.8200 14.1506 14.1506 14.2873 14.2873 14.3037 14.3037 14.6901 14.6901 14.9379 14.9379 15.1411 15.1411 15.3771 15.3771 k = 0.5000-0.1340 0.5176 ( 3920 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0655 -0.0655 -0.0607 -0.0607 0.3735 0.3735 0.3966 0.3966 0.4136 0.4136 7.5226 7.5226 9.4357 9.4357 10.7464 10.7464 11.0637 11.0637 12.2290 12.2290 12.2526 12.2526 12.3126 12.3126 12.7910 12.7910 12.8626 12.8626 13.3684 13.3684 13.7196 13.7196 13.8472 13.8472 14.1358 14.1358 14.2902 14.2902 14.3117 14.3117 14.6745 14.6745 14.9494 14.9494 15.1640 15.1640 15.3766 15.3766 k = 0.5000-0.1237 0.5249 ( 3920 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0652 -0.0652 -0.0608 -0.0608 0.3736 0.3736 0.3970 0.3970 0.4133 0.4133 7.5300 7.5300 9.4731 9.4731 10.6984 10.6984 11.0509 11.0509 12.2094 12.2094 12.2403 12.2403 12.3156 12.3156 12.7639 12.7639 12.8886 12.8886 13.3524 13.3524 13.7168 13.7168 13.8727 13.8727 14.1215 14.1215 14.2933 14.2933 14.3199 14.3199 14.6575 14.6575 14.9600 14.9600 15.1855 15.1855 15.3760 15.3760 k = 0.5000-0.1134 0.5322 ( 3920 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0650 -0.0650 -0.0609 -0.0609 0.3737 0.3737 0.3974 0.3974 0.4129 0.4129 7.5374 7.5374 9.5125 9.5125 10.6489 10.6489 11.0379 11.0379 12.1788 12.1788 12.2429 12.2429 12.3191 12.3191 12.7344 12.7344 12.9148 12.9148 13.3387 13.3387 13.7136 13.7136 13.8960 13.8960 14.1078 14.1078 14.2974 14.2974 14.3274 14.3274 14.6400 14.6400 14.9704 14.9704 15.2056 15.2056 15.3751 15.3751 k = 0.5000-0.1031 0.5395 ( 3922 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0648 -0.0648 -0.0609 -0.0609 0.3738 0.3738 0.3977 0.3977 0.4125 0.4125 7.5445 7.5445 9.5537 9.5537 10.5978 10.5978 11.0251 11.0251 12.1497 12.1497 12.2485 12.2485 12.3224 12.3224 12.7031 12.7031 12.9411 12.9411 13.3266 13.3266 13.7104 13.7104 13.9173 13.9173 14.0950 14.0950 14.3024 14.3024 14.3344 14.3344 14.6219 14.6219 14.9800 14.9800 15.2242 15.2242 15.3740 15.3740 k = 0.5000-0.0928 0.5468 ( 3922 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0645 -0.0645 -0.0610 -0.0610 0.3738 0.3738 0.3981 0.3981 0.4121 0.4121 7.5513 7.5513 9.5968 9.5968 10.5455 10.5455 11.0125 11.0125 12.1235 12.1235 12.2559 12.2559 12.3256 12.3256 12.6707 12.6707 12.9671 12.9671 13.3155 13.3155 13.7073 13.7073 13.9367 13.9367 14.0830 14.0830 14.3083 14.3083 14.3416 14.3416 14.6033 14.6033 14.9888 14.9888 15.2414 15.2414 15.3726 15.3726 k = 0.5000-0.0825 0.5541 ( 3918 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2500 -41.2500 -41.2497 -41.2497 -0.0643 -0.0643 -0.0611 -0.0611 0.3739 0.3739 0.3985 0.3985 0.4117 0.4117 7.5578 7.5578 9.6417 9.6417 10.4921 10.4921 11.0004 11.0004 12.1006 12.1006 12.2651 12.2651 12.3287 12.3287 12.6379 12.6379 12.9929 12.9929 13.3049 13.3049 13.7045 13.7045 13.9540 13.9540 14.0720 14.0720 14.3153 14.3153 14.3492 14.3492 14.5844 14.5844 14.9968 14.9968 15.2572 15.2572 15.3709 15.3709 k = 0.5000-0.0722 0.5613 ( 3916 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2499 -41.2499 -41.2497 -41.2497 -0.0641 -0.0641 -0.0611 -0.0611 0.3740 0.3740 0.3989 0.3989 0.4114 0.4114 7.5637 7.5637 9.6882 9.6882 10.4378 10.4378 10.9890 10.9890 12.0801 12.0801 12.2762 12.2762 12.3315 12.3315 12.6049 12.6049 13.0182 13.0182 13.2941 13.2941 13.7018 13.7018 13.9694 13.9694 14.0621 14.0621 14.3229 14.3229 14.3559 14.3559 14.5655 14.5655 15.0041 15.0041 15.2716 15.2716 15.3689 15.3689 k = 0.5000-0.0619 0.5686 ( 3920 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0638 -0.0638 -0.0612 -0.0612 0.3741 0.3741 0.3992 0.3992 0.4110 0.4110 7.5690 7.5690 9.7362 9.7362 10.3828 10.3828 10.9787 10.9787 12.0626 12.0626 12.2886 12.2886 12.3341 12.3341 12.5725 12.5725 13.0428 13.0428 13.2830 13.2830 13.6994 13.6994 13.9820 13.9820 14.0532 14.0532 14.3313 14.3313 14.3626 14.3626 14.5459 14.5459 15.0104 15.0104 15.2848 15.2848 15.3664 15.3664 k = 0.5000-0.0515 0.5759 ( 3916 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0636 -0.0636 -0.0613 -0.0613 0.3741 0.3741 0.3996 0.3996 0.4107 0.4107 7.5736 7.5736 9.7856 9.7856 10.3275 10.3275 10.9695 10.9695 12.0480 12.0480 12.3029 12.3029 12.3363 12.3363 12.5409 12.5409 13.0665 13.0665 13.2714 13.2714 13.6974 13.6974 13.9930 13.9930 14.0456 14.0456 14.3400 14.3400 14.3704 14.3704 14.5267 14.5267 15.0158 15.0158 15.2967 15.2967 15.3635 15.3635 k = 0.5000-0.0412 0.5832 ( 3916 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2497 -41.2497 -0.0634 -0.0634 -0.0614 -0.0614 0.3741 0.3741 0.3999 0.3999 0.4104 0.4104 7.5775 7.5775 9.8363 9.8363 10.2718 10.2718 10.9617 10.9617 12.0361 12.0361 12.3187 12.3187 12.3382 12.3382 12.5102 12.5102 13.0890 13.0890 13.2592 13.2592 13.6957 13.6957 14.0028 14.0028 14.0392 14.0392 14.3476 14.3476 14.3789 14.3789 14.5073 14.5073 15.0201 15.0201 15.3074 15.3074 15.3601 15.3601 k = 0.5000-0.0309 0.5905 ( 3908 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0633 -0.0633 -0.0615 -0.0615 0.3742 0.3742 0.4001 0.4001 0.4101 0.4101 7.5806 7.5806 9.8882 9.8882 10.2160 10.2160 10.9555 10.9555 12.0270 12.0270 12.3355 12.3355 12.3414 12.3414 12.4810 12.4810 13.1098 13.1098 13.2466 13.2466 13.6944 13.6944 14.0104 14.0104 14.0341 14.0341 14.3538 14.3538 14.3896 14.3896 14.4885 14.4885 15.0241 15.0241 15.3171 15.3171 15.3561 15.3561 k = 0.5000-0.0206 0.5978 ( 3904 PWs) bands (ev): -77.3118 -77.3118 -42.9858 -42.9858 -41.2498 -41.2498 -41.2496 -41.2496 -0.0632 -0.0632 -0.0616 -0.0616 0.3742 0.3742 0.4003 0.4003 0.4099 0.4099 7.5829 7.5829 9.9410 9.9410 10.1604 10.1604 10.9510 10.9510 12.0202 12.0202 12.3410 12.3410 12.3569 12.3569 12.4533 12.4533 13.1281 13.1281 13.2344 13.2344 13.6934 13.6934 14.0161 14.0161 14.0302 14.0302 14.3577 14.3577 14.4024 14.4024 14.4704 14.4704 15.0269 15.0269 15.3257 15.3257 15.3515 15.3515 k = 0.5000-0.0103 0.6051 ( 3884 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2497 -41.2497 -41.2494 -41.2494 -0.0631 -0.0631 -0.0616 -0.0616 0.3742 0.3742 0.4004 0.4004 0.4098 0.4098 7.5843 7.5843 9.9947 9.9947 10.1052 10.1052 10.9482 10.9482 12.0167 12.0167 12.3420 12.3420 12.3785 12.3785 12.4276 12.4276 13.1420 13.1420 13.2245 13.2245 13.6929 13.6929 14.0204 14.0204 14.0275 14.0275 14.3609 14.3609 14.4168 14.4168 14.4547 14.4547 15.0286 15.0286 15.3334 15.3334 15.3463 15.3463 k = 0.5000 0.0000 0.6124 ( 3884 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2497 -41.2497 -41.2494 -41.2494 -0.0630 -0.0630 -0.0617 -0.0617 0.3742 0.3742 0.4005 0.4005 0.4098 0.4098 7.5847 7.5847 10.0431 10.0431 10.0562 10.0562 10.9473 10.9473 12.0154 12.0154 12.3423 12.3423 12.3963 12.3963 12.4081 12.4081 13.1474 13.1474 13.2202 13.2202 13.6928 13.6928 14.0219 14.0219 14.0262 14.0262 14.3617 14.3617 14.4262 14.4262 14.4442 14.4442 15.0291 15.0291 15.3398 15.3398 15.3407 15.3407 k = 0.5000 0.0000 0.6124 ( 3884 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2497 -41.2497 -41.2494 -41.2494 -0.0630 -0.0630 -0.0617 -0.0617 0.3742 0.3742 0.4005 0.4005 0.4098 0.4098 7.5847 7.5847 10.0431 10.0431 10.0562 10.0562 10.9473 10.9473 12.0154 12.0154 12.3423 12.3423 12.3963 12.3963 12.4081 12.4081 13.1474 13.1474 13.2202 13.2202 13.6928 13.6928 14.0219 14.0219 14.0262 14.0262 14.3617 14.3617 14.4262 14.4262 14.4442 14.4442 15.0291 15.0291 15.3398 15.3398 15.3407 15.3407 k = 0.4938 0.0108 0.6124 ( 3884 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2497 -41.2497 -41.2494 -41.2494 -0.0630 -0.0630 -0.0617 -0.0617 0.3742 0.3742 0.4004 0.4004 0.4098 0.4098 7.5838 7.5838 10.0114 10.0114 10.0863 10.0863 10.9502 10.9502 12.0148 12.0148 12.3395 12.3395 12.3874 12.3874 12.4210 12.4210 13.1451 13.1451 13.2229 13.2229 13.6911 13.6911 14.0210 14.0210 14.0261 14.0261 14.3595 14.3595 14.4235 14.4235 14.4518 14.4518 15.0284 15.0284 15.3378 15.3378 15.3453 15.3453 k = 0.4875 0.0217 0.6124 ( 3906 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0616 -0.0616 0.3742 0.3742 0.4004 0.4004 0.4099 0.4099 7.5812 7.5812 9.9755 9.9755 10.1170 10.1170 10.9589 10.9589 12.0128 12.0128 12.3284 12.3284 12.3819 12.3819 12.4402 12.4402 13.1387 13.1387 13.2299 13.2299 13.6861 13.6861 14.0176 14.0176 14.0252 14.0252 14.3524 14.3524 14.4228 14.4228 14.4652 14.4652 15.0256 15.0256 15.3399 15.3399 15.3514 15.3514 k = 0.4813 0.0325 0.6124 ( 3908 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0632 -0.0632 -0.0616 -0.0616 0.3742 0.3742 0.4003 0.4003 0.4100 0.4100 7.5773 7.5773 9.9411 9.9411 10.1424 10.1424 10.9735 10.9735 12.0103 12.0103 12.3122 12.3122 12.3825 12.3825 12.4621 12.4621 13.1297 13.1297 13.2401 13.2401 13.6781 13.6781 14.0144 14.0144 14.0236 14.0236 14.3434 14.3434 14.4275 14.4275 14.4816 14.4816 15.0222 15.0222 15.3465 15.3465 15.3581 15.3581 k = 0.4750 0.0433 0.6124 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0632 -0.0632 -0.0615 -0.0615 0.3742 0.3742 0.4001 0.4001 0.4101 0.4101 7.5723 7.5723 9.9083 9.9083 10.1623 10.1623 10.9937 10.9937 12.0067 12.0067 12.2936 12.2936 12.3864 12.3864 12.4857 12.4857 13.1194 13.1194 13.2521 13.2521 13.6674 13.6674 14.0108 14.0108 14.0214 14.0214 14.3329 14.3329 14.4347 14.4347 14.5001 14.5001 15.0176 15.0176 15.3580 15.3580 15.3653 15.3653 k = 0.4688 0.0541 0.6124 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0633 -0.0633 -0.0615 -0.0615 0.3742 0.3742 0.3999 0.3999 0.4102 0.4102 7.5666 7.5666 9.8772 9.8772 10.1769 10.1769 11.0186 11.0186 12.0023 12.0023 12.2744 12.2744 12.3919 12.3919 12.5110 12.5110 13.1085 13.1085 13.2652 13.2652 13.6545 13.6545 14.0067 14.0067 14.0188 14.0188 14.3218 14.3218 14.4438 14.4438 14.5202 14.5202 15.0121 15.0121 15.3724 15.3724 15.3749 15.3749 k = 0.4625 0.0650 0.6124 ( 3913 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0634 -0.0634 -0.0614 -0.0614 0.3743 0.3743 0.3997 0.3997 0.4104 0.4104 7.5602 7.5602 9.8479 9.8479 10.1868 10.1868 11.0473 11.0473 11.9971 11.9971 12.2553 12.2553 12.3982 12.3982 12.5376 12.5376 13.0972 13.0972 13.2789 13.2789 13.6396 13.6396 14.0020 14.0020 14.0158 14.0158 14.3100 14.3100 14.4537 14.4537 14.5413 14.5413 15.0056 15.0056 15.3801 15.3801 15.3959 15.3959 k = 0.4562 0.0758 0.6124 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0635 -0.0635 -0.0613 -0.0613 0.3743 0.3743 0.3995 0.3995 0.4106 0.4106 7.5536 7.5536 9.8203 9.8203 10.1927 10.1927 11.0788 11.0788 11.9912 11.9912 12.2369 12.2369 12.4048 12.4048 12.5651 12.5651 13.0860 13.0860 13.2929 13.2929 13.6235 13.6235 13.9971 13.9971 14.0127 14.0127 14.2970 14.2970 14.4649 14.4649 14.5634 14.5634 14.9984 14.9984 15.3875 15.3875 15.4218 15.4218 k = 0.4500 0.0866 0.6124 ( 3908 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0636 -0.0636 -0.0613 -0.0613 0.3743 0.3743 0.3993 0.3993 0.4108 0.4108 7.5468 7.5468 9.7947 9.7947 10.1955 10.1955 11.1121 11.1121 11.9849 11.9849 12.2196 12.2196 12.4117 12.4117 12.5932 12.5932 13.0750 13.0750 13.3069 13.3069 13.6067 13.6067 13.9925 13.9925 14.0104 14.0104 14.2830 14.2830 14.4766 14.4766 14.5863 14.5863 14.9906 14.9906 15.3947 15.3947 15.4520 15.4520 k = 0.4437 0.0974 0.6124 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0637 -0.0637 -0.0612 -0.0612 0.3743 0.3743 0.3991 0.3991 0.4110 0.4110 7.5400 7.5400 9.7709 9.7709 10.1957 10.1957 11.1460 11.1460 11.9782 11.9782 12.2031 12.2031 12.4187 12.4187 12.6212 12.6212 13.0642 13.0642 13.3206 13.3206 13.5894 13.5894 13.9875 13.9875 14.0082 14.0082 14.2679 14.2679 14.4880 14.4880 14.6091 14.6091 14.9821 14.9821 15.4015 15.4015 15.4859 15.4859 k = 0.4375 0.1083 0.6124 ( 3912 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0638 -0.0638 -0.0611 -0.0611 0.3743 0.3743 0.3988 0.3988 0.4112 0.4112 7.5333 7.5333 9.7491 9.7491 10.1941 10.1941 11.1796 11.1796 11.9712 11.9712 12.1876 12.1876 12.4255 12.4255 12.6490 12.6490 13.0539 13.0539 13.3338 13.3338 13.5723 13.5723 13.9827 13.9827 14.0066 14.0066 14.2518 14.2518 14.4996 14.4996 14.6320 14.6320 14.9727 14.9727 15.4079 15.4079 15.5229 15.5229 k = 0.4313 0.1191 0.6124 ( 3904 PWs) bands (ev): -77.3118 -77.3118 -42.9858 -42.9858 -41.2499 -41.2499 -41.2496 -41.2496 -0.0639 -0.0639 -0.0611 -0.0611 0.3744 0.3744 0.3986 0.3986 0.4114 0.4114 7.5269 7.5269 9.7293 9.7293 10.1914 10.1914 11.2124 11.2124 11.9641 11.9641 12.1736 12.1736 12.4323 12.4323 12.6762 12.6762 13.0442 13.0442 13.3464 13.3464 13.5558 13.5558 13.9781 13.9781 14.0062 14.0062 14.2349 14.2349 14.5116 14.5116 14.6551 14.6551 14.9630 14.9630 15.4138 15.4138 15.5621 15.5621 k = 0.4250 0.1299 0.6124 ( 3906 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2499 -41.2499 -41.2496 -41.2496 -0.0640 -0.0640 -0.0610 -0.0610 0.3744 0.3744 0.3984 0.3984 0.4116 0.4116 7.5210 7.5210 9.7114 9.7114 10.1879 10.1879 11.2434 11.2434 11.9569 11.9569 12.1605 12.1605 12.4385 12.4385 12.7020 12.7020 13.0350 13.0350 13.3580 13.3580 13.5402 13.5402 13.9737 13.9737 14.0068 14.0068 14.2169 14.2169 14.5225 14.5225 14.6777 14.6777 14.9520 14.9520 15.4192 15.4192 15.6025 15.6025 k = 0.4188 0.1407 0.6124 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2497 -41.2497 -0.0641 -0.0641 -0.0610 -0.0610 0.3744 0.3744 0.3982 0.3982 0.4118 0.4118 7.5155 7.5155 9.6956 9.6956 10.1840 10.1840 11.2719 11.2719 11.9498 11.9498 12.1490 12.1490 12.4442 12.4442 12.7260 12.7260 13.0267 13.0267 13.3683 13.3683 13.5258 13.5258 13.9695 13.9695 14.0082 14.0082 14.1983 14.1983 14.5317 14.5317 14.7000 14.7000 14.9406 14.9406 15.4240 15.4240 15.6429 15.6429 k = 0.4125 0.1516 0.6124 ( 3908 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0642 -0.0642 -0.0609 -0.0609 0.3745 0.3745 0.3980 0.3980 0.4119 0.4119 7.5105 7.5105 9.6819 9.6819 10.1801 10.1801 11.2980 11.2980 11.9434 11.9434 12.1393 12.1393 12.4496 12.4496 12.7481 12.7481 13.0192 13.0192 13.3774 13.3774 13.5132 13.5132 13.9659 13.9659 14.0110 14.0110 14.1803 14.1803 14.5409 14.5409 14.7221 14.7221 14.9287 14.9287 15.4282 15.4282 15.6822 15.6822 k = 0.4062 0.1624 0.6124 ( 3908 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0642 -0.0642 -0.0609 -0.0609 0.3745 0.3745 0.3978 0.3978 0.4121 0.4121 7.5062 7.5062 9.6702 9.6702 10.1765 10.1765 11.3208 11.3208 11.9374 11.9374 12.1308 12.1308 12.4544 12.4544 12.7677 12.7677 13.0127 13.0127 13.3847 13.3847 13.5025 13.5025 13.9626 13.9626 14.0149 14.0149 14.1625 14.1625 14.5486 14.5486 14.7432 14.7432 14.9160 14.9160 15.4318 15.4318 15.7187 15.7187 k = 0.4000 0.1732 0.6124 ( 3906 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2499 -41.2499 -41.2496 -41.2496 -0.0643 -0.0643 -0.0609 -0.0609 0.3745 0.3745 0.3977 0.3977 0.4122 0.4122 7.5027 7.5027 9.6607 9.6607 10.1732 10.1732 11.3401 11.3401 11.9321 11.9321 12.1239 12.1239 12.4584 12.4584 12.7843 12.7843 13.0072 13.0072 13.3903 13.3903 13.4939 13.4939 13.9599 13.9599 14.0201 14.0201 14.1456 14.1456 14.5551 14.5551 14.7637 14.7637 14.9028 14.9028 15.4347 15.4347 15.7512 15.7512 k = 0.3937 0.1840 0.6124 ( 3908 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0643 -0.0643 -0.0609 -0.0609 0.3745 0.3745 0.3976 0.3976 0.4123 0.4123 7.4998 7.4998 9.6532 9.6532 10.1706 10.1706 11.3554 11.3554 11.9277 11.9277 12.1183 12.1183 12.4615 12.4615 12.7977 12.7977 13.0028 13.0028 13.3942 13.3942 13.4875 13.4875 13.9577 13.9577 14.0264 14.0264 14.1299 14.1299 14.5601 14.5601 14.7829 14.7829 14.8890 14.8890 15.4370 15.4370 15.7783 15.7783 k = 0.3875 0.1949 0.6124 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0644 -0.0644 -0.0609 -0.0609 0.3745 0.3745 0.3975 0.3975 0.4123 0.4123 7.4978 7.4978 9.6479 9.6479 10.1686 10.1686 11.3666 11.3666 11.9244 11.9244 12.1143 12.1143 12.4638 12.4638 12.8074 12.8074 12.9996 12.9996 13.3967 13.3967 13.4833 13.4833 13.9562 13.9562 14.0325 14.0325 14.1164 14.1164 14.5639 14.5639 14.8010 14.8010 14.8747 14.8747 15.4387 15.4387 15.7986 15.7986 k = 0.3812 0.2057 0.6124 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0644 -0.0644 -0.0608 -0.0608 0.3745 0.3745 0.3974 0.3974 0.4124 0.4124 7.4965 7.4965 9.6447 9.6447 10.1674 10.1674 11.3734 11.3734 11.9224 11.9224 12.1120 12.1120 12.4653 12.4653 12.8135 12.8135 12.9977 12.9977 13.3980 13.3980 13.4809 13.4809 13.9552 13.9552 14.0382 14.0382 14.1070 14.1070 14.5661 14.5661 14.8170 14.8170 14.8612 14.8612 15.4397 15.4397 15.8112 15.8112 k = 0.3750 0.2165 0.6124 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0644 -0.0644 -0.0608 -0.0608 0.3746 0.3746 0.3974 0.3974 0.4124 0.4124 7.4961 7.4961 9.6436 9.6436 10.1670 10.1670 11.3757 11.3757 11.9217 11.9217 12.1112 12.1112 12.4658 12.4658 12.8155 12.8155 12.9970 12.9970 13.3983 13.3983 13.4801 13.4801 13.9549 13.9549 14.0404 14.0404 14.1033 14.1033 14.5668 14.5668 14.8255 14.8255 14.8535 14.8535 15.4400 15.4400 15.8155 15.8155 k = 0.3750 0.2165 0.6124 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0644 -0.0644 -0.0608 -0.0608 0.3746 0.3746 0.3974 0.3974 0.4124 0.4124 7.4961 7.4961 9.6436 9.6436 10.1670 10.1670 11.3757 11.3757 11.9217 11.9217 12.1112 12.1112 12.4658 12.4658 12.8155 12.8155 12.9970 12.9970 13.3983 13.3983 13.4801 13.4801 13.9549 13.9549 14.0404 14.0404 14.1033 14.1033 14.5668 14.5668 14.8255 14.8255 14.8535 14.8535 15.4400 15.4400 15.8155 15.8155 k = 0.3685 0.2128 0.6018 ( 3911 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2497 -41.2497 -0.0642 -0.0642 -0.0609 -0.0609 0.3747 0.3747 0.3977 0.3977 0.4121 0.4121 7.4860 7.4860 9.6934 9.6934 10.0953 10.0953 11.3958 11.3958 11.8723 11.8723 12.1047 12.1047 12.4792 12.4792 12.8065 12.8065 13.0274 13.0274 13.3706 13.3706 13.4787 13.4787 13.9317 13.9317 14.0643 14.0643 14.0895 14.0895 14.6043 14.6043 14.8267 14.8267 14.8517 14.8517 15.4530 15.4530 15.9067 15.9067 k = 0.3621 0.2090 0.5913 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0640 -0.0640 -0.0609 -0.0609 0.3749 0.3749 0.3979 0.3979 0.4118 0.4118 7.4720 7.4720 9.7453 9.7453 10.0271 10.0271 11.4164 11.4164 11.8244 11.8244 12.0991 12.0991 12.4919 12.4919 12.7984 12.7984 13.0582 13.0582 13.3420 13.3420 13.4774 13.4774 13.9085 13.9085 14.0763 14.0763 14.0889 14.0889 14.6442 14.6442 14.8279 14.8279 14.8497 14.8497 15.4678 15.4678 16.0006 16.0006 k = 0.3556 0.2053 0.5807 ( 3913 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2497 -41.2497 -0.0638 -0.0638 -0.0610 -0.0610 0.3750 0.3750 0.3981 0.3981 0.4115 0.4115 7.4535 7.4535 9.7991 9.7991 9.9632 9.9632 11.4372 11.4372 11.7776 11.7776 12.0939 12.0939 12.5033 12.5033 12.7909 12.7909 13.0892 13.0892 13.3128 13.3128 13.4754 13.4754 13.8862 13.8862 14.0648 14.0648 14.1115 14.1115 14.6859 14.6859 14.8285 14.8285 14.8482 14.8482 15.4844 15.4844 16.0969 16.0969 k = 0.3491 0.2016 0.5701 ( 3901 PWs) bands (ev): -77.3117 -77.3117 -42.9858 -42.9858 -41.2498 -41.2498 -41.2496 -41.2496 -0.0636 -0.0636 -0.0610 -0.0610 0.3751 0.3751 0.3984 0.3984 0.4112 0.4112 7.4302 7.4302 9.8545 9.8545 9.9049 9.9049 11.4584 11.4584 11.7323 11.7323 12.0901 12.0901 12.5138 12.5138 12.7850 12.7850 13.1203 13.1203 13.2834 13.2834 13.4724 13.4724 13.8654 13.8654 14.0555 14.0555 14.1335 14.1335 14.7282 14.7282 14.8294 14.8294 14.8490 14.8490 15.5030 15.5030 16.1955 16.1955 k = 0.3427 0.1978 0.5596 ( 3905 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2498 -41.2498 -41.2496 -41.2496 -0.0634 -0.0634 -0.0611 -0.0611 0.3752 0.3752 0.3985 0.3985 0.4110 0.4110 7.4015 7.4015 9.8509 9.8509 9.9132 9.9132 11.4796 11.4796 11.6883 11.6883 12.0863 12.0863 12.5220 12.5220 12.7797 12.7797 13.1508 13.1508 13.2543 13.2543 13.4680 13.4680 13.8462 13.8462 14.0469 14.0469 14.1539 14.1539 14.7659 14.7659 14.8311 14.8311 14.8547 14.8547 15.5235 15.5235 16.2961 16.2961 k = 0.3362 0.1941 0.5490 ( 3893 PWs) bands (ev): -77.3115 -77.3115 -42.9857 -42.9857 -41.2497 -41.2497 -41.2495 -41.2495 -0.0633 -0.0633 -0.0611 -0.0611 0.3753 0.3753 0.3987 0.3987 0.4107 0.4107 7.3672 7.3672 9.8048 9.8048 9.9723 9.9723 11.5007 11.5007 11.6460 11.6460 12.0833 12.0833 12.5290 12.5290 12.7760 12.7760 13.1776 13.1776 13.2287 13.2287 13.4624 13.4624 13.8291 13.8291 14.0411 14.0411 14.1740 14.1740 14.7882 14.7882 14.8354 14.8354 14.8765 14.8765 15.5463 15.5463 16.3987 16.3987 k = 0.3297 0.1904 0.5385 ( 3901 PWs) bands (ev): -77.3117 -77.3117 -42.9858 -42.9858 -41.2498 -41.2498 -41.2496 -41.2496 -0.0632 -0.0632 -0.0611 -0.0611 0.3754 0.3754 0.3989 0.3989 0.4105 0.4105 7.3271 7.3271 9.7652 9.7652 10.0333 10.0333 11.5213 11.5213 11.6051 11.6051 12.0808 12.0808 12.5329 12.5329 12.7725 12.7725 13.1784 13.1784 13.2287 13.2287 13.4552 13.4552 13.8142 13.8142 14.0364 14.0364 14.1916 14.1916 14.7917 14.7917 14.8391 14.8391 14.9188 14.9188 15.5711 15.5711 16.5031 16.5031 k = 0.3233 0.1866 0.5279 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0612 -0.0612 0.3754 0.3754 0.3990 0.3990 0.4103 0.4103 7.2810 7.2810 9.7328 9.7328 10.0957 10.0957 11.5384 11.5384 11.5692 11.5692 12.0789 12.0789 12.5340 12.5340 12.7704 12.7704 13.1523 13.1523 13.2553 13.2553 13.4471 13.4471 13.8018 13.8018 14.0335 14.0335 14.2087 14.2087 14.7872 14.7872 14.8415 14.8415 14.9722 14.9722 15.5980 15.5980 16.6092 16.6092 k = 0.3168 0.1829 0.5173 ( 3917 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2499 -41.2499 -41.2497 -41.2497 -0.0631 -0.0631 -0.0612 -0.0612 0.3755 0.3755 0.3991 0.3991 0.4102 0.4102 7.2291 7.2291 9.7078 9.7078 10.1596 10.1596 11.5210 11.5210 11.5687 11.5687 12.0776 12.0776 12.5325 12.5325 12.7690 12.7690 13.1216 13.1216 13.2857 13.2857 13.4384 13.4384 13.7919 13.7919 14.0328 14.0328 14.2245 14.2245 14.7801 14.7801 14.8435 14.8435 15.0314 15.0314 15.6272 15.6272 16.7168 16.7168 k = 0.3103 0.1792 0.5068 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0612 -0.0612 0.3755 0.3755 0.3991 0.3991 0.4100 0.4100 7.1717 7.1717 9.6902 9.6902 10.2249 10.2249 11.4860 11.4860 11.5875 11.5875 12.0772 12.0772 12.5289 12.5289 12.7682 12.7682 13.0898 13.0898 13.3160 13.3160 13.4302 13.4302 13.7848 13.7848 14.0345 14.0345 14.2403 14.2403 14.7723 14.7723 14.8456 14.8456 15.0948 15.0948 15.6590 15.6590 16.8262 16.8262 k = 0.3039 0.1754 0.4962 ( 3911 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0612 -0.0612 0.3755 0.3755 0.3992 0.3992 0.4099 0.4099 7.1089 7.1089 9.6797 9.6797 10.2914 10.2914 11.4508 11.4508 11.6071 11.6071 12.0774 12.0774 12.5221 12.5221 12.7677 12.7677 13.0574 13.0574 13.3441 13.3441 13.4246 13.4246 13.7804 13.7804 14.0369 14.0369 14.2546 14.2546 14.7637 14.7637 14.8475 14.8475 15.1615 15.1615 15.6932 15.6932 16.9367 16.9367 k = 0.2974 0.1717 0.4857 ( 3915 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0612 -0.0612 0.3755 0.3755 0.3992 0.3992 0.4097 0.4097 7.0413 7.0413 9.6761 9.6761 10.3589 10.3589 11.4166 11.4166 11.6263 11.6263 12.0782 12.0782 12.5125 12.5125 12.7670 12.7670 13.0245 13.0245 13.3648 13.3648 13.4269 13.4269 13.7786 13.7786 14.0413 14.0413 14.2675 14.2675 14.7549 14.7549 14.8494 14.8494 15.2311 15.2311 15.7299 15.7299 17.0483 17.0483 k = 0.2909 0.1680 0.4751 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0632 -0.0632 -0.0612 -0.0612 0.3754 0.3754 0.3992 0.3992 0.4096 0.4096 6.9693 6.9693 9.6791 9.6791 10.4273 10.4273 11.3839 11.3839 11.6450 11.6450 12.0797 12.0797 12.4999 12.4999 12.7655 12.7655 12.9913 12.9913 13.3723 13.3723 13.4436 13.4436 13.7792 13.7792 14.0470 14.0470 14.2800 14.2800 14.7459 14.7459 14.8513 14.8513 15.3035 15.3035 15.7693 15.7693 17.1611 17.1611 k = 0.2845 0.1642 0.4646 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0633 -0.0633 -0.0612 -0.0612 0.3754 0.3754 0.3992 0.3992 0.4095 0.4095 6.8935 6.8935 9.6882 9.6882 10.4965 10.4965 11.3527 11.3527 11.6631 11.6631 12.0818 12.0818 12.4846 12.4846 12.7638 12.7638 12.9577 12.9577 13.3712 13.3712 13.4706 13.4706 13.7823 13.7823 14.0541 14.0541 14.2917 14.2917 14.7372 14.7372 14.8532 14.8532 15.3787 15.3787 15.8114 15.8114 17.2749 17.2749 k = 0.2780 0.1605 0.4540 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0634 -0.0634 -0.0612 -0.0612 0.3753 0.3753 0.3992 0.3992 0.4094 0.4094 6.8145 6.8145 9.7029 9.7029 10.5663 10.5663 11.3231 11.3231 11.6802 11.6802 12.0845 12.0845 12.4669 12.4669 12.7610 12.7610 12.9238 12.9238 13.3685 13.3685 13.5015 13.5015 13.7874 13.7874 14.0622 14.0622 14.3027 14.3027 14.7290 14.7290 14.8551 14.8551 15.4565 15.4565 15.8564 15.8564 17.3895 17.3895 k = 0.2716 0.1568 0.4434 ( 3905 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2499 -41.2499 -41.2495 -41.2495 -0.0635 -0.0635 -0.0613 -0.0613 0.3752 0.3752 0.3991 0.3991 0.4093 0.4093 6.7328 6.7328 9.7227 9.7227 10.6365 10.6365 11.2952 11.2952 11.6967 11.6967 12.0880 12.0880 12.4471 12.4471 12.7573 12.7573 12.8896 12.8896 13.3671 13.3671 13.5339 13.5339 13.7943 13.7943 14.0720 14.0720 14.3138 14.3138 14.7215 14.7215 14.8571 14.8571 15.5371 15.5371 15.9046 15.9046 17.5052 17.5052 k = 0.2651 0.1530 0.4329 ( 3905 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2498 -41.2498 -41.2495 -41.2495 -0.0636 -0.0636 -0.0613 -0.0613 0.3751 0.3751 0.3990 0.3990 0.4092 0.4092 6.6489 6.6489 9.7472 9.7472 10.7070 10.7070 11.2685 11.2685 11.7119 11.7119 12.0918 12.0918 12.4251 12.4251 12.7513 12.7513 12.8552 12.8552 13.3682 13.3682 13.5671 13.5671 13.8026 13.8026 14.0816 14.0816 14.3233 14.3233 14.7146 14.7146 14.8589 14.8589 15.6195 15.6195 15.9557 15.9557 17.6213 17.6213 k = 0.2586 0.1493 0.4223 ( 3913 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0638 -0.0638 -0.0613 -0.0613 0.3749 0.3749 0.3990 0.3990 0.4090 0.4090 6.5633 6.5633 9.7758 9.7758 10.7774 10.7774 11.2434 11.2434 11.7259 11.7259 12.0957 12.0957 12.4014 12.4014 12.7428 12.7428 12.8205 12.8205 13.3725 13.3725 13.6005 13.6005 13.8122 13.8122 14.0911 14.0911 14.3324 14.3324 14.7086 14.7086 14.8601 14.8601 15.7040 15.7040 16.0100 16.0100 17.7379 17.7379 k = 0.2522 0.1456 0.4118 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0640 -0.0640 -0.0614 -0.0614 0.3748 0.3748 0.3989 0.3989 0.4089 0.4089 6.4765 6.4765 9.8082 9.8082 10.8475 10.8475 11.2197 11.2197 11.7387 11.7387 12.1005 12.1005 12.3760 12.3760 12.7325 12.7325 12.7857 12.7857 13.3805 13.3805 13.6341 13.6341 13.8226 13.8226 14.1018 14.1018 14.3402 14.3402 14.7035 14.7035 14.8618 14.8618 15.7906 15.7906 16.0676 16.0676 17.8547 17.8547 k = 0.2457 0.1418 0.4012 ( 3917 PWs) bands (ev): -77.3123 -77.3123 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0641 -0.0641 -0.0615 -0.0615 0.3746 0.3746 0.3988 0.3988 0.4087 0.4087 6.3890 6.3890 9.8440 9.8440 10.9173 10.9173 11.1977 11.1977 11.7503 11.7503 12.1059 12.1059 12.3498 12.3498 12.7202 12.7202 12.7510 12.7510 13.3923 13.3923 13.6677 13.6677 13.8337 13.8337 14.1131 14.1131 14.3483 14.3483 14.6997 14.6997 14.8635 14.8635 15.8793 15.8793 16.1287 16.1287 17.9719 17.9719 k = 0.2392 0.1381 0.3907 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9858 -42.9858 -41.2499 -41.2499 -41.2495 -41.2495 -0.0643 -0.0643 -0.0616 -0.0616 0.3745 0.3745 0.3987 0.3987 0.4085 0.4085 6.3011 6.3011 9.8828 9.8828 10.9863 10.9863 11.1773 11.1773 11.7609 11.7609 12.1123 12.1123 12.3229 12.3229 12.7044 12.7044 12.7178 12.7178 13.4079 13.4079 13.7014 13.7014 13.8451 13.8451 14.1249 14.1249 14.3557 14.3557 14.6973 14.6973 14.8655 14.8655 15.9701 15.9701 16.1935 16.1935 18.0891 18.0891 k = 0.2328 0.1344 0.3801 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9858 -42.9858 -41.2499 -41.2499 -41.2495 -41.2495 -0.0644 -0.0644 -0.0617 -0.0617 0.3743 0.3743 0.3986 0.3986 0.4083 0.4083 6.2133 6.2133 9.9241 9.9241 11.0541 11.0541 11.1582 11.1582 11.7700 11.7700 12.1188 12.1188 12.2954 12.2954 12.6765 12.6765 12.6950 12.6950 13.4273 13.4273 13.7348 13.7348 13.8568 13.8568 14.1367 14.1367 14.3621 14.3621 14.6959 14.6959 14.8674 14.8674 16.0625 16.0625 16.2616 16.2616 18.2060 18.2060 k = 0.2263 0.1307 0.3695 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9858 -42.9858 -41.2499 -41.2499 -41.2495 -41.2495 -0.0646 -0.0646 -0.0618 -0.0618 0.3741 0.3741 0.3985 0.3985 0.4081 0.4081 6.1257 6.1257 9.9677 9.9677 11.1206 11.1206 11.1407 11.1407 11.7775 11.7775 12.1255 12.1255 12.2680 12.2680 12.6416 12.6416 12.6773 12.6773 13.4500 13.4500 13.7680 13.7680 13.8687 13.8687 14.1487 14.1487 14.3682 14.3682 14.6960 14.6960 14.8689 14.8689 16.1563 16.1563 16.3337 16.3337 18.3226 18.3226 k = 0.2198 0.1269 0.3590 ( 3899 PWs) bands (ev): -77.3117 -77.3117 -42.9857 -42.9857 -41.2498 -41.2498 -41.2494 -41.2494 -0.0648 -0.0648 -0.0620 -0.0620 0.3739 0.3739 0.3983 0.3983 0.4078 0.4078 6.0388 6.0388 10.0132 10.0132 11.1249 11.1249 11.1853 11.1853 11.7836 11.7836 12.1328 12.1328 12.2412 12.2412 12.6059 12.6059 12.6602 12.6602 13.4761 13.4761 13.8010 13.8010 13.8807 13.8807 14.1613 14.1613 14.3742 14.3742 14.6976 14.6976 14.8707 14.8707 16.2519 16.2519 16.4098 16.4098 18.4387 18.4387 k = 0.2134 0.1232 0.3484 ( 3899 PWs) bands (ev): -77.3117 -77.3117 -42.9857 -42.9857 -41.2498 -41.2498 -41.2494 -41.2494 -0.0650 -0.0650 -0.0621 -0.0621 0.3737 0.3737 0.3982 0.3982 0.4075 0.4075 5.9527 5.9527 10.0605 10.0605 11.1105 11.1105 11.2477 11.2477 11.7883 11.7883 12.1402 12.1402 12.2151 12.2151 12.5698 12.5698 12.6418 12.6418 13.5050 13.5050 13.8333 13.8333 13.8931 13.8931 14.1736 14.1736 14.3793 14.3793 14.7002 14.7002 14.8722 14.8722 16.3486 16.3486 16.4896 16.4896 18.5539 18.5539 k = 0.2069 0.1195 0.3379 ( 3907 PWs) bands (ev): -77.3120 -77.3120 -42.9858 -42.9858 -41.2498 -41.2498 -41.2495 -41.2495 -0.0652 -0.0652 -0.0623 -0.0623 0.3734 0.3734 0.3981 0.3981 0.4072 0.4072 5.8676 5.8676 10.1091 10.1091 11.0973 11.0973 11.3071 11.3071 11.7913 11.7913 12.1476 12.1476 12.1901 12.1901 12.5334 12.5334 12.6233 12.6233 13.5365 13.5365 13.8646 13.8646 13.9064 13.9064 14.1859 14.1859 14.3831 14.3831 14.7039 14.7039 14.8735 14.8735 16.4465 16.4465 16.5730 16.5730 18.6678 18.6678 k = 0.2004 0.1157 0.3273 ( 3911 PWs) bands (ev): -77.3121 -77.3121 -42.9858 -42.9858 -41.2498 -41.2498 -41.2495 -41.2495 -0.0654 -0.0654 -0.0625 -0.0625 0.3732 0.3732 0.3980 0.3980 0.4069 0.4069 5.7839 5.7839 10.1589 10.1589 11.0860 11.0860 11.3631 11.3631 11.7929 11.7929 12.1541 12.1541 12.1684 12.1684 12.4968 12.4968 12.6040 12.6040 13.5704 13.5704 13.8932 13.8932 13.9221 13.9221 14.1982 14.1982 14.3873 14.3873 14.7089 14.7089 14.8748 14.8748 16.5455 16.5455 16.6605 16.6605 18.7804 18.7804 k = 0.1940 0.1120 0.3167 ( 3911 PWs) bands (ev): -77.3121 -77.3121 -42.9858 -42.9858 -41.2498 -41.2498 -41.2495 -41.2495 -0.0656 -0.0656 -0.0627 -0.0627 0.3730 0.3730 0.3978 0.3978 0.4065 0.4065 5.7017 5.7017 10.2096 10.2096 11.0761 11.0761 11.4150 11.4150 11.7929 11.7929 12.1442 12.1442 12.1660 12.1660 12.4601 12.4601 12.5855 12.5855 13.6062 13.6062 13.9159 13.9159 13.9439 13.9439 14.2107 14.2107 14.3912 14.3912 14.7149 14.7149 14.8761 14.8761 16.6456 16.6456 16.7522 16.7522 18.8913 18.8913 k = 0.1875 0.1083 0.3062 ( 3889 PWs) bands (ev): -77.3115 -77.3115 -42.9856 -42.9856 -41.2497 -41.2497 -41.2493 -41.2493 -0.0657 -0.0657 -0.0630 -0.0630 0.3728 0.3728 0.3977 0.3977 0.4062 0.4062 5.6212 5.6212 10.2611 10.2611 11.0682 11.0682 11.4620 11.4620 11.7917 11.7917 12.1283 12.1283 12.1750 12.1750 12.4233 12.4233 12.5675 12.5675 13.6437 13.6437 13.9328 13.9328 13.9716 13.9716 14.2239 14.2239 14.3963 14.3963 14.7222 14.7222 14.8779 14.8779 16.7467 16.7467 16.8484 16.8484 19.0006 19.0006 k = 0.1810 0.1045 0.2956 ( 3889 PWs) bands (ev): -77.3115 -77.3115 -42.9856 -42.9856 -41.2497 -41.2497 -41.2493 -41.2493 -0.0659 -0.0659 -0.0632 -0.0632 0.3725 0.3725 0.3976 0.3976 0.4057 0.4057 5.5424 5.5424 10.3131 10.3131 11.0613 11.0613 11.5029 11.5029 11.7887 11.7887 12.1150 12.1150 12.1836 12.1836 12.3864 12.3864 12.5501 12.5501 13.6826 13.6826 13.9479 13.9479 14.0014 14.0014 14.2362 14.2362 14.3995 14.3995 14.7298 14.7298 14.8789 14.8789 16.8485 16.8485 16.9479 16.9479 19.1069 19.1069 k = 0.1746 0.1008 0.2851 ( 3889 PWs) bands (ev): -77.3115 -77.3115 -42.9856 -42.9856 -41.2497 -41.2497 -41.2493 -41.2493 -0.0661 -0.0661 -0.0634 -0.0634 0.3723 0.3723 0.3975 0.3975 0.4053 0.4053 5.4656 5.4656 10.3653 10.3653 11.0560 11.0560 11.5368 11.5368 11.7842 11.7842 12.1065 12.1065 12.1924 12.1924 12.3494 12.3494 12.5334 12.5334 13.7226 13.7226 13.9631 13.9631 14.0316 14.0316 14.2485 14.2485 14.4024 14.4024 14.7380 14.7380 14.8800 14.8800 16.9510 16.9510 17.0514 17.0514 19.2103 19.2103 k = 0.1681 0.0971 0.2745 ( 3897 PWs) bands (ev): -77.3117 -77.3117 -42.9857 -42.9857 -41.2497 -41.2497 -41.2494 -41.2494 -0.0663 -0.0663 -0.0637 -0.0637 0.3720 0.3720 0.3973 0.3973 0.4049 0.4049 5.3908 5.3908 10.4177 10.4177 11.0520 11.0520 11.5632 11.5632 11.7784 11.7784 12.1029 12.1029 12.2014 12.2014 12.3123 12.3123 12.5172 12.5172 13.7634 13.7634 13.9791 13.9791 14.0617 14.0617 14.2604 14.2604 14.4047 14.4047 14.7465 14.7465 14.8809 14.8809 17.0540 17.0540 17.1583 17.1583 19.3103 19.3103 k = 0.1616 0.0933 0.2640 ( 3897 PWs) bands (ev): -77.3117 -77.3117 -42.9857 -42.9857 -41.2498 -41.2498 -41.2493 -41.2493 -0.0665 -0.0665 -0.0640 -0.0640 0.3718 0.3718 0.3972 0.3972 0.4044 0.4044 5.3182 5.3182 10.4700 10.4700 11.0496 11.0496 11.5816 11.5816 11.7712 11.7712 12.1057 12.1057 12.2104 12.2104 12.2755 12.2755 12.5014 12.5014 13.8048 13.8048 13.9964 13.9964 14.0914 14.0914 14.2722 14.2722 14.4074 14.4074 14.7555 14.7555 14.8818 14.8818 17.1575 17.1575 17.2697 17.2697 19.4065 19.4065 k = 0.1552 0.0896 0.2534 ( 3893 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2497 -41.2497 -41.2493 -41.2493 -0.0667 -0.0667 -0.0642 -0.0642 0.3716 0.3716 0.3971 0.3971 0.4039 0.4039 5.2479 5.2479 10.5220 10.5220 11.0487 11.0487 11.5923 11.5923 11.7628 11.7628 12.1139 12.1139 12.2186 12.2186 12.2396 12.2396 12.4876 12.4876 13.8464 13.8464 14.0152 14.0152 14.1206 14.1206 14.2843 14.2843 14.4095 14.4095 14.7648 14.7648 14.8826 14.8826 17.2614 17.2614 17.3848 17.3848 19.4984 19.4984 k = 0.1487 0.0859 0.2428 ( 3897 PWs) bands (ev): -77.3118 -77.3118 -42.9857 -42.9857 -41.2497 -41.2497 -41.2493 -41.2493 -0.0668 -0.0668 -0.0645 -0.0645 0.3713 0.3713 0.3970 0.3970 0.4034 0.4034 5.1799 5.1799 10.5737 10.5737 11.0491 11.0491 11.5959 11.5959 11.7533 11.7533 12.1261 12.1261 12.1995 12.1995 12.2307 12.2307 12.4750 12.4750 13.8879 13.8879 14.0356 14.0356 14.1492 14.1492 14.2959 14.2959 14.4108 14.4108 14.7739 14.7739 14.8831 14.8831 17.3657 17.3657 17.5032 17.5032 19.5853 19.5853 k = 0.1422 0.0821 0.2323 ( 3889 PWs) bands (ev): -77.3115 -77.3115 -42.9856 -42.9856 -41.2497 -41.2497 -41.2493 -41.2493 -0.0670 -0.0670 -0.0648 -0.0648 0.3711 0.3711 0.3968 0.3968 0.4029 0.4029 5.1144 5.1144 10.6248 10.6248 11.0510 11.0510 11.5937 11.5937 11.7428 11.7428 12.1419 12.1419 12.1636 12.1636 12.2397 12.2397 12.4638 12.4638 13.9292 13.9292 14.0580 14.0580 14.1772 14.1772 14.3075 14.3075 14.4126 14.4126 14.7832 14.7832 14.8839 14.8839 17.4705 17.4705 17.6256 17.6256 19.6671 19.6671 k = 0.1358 0.0784 0.2217 ( 3897 PWs) bands (ev): -77.3118 -77.3118 -42.9857 -42.9857 -41.2497 -41.2497 -41.2493 -41.2493 -0.0672 -0.0672 -0.0651 -0.0651 0.3709 0.3709 0.3967 0.3967 0.4024 0.4024 5.0513 5.0513 10.6751 10.6751 11.0542 11.0542 11.5869 11.5869 11.7310 11.7310 12.1255 12.1255 12.1607 12.1607 12.2487 12.2487 12.4532 12.4532 13.9696 13.9696 14.0824 14.0824 14.2043 14.2043 14.3185 14.3185 14.4136 14.4136 14.7921 14.7921 14.8842 14.8842 17.5750 17.5750 17.7507 17.7507 19.7431 19.7431 k = 0.1293 0.0747 0.2112 ( 3885 PWs) bands (ev): -77.3114 -77.3114 -42.9856 -42.9856 -41.2496 -41.2496 -41.2493 -41.2493 -0.0674 -0.0674 -0.0654 -0.0654 0.3706 0.3706 0.3966 0.3966 0.4019 0.4019 4.9909 4.9909 10.7247 10.7247 11.0591 11.0591 11.5766 11.5766 11.7187 11.7187 12.0889 12.0889 12.1800 12.1800 12.2581 12.2581 12.4444 12.4444 14.0092 14.0092 14.1087 14.1087 14.2305 14.2305 14.3303 14.3303 14.4156 14.4156 14.8010 14.8010 14.8846 14.8846 17.6801 17.6801 17.8797 17.8797 19.8134 19.8134 k = 0.1228 0.0709 0.2006 ( 3885 PWs) bands (ev): -77.3114 -77.3114 -42.9856 -42.9856 -41.2496 -41.2496 -41.2493 -41.2493 -0.0675 -0.0675 -0.0657 -0.0657 0.3704 0.3704 0.3965 0.3965 0.4014 0.4014 4.9331 4.9331 10.7733 10.7733 11.0651 11.0651 11.5639 11.5639 11.7058 11.7058 12.0522 12.0522 12.1987 12.1987 12.2673 12.2673 12.4359 12.4359 14.0476 14.0476 14.1370 14.1370 14.2557 14.2557 14.3418 14.3418 14.4167 14.4167 14.8094 14.8094 14.8848 14.8848 17.7851 17.7851 18.0111 18.0111 19.8774 19.8774 k = 0.1164 0.0672 0.1900 ( 3879 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2495 -41.2495 -41.2493 -41.2493 -0.0677 -0.0677 -0.0660 -0.0660 0.3702 0.3702 0.3964 0.3964 0.4009 0.4009 4.8780 4.8780 10.8207 10.8207 11.0725 11.0725 11.5496 11.5496 11.6924 11.6924 12.0155 12.0155 12.2169 12.2169 12.2764 12.2764 12.4293 12.4293 14.0848 14.0848 14.1669 14.1669 14.2796 14.2796 14.3539 14.3539 14.4178 14.4178 14.8175 14.8175 14.8848 14.8848 17.8903 17.8903 18.1454 18.1454 19.9351 19.9351 k = 0.1099 0.0635 0.1795 ( 3883 PWs) bands (ev): -77.3114 -77.3114 -42.9856 -42.9856 -41.2495 -41.2495 -41.2493 -41.2493 -0.0678 -0.0678 -0.0663 -0.0663 0.3700 0.3700 0.3963 0.3963 0.4004 0.4004 4.8256 4.8256 10.8670 10.8670 11.0811 11.0811 11.5344 11.5344 11.6785 11.6785 11.9790 11.9790 12.2337 12.2337 12.2853 12.2853 12.4226 12.4226 14.1207 14.1207 14.1979 14.1979 14.3018 14.3018 14.3660 14.3660 14.4182 14.4182 14.8251 14.8251 14.8847 14.8847 17.9953 17.9953 18.2821 18.2821 19.9865 19.9865 k = 0.1034 0.0597 0.1689 ( 3885 PWs) bands (ev): -77.3115 -77.3115 -42.9856 -42.9856 -41.2495 -41.2495 -41.2493 -41.2493 -0.0680 -0.0680 -0.0666 -0.0666 0.3698 0.3698 0.3962 0.3962 0.3999 0.3999 4.7760 4.7760 10.9119 10.9119 11.0911 11.0911 11.5187 11.5187 11.6643 11.6643 11.9427 11.9427 12.2490 12.2490 12.2939 12.2939 12.4167 12.4167 14.1555 14.1555 14.2296 14.2296 14.3220 14.3220 14.3790 14.3790 14.4189 14.4189 14.8322 14.8322 14.8845 14.8845 18.1002 18.1002 18.4209 18.4209 20.0312 20.0312 k = 0.0970 0.0560 0.1584 ( 3879 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2495 -41.2495 -41.2493 -41.2493 -0.0681 -0.0681 -0.0668 -0.0668 0.3696 0.3696 0.3961 0.3961 0.3994 0.3994 4.7292 4.7292 10.9553 10.9553 11.1024 11.1024 11.5030 11.5030 11.6501 11.6501 11.9066 11.9066 12.2629 12.2629 12.3025 12.3025 12.4124 12.4124 14.1892 14.1892 14.2613 14.2613 14.3399 14.3399 14.3937 14.3937 14.4197 14.4197 14.8388 14.8388 14.8843 14.8843 18.2051 18.2051 18.5618 18.5618 20.0507 20.0507 k = 0.0905 0.0523 0.1478 ( 3879 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2495 -41.2495 -41.2493 -41.2493 -0.0683 -0.0683 -0.0671 -0.0671 0.3694 0.3694 0.3960 0.3960 0.3989 0.3989 4.6853 4.6853 10.9972 10.9972 11.1149 11.1149 11.4875 11.4875 11.6356 11.6356 11.8708 11.8708 12.2749 12.2749 12.3102 12.3102 12.4087 12.4087 14.2216 14.2216 14.2923 14.2923 14.3551 14.3551 14.4098 14.4098 14.4207 14.4207 14.8447 14.8447 14.8838 14.8838 18.3095 18.3095 18.7040 18.7040 20.0576 20.0576 k = 0.0841 0.0485 0.1373 ( 3879 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2494 -41.2494 -41.2493 -41.2493 -0.0684 -0.0684 -0.0674 -0.0674 0.3692 0.3692 0.3959 0.3959 0.3985 0.3985 4.6443 4.6443 11.0374 11.0374 11.1286 11.1286 11.4724 11.4724 11.6211 11.6211 11.8353 11.8353 12.2855 12.2855 12.3174 12.3174 12.4057 12.4057 14.2529 14.2529 14.3222 14.3222 14.3678 14.3678 14.4212 14.4212 14.4274 14.4274 14.8501 14.8501 14.8833 14.8833 18.4132 18.4132 18.8472 18.8472 20.0636 20.0636 k = 0.0776 0.0448 0.1267 ( 3879 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2494 -41.2494 -41.2493 -41.2493 -0.0685 -0.0685 -0.0676 -0.0676 0.3690 0.3690 0.3959 0.3959 0.3981 0.3981 4.6063 4.6063 11.0759 11.0759 11.1435 11.1435 11.4580 11.4580 11.6066 11.6066 11.8002 11.8002 12.2946 12.2946 12.3235 12.3235 12.4039 12.4039 14.2825 14.2825 14.3501 14.3501 14.3786 14.3786 14.4226 14.4226 14.4456 14.4456 14.8548 14.8548 14.8826 14.8826 18.5160 18.5160 18.9906 18.9906 20.0696 20.0696 k = 0.0711 0.0411 0.1161 ( 3883 PWs) bands (ev): -77.3115 -77.3115 -42.9855 -42.9855 -41.2495 -41.2495 -41.2493 -41.2493 -0.0686 -0.0686 -0.0679 -0.0679 0.3689 0.3689 0.3958 0.3958 0.3977 0.3977 4.5712 4.5712 11.1125 11.1125 11.1597 11.1597 11.4444 11.4444 11.5921 11.5921 11.7655 11.7655 12.3022 12.3022 12.3284 12.3284 12.4025 12.4025 14.3101 14.3101 14.3755 14.3755 14.3882 14.3882 14.4253 14.4253 14.4642 14.4642 14.8588 14.8588 14.8818 14.8818 18.6173 18.6173 19.1335 19.1335 20.0756 20.0756 k = 0.0647 0.0373 0.1056 ( 3879 PWs) bands (ev): -77.3114 -77.3114 -42.9855 -42.9855 -41.2494 -41.2494 -41.2493 -41.2493 -0.0687 -0.0687 -0.0681 -0.0681 0.3687 0.3687 0.3957 0.3957 0.3973 0.3973 4.5390 4.5390 11.1472 11.1472 11.1772 11.1772 11.4316 11.4316 11.5778 11.5778 11.7313 11.7313 12.3094 12.3094 12.3324 12.3324 12.4020 12.4020 14.3350 14.3350 14.3937 14.3937 14.4004 14.4004 14.4306 14.4306 14.4830 14.4830 14.8623 14.8623 14.8809 14.8809 18.7166 18.7166 19.2757 19.2757 20.0826 20.0826 k = 0.0582 0.0336 0.0950 ( 3871 PWs) bands (ev): -77.3111 -77.3111 -42.9854 -42.9854 -41.2494 -41.2494 -41.2492 -41.2492 -0.0688 -0.0688 -0.0683 -0.0683 0.3686 0.3686 0.3957 0.3957 0.3969 0.3969 4.5099 4.5099 11.1797 11.1797 11.1960 11.1960 11.4199 11.4199 11.5637 11.5637 11.6977 11.6977 12.3159 12.3159 12.3356 12.3356 12.4023 12.4023 14.3563 14.3563 14.4010 14.4010 14.4185 14.4185 14.4398 14.4398 14.5016 14.5016 14.8652 14.8652 14.8800 14.8800 18.8130 18.8130 19.4160 19.4160 20.0912 20.0912 k = 0.0517 0.0299 0.0845 ( 3877 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2494 -41.2494 -41.2492 -41.2492 -0.0689 -0.0689 -0.0685 -0.0685 0.3685 0.3685 0.3956 0.3956 0.3966 0.3966 4.4838 4.4838 11.2088 11.2088 11.2171 11.2171 11.4092 11.4092 11.5495 11.5495 11.6646 11.6646 12.3210 12.3210 12.3371 12.3371 12.4025 12.4025 14.3730 14.3730 14.4049 14.4049 14.4344 14.4344 14.4526 14.4526 14.5196 14.5196 14.8674 14.8674 14.8789 14.8789 18.9054 18.9054 19.5525 19.5525 20.1015 20.1015 k = 0.0453 0.0261 0.0739 ( 3861 PWs) bands (ev): -77.3109 -77.3109 -42.9854 -42.9854 -41.2493 -41.2493 -41.2492 -41.2492 -0.0690 -0.0690 -0.0686 -0.0686 0.3683 0.3683 0.3956 0.3956 0.3964 0.3964 4.4607 4.4607 11.2325 11.2325 11.2428 11.2428 11.3997 11.3997 11.5357 11.5357 11.6323 11.6323 12.3263 12.3263 12.3388 12.3388 12.4041 12.4041 14.3857 14.3857 14.4081 14.4081 14.4500 14.4500 14.4667 14.4667 14.5368 14.5368 14.8691 14.8691 14.8778 14.8778 18.9926 18.9926 19.6846 19.6846 20.1150 20.1150 k = 0.0388 0.0224 0.0633 ( 3857 PWs) bands (ev): -77.3108 -77.3108 -42.9853 -42.9853 -41.2493 -41.2493 -41.2491 -41.2491 -0.0690 -0.0690 -0.0688 -0.0688 0.3682 0.3682 0.3955 0.3955 0.3961 0.3961 4.4407 4.4407 11.2543 11.2543 11.2691 11.2691 11.3914 11.3914 11.5219 11.5219 11.6007 11.6007 12.3301 12.3301 12.3396 12.3396 12.4054 12.4054 14.3945 14.3945 14.4098 14.4098 14.4654 14.4654 14.4797 14.4797 14.5529 14.5529 14.8704 14.8704 14.8767 14.8767 19.0730 19.0730 19.8090 19.8090 20.1319 20.1319 k = 0.0323 0.0187 0.0528 ( 3845 PWs) bands (ev): -77.3104 -77.3104 -42.9852 -42.9852 -41.2492 -41.2492 -41.2491 -41.2491 -0.0691 -0.0691 -0.0689 -0.0689 0.3682 0.3682 0.3955 0.3955 0.3959 0.3959 4.4237 4.4237 11.2764 11.2764 11.2937 11.2937 11.3843 11.3843 11.5083 11.5083 11.5701 11.5701 12.3336 12.3336 12.3403 12.3403 12.4070 12.4070 14.4011 14.4011 14.4115 14.4115 14.4798 14.4798 14.4908 14.4908 14.5673 14.5673 14.8712 14.8712 14.8756 14.8756 19.1449 19.1449 19.9227 19.9227 20.1534 20.1534 k = 0.0259 0.0149 0.0422 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0691 -0.0691 -0.0690 -0.0690 0.3681 0.3681 0.3955 0.3955 0.3957 0.3957 4.4099 4.4099 11.2986 11.2986 11.3162 11.3162 11.3785 11.3785 11.4950 11.4950 11.5406 11.5406 12.3361 12.3361 12.3408 12.3408 12.4083 12.4083 14.4059 14.4059 14.4123 14.4123 14.4925 14.4925 14.5000 14.5000 14.5798 14.5798 14.8717 14.8717 14.8745 14.8745 19.2064 19.2064 20.0195 20.0195 20.1815 20.1815 k = 0.0194 0.0112 0.0317 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0691 -0.0691 0.3680 0.3680 0.3954 0.3954 0.3956 0.3956 4.3990 4.3990 11.3205 11.3205 11.3361 11.3361 11.3741 11.3741 11.4824 11.4824 11.5128 11.5128 12.3380 12.3380 12.3406 12.3406 12.4091 12.4091 14.4091 14.4091 14.4127 14.4127 14.5026 14.5026 14.5071 14.5071 14.5898 14.5898 14.8720 14.8720 14.8736 14.8736 19.2559 19.2559 20.0899 20.0899 20.2206 20.2206 k = 0.0129 0.0075 0.0211 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0692 -0.0692 0.3680 0.3680 0.3954 0.3954 0.3955 0.3955 4.3913 4.3913 11.3407 11.3407 11.3529 11.3529 11.3713 11.3713 11.4712 11.4712 11.4876 11.4876 12.3393 12.3393 12.3405 12.3405 12.4097 12.4097 14.4113 14.4113 14.4129 14.4129 14.5101 14.5101 14.5121 14.5121 14.5972 14.5972 14.8721 14.8721 14.8728 14.8728 19.2921 19.2921 20.1297 20.1297 20.2682 20.2682 k = 0.0065 0.0037 0.0106 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0692 -0.0692 0.3680 0.3680 0.3954 0.3954 0.3954 0.3954 4.3867 4.3867 11.3552 11.3552 11.3657 11.3657 11.3707 11.3707 11.4628 11.4628 11.4679 11.4679 12.3401 12.3401 12.3404 12.3404 12.4101 12.4101 14.4126 14.4126 14.4130 14.4130 14.5146 14.5146 14.5151 14.5151 14.6018 14.6018 14.8722 14.8722 14.8724 14.8724 19.3141 19.3141 20.1481 20.1481 20.3071 20.3071 k = 0.0000 0.0000 0.0000 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0692 -0.0692 0.3680 0.3680 0.3954 0.3954 0.3954 0.3954 4.3851 4.3851 11.3596 11.3596 11.3715 11.3715 11.3715 11.3715 11.4596 11.4596 11.4596 11.4596 12.3404 12.3404 12.3404 12.3404 12.4103 12.4103 14.4130 14.4130 14.4130 14.4130 14.5161 14.5161 14.5161 14.5161 14.6033 14.6033 14.8722 14.8722 14.8722 14.8722 19.3215 19.3215 20.1536 20.1536 20.3219 20.3219 k = 0.0000 0.0000 0.0000 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0692 -0.0692 0.3680 0.3680 0.3954 0.3954 0.3954 0.3954 4.3851 4.3851 11.3596 11.3596 11.3715 11.3715 11.3715 11.3715 11.4596 11.4596 11.4596 11.4596 12.3404 12.3404 12.3404 12.3404 12.4103 12.4103 14.4130 14.4130 14.4130 14.4130 14.5161 14.5161 14.5161 14.5161 14.6033 14.6033 14.8722 14.8722 14.8722 14.8722 19.3215 19.3215 20.1536 20.1536 20.3219 20.3219 k = 0.0104 0.0060 0.0043 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0692 -0.0692 0.3680 0.3680 0.3954 0.3954 0.3954 0.3954 4.3866 4.3866 11.3559 11.3559 11.3667 11.3667 11.3691 11.3691 11.4652 11.4652 11.4654 11.4654 12.3402 12.3402 12.3403 12.3403 12.4101 12.4101 14.4127 14.4127 14.4129 14.4129 14.5146 14.5146 14.5152 14.5152 14.6018 14.6018 14.8722 14.8722 14.8724 14.8724 19.3143 19.3143 20.1485 20.1485 20.3095 20.3095 k = 0.0208 0.0120 0.0085 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0692 -0.0692 0.3680 0.3680 0.3954 0.3954 0.3955 0.3955 4.3911 4.3911 11.3456 11.3456 11.3548 11.3548 11.3636 11.3636 11.4796 11.4796 11.4800 11.4800 12.3399 12.3399 12.3400 12.3400 12.4097 12.4097 14.4118 14.4118 14.4124 14.4124 14.5100 14.5100 14.5124 14.5124 14.5974 14.5974 14.8722 14.8722 14.8728 14.8728 19.2925 19.2925 20.1335 20.1335 20.2759 20.2759 k = 0.0312 0.0180 0.0128 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0692 -0.0692 -0.0691 -0.0691 0.3680 0.3680 0.3954 0.3954 0.3956 0.3956 4.3987 4.3987 11.3314 11.3314 11.3397 11.3397 11.3559 11.3559 11.4991 11.4991 11.4996 11.4996 12.3393 12.3393 12.3394 12.3394 12.4091 12.4091 14.4102 14.4102 14.4116 14.4116 14.5025 14.5025 14.5078 14.5078 14.5902 14.5902 14.8721 14.8721 14.8735 14.8735 19.2560 19.2560 20.1091 20.1091 20.2286 20.2286 k = 0.0417 0.0241 0.0170 ( 3839 PWs) bands (ev): -77.3103 -77.3103 -42.9852 -42.9852 -41.2491 -41.2491 -41.2491 -41.2491 -0.0691 -0.0691 -0.0690 -0.0690 0.3681 0.3681 0.3954 0.3954 0.3957 0.3957 4.4092 4.4092 11.3158 11.3158 11.3237 11.3237 11.3457 11.3457 11.5216 11.5216 11.5219 11.5219 12.3385 12.3385 12.3386 12.3386 12.4082 12.4082 14.4078 14.4078 14.4105 14.4105 14.4920 14.4920 14.5014 14.5014 14.5805 14.5805 14.8719 14.8719 14.8743 14.8743 19.2043 19.2043 20.0764 20.0764 20.1758 20.1758 k = 0.0521 0.0301 0.0213 ( 3849 PWs) bands (ev): -77.3105 -77.3105 -42.9853 -42.9853 -41.2492 -41.2492 -41.2491 -41.2491 -0.0691 -0.0691 -0.0689 -0.0689 0.3682 0.3682 0.3955 0.3955 0.3959 0.3959 4.4227 4.4227 11.2998 11.2998 11.3076 11.3076 11.3329 11.3329 11.5460 11.5460 11.5460 11.5460 12.3366 12.3366 12.3374 12.3374 12.4064 12.4064 14.4039 14.4039 14.4087 14.4087 14.4787 14.4787 14.4933 14.4933 14.5686 14.5686 14.8716 14.8716 14.8751 14.8751 19.1375 19.1375 20.0362 20.0362 20.1228 20.1228 k = 0.0625 0.0361 0.0255 ( 3855 PWs) bands (ev): -77.3107 -77.3107 -42.9853 -42.9853 -41.2493 -41.2493 -41.2491 -41.2491 -0.0690 -0.0690 -0.0688 -0.0688 0.3682 0.3682 0.3955 0.3955 0.3961 0.3961 4.4392 4.4392 11.2841 11.2841 11.2919 11.2919 11.3174 11.3174 11.5714 11.5714 11.5718 11.5718 12.3349 12.3349 12.3360 12.3360 12.4047 12.4047 14.3982 14.3982 14.4064 14.4064 14.4634 14.4634 14.4837 14.4837 14.5550 14.5550 14.8711 14.8711 14.8757 14.8757 19.0561 19.0561 19.9917 19.9917 20.0726 20.0726 k = 0.0729 0.0421 0.0298 ( 3861 PWs) bands (ev): -77.3109 -77.3109 -42.9854 -42.9854 -41.2493 -41.2493 -41.2491 -41.2491 -0.0689 -0.0689 -0.0687 -0.0687 0.3683 0.3683 0.3955 0.3955 0.3964 0.3964 4.4587 4.4587 11.2690 11.2690 11.2769 11.2769 11.2994 11.2994 11.5978 11.5978 11.5988 11.5988 12.3322 12.3322 12.3347 12.3347 12.4024 12.4024 14.3898 14.3898 14.4038 14.4038 14.4468 14.4468 14.4728 14.4728 14.5402 14.5402 14.8704 14.8704 14.8762 14.8762 18.9611 18.9611 19.9458 19.9458 20.0249 20.0249 k = 0.0833 0.0481 0.0340 ( 3879 PWs) bands (ev): -77.3114 -77.3114 -42.9855 -42.9855 -41.2495 -41.2495 -41.2492 -41.2492 -0.0689 -0.0689 -0.0686 -0.0686 0.3684 0.3684 0.3955 0.3955 0.3967 0.3967 4.4812 4.4812 11.2542 11.2542 11.2624 11.2624 11.2788 11.2788 11.6250 11.6250 11.6267 11.6267 12.3292 12.3292 12.3324 12.3324 12.3994 12.3994 14.3764 14.3764 14.3996 14.3996 14.4304 14.4304 14.4607 14.4607 14.5245 14.5245 14.8693 14.8693 14.8763 14.8763 18.8540 18.8540 19.9019 19.9019 19.9789 19.9789 k = 0.0938 0.0541 0.0383 ( 3876 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2494 -41.2494 -41.2492 -41.2492 -0.0688 -0.0688 -0.0684 -0.0684 0.3686 0.3686 0.3955 0.3955 0.3970 0.3970 4.5066 4.5066 11.2398 11.2398 11.2491 11.2491 11.2563 11.2563 11.6530 11.6530 11.6554 11.6554 12.3263 12.3263 12.3310 12.3310 12.3969 12.3969 14.3576 14.3576 14.3952 14.3952 14.4163 14.4163 14.4483 14.4483 14.5088 14.5088 14.8679 14.8679 14.8760 14.8760 18.7368 18.7368 19.8620 19.8620 19.9340 19.9340 k = 0.1042 0.0601 0.0425 ( 3876 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2495 -41.2495 -41.2492 -41.2492 -0.0687 -0.0687 -0.0682 -0.0682 0.3687 0.3687 0.3956 0.3956 0.3974 0.3974 4.5350 4.5350 11.2227 11.2227 11.2348 11.2348 11.2366 11.2366 11.6816 11.6816 11.6848 11.6848 12.3224 12.3224 12.3295 12.3295 12.3939 12.3939 14.3328 14.3328 14.3889 14.3889 14.4036 14.4036 14.4363 14.4363 14.4936 14.4936 14.8661 14.8661 14.8751 14.8751 18.6115 18.6115 19.8258 19.8258 19.8898 19.8898 k = 0.1146 0.0662 0.0468 ( 3876 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2494 -41.2494 -41.2493 -41.2493 -0.0685 -0.0685 -0.0680 -0.0680 0.3689 0.3689 0.3956 0.3956 0.3978 0.3978 4.5662 4.5662 11.1970 11.1970 11.2201 11.2201 11.2250 11.2250 11.7106 11.7106 11.7148 11.7148 12.3178 12.3178 12.3278 12.3278 12.3905 12.3905 14.3038 14.3038 14.3797 14.3797 14.3906 14.3906 14.4257 14.4257 14.4797 14.4797 14.8638 14.8638 14.8737 14.8737 18.4798 18.4798 19.7935 19.7935 19.8465 19.8465 k = 0.1250 0.0722 0.0510 ( 3882 PWs) bands (ev): -77.3114 -77.3114 -42.9855 -42.9855 -41.2495 -41.2495 -41.2493 -41.2493 -0.0684 -0.0684 -0.0677 -0.0677 0.3690 0.3690 0.3957 0.3957 0.3982 0.3982 4.6004 4.6004 11.1662 11.1662 11.2087 11.2087 11.2144 11.2144 11.7399 11.7399 11.7452 11.7452 12.3121 12.3121 12.3261 12.3261 12.3867 12.3867 14.2716 14.2716 14.3668 14.3668 14.3758 14.3758 14.4172 14.4172 14.4674 14.4674 14.8609 14.8609 14.8715 14.8715 18.3433 18.3433 19.7647 19.7647 19.8042 19.8042 k = 0.1354 0.0782 0.0553 ( 3882 PWs) bands (ev): -77.3114 -77.3114 -42.9855 -42.9855 -41.2495 -41.2495 -41.2493 -41.2493 -0.0683 -0.0683 -0.0675 -0.0675 0.3692 0.3692 0.3957 0.3957 0.3987 0.3987 4.6375 4.6375 11.1320 11.1320 11.1988 11.1988 11.2047 11.2047 11.7695 11.7695 11.7758 11.7758 12.3054 12.3054 12.3251 12.3251 12.3831 12.3831 14.2373 14.2373 14.3504 14.3504 14.3586 14.3586 14.4111 14.4111 14.4576 14.4576 14.8575 14.8575 14.8687 14.8687 18.2035 18.2035 19.7390 19.7390 19.7633 19.7633 k = 0.1458 0.0842 0.0595 ( 3882 PWs) bands (ev): -77.3114 -77.3114 -42.9855 -42.9855 -41.2495 -41.2495 -41.2493 -41.2493 -0.0682 -0.0682 -0.0673 -0.0673 0.3694 0.3694 0.3957 0.3957 0.3991 0.3991 4.6774 4.6774 11.0948 11.0948 11.1900 11.1900 11.1959 11.1959 11.7990 11.7990 11.8065 11.8065 12.2977 12.2977 12.3245 12.3245 12.3797 12.3797 14.2017 14.2017 14.3315 14.3315 14.3389 14.3389 14.4064 14.4064 14.4496 14.4496 14.8536 14.8536 14.8651 14.8651 18.0615 18.0615 19.7148 19.7148 19.7254 19.7254 k = 0.1562 0.0902 0.0638 ( 3888 PWs) bands (ev): -77.3116 -77.3116 -42.9856 -42.9856 -41.2495 -41.2495 -41.2493 -41.2493 -0.0680 -0.0680 -0.0670 -0.0670 0.3696 0.3696 0.3958 0.3958 0.3997 0.3997 4.7202 4.7202 11.0545 11.0545 11.1822 11.1822 11.1881 11.1881 11.8284 11.8284 11.8373 11.8373 12.2879 12.2879 12.3242 12.3242 12.3764 12.3764 14.1654 14.1654 14.3107 14.3107 14.3170 14.3170 14.4024 14.4024 14.4433 14.4433 14.8490 14.8490 14.8608 14.8608 17.9179 17.9179 19.6825 19.6825 19.6992 19.6992 k = 0.1667 0.0962 0.0680 ( 3879 PWs) bands (ev): -77.3113 -77.3113 -42.9855 -42.9855 -41.2495 -41.2495 -41.2493 -41.2493 -0.0679 -0.0679 -0.0667 -0.0667 0.3698 0.3698 0.3958 0.3958 0.4002 0.4002 4.7657 4.7657 11.0111 11.0111 11.1755 11.1755 11.1813 11.1813 11.8575 11.8575 11.8678 11.8678 12.2778 12.2778 12.3252 12.3252 12.3745 12.3745 14.1289 14.1289 14.2885 14.2885 14.2935 14.2935 14.3996 14.3996 14.4386 14.4386 14.8439 14.8439 14.8557 14.8557 17.7740 17.7740 19.6465 19.6465 19.6813 19.6813 k = 0.1771 0.1022 0.0723 ( 3885 PWs) bands (ev): -77.3115 -77.3115 -42.9856 -42.9856 -41.2495 -41.2495 -41.2493 -41.2493 -0.0677 -0.0677 -0.0664 -0.0664 0.3700 0.3700 0.3959 0.3959 0.4008 0.4008 4.8140 4.8140 10.9642 10.9642 11.1697 11.1697 11.1752 11.1752 11.8859 11.8859 11.8977 11.8977 12.2663 12.2663 12.3264 12.3264 12.3728 12.3728 14.0927 14.0927 14.2649 14.2649 14.2682 14.2682 14.3964 14.3964 14.4343 14.4343 14.8379 14.8379 14.8496 14.8496 17.6303 17.6303 19.6114 19.6114 19.6594 19.6594 k = 0.1875 0.1083 0.0765 ( 3891 PWs) bands (ev): -77.3116 -77.3116 -42.9856 -42.9856 -41.2496 -41.2496 -41.2493 -41.2493 -0.0676 -0.0676 -0.0662 -0.0662 0.3702 0.3702 0.3959 0.3959 0.4013 0.4013 4.8651 4.8651 10.9140 10.9140 11.1647 11.1647 11.1700 11.1700 11.9135 11.9135 11.9268 11.9268 12.2536 12.2536 12.3286 12.3286 12.3724 12.3724 14.0571 14.0571 14.2404 14.2404 14.2418 14.2418 14.3933 14.3933 14.4305 14.4305 14.8314 14.8314 14.8428 14.8428 17.4872 17.4872 19.5779 19.5779 19.6231 19.6231 k = 0.1979 0.1143 0.0808 ( 3897 PWs) bands (ev): -77.3118 -77.3118 -42.9857 -42.9857 -41.2497 -41.2497 -41.2493 -41.2493 -0.0674 -0.0674 -0.0659 -0.0659 0.3704 0.3704 0.3960 0.3960 0.4019 0.4019 4.9188 4.9188 10.8600 10.8600 11.1606 11.1606 11.1657 11.1657 11.9400 11.9400 11.9549 11.9549 12.2393 12.2393 12.3327 12.3327 12.3739 12.3739 14.0226 14.0226 14.2146 14.2146 14.2150 14.2150 14.3906 14.3906 14.4274 14.4274 14.8242 14.8242 14.8352 14.8352 17.3446 17.3446 19.5462 19.5462 19.5888 19.5888 k = 0.2083 0.1203 0.0851 ( 3897 PWs) bands (ev): -77.3118 -77.3118 -42.9857 -42.9857 -41.2497 -41.2497 -41.2493 -41.2493 -0.0672 -0.0672 -0.0656 -0.0656 0.3706 0.3706 0.3960 0.3960 0.4025 0.4025 4.9751 4.9751 10.8024 10.8024 11.1573 11.1573 11.1622 11.1622 11.9649 11.9649 11.9815 11.9815 12.2251 12.2251 12.3385 12.3385 12.3773 12.3773 13.9894 13.9894 14.1866 14.1866 14.1890 14.1890 14.3880 14.3880 14.4246 14.4246 14.8164 14.8164 14.8267 14.8267 17.2042 17.2042 19.5164 19.5164 19.5565 19.5565 k = 0.2188 0.1263 0.0893 ( 3888 PWs) bands (ev): -77.3115 -77.3115 -42.9856 -42.9856 -41.2496 -41.2496 -41.2493 -41.2493 -0.0671 -0.0671 -0.0653 -0.0653 0.3708 0.3708 0.3961 0.3961 0.4031 0.4031 5.0341 5.0341 10.7409 10.7409 11.1551 11.1551 11.1596 11.1596 11.9881 11.9881 12.0063 12.0063 12.2104 12.2104 12.3465 12.3465 12.3832 12.3832 13.9578 13.9578 14.1583 14.1583 14.1624 14.1624 14.3864 14.3864 14.4230 14.4230 14.8080 14.8080 14.8176 14.8176 17.0656 17.0656 19.4885 19.4885 19.5265 19.5265 k = 0.2292 0.1323 0.0936 ( 3888 PWs) bands (ev): -77.3115 -77.3115 -42.9856 -42.9856 -41.2497 -41.2497 -41.2492 -41.2492 -0.0669 -0.0669 -0.0650 -0.0650 0.3711 0.3711 0.3961 0.3961 0.4038 0.4038 5.0956 5.0956 10.6754 10.6754 11.1535 11.1535 11.1576 11.1576 12.0092 12.0092 12.0289 12.0289 12.1955 12.1955 12.3565 12.3565 12.3913 12.3913 13.9279 13.9279 14.1294 14.1294 14.1353 14.1353 14.3842 14.3842 14.4208 14.4208 14.7990 14.7990 14.8076 14.8076 16.9290 16.9290 19.4626 19.4626 19.4986 19.4986 k = 0.2396 0.1383 0.0978 ( 3894 PWs) bands (ev): -77.3117 -77.3117 -42.9857 -42.9857 -41.2497 -41.2497 -41.2493 -41.2493 -0.0667 -0.0667 -0.0647 -0.0647 0.3713 0.3713 0.3962 0.3962 0.4044 0.4044 5.1595 5.1595 10.6060 10.6060 11.1525 11.1525 11.1563 11.1563 12.0277 12.0277 12.0488 12.0488 12.1810 12.1810 12.3689 12.3689 12.4021 12.4021 13.8998 13.8998 14.1001 14.1001 14.1078 14.1078 14.3816 14.3816 14.4184 14.4184 14.7893 14.7893 14.7968 14.7968 16.7949 16.7949 19.4385 19.4385 19.4726 19.4726 k = 0.2500 0.1443 0.1021 ( 3885 PWs) bands (ev): -77.3114 -77.3114 -42.9856 -42.9856 -41.2497 -41.2497 -41.2492 -41.2492 -0.0665 -0.0665 -0.0644 -0.0644 0.3715 0.3715 0.3962 0.3962 0.4050 0.4050 5.2259 5.2259 10.5326 10.5326 11.1524 11.1524 11.1558 11.1558 12.0438 12.0438 12.0661 12.0661 12.1674 12.1674 12.3842 12.3842 12.4163 12.4163 13.8737 13.8737 14.0709 14.0709 14.0801 14.0801 14.3799 14.3799 14.4170 14.4170 14.7791 14.7791 14.7853 14.7853 16.6639 16.6639 19.4165 19.4165 19.4490 19.4490 k = 0.2604 0.1504 0.1063 ( 3897 PWs) bands (ev): -77.3118 -77.3118 -42.9857 -42.9857 -41.2498 -41.2498 -41.2493 -41.2493 -0.0664 -0.0664 -0.0641 -0.0641 0.3717 0.3717 0.3963 0.3963 0.4056 0.4056 5.2945 5.2945 10.4553 10.4553 11.1526 11.1526 11.1556 11.1556 12.0572 12.0572 12.0803 12.0803 12.1537 12.1537 12.4016 12.4016 12.4330 12.4330 13.8495 13.8495 14.0415 14.0415 14.0520 14.0520 14.3772 14.3772 14.4146 14.4146 14.7680 14.7680 14.7730 14.7730 16.5352 16.5352 19.3962 19.3962 19.4273 19.4273 k = 0.2708 0.1564 0.1106 ( 3891 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2497 -41.2497 -41.2493 -41.2493 -0.0662 -0.0662 -0.0638 -0.0638 0.3720 0.3720 0.3963 0.3963 0.4063 0.4063 5.3654 5.3654 10.3743 10.3743 11.1536 11.1536 11.1561 11.1561 12.0683 12.0683 12.0917 12.0917 12.1421 12.1421 12.4218 12.4218 12.4530 12.4530 13.8271 13.8271 14.0124 14.0124 14.0240 14.0240 14.3753 14.3753 14.4130 14.4130 14.7568 14.7568 14.7602 14.7602 16.4104 16.4104 19.3781 19.3781 19.4079 19.4079 k = 0.2812 0.1624 0.1148 ( 3900 PWs) bands (ev): -77.3119 -77.3119 -42.9857 -42.9857 -41.2498 -41.2498 -41.2493 -41.2493 -0.0660 -0.0660 -0.0635 -0.0635 0.3722 0.3722 0.3964 0.3964 0.4069 0.4069 5.4385 5.4385 10.2896 10.2896 11.1549 11.1549 11.1570 11.1570 12.0770 12.0770 12.1003 12.1003 12.1310 12.1310 12.4438 12.4438 12.4753 12.4753 13.8066 13.8066 13.9836 13.9836 13.9960 13.9960 14.3729 14.3729 14.4109 14.4109 14.7449 14.7449 14.7468 14.7468 16.2881 16.2881 19.3617 19.3617 19.3906 19.3906 k = 0.2917 0.1684 0.1191 ( 3897 PWs) bands (ev): -77.3118 -77.3118 -42.9857 -42.9857 -41.2498 -41.2498 -41.2493 -41.2493 -0.0658 -0.0658 -0.0632 -0.0632 0.3724 0.3724 0.3964 0.3964 0.4075 0.4075 5.5136 5.5136 10.2015 10.2015 11.1570 11.1570 11.1585 11.1585 12.0840 12.0840 12.1060 12.1060 12.1221 12.1221 12.4678 12.4678 12.4999 12.4999 13.7876 13.7876 13.9553 13.9553 13.9682 13.9682 14.3714 14.3714 14.4097 14.4097 14.7329 14.7329 14.7330 14.7330 16.1695 16.1695 19.3474 19.3474 19.3754 19.3754 k = 0.3021 0.1744 0.1233 ( 3891 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2498 -41.2498 -41.2493 -41.2493 -0.0657 -0.0657 -0.0629 -0.0629 0.3726 0.3726 0.3965 0.3965 0.4081 0.4081 5.5906 5.5906 10.1103 10.1103 11.1594 11.1594 11.1604 11.1604 12.0894 12.0894 12.1067 12.1067 12.1182 12.1182 12.4930 12.4930 12.5263 12.5263 13.7702 13.7702 13.9278 13.9278 13.9407 13.9407 14.3700 14.3700 14.4086 14.4086 14.7188 14.7188 14.7205 14.7205 16.0546 16.0546 19.3351 19.3351 19.3624 19.3624 k = 0.3125 0.1804 0.1276 ( 3891 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2498 -41.2498 -41.2493 -41.2493 -0.0655 -0.0655 -0.0626 -0.0626 0.3728 0.3728 0.3966 0.3966 0.4087 0.4087 5.6694 5.6694 10.0164 10.0164 11.1622 11.1622 11.1627 11.1627 12.0936 12.0936 12.1018 12.1018 12.1193 12.1193 12.5192 12.5192 12.5537 12.5537 13.7541 13.7541 13.9011 13.9011 13.9135 13.9135 14.3685 14.3685 14.4073 14.4073 14.7041 14.7041 14.7078 14.7078 15.9434 15.9434 19.3245 19.3245 19.3514 19.3514 k = 0.3229 0.1864 0.1318 ( 3897 PWs) bands (ev): -77.3118 -77.3118 -42.9857 -42.9857 -41.2498 -41.2498 -41.2494 -41.2494 -0.0654 -0.0654 -0.0624 -0.0624 0.3730 0.3730 0.3966 0.3966 0.4093 0.4093 5.7498 5.7498 9.9200 9.9200 11.1651 11.1651 11.1652 11.1652 12.0964 12.0964 12.0966 12.0966 12.1210 12.1210 12.5457 12.5457 12.5819 12.5819 13.7390 13.7390 13.8757 13.8757 13.8869 13.8869 14.3668 14.3668 14.4057 14.4057 14.6891 14.6891 14.6948 14.6948 15.8361 15.8361 19.3157 19.3157 19.3422 19.3422 k = 0.3333 0.1925 0.1361 ( 3897 PWs) bands (ev): -77.3118 -77.3118 -42.9857 -42.9857 -41.2498 -41.2498 -41.2494 -41.2494 -0.0652 -0.0652 -0.0621 -0.0621 0.3732 0.3732 0.3966 0.3966 0.4099 0.4099 5.8316 5.8316 9.8216 9.8216 11.1678 11.1678 11.1685 11.1685 12.0921 12.0921 12.0990 12.0990 12.1224 12.1224 12.5726 12.5726 12.6105 12.6105 13.7247 13.7247 13.8518 13.8518 13.8608 13.8608 14.3655 14.3655 14.4046 14.4046 14.6741 14.6741 14.6818 14.6818 15.7331 15.7331 19.3088 19.3088 19.3352 19.3352 k = 0.3438 0.1985 0.1403 ( 3891 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2498 -41.2498 -41.2494 -41.2494 -0.0651 -0.0651 -0.0619 -0.0619 0.3734 0.3734 0.3967 0.3967 0.4104 0.4104 5.9147 5.9147 9.7218 9.7218 11.1708 11.1708 11.1720 11.1720 12.0895 12.0895 12.1009 12.1009 12.1235 12.1235 12.5994 12.5994 12.6393 12.6393 13.7108 13.7108 13.8298 13.8298 13.8356 13.8356 14.3645 14.3645 14.4036 14.4036 14.6590 14.6590 14.6688 14.6688 15.6351 15.6351 19.3036 19.3036 19.3301 19.3301 k = 0.3542 0.2045 0.1446 ( 3891 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2498 -41.2498 -41.2494 -41.2494 -0.0649 -0.0649 -0.0616 -0.0616 0.3736 0.3736 0.3967 0.3967 0.4109 0.4109 5.9987 5.9987 9.6208 9.6208 11.1738 11.1738 11.1756 11.1756 12.0876 12.0876 12.1024 12.1024 12.1241 12.1241 12.6258 12.6258 12.6677 12.6677 13.6970 13.6970 13.8100 13.8100 13.8112 13.8112 14.3634 14.3634 14.4026 14.4026 14.6439 14.6439 14.6559 14.6559 15.5412 15.5412 19.3001 19.3001 19.3267 19.3267 k = 0.3646 0.2105 0.1488 ( 3879 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2498 -41.2498 -41.2493 -41.2493 -0.0648 -0.0648 -0.0614 -0.0614 0.3738 0.3738 0.3968 0.3968 0.4114 0.4114 6.0834 6.0834 9.5192 9.5192 11.1772 11.1772 11.1795 11.1795 12.0873 12.0873 12.1039 12.1039 12.1247 12.1247 12.6516 12.6516 12.6956 12.6956 13.6830 13.6830 13.7878 13.7878 13.7927 13.7927 14.3628 14.3628 14.4019 14.4019 14.6293 14.6293 14.6434 14.6434 15.4525 15.4525 19.2985 19.2985 19.3255 19.3255 k = 0.3750 0.2165 0.1531 ( 3885 PWs) bands (ev): -77.3114 -77.3114 -42.9856 -42.9856 -41.2498 -41.2498 -41.2493 -41.2493 -0.0647 -0.0647 -0.0612 -0.0612 0.3739 0.3739 0.3968 0.3968 0.4119 0.4119 6.1684 6.1684 9.4176 9.4176 11.1803 11.1803 11.1831 11.1831 12.0872 12.0872 12.1047 12.1047 12.1248 12.1248 12.6764 12.6764 12.7226 12.7226 13.6687 13.6687 13.7655 13.7655 13.7781 13.7781 14.3618 14.3618 14.4006 14.4006 14.6146 14.6146 14.6308 14.6308 15.3682 15.3682 19.2979 19.2979 19.3254 19.3254 k = 0.3854 0.2225 0.1573 ( 3891 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2499 -41.2499 -41.2493 -41.2493 -0.0645 -0.0645 -0.0610 -0.0610 0.3741 0.3741 0.3969 0.3969 0.4123 0.4123 6.2532 6.2532 9.3167 9.3167 11.1833 11.1833 11.1867 11.1867 12.0880 12.0880 12.1054 12.1054 12.1248 12.1248 12.7002 12.7002 12.7486 12.7486 13.6540 13.6540 13.7444 13.7444 13.7661 13.7661 14.3609 14.3609 14.3995 14.3995 14.6003 14.6003 14.6185 14.6185 15.2890 15.2890 19.2987 19.2987 19.3269 19.3269 k = 0.3958 0.2285 0.1616 ( 3882 PWs) bands (ev): -77.3113 -77.3113 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0644 -0.0644 -0.0608 -0.0608 0.3742 0.3742 0.3969 0.3969 0.4127 0.4127 6.3375 6.3375 9.2173 9.2173 11.1865 11.1865 11.1903 11.1903 12.0900 12.0900 12.1064 12.1064 12.1251 12.1251 12.7228 12.7228 12.7733 12.7733 13.6393 13.6393 13.7247 13.7247 13.7566 13.7566 14.3608 14.3608 14.3990 14.3990 14.5869 14.5869 14.6072 14.6072 15.2160 15.2160 19.3008 19.3008 19.3297 19.3297 k = 0.4062 0.2345 0.1659 ( 3882 PWs) bands (ev): -77.3113 -77.3113 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0643 -0.0643 -0.0607 -0.0607 0.3744 0.3744 0.3969 0.3969 0.4131 0.4131 6.4204 6.4204 9.1201 9.1201 11.1893 11.1893 11.1937 11.1937 12.0925 12.0925 12.1070 12.1070 12.1251 12.1251 12.7438 12.7438 12.7964 12.7964 13.6248 13.6248 13.7065 13.7065 13.7493 13.7493 14.3601 14.3601 14.3979 14.3979 14.5740 14.5740 14.5962 14.5962 15.1489 15.1489 19.3038 19.3038 19.3336 19.3336 k = 0.4167 0.2406 0.1701 ( 3888 PWs) bands (ev): -77.3115 -77.3115 -42.9857 -42.9857 -41.2499 -41.2499 -41.2492 -41.2492 -0.0643 -0.0643 -0.0605 -0.0605 0.3745 0.3745 0.3970 0.3970 0.4134 0.4134 6.5011 6.5011 9.0260 9.0260 11.1919 11.1919 11.1967 11.1967 12.0953 12.0953 12.1075 12.1075 12.1251 12.1251 12.7632 12.7632 12.8177 12.8177 13.6109 13.6109 13.6898 13.6898 13.7438 13.7438 14.3591 14.3591 14.3964 14.3964 14.5620 14.5620 14.5860 14.5860 15.0876 15.0876 19.3076 19.3076 19.3384 19.3384 k = 0.4271 0.2466 0.1744 ( 3894 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2499 -41.2499 -41.2493 -41.2493 -0.0642 -0.0642 -0.0604 -0.0604 0.3746 0.3746 0.3970 0.3970 0.4137 0.4137 6.5787 6.5787 8.9364 8.9364 11.1943 11.1943 11.1996 11.1996 12.0982 12.0982 12.1076 12.1076 12.1248 12.1248 12.7807 12.7807 12.8371 12.8371 13.5979 13.5979 13.6748 13.6748 13.7397 13.7397 14.3587 14.3587 14.3952 14.3952 14.5506 14.5506 14.5762 14.5762 15.0328 15.0328 19.3118 19.3118 19.3436 19.3436 k = 0.4375 0.2526 0.1786 ( 3876 PWs) bands (ev): -77.3111 -77.3111 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0641 -0.0641 -0.0603 -0.0603 0.3747 0.3747 0.3970 0.3970 0.4140 0.4140 6.6518 6.6518 8.8526 8.8526 11.1969 11.1969 11.2025 11.2025 12.1012 12.1012 12.1086 12.1086 12.1254 12.1254 12.7963 12.7963 12.8544 12.8544 13.5862 13.5862 13.6617 13.6617 13.7368 13.7368 14.3593 14.3593 14.3954 14.3954 14.5413 14.5413 14.5686 14.5686 14.9848 14.9848 19.3169 19.3169 19.3497 19.3497 k = 0.4479 0.2586 0.1829 ( 3876 PWs) bands (ev): -77.3111 -77.3111 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0640 -0.0640 -0.0602 -0.0602 0.3748 0.3748 0.3971 0.3971 0.4142 0.4142 6.7190 6.7190 8.7762 8.7762 11.1988 11.1988 11.2047 11.2047 12.1041 12.1041 12.1090 12.1090 12.1256 12.1256 12.8097 12.8097 12.8693 12.8693 13.5759 13.5759 13.6503 13.6503 13.7348 13.7348 14.3589 14.3589 14.3943 14.3943 14.5327 14.5327 14.5613 14.5613 14.9436 14.9436 19.3216 19.3216 19.3555 19.3555 k = 0.4583 0.2646 0.1871 ( 3879 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2499 -41.2499 -41.2492 -41.2492 -0.0640 -0.0640 -0.0601 -0.0601 0.3748 0.3748 0.3971 0.3971 0.4144 0.4144 6.7784 6.7784 8.7091 8.7091 11.2004 11.2004 11.2065 11.2065 12.1067 12.1067 12.1092 12.1092 12.1258 12.1258 12.8208 12.8208 12.8817 12.8817 13.5673 13.5673 13.6410 13.6410 13.7335 13.7335 14.3585 14.3585 14.3932 14.3932 14.5253 14.5253 14.5549 14.5549 14.9097 14.9097 19.3260 19.3260 19.3609 19.3609 k = 0.4688 0.2706 0.1914 ( 3879 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2499 -41.2499 -41.2492 -41.2492 -0.0640 -0.0640 -0.0600 -0.0600 0.3749 0.3749 0.3971 0.3971 0.4146 0.4146 6.8279 6.8279 8.6536 8.6536 11.2016 11.2016 11.2080 11.2080 12.1087 12.1087 12.1095 12.1095 12.1260 12.1260 12.8296 12.8296 12.8915 12.8915 13.5605 13.5605 13.6336 13.6336 13.7327 13.7327 14.3583 14.3583 14.3924 14.3924 14.5196 14.5196 14.5501 14.5501 14.8831 14.8831 19.3299 19.3299 19.3656 19.3656 k = 0.4792 0.2766 0.1956 ( 3879 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2499 -41.2499 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3749 0.3749 0.3971 0.3971 0.4147 0.4147 6.8654 6.8654 8.6117 8.6117 11.2025 11.2025 11.2091 11.2091 12.1098 12.1098 12.1102 12.1102 12.1263 12.1263 12.8359 12.8359 12.8986 12.8986 13.5555 13.5555 13.6283 13.6283 13.7322 13.7322 14.3582 14.3582 14.3918 14.3918 14.5154 14.5154 14.5466 14.5466 14.8639 14.8639 19.3329 19.3329 19.3692 19.3692 k = 0.4896 0.2827 0.1999 ( 3879 PWs) bands (ev): -77.3111 -77.3111 -42.9856 -42.9856 -41.2499 -41.2499 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3749 0.3749 0.3971 0.3971 0.4147 0.4147 6.8888 6.8888 8.5856 8.5856 11.2031 11.2031 11.2097 11.2097 12.1099 12.1099 12.1111 12.1111 12.1265 12.1265 12.8398 12.8398 12.9029 12.9029 13.5525 13.5525 13.6251 13.6251 13.7320 13.7320 14.3581 14.3581 14.3914 14.3914 14.5129 14.5129 14.5445 14.5445 14.8524 14.8524 19.3348 19.3348 19.3716 19.3716 k = 0.5000 0.2887 0.2041 ( 3852 PWs) bands (ev): -77.3103 -77.3103 -42.9854 -42.9854 -41.2496 -41.2496 -41.2491 -41.2491 -0.0639 -0.0639 -0.0599 -0.0599 0.3749 0.3749 0.3971 0.3971 0.4148 0.4148 6.8968 6.8968 8.5770 8.5770 11.2036 11.2036 11.2103 11.2103 12.1107 12.1107 12.1121 12.1121 12.1273 12.1273 12.8411 12.8411 12.9044 12.9044 13.5515 13.5515 13.6241 13.6241 13.7319 13.7319 14.3594 14.3594 14.3929 14.3929 14.5125 14.5125 14.5444 14.5444 14.8499 14.8499 19.3358 19.3358 19.3727 19.3727 k = 0.5000 0.2887 0.2041 ( 3852 PWs) bands (ev): -77.3103 -77.3103 -42.9854 -42.9854 -41.2496 -41.2496 -41.2491 -41.2491 -0.0639 -0.0639 -0.0599 -0.0599 0.3749 0.3749 0.3971 0.3971 0.4148 0.4148 6.8968 6.8968 8.5770 8.5770 11.2036 11.2036 11.2103 11.2103 12.1107 12.1107 12.1121 12.1121 12.1273 12.1273 12.8411 12.8411 12.9044 12.9044 13.5515 13.5515 13.6241 13.6241 13.7319 13.7319 14.3594 14.3594 14.3929 14.3929 14.5125 14.5125 14.5444 14.5444 14.8499 14.8499 19.3358 19.3358 19.3727 19.3727 k = 0.5037 0.2781 0.2101 ( 3877 PWs) bands (ev): -77.3111 -77.3111 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3749 0.3749 0.3971 0.3971 0.4147 0.4147 6.8976 6.8976 8.5783 8.5783 11.2027 11.2027 11.2098 11.2098 12.1099 12.1099 12.1109 12.1109 12.1265 12.1265 12.8416 12.8416 12.9048 12.9048 13.5508 13.5508 13.6232 13.6232 13.7321 13.7321 14.3580 14.3580 14.3910 14.3910 14.5127 14.5127 14.5441 14.5441 14.8487 14.8487 19.2768 19.2768 19.3263 19.3263 k = 0.5074 0.2674 0.2161 ( 3877 PWs) bands (ev): -77.3111 -77.3111 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3749 0.3749 0.3971 0.3971 0.4147 0.4147 6.9001 6.9001 8.5826 8.5826 11.1994 11.1994 11.2108 11.2108 12.1072 12.1072 12.1112 12.1112 12.1266 12.1266 12.8432 12.8432 12.9063 12.9063 13.5488 13.5488 13.6208 13.6208 13.7327 13.7327 14.3574 14.3574 14.3896 14.3896 14.5144 14.5144 14.5451 14.5451 14.8485 14.8485 19.1378 19.1378 19.2404 19.2404 k = 0.5110 0.2568 0.2221 ( 3877 PWs) bands (ev): -77.3111 -77.3111 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3750 0.3750 0.3972 0.3972 0.4146 0.4146 6.9042 6.9042 8.5898 8.5898 11.1923 11.1923 11.2141 11.2141 12.1017 12.1017 12.1119 12.1119 12.1275 12.1275 12.8458 12.8458 12.9087 12.9087 13.5455 13.5455 13.6167 13.6167 13.7337 13.7337 14.3563 14.3563 14.3874 14.3874 14.5173 14.5173 14.5468 14.5468 14.8484 14.8484 18.9755 18.9755 19.1311 19.1311 k = 0.5147 0.2462 0.2281 ( 3881 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3750 0.3750 0.3972 0.3972 0.4145 0.4145 6.9099 6.9099 8.5999 8.5999 11.1816 11.1816 11.2192 11.2192 12.0936 12.0936 12.1122 12.1122 12.1298 12.1298 12.8493 12.8493 12.9120 12.9120 13.5408 13.5408 13.6111 13.6111 13.7353 13.7353 14.3544 14.3544 14.3840 14.3840 14.5212 14.5212 14.5493 14.5493 14.8480 14.8480 18.8047 18.8047 19.0095 19.0095 k = 0.5184 0.2356 0.2341 ( 3889 PWs) bands (ev): -77.3114 -77.3114 -42.9857 -42.9857 -41.2499 -41.2499 -41.2493 -41.2493 -0.0638 -0.0638 -0.0600 -0.0600 0.3750 0.3750 0.3972 0.3972 0.4144 0.4144 6.9173 6.9173 8.6129 8.6129 11.1678 11.1678 11.2259 11.2259 12.0830 12.0830 12.1118 12.1118 12.1337 12.1337 12.8535 12.8535 12.9161 12.9161 13.5347 13.5347 13.6042 13.6042 13.7375 13.7375 14.3517 14.3517 14.3793 14.3793 14.5259 14.5259 14.5526 14.5526 14.8476 14.8476 18.6304 18.6304 18.8820 18.8820 k = 0.5221 0.2250 0.2401 ( 3895 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2499 -41.2499 -41.2493 -41.2493 -0.0638 -0.0638 -0.0601 -0.0601 0.3750 0.3750 0.3973 0.3973 0.4142 0.4142 6.9262 6.9262 8.6287 8.6287 11.1511 11.1511 11.2341 11.2341 12.0702 12.0702 12.1107 12.1107 12.1396 12.1396 12.8582 12.8582 12.9210 12.9210 13.5273 13.5273 13.5959 13.5959 13.7405 13.7405 14.3480 14.3480 14.3736 14.3736 14.5318 14.5318 14.5570 14.5570 14.8473 14.8473 18.4552 18.4552 18.7517 18.7517 k = 0.5257 0.2144 0.2461 ( 3893 PWs) bands (ev): -77.3115 -77.3115 -42.9857 -42.9857 -41.2499 -41.2499 -41.2493 -41.2493 -0.0638 -0.0638 -0.0601 -0.0601 0.3751 0.3751 0.3974 0.3974 0.4141 0.4141 6.9367 6.9367 8.6474 8.6474 11.1314 11.1314 11.2438 11.2438 12.0553 12.0553 12.1098 12.1098 12.1474 12.1474 12.8632 12.8632 12.9267 12.9267 13.5188 13.5188 13.5866 13.5866 13.7442 13.7442 14.3437 14.3437 14.3672 14.3672 14.5389 14.5389 14.5629 14.5629 14.8472 14.8472 18.2802 18.2802 18.6207 18.6207 k = 0.5294 0.2038 0.2522 ( 3899 PWs) bands (ev): -77.3117 -77.3117 -42.9858 -42.9858 -41.2499 -41.2499 -41.2494 -41.2494 -0.0638 -0.0638 -0.0601 -0.0601 0.3751 0.3751 0.3975 0.3975 0.4139 0.4139 6.9488 6.9488 8.6688 8.6688 11.1087 11.1087 11.2551 11.2551 12.0385 12.0385 12.1082 12.1082 12.1563 12.1563 12.8681 12.8681 12.9333 12.9333 13.5090 13.5090 13.5764 13.5764 13.7487 13.7487 14.3378 14.3378 14.3592 14.3592 14.5466 14.5466 14.5695 14.5695 14.8469 14.8469 18.1063 18.1063 18.4895 18.4895 k = 0.5331 0.1932 0.2582 ( 3902 PWs) bands (ev): -77.3118 -77.3118 -42.9858 -42.9858 -41.2499 -41.2499 -41.2494 -41.2494 -0.0637 -0.0637 -0.0602 -0.0602 0.3751 0.3751 0.3975 0.3975 0.4137 0.4137 6.9624 6.9624 8.6929 8.6929 11.0832 11.0832 11.2679 11.2679 12.0197 12.0197 12.1065 12.1065 12.1669 12.1669 12.8724 12.8724 12.9408 12.9408 13.4983 13.4983 13.5655 13.5655 13.7540 13.7540 14.3309 14.3309 14.3507 14.3507 14.5551 14.5551 14.5774 14.5774 14.8466 14.8466 17.9343 17.9343 18.3590 18.3590 k = 0.5368 0.1825 0.2642 ( 3901 PWs) bands (ev): -77.3118 -77.3118 -42.9858 -42.9858 -41.2499 -41.2499 -41.2494 -41.2494 -0.0637 -0.0637 -0.0602 -0.0602 0.3751 0.3751 0.3976 0.3976 0.4135 0.4135 6.9774 6.9774 8.7198 8.7198 11.0550 11.0550 11.2821 11.2821 11.9995 11.9995 12.1049 12.1049 12.1790 12.1790 12.8758 12.8758 12.9494 12.9494 13.4866 13.4866 13.5543 13.5543 13.7600 13.7600 14.3221 14.3221 14.3415 14.3415 14.5646 14.5646 14.5865 14.5865 14.8466 14.8466 17.7650 17.7650 18.2295 18.2295 k = 0.5404 0.1719 0.2702 ( 3905 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2500 -41.2500 -41.2494 -41.2494 -0.0637 -0.0637 -0.0603 -0.0603 0.3752 0.3752 0.3977 0.3977 0.4132 0.4132 6.9939 6.9939 8.7493 8.7493 11.0239 11.0239 11.2978 11.2978 11.9777 11.9777 12.1031 12.1031 12.1921 12.1921 12.8778 12.8778 12.9591 12.9591 13.4741 13.4741 13.5428 13.5428 13.7667 13.7667 14.3114 14.3114 14.3318 14.3318 14.5745 14.5745 14.5964 14.5964 14.8466 14.8466 17.5984 17.5984 18.1011 18.1011 k = 0.5441 0.1613 0.2762 ( 3899 PWs) bands (ev): -77.3117 -77.3117 -42.9858 -42.9858 -41.2499 -41.2499 -41.2494 -41.2494 -0.0636 -0.0636 -0.0603 -0.0603 0.3752 0.3752 0.3979 0.3979 0.4130 0.4130 7.0117 7.0117 8.7815 8.7815 10.9905 10.9905 11.3149 11.3149 11.9546 11.9546 12.1014 12.1014 12.2074 12.2074 12.8783 12.8783 12.9701 12.9701 13.4608 13.4608 13.5316 13.5316 13.7740 13.7740 14.2995 14.2995 14.3223 14.3223 14.5854 14.5854 14.6071 14.6071 14.8469 14.8469 17.4356 17.4356 17.9742 17.9742 k = 0.5478 0.1507 0.2822 ( 3915 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0636 -0.0636 -0.0604 -0.0604 0.3752 0.3752 0.3980 0.3980 0.4127 0.4127 7.0309 7.0309 8.8162 8.8162 10.9541 10.9541 11.3330 11.3330 11.9298 11.9298 12.0989 12.0989 12.2233 12.2233 12.8768 12.8768 12.9823 12.9823 13.4466 13.4466 13.5209 13.5209 13.7816 13.7816 14.2849 14.2849 14.3117 14.3117 14.5961 14.5961 14.6178 14.6178 14.8467 14.8467 17.2763 17.2763 17.8485 17.8485 k = 0.5515 0.1401 0.2882 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0636 -0.0636 -0.0604 -0.0604 0.3753 0.3753 0.3981 0.3981 0.4125 0.4125 7.0513 7.0513 8.8534 8.8534 10.9155 10.9155 11.3526 11.3526 11.9040 11.9040 12.0970 12.0970 12.2405 12.2405 12.8736 12.8736 12.9956 12.9956 13.4317 13.4317 13.5110 13.5110 13.7897 13.7897 14.2694 14.2694 14.3014 14.3014 14.6074 14.6074 14.6295 14.6295 14.8467 14.8467 17.1216 17.1216 17.7247 17.7247 k = 0.5551 0.1295 0.2942 ( 3921 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0605 -0.0605 0.3753 0.3753 0.3982 0.3982 0.4122 0.4122 7.0729 7.0729 8.8930 8.8930 10.8746 10.8746 11.3735 11.3735 11.8772 11.8772 12.0954 12.0954 12.2589 12.2589 12.8684 12.8684 13.0100 13.0100 13.4158 13.4158 13.5023 13.5023 13.7982 13.7982 14.2532 14.2532 14.2907 14.2907 14.6188 14.6188 14.6419 14.6419 14.8468 14.8468 16.9716 16.9716 17.6027 17.6027 k = 0.5588 0.1189 0.3002 ( 3923 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0605 -0.0605 0.3753 0.3753 0.3983 0.3983 0.4120 0.4120 7.0956 7.0956 8.9349 8.9349 10.8315 10.8315 11.3958 11.3958 11.8493 11.8493 12.0939 12.0939 12.2782 12.2782 12.8616 12.8616 13.0253 13.0253 13.3991 13.3991 13.4948 13.4948 13.8069 13.8069 14.2365 14.2365 14.2796 14.2796 14.6301 14.6301 14.6546 14.6546 14.8466 14.8466 16.8266 16.8266 17.4826 17.4826 k = 0.5625 0.1083 0.3062 ( 3921 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0606 -0.0606 0.3753 0.3753 0.3984 0.3984 0.4118 0.4118 7.1193 7.1193 8.9791 8.9791 10.7863 10.7863 11.4192 11.4192 11.8206 11.8206 12.0925 12.0925 12.2987 12.2987 12.8531 12.8531 13.0413 13.0413 13.3817 13.3817 13.4887 13.4887 13.8157 13.8157 14.2194 14.2194 14.2684 14.2684 14.6413 14.6413 14.6676 14.6676 14.8466 14.8466 16.6871 16.6871 17.3645 17.3645 k = 0.5662 0.0976 0.3122 ( 3925 PWs) bands (ev): -77.3125 -77.3125 -42.9860 -42.9860 -41.2501 -41.2501 -41.2496 -41.2496 -0.0635 -0.0635 -0.0607 -0.0607 0.3753 0.3753 0.3985 0.3985 0.4116 0.4116 7.1439 7.1439 9.0254 9.0254 10.7391 10.7391 11.4437 11.4437 11.7910 11.7910 12.0912 12.0912 12.3198 12.3198 12.8433 12.8433 13.0578 13.0578 13.3636 13.3636 13.4839 13.4839 13.8246 13.8246 14.2017 14.2017 14.2566 14.2566 14.6518 14.6518 14.6806 14.6806 14.8464 14.8464 16.5533 16.5533 17.2484 17.2484 k = 0.5699 0.0870 0.3182 ( 3920 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0634 -0.0634 -0.0607 -0.0607 0.3753 0.3753 0.3985 0.3985 0.4115 0.4115 7.1693 7.1693 9.0737 9.0737 10.6903 10.6903 11.4693 11.4693 11.7608 11.7608 12.0902 12.0902 12.3418 12.3418 12.8326 12.8326 13.0747 13.0747 13.3451 13.3451 13.4804 13.4804 13.8335 13.8335 14.1852 14.1852 14.2446 14.2446 14.6620 14.6620 14.6937 14.6937 14.8463 14.8463 16.4258 16.4258 17.1345 17.1345 k = 0.5735 0.0764 0.3242 ( 3922 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0634 -0.0634 -0.0608 -0.0608 0.3753 0.3753 0.3986 0.3986 0.4113 0.4113 7.1953 7.1953 9.1238 9.1238 10.6397 10.6397 11.4959 11.4959 11.7301 11.7301 12.0893 12.0893 12.3635 12.3635 12.8212 12.8212 13.0915 13.0915 13.3266 13.3266 13.4778 13.4778 13.8423 13.8423 14.1685 14.1685 14.2321 14.2321 14.6710 14.6710 14.7067 14.7067 14.8461 14.8461 16.3046 16.3046 17.0228 17.0228 k = 0.5772 0.0658 0.3302 ( 3918 PWs) bands (ev): -77.3123 -77.3123 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0634 -0.0634 -0.0608 -0.0608 0.3753 0.3753 0.3986 0.3986 0.4112 0.4112 7.2218 7.2218 9.1756 9.1756 10.5876 10.5876 11.5233 11.5233 11.6993 11.6993 12.0889 12.0889 12.3853 12.3853 12.8097 12.8097 13.1080 13.1080 13.3085 13.3085 13.4763 13.4763 13.8510 13.8510 14.1531 14.1531 14.2191 14.2191 14.6788 14.6788 14.7198 14.7198 14.8461 14.8461 16.1903 16.1903 16.9137 16.9137 k = 0.5809 0.0552 0.3362 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0634 -0.0634 -0.0608 -0.0608 0.3753 0.3753 0.3987 0.3987 0.4111 0.4111 7.2486 7.2486 9.2289 9.2289 10.5341 10.5341 11.5514 11.5514 11.6687 11.6687 12.0889 12.0889 12.4061 12.4061 12.7986 12.7986 13.1232 13.1232 13.2916 13.2916 13.4754 13.4754 13.8594 13.8594 14.1377 14.1377 14.2060 14.2060 14.6849 14.6849 14.7328 14.7328 14.8461 14.8461 16.0830 16.0830 16.8071 16.8071 k = 0.5846 0.0446 0.3422 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0609 -0.0609 0.3752 0.3752 0.3986 0.3986 0.4111 0.4111 7.2756 7.2756 9.2834 9.2834 10.4796 10.4796 11.5794 11.5794 11.6390 11.6390 12.0889 12.0889 12.4260 12.4260 12.7883 12.7883 13.1360 13.1360 13.2772 13.2772 13.4751 13.4751 13.8675 13.8675 14.1239 14.1239 14.1928 14.1928 14.6891 14.6891 14.7453 14.7453 14.8463 14.8463 15.9833 15.9833 16.7032 16.7032 k = 0.5882 0.0340 0.3482 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0609 -0.0609 0.3752 0.3752 0.3986 0.3986 0.4111 0.4111 7.3025 7.3025 9.3388 9.3388 10.4245 10.4245 11.5962 11.5962 11.6216 11.6216 12.0893 12.0893 12.4442 12.4442 12.7797 12.7797 13.1441 13.1441 13.2673 13.2673 13.4751 13.4751 13.8751 13.8751 14.1116 14.1116 14.1797 14.1797 14.6908 14.6908 14.7573 14.7573 14.8467 14.8467 15.8914 15.8914 16.6023 16.6023 k = 0.5919 0.0233 0.3542 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0609 -0.0609 0.3752 0.3752 0.3986 0.3986 0.4111 0.4111 7.3290 7.3290 9.3946 9.3946 10.3692 10.3692 11.5734 11.5734 11.6449 11.6449 12.0899 12.0899 12.4599 12.4599 12.7733 12.7733 13.1452 13.1452 13.2646 13.2646 13.4755 13.4755 13.8825 13.8825 14.1013 14.1013 14.1661 14.1661 14.6900 14.6900 14.7688 14.7688 14.8474 14.8474 15.8077 15.8077 16.5044 16.5044 k = 0.5956 0.0127 0.3602 ( 3921 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0636 -0.0636 -0.0609 -0.0609 0.3751 0.3751 0.3985 0.3985 0.4112 0.4112 7.3549 7.3549 9.4501 9.4501 10.3146 10.3146 11.5452 11.5452 11.6749 11.6749 12.0909 12.0909 12.4728 12.4728 12.7695 12.7695 13.1385 13.1385 13.2697 13.2697 13.4759 13.4759 13.8893 13.8893 14.0927 14.0927 14.1522 14.1522 14.6864 14.6864 14.7797 14.7797 14.8483 14.8483 15.7326 15.7326 16.4098 16.4098 k = 0.5993 0.0021 0.3662 ( 3921 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0637 -0.0637 -0.0609 -0.0609 0.3751 0.3751 0.3984 0.3984 0.4113 0.4113 7.3799 7.3799 9.5045 9.5045 10.2617 10.2617 11.5174 11.5174 11.7060 11.7060 12.0920 12.0920 12.4823 12.4823 12.7688 12.7688 13.1257 13.1257 13.2808 13.2808 13.4764 13.4764 13.8959 13.8959 14.0866 14.0866 14.1385 14.1385 14.6797 14.6797 14.7896 14.7896 14.8494 14.8494 15.6663 15.6663 16.3189 16.3189 k = 0.6029-0.0085 0.3722 ( 3913 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0637 -0.0637 -0.0609 -0.0609 0.3750 0.3750 0.3983 0.3983 0.4114 0.4114 7.4037 7.4037 9.5563 9.5563 10.2120 10.2120 11.4910 11.4910 11.7376 11.7376 12.0939 12.0939 12.4881 12.4881 12.7716 12.7716 13.1094 13.1094 13.2956 13.2956 13.4770 13.4770 13.9024 13.9024 14.0833 14.0833 14.1249 14.1249 14.6704 14.6704 14.7990 14.7990 14.8504 14.8504 15.6089 15.6089 16.2320 16.2320 k = 0.6066-0.0191 0.3782 ( 3915 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0638 -0.0638 -0.0609 -0.0609 0.3750 0.3750 0.3981 0.3981 0.4115 0.4115 7.4259 7.4259 9.6032 9.6032 10.1681 10.1681 11.4662 11.4662 11.7692 11.7692 12.0959 12.0959 12.4900 12.4900 12.7769 12.7769 13.0910 13.0910 13.3124 13.3124 13.4775 13.4775 13.9088 13.9088 14.0814 14.0814 14.1110 14.1110 14.6580 14.6580 14.8071 14.8071 14.8511 14.8511 15.5604 15.5604 16.1493 16.1493 k = 0.6103-0.0297 0.3842 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0639 -0.0639 -0.0609 -0.0609 0.3749 0.3749 0.3980 0.3980 0.4117 0.4117 7.4460 7.4460 9.6418 9.6418 10.1338 10.1338 11.4432 11.4432 11.8008 11.8008 12.0985 12.0985 12.4892 12.4892 12.7842 12.7842 13.0719 13.0719 13.3300 13.3300 13.4779 13.4779 13.9157 13.9157 14.0821 14.0821 14.0973 14.0973 14.6432 14.6432 14.8143 14.8143 14.8519 14.8519 15.5208 15.5208 16.0713 16.0713 k = 0.6140-0.0403 0.3902 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0640 -0.0640 -0.0609 -0.0609 0.3748 0.3748 0.3979 0.3979 0.4118 0.4118 7.4635 7.4635 9.6673 9.6673 10.1139 10.1139 11.4225 11.4225 11.8321 11.8321 12.1012 12.1012 12.4855 12.4855 12.7928 12.7928 13.0525 13.0525 13.3478 13.3478 13.4783 13.4783 13.9234 13.9234 14.0809 14.0809 14.0869 14.0869 14.6260 14.6260 14.8196 14.8196 14.8522 14.8522 15.4896 15.4896 15.9985 15.9985 k = 0.6176-0.0509 0.3962 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0641 -0.0641 -0.0609 -0.0609 0.3747 0.3747 0.3977 0.3977 0.4120 0.4120 7.4781 7.4781 9.6756 9.6756 10.1130 10.1130 11.4041 11.4041 11.8627 11.8627 12.1043 12.1043 12.4802 12.4802 12.8014 12.8014 13.0334 13.0334 13.3654 13.3654 13.4788 13.4788 13.9323 13.9323 14.0682 14.0682 14.0901 14.0901 14.6073 14.6073 14.8234 14.8234 14.8526 14.8526 15.4662 15.4662 15.9312 15.9312 k = 0.6213-0.0616 0.4022 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0643 -0.0643 -0.0609 -0.0609 0.3746 0.3746 0.3976 0.3976 0.4122 0.4122 7.4892 7.4892 9.6664 9.6664 10.1318 10.1318 11.3885 11.3885 11.8928 11.8928 12.1075 12.1075 12.4732 12.4732 12.8093 12.8093 13.0147 13.0147 13.3823 13.3823 13.4793 13.4793 13.9428 13.9428 14.0544 14.0544 14.0959 14.0959 14.5873 14.5873 14.8253 14.8253 14.8527 14.8527 15.4499 15.4499 15.8701 15.8701 k = 0.6250-0.0722 0.4082 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0644 -0.0644 -0.0608 -0.0608 0.3746 0.3746 0.3974 0.3974 0.4124 0.4124 7.4961 7.4961 9.6436 9.6436 10.1670 10.1670 11.3757 11.3757 11.9217 11.9217 12.1112 12.1112 12.4658 12.4658 12.8155 12.8155 12.9970 12.9970 13.3983 13.3983 13.4801 13.4801 13.9549 13.9549 14.0404 14.0404 14.1032 14.1032 14.5668 14.5668 14.8255 14.8255 14.8535 14.8535 15.4400 15.4400 15.8155 15.8155 k = 0.6250-0.0722 0.4082 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0644 -0.0644 -0.0608 -0.0608 0.3746 0.3746 0.3974 0.3974 0.4124 0.4124 7.4961 7.4961 9.6436 9.6436 10.1670 10.1670 11.3757 11.3757 11.9217 11.9217 12.1112 12.1112 12.4658 12.4658 12.8155 12.8155 12.9970 12.9970 13.3983 13.3983 13.4801 13.4801 13.9549 13.9549 14.0404 14.0404 14.1032 14.1032 14.5668 14.5668 14.8255 14.8255 14.8535 14.8535 15.4400 15.4400 15.8155 15.8155 k = 0.6188-0.0686 0.4185 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0644 -0.0644 -0.0608 -0.0608 0.3745 0.3745 0.3974 0.3974 0.4124 0.4124 7.4965 7.4965 9.6447 9.6447 10.1674 10.1674 11.3734 11.3734 11.9224 11.9224 12.1120 12.1120 12.4653 12.4653 12.8135 12.8135 12.9977 12.9977 13.3980 13.3980 13.4809 13.4809 13.9552 13.9552 14.0382 14.0382 14.1069 14.1069 14.5661 14.5661 14.8170 14.8170 14.8612 14.8612 15.4397 15.4397 15.8112 15.8112 k = 0.6125-0.0650 0.4287 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0644 -0.0644 -0.0609 -0.0609 0.3745 0.3745 0.3975 0.3975 0.4123 0.4123 7.4978 7.4978 9.6479 9.6479 10.1686 10.1686 11.3666 11.3666 11.9244 11.9244 12.1143 12.1143 12.4638 12.4638 12.8074 12.8074 12.9996 12.9996 13.3967 13.3967 13.4833 13.4833 13.9562 13.9562 14.0325 14.0325 14.1164 14.1164 14.5639 14.5639 14.8010 14.8010 14.8747 14.8747 15.4387 15.4387 15.7986 15.7986 k = 0.6062-0.0613 0.4389 ( 3908 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0643 -0.0643 -0.0609 -0.0609 0.3745 0.3745 0.3976 0.3976 0.4123 0.4123 7.4998 7.4998 9.6532 9.6532 10.1706 10.1706 11.3554 11.3554 11.9277 11.9277 12.1183 12.1183 12.4615 12.4615 12.7977 12.7977 13.0028 13.0028 13.3943 13.3943 13.4875 13.4875 13.9577 13.9577 14.0264 14.0264 14.1299 14.1299 14.5601 14.5601 14.7829 14.7829 14.8890 14.8890 15.4370 15.4370 15.7783 15.7783 k = 0.6000-0.0577 0.4491 ( 3906 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2499 -41.2499 -41.2496 -41.2496 -0.0643 -0.0643 -0.0609 -0.0609 0.3745 0.3745 0.3977 0.3977 0.4122 0.4122 7.5027 7.5027 9.6607 9.6607 10.1733 10.1733 11.3401 11.3401 11.9321 11.9321 12.1239 12.1239 12.4584 12.4584 12.7843 12.7843 13.0072 13.0072 13.3903 13.3903 13.4939 13.4939 13.9599 13.9599 14.0201 14.0201 14.1456 14.1456 14.5551 14.5551 14.7637 14.7637 14.9028 14.9028 15.4347 15.4347 15.7512 15.7512 k = 0.5938-0.0541 0.4593 ( 3908 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0642 -0.0642 -0.0609 -0.0609 0.3745 0.3745 0.3978 0.3978 0.4121 0.4121 7.5062 7.5062 9.6702 9.6702 10.1765 10.1765 11.3208 11.3208 11.9374 11.9374 12.1308 12.1308 12.4544 12.4544 12.7677 12.7677 13.0127 13.0127 13.3847 13.3847 13.5025 13.5025 13.9626 13.9626 14.0149 14.0149 14.1625 14.1625 14.5486 14.5486 14.7432 14.7432 14.9160 14.9160 15.4318 15.4318 15.7187 15.7187 k = 0.5875-0.0505 0.4695 ( 3908 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0642 -0.0642 -0.0609 -0.0609 0.3745 0.3745 0.3980 0.3980 0.4119 0.4119 7.5105 7.5105 9.6819 9.6819 10.1801 10.1801 11.2980 11.2980 11.9434 11.9434 12.1393 12.1393 12.4496 12.4496 12.7481 12.7481 13.0192 13.0192 13.3774 13.3774 13.5132 13.5132 13.9659 13.9659 14.0110 14.0110 14.1803 14.1803 14.5409 14.5409 14.7221 14.7221 14.9287 14.9287 15.4282 15.4282 15.6822 15.6822 k = 0.5813-0.0469 0.4797 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2497 -41.2497 -0.0641 -0.0641 -0.0610 -0.0610 0.3744 0.3744 0.3982 0.3982 0.4118 0.4118 7.5155 7.5155 9.6956 9.6956 10.1840 10.1840 11.2719 11.2719 11.9498 11.9498 12.1490 12.1490 12.4442 12.4442 12.7260 12.7260 13.0267 13.0267 13.3684 13.3684 13.5258 13.5258 13.9695 13.9695 14.0082 14.0082 14.1983 14.1983 14.5317 14.5317 14.7000 14.7000 14.9406 14.9406 15.4240 15.4240 15.6429 15.6429 k = 0.5750-0.0433 0.4899 ( 3906 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2499 -41.2499 -41.2496 -41.2496 -0.0640 -0.0640 -0.0610 -0.0610 0.3744 0.3744 0.3984 0.3984 0.4116 0.4116 7.5210 7.5210 9.7114 9.7114 10.1879 10.1879 11.2434 11.2434 11.9569 11.9569 12.1605 12.1605 12.4385 12.4385 12.7020 12.7020 13.0350 13.0350 13.3580 13.3580 13.5402 13.5402 13.9737 13.9737 14.0068 14.0068 14.2169 14.2169 14.5225 14.5225 14.6777 14.6777 14.9520 14.9520 15.4192 15.4192 15.6025 15.6025 k = 0.5687-0.0397 0.5001 ( 3904 PWs) bands (ev): -77.3118 -77.3118 -42.9858 -42.9858 -41.2499 -41.2499 -41.2496 -41.2496 -0.0639 -0.0639 -0.0611 -0.0611 0.3744 0.3744 0.3986 0.3986 0.4114 0.4114 7.5269 7.5269 9.7293 9.7293 10.1914 10.1914 11.2124 11.2124 11.9641 11.9641 12.1736 12.1736 12.4323 12.4323 12.6762 12.6762 13.0442 13.0442 13.3464 13.3464 13.5558 13.5558 13.9781 13.9781 14.0062 14.0062 14.2349 14.2349 14.5116 14.5116 14.6551 14.6551 14.9630 14.9630 15.4138 15.4138 15.5621 15.5621 k = 0.5625-0.0361 0.5103 ( 3912 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0638 -0.0638 -0.0611 -0.0611 0.3743 0.3743 0.3988 0.3988 0.4112 0.4112 7.5333 7.5333 9.7491 9.7491 10.1941 10.1941 11.1796 11.1796 11.9712 11.9712 12.1876 12.1876 12.4254 12.4254 12.6490 12.6490 13.0539 13.0539 13.3338 13.3338 13.5723 13.5723 13.9827 13.9827 14.0066 14.0066 14.2518 14.2518 14.4996 14.4996 14.6320 14.6320 14.9727 14.9727 15.4079 15.4079 15.5229 15.5229 k = 0.5563-0.0325 0.5205 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0637 -0.0637 -0.0612 -0.0612 0.3743 0.3743 0.3991 0.3991 0.4110 0.4110 7.5400 7.5400 9.7709 9.7709 10.1957 10.1957 11.1460 11.1460 11.9782 11.9782 12.2031 12.2031 12.4186 12.4186 12.6212 12.6212 13.0642 13.0642 13.3206 13.3206 13.5894 13.5894 13.9875 13.9875 14.0081 14.0081 14.2679 14.2679 14.4880 14.4880 14.6091 14.6091 14.9821 14.9821 15.4015 15.4015 15.4859 15.4859 k = 0.5500-0.0289 0.5307 ( 3908 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0636 -0.0636 -0.0613 -0.0613 0.3743 0.3743 0.3993 0.3993 0.4108 0.4108 7.5468 7.5468 9.7947 9.7947 10.1955 10.1955 11.1121 11.1121 11.9849 11.9849 12.2196 12.2196 12.4117 12.4117 12.5932 12.5932 13.0750 13.0750 13.3069 13.3069 13.6067 13.6067 13.9925 13.9925 14.0104 14.0104 14.2830 14.2830 14.4766 14.4766 14.5863 14.5863 14.9906 14.9906 15.3947 15.3947 15.4520 15.4520 k = 0.5437-0.0253 0.5409 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0635 -0.0635 -0.0613 -0.0613 0.3743 0.3743 0.3995 0.3995 0.4106 0.4106 7.5536 7.5536 9.8203 9.8203 10.1927 10.1927 11.0788 11.0788 11.9912 11.9912 12.2369 12.2369 12.4048 12.4048 12.5651 12.5651 13.0860 13.0860 13.2929 13.2929 13.6235 13.6235 13.9971 13.9971 14.0127 14.0127 14.2970 14.2970 14.4649 14.4649 14.5634 14.5634 14.9984 14.9984 15.3875 15.3875 15.4218 15.4218 k = 0.5375-0.0217 0.5511 ( 3913 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0634 -0.0634 -0.0614 -0.0614 0.3743 0.3743 0.3997 0.3997 0.4104 0.4104 7.5602 7.5602 9.8479 9.8479 10.1868 10.1868 11.0473 11.0473 11.9971 11.9971 12.2553 12.2553 12.3982 12.3982 12.5376 12.5376 13.0972 13.0972 13.2789 13.2789 13.6396 13.6396 14.0020 14.0020 14.0158 14.0158 14.3100 14.3100 14.4537 14.4537 14.5413 14.5413 15.0056 15.0056 15.3801 15.3801 15.3959 15.3959 k = 0.5312-0.0180 0.5613 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0633 -0.0633 -0.0615 -0.0615 0.3742 0.3742 0.3999 0.3999 0.4102 0.4102 7.5666 7.5666 9.8772 9.8772 10.1769 10.1769 11.0186 11.0186 12.0023 12.0023 12.2744 12.2744 12.3919 12.3919 12.5110 12.5110 13.1085 13.1085 13.2652 13.2652 13.6545 13.6545 14.0067 14.0067 14.0188 14.0188 14.3218 14.3218 14.4438 14.4438 14.5202 14.5202 15.0121 15.0121 15.3724 15.3724 15.3749 15.3749 k = 0.5250-0.0144 0.5715 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0632 -0.0632 -0.0615 -0.0615 0.3742 0.3742 0.4001 0.4001 0.4101 0.4101 7.5723 7.5723 9.9083 9.9083 10.1623 10.1623 10.9937 10.9937 12.0067 12.0067 12.2936 12.2936 12.3864 12.3864 12.4857 12.4857 13.1194 13.1194 13.2521 13.2521 13.6674 13.6674 14.0108 14.0108 14.0214 14.0214 14.3329 14.3329 14.4347 14.4347 14.5001 14.5001 15.0176 15.0176 15.3580 15.3580 15.3653 15.3653 k = 0.5188-0.0108 0.5818 ( 3908 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0632 -0.0632 -0.0616 -0.0616 0.3742 0.3742 0.4003 0.4003 0.4100 0.4100 7.5773 7.5773 9.9411 9.9411 10.1424 10.1424 10.9735 10.9735 12.0103 12.0103 12.3122 12.3122 12.3825 12.3825 12.4621 12.4621 13.1297 13.1297 13.2401 13.2401 13.6781 13.6781 14.0144 14.0144 14.0236 14.0236 14.3434 14.3434 14.4275 14.4275 14.4816 14.4816 15.0222 15.0222 15.3465 15.3465 15.3581 15.3581 k = 0.5125-0.0072 0.5920 ( 3906 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0616 -0.0616 0.3742 0.3742 0.4004 0.4004 0.4099 0.4099 7.5812 7.5812 9.9755 9.9755 10.1170 10.1170 10.9589 10.9589 12.0128 12.0128 12.3284 12.3284 12.3819 12.3819 12.4402 12.4402 13.1387 13.1387 13.2299 13.2299 13.6861 13.6861 14.0176 14.0176 14.0252 14.0252 14.3524 14.3524 14.4228 14.4228 14.4652 14.4652 15.0256 15.0256 15.3399 15.3399 15.3514 15.3514 k = 0.5062-0.0036 0.6022 ( 3884 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2497 -41.2497 -41.2494 -41.2494 -0.0630 -0.0630 -0.0617 -0.0617 0.3742 0.3742 0.4004 0.4004 0.4098 0.4098 7.5838 7.5838 10.0114 10.0114 10.0863 10.0863 10.9502 10.9502 12.0148 12.0148 12.3395 12.3395 12.3874 12.3874 12.4210 12.4210 13.1451 13.1451 13.2229 13.2229 13.6911 13.6911 14.0210 14.0210 14.0261 14.0261 14.3595 14.3595 14.4235 14.4235 14.4518 14.4518 15.0284 15.0284 15.3378 15.3378 15.3453 15.3453 k = 0.5000 0.0000 0.6124 ( 3884 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2497 -41.2497 -41.2494 -41.2494 -0.0630 -0.0630 -0.0617 -0.0617 0.3742 0.3742 0.4005 0.4005 0.4098 0.4098 7.5847 7.5847 10.0431 10.0431 10.0562 10.0562 10.9473 10.9473 12.0154 12.0154 12.3423 12.3423 12.3963 12.3963 12.4081 12.4081 13.1474 13.1474 13.2202 13.2202 13.6928 13.6928 14.0219 14.0219 14.0262 14.0262 14.3617 14.3617 14.4262 14.4262 14.4442 14.4442 15.0291 15.0291 15.3398 15.3398 15.3407 15.3407 k = 0.5000 0.0000 0.6124 ( 3884 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2497 -41.2497 -41.2494 -41.2494 -0.0630 -0.0630 -0.0617 -0.0617 0.3742 0.3742 0.4005 0.4005 0.4098 0.4098 7.5847 7.5847 10.0431 10.0431 10.0562 10.0562 10.9473 10.9473 12.0154 12.0154 12.3423 12.3423 12.3963 12.3963 12.4081 12.4081 13.1474 13.1474 13.2202 13.2202 13.6928 13.6928 14.0219 14.0219 14.0262 14.0262 14.3617 14.3617 14.4262 14.4262 14.4442 14.4442 15.0291 15.0291 15.3398 15.3398 15.3407 15.3407 k = 0.5000 0.0074 0.6019 ( 3884 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2497 -41.2497 -41.2494 -41.2494 -0.0630 -0.0630 -0.0617 -0.0617 0.3742 0.3742 0.4005 0.4005 0.4098 0.4098 7.5831 7.5831 10.0402 10.0402 10.0556 10.0556 10.9523 10.9523 12.0129 12.0129 12.3385 12.3385 12.3981 12.3981 12.4112 12.4112 13.1484 13.1484 13.2212 13.2212 13.6891 13.6891 14.0213 14.0213 14.0249 14.0249 14.3584 14.3584 14.4294 14.4294 14.4499 14.4499 15.0280 15.0280 15.3425 15.3425 15.3445 15.3445 k = 0.5000 0.0148 0.5914 ( 3906 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2499 -41.2499 -41.2496 -41.2496 -0.0630 -0.0630 -0.0617 -0.0617 0.3742 0.3742 0.4004 0.4004 0.4098 0.4098 7.5783 7.5783 10.0252 10.0252 10.0602 10.0602 10.9667 10.9667 12.0055 12.0055 12.3293 12.3293 12.3983 12.3983 12.4220 12.4220 13.1510 13.1510 13.2239 13.2239 13.6780 13.6780 14.0157 14.0157 14.0237 14.0237 14.3494 14.3494 14.4391 14.4391 14.4637 14.4637 15.0241 15.0241 15.3499 15.3499 15.3564 15.3564 k = 0.5000 0.0222 0.5810 ( 3912 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0630 -0.0630 -0.0617 -0.0617 0.3743 0.3743 0.4004 0.4004 0.4098 0.4098 7.5704 7.5704 9.9983 9.9983 10.0711 10.0711 10.9895 10.9895 11.9938 11.9938 12.3189 12.3189 12.3968 12.3968 12.4388 12.4388 13.1554 13.1554 13.2285 13.2285 13.6604 13.6604 14.0072 14.0072 14.0248 14.0248 14.3376 14.3376 14.4551 14.4551 14.4838 14.4838 15.0191 15.0191 15.3623 15.3623 15.3762 15.3762 k = 0.5000 0.0296 0.5705 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0630 -0.0630 -0.0616 -0.0616 0.3743 0.3743 0.4004 0.4004 0.4098 0.4098 7.5596 7.5596 9.9624 9.9624 10.0869 10.0869 11.0191 11.0191 11.9782 11.9782 12.3086 12.3086 12.3942 12.3942 12.4582 12.4582 13.1613 13.1613 13.2351 13.2351 13.6369 13.6369 13.9975 13.9975 14.0278 14.0278 14.3246 14.3246 14.4732 14.4732 14.5087 14.5087 15.0126 15.0126 15.3804 15.3804 15.4035 15.4035 k = 0.5000 0.0370 0.5600 ( 3912 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0630 -0.0630 -0.0616 -0.0616 0.3744 0.3744 0.4004 0.4004 0.4098 0.4098 7.5459 7.5459 9.9195 9.9195 10.1071 10.1071 11.0539 11.0539 11.9594 11.9594 12.2987 12.2987 12.3906 12.3906 12.4796 12.4796 13.1684 13.1684 13.2434 13.2434 13.6086 13.6086 13.9874 13.9874 14.0319 14.0319 14.3122 14.3122 14.4913 14.4913 14.5368 14.5368 15.0051 15.0051 15.4046 15.4046 15.4379 15.4379 k = 0.5000 0.0444 0.5496 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0616 -0.0616 0.3744 0.3744 0.4003 0.4003 0.4098 0.4098 7.5297 7.5297 9.8711 9.8711 10.1312 10.1312 11.0922 11.0922 11.9379 11.9379 12.2893 12.2893 12.3861 12.3861 12.5021 12.5021 13.1765 13.1765 13.2535 13.2535 13.5766 13.5766 13.9775 13.9775 14.0366 14.0366 14.3003 14.3003 14.5084 14.5084 14.5659 14.5659 14.9969 14.9969 15.4355 15.4355 15.4794 15.4794 k = 0.5000 0.0518 0.5391 ( 3912 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0615 -0.0615 0.3745 0.3745 0.4003 0.4003 0.4098 0.4098 7.5112 7.5112 9.8187 9.8187 10.1592 10.1592 11.1329 11.1329 11.9144 11.9144 12.2805 12.2805 12.3807 12.3807 12.5256 12.5256 13.1854 13.1854 13.2649 13.2649 13.5420 13.5420 13.9679 13.9679 14.0424 14.0424 14.2895 14.2895 14.5244 14.5244 14.5943 14.5943 14.9886 14.9886 15.4737 15.4737 15.5279 15.5279 k = 0.5000 0.0592 0.5286 ( 3912 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0615 -0.0615 0.3745 0.3745 0.4002 0.4002 0.4098 0.4098 7.4906 7.4906 9.7633 9.7633 10.1904 10.1904 11.1747 11.1747 11.8896 11.8896 12.2717 12.2717 12.3746 12.3746 12.5495 12.5495 13.1950 13.1950 13.2775 13.2775 13.5059 13.5059 13.9586 13.9586 14.0495 14.0495 14.2799 14.2799 14.5393 14.5393 14.6202 14.6202 14.9796 14.9796 15.5195 15.5195 15.5831 15.5831 k = 0.5000 0.0666 0.5182 ( 3916 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0631 -0.0631 -0.0615 -0.0615 0.3746 0.3746 0.4001 0.4001 0.4098 0.4098 7.4682 7.4682 9.7059 9.7059 10.2247 10.2247 11.2167 11.2167 11.8637 11.8637 12.2629 12.2629 12.3676 12.3676 12.5737 12.5737 13.2052 13.2052 13.2906 13.2906 13.4693 13.4693 13.9496 13.9496 14.0576 14.0576 14.2714 14.2714 14.5530 14.5530 14.6425 14.6425 14.9702 14.9702 15.5732 15.5732 15.6451 15.6451 k = 0.5000 0.0740 0.5077 ( 3920 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0631 -0.0631 -0.0614 -0.0614 0.3747 0.3747 0.4001 0.4001 0.4099 0.4099 7.4442 7.4442 9.6472 9.6472 10.2617 10.2617 11.2582 11.2582 11.8376 11.8376 12.2546 12.2546 12.3598 12.3598 12.5982 12.5982 13.2159 13.2159 13.3036 13.3036 13.4332 13.4332 13.9405 13.9405 14.0664 14.0664 14.2641 14.2641 14.5654 14.5654 14.6609 14.6609 14.9611 14.9611 15.6347 15.6347 15.7139 15.7139 k = 0.5000 0.0814 0.4972 ( 3916 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0613 -0.0613 0.3748 0.3748 0.4000 0.4000 0.4099 0.4099 7.4190 7.4190 9.5877 9.5877 10.3011 10.3011 11.2986 11.2986 11.8119 11.8119 12.2470 12.2470 12.3513 12.3513 12.6228 12.6228 13.2273 13.2273 13.3149 13.3149 13.3996 13.3996 13.9314 13.9314 14.0766 14.0766 14.2587 14.2587 14.5765 14.5765 14.6754 14.6754 14.9523 14.9523 15.7039 15.7039 15.7894 15.7894 k = 0.5000 0.0888 0.4868 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0613 -0.0613 0.3748 0.3748 0.3999 0.3999 0.4100 0.4100 7.3927 7.3927 9.5280 9.5280 10.3424 10.3424 11.3369 11.3369 11.7872 11.7872 12.2394 12.2394 12.3423 12.3423 12.6472 12.6472 13.2392 13.2392 13.3185 13.3185 13.3743 13.3743 13.9222 13.9222 14.0876 14.0876 14.2546 14.2546 14.5863 14.5863 14.6861 14.6861 14.9433 14.9433 15.7803 15.7803 15.8715 15.8715 k = 0.5000 0.0962 0.4763 ( 3916 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0631 -0.0631 -0.0612 -0.0612 0.3749 0.3749 0.3998 0.3998 0.4101 0.4101 7.3657 7.3657 9.4685 9.4685 10.3855 10.3855 11.3724 11.3724 11.7644 11.7644 12.2316 12.2316 12.3324 12.3324 12.6713 12.6713 13.2515 13.2515 13.3031 13.3031 13.3689 13.3689 13.9128 13.9128 14.0992 14.0992 14.2520 14.2520 14.5947 14.5947 14.6932 14.6932 14.9343 14.9343 15.8635 15.8635 15.9601 15.9601 k = 0.5000 0.1036 0.4658 ( 3916 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0632 -0.0632 -0.0612 -0.0612 0.3750 0.3750 0.3997 0.3997 0.4102 0.4102 7.3382 7.3382 9.4095 9.4095 10.4298 10.4298 11.4038 11.4038 11.7447 11.7447 12.2242 12.2242 12.3218 12.3218 12.6951 12.6951 13.2626 13.2626 13.2767 13.2767 13.3769 13.3769 13.9031 13.9031 14.1115 14.1115 14.2507 14.2507 14.6019 14.6019 14.6968 14.6968 14.9256 14.9256 15.9530 15.9530 16.0551 16.0551 k = 0.5000 0.1110 0.4554 ( 3914 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0632 -0.0632 -0.0611 -0.0611 0.3750 0.3750 0.3996 0.3996 0.4103 0.4103 7.3103 7.3103 9.3513 9.3513 10.4751 10.4751 11.4297 11.4297 11.7300 11.7300 12.2168 12.2168 12.3110 12.3110 12.7181 12.7181 13.2427 13.2427 13.2795 13.2795 13.3885 13.3885 13.8933 13.8933 14.1248 14.1248 14.2510 14.2510 14.6080 14.6080 14.6977 14.6977 14.9170 14.9170 16.0484 16.0484 16.1560 16.1560 k = 0.5000 0.1184 0.4449 ( 3916 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0632 -0.0632 -0.0610 -0.0610 0.3751 0.3751 0.3994 0.3994 0.4104 0.4104 7.2824 7.2824 9.2942 9.2942 10.5209 10.5209 11.4481 11.4481 11.7217 11.7217 12.2095 12.2095 12.2994 12.2994 12.7402 12.7402 13.2126 13.2126 13.2931 13.2931 13.4006 13.4006 13.8833 13.8833 14.1387 14.1387 14.2525 14.2525 14.6127 14.6127 14.6957 14.6957 14.9085 14.9085 16.1490 16.1490 16.2630 16.2630 k = 0.5000 0.1258 0.4344 ( 3912 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0632 -0.0632 -0.0610 -0.0610 0.3751 0.3751 0.3993 0.3993 0.4106 0.4106 7.2546 7.2546 9.2383 9.2383 10.5673 10.5673 11.4578 11.4578 11.7217 11.7217 12.2024 12.2024 12.2877 12.2877 12.7613 12.7613 13.1832 13.1832 13.3075 13.3075 13.4128 13.4128 13.8732 13.8732 14.1533 14.1533 14.2554 14.2554 14.6162 14.6162 14.6921 14.6921 14.9005 14.9005 16.2550 16.2550 16.3755 16.3755 k = 0.5000 0.1332 0.4240 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0633 -0.0633 -0.0609 -0.0609 0.3752 0.3752 0.3992 0.3992 0.4108 0.4108 7.2270 7.2270 9.1840 9.1840 10.6136 10.6136 11.4584 11.4584 11.7304 11.7304 12.1956 12.1956 12.2754 12.2754 12.7813 12.7813 13.1551 13.1551 13.3223 13.3223 13.4247 13.4247 13.8630 13.8630 14.1681 14.1681 14.2596 14.2596 14.6187 14.6187 14.6862 14.6862 14.8928 14.8928 16.3656 16.3656 16.4936 16.4936 k = 0.5000 0.1406 0.4135 ( 3906 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2499 -41.2499 -41.2495 -41.2495 -0.0633 -0.0633 -0.0608 -0.0608 0.3752 0.3752 0.3990 0.3990 0.4110 0.4110 7.1999 7.1999 9.1312 9.1312 10.6599 10.6599 11.4513 11.4513 11.7462 11.7462 12.1889 12.1889 12.2633 12.2633 12.7998 12.7998 13.1286 13.1286 13.3375 13.3375 13.4363 13.4363 13.8528 13.8528 14.1835 14.1835 14.2646 14.2646 14.6199 14.6199 14.6791 14.6791 14.8856 14.8856 16.4808 16.4808 16.6168 16.6168 k = 0.5000 0.1480 0.4030 ( 3912 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0633 -0.0633 -0.0608 -0.0608 0.3752 0.3752 0.3989 0.3989 0.4112 0.4112 7.1733 7.1733 9.0803 9.0803 10.7054 10.7054 11.4386 11.4386 11.7670 11.7670 12.1820 12.1820 12.2508 12.2508 12.8165 12.8165 13.1036 13.1036 13.3528 13.3528 13.4477 13.4477 13.8424 13.8424 14.1986 14.1986 14.2703 14.2703 14.6197 14.6197 14.6704 14.6704 14.8787 14.8787 16.6001 16.6001 16.7447 16.7447 k = 0.5000 0.1554 0.3925 ( 3912 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0634 -0.0634 -0.0607 -0.0607 0.3753 0.3753 0.3987 0.3987 0.4114 0.4114 7.1475 7.1475 9.0313 9.0313 10.7503 10.7503 11.4226 11.4226 11.7909 11.7909 12.1757 12.1757 12.2386 12.2386 12.8315 12.8315 13.0802 13.0802 13.3683 13.3683 13.4589 13.4589 13.8321 13.8321 14.2142 14.2142 14.2768 14.2768 14.6183 14.6183 14.6608 14.6608 14.8727 14.8727 16.7235 16.7235 16.8774 16.8774 k = 0.5000 0.1628 0.3821 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0634 -0.0634 -0.0606 -0.0606 0.3753 0.3753 0.3986 0.3986 0.4117 0.4117 7.1224 7.1224 8.9844 8.9844 10.7941 10.7941 11.4048 11.4048 11.8166 11.8166 12.1696 12.1696 12.2265 12.2265 12.8446 12.8446 13.0584 13.0584 13.3839 13.3839 13.4702 13.4702 13.8220 13.8220 14.2301 14.2301 14.2841 14.2841 14.6157 14.6157 14.6505 14.6505 14.8673 14.8673 16.8508 16.8508 17.0143 17.0143 k = 0.5000 0.1702 0.3716 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0635 -0.0635 -0.0606 -0.0606 0.3753 0.3753 0.3984 0.3984 0.4119 0.4119 7.0984 7.0984 8.9396 8.9396 10.8367 10.8367 11.3861 11.3861 11.8430 11.8430 12.1636 12.1636 12.2147 12.2147 12.8556 12.8556 13.0381 13.0381 13.3993 13.3993 13.4816 13.4816 13.8121 13.8121 14.2454 14.2454 14.2918 14.2918 14.6121 14.6121 14.6397 14.6397 14.8625 14.8625 16.9820 16.9820 17.1551 17.1551 k = 0.5000 0.1776 0.3611 ( 3918 PWs) bands (ev): -77.3123 -77.3123 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0605 -0.0605 0.3753 0.3753 0.3983 0.3983 0.4122 0.4122 7.0753 7.0753 8.8971 8.8971 10.8777 10.8777 11.3671 11.3671 11.8695 11.8695 12.1577 12.1577 12.2030 12.2030 12.8644 12.8644 13.0195 13.0195 13.4146 13.4146 13.4932 13.4932 13.8023 13.8023 14.2600 14.2600 14.2994 14.2994 14.6071 14.6071 14.6285 14.6285 14.8583 14.8583 17.1167 17.1167 17.2995 17.2995 k = 0.5000 0.1850 0.3507 ( 3912 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0635 -0.0635 -0.0604 -0.0604 0.3752 0.3752 0.3981 0.3981 0.4124 0.4124 7.0534 7.0534 8.8570 8.8570 10.9172 10.9172 11.3485 11.3485 11.8958 11.8958 12.1526 12.1526 12.1921 12.1921 12.8710 12.8710 13.0025 13.0025 13.4297 13.4297 13.5050 13.5050 13.7931 13.7931 14.2748 14.2748 14.3078 14.3078 14.6011 14.6011 14.6176 14.6176 14.8552 14.8552 17.2553 17.2553 17.4474 17.4474 k = 0.5000 0.1925 0.3402 ( 3906 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2500 -41.2500 -41.2495 -41.2495 -0.0636 -0.0636 -0.0604 -0.0604 0.3752 0.3752 0.3980 0.3980 0.4127 0.4127 7.0327 7.0327 8.8194 8.8194 10.9548 10.9548 11.3305 11.3305 11.9216 11.9216 12.1476 12.1476 12.1821 12.1821 12.8753 12.8753 12.9871 12.9871 13.4444 13.4444 13.5170 13.5170 13.7842 13.7842 14.2889 14.2889 14.3163 14.3163 14.5938 14.5938 14.6076 14.6076 14.8528 14.8528 17.3975 17.3975 17.5980 17.5980 k = 0.5000 0.1999 0.3297 ( 3914 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0636 -0.0636 -0.0603 -0.0603 0.3752 0.3752 0.3979 0.3979 0.4129 0.4129 7.0133 7.0133 8.7842 8.7842 10.9900 10.9900 11.3132 11.3132 11.9463 11.9463 12.1424 12.1424 12.1723 12.1723 12.8774 12.8774 12.9734 12.9734 13.4586 13.4586 13.5290 13.5290 13.7758 13.7758 14.3011 14.3011 14.3245 14.3245 14.5850 14.5850 14.5980 14.5980 14.8505 14.8505 17.5428 17.5428 17.7509 17.7509 k = 0.5000 0.2073 0.3193 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0637 -0.0637 -0.0603 -0.0603 0.3752 0.3752 0.3978 0.3978 0.4132 0.4132 6.9952 6.9952 8.7516 8.7516 11.0233 11.0233 11.2969 11.2969 11.9701 11.9701 12.1379 12.1379 12.1635 12.1635 12.8775 12.8775 12.9613 12.9613 13.4722 13.4722 13.5411 13.5411 13.7681 13.7681 14.3129 14.3129 14.3333 14.3333 14.5754 14.5754 14.5896 14.5896 14.8490 14.8490 17.6917 17.6917 17.9059 17.9059 k = 0.5000 0.2147 0.3088 ( 3902 PWs) bands (ev): -77.3118 -77.3118 -42.9858 -42.9858 -41.2499 -41.2499 -41.2494 -41.2494 -0.0637 -0.0637 -0.0602 -0.0602 0.3751 0.3751 0.3977 0.3977 0.4134 0.4134 6.9785 6.9785 8.7217 8.7217 11.0540 11.0540 11.2820 11.2820 11.9928 11.9928 12.1338 12.1338 12.1558 12.1558 12.8758 12.8758 12.9508 12.9508 13.4851 13.4851 13.5531 13.5531 13.7611 13.7611 14.3231 14.3231 14.3424 14.3424 14.5657 14.5657 14.5819 14.5819 14.8483 14.8483 17.8437 17.8437 18.0624 18.0624 k = 0.5000 0.2221 0.2983 ( 3904 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2499 -41.2499 -41.2494 -41.2494 -0.0637 -0.0637 -0.0602 -0.0602 0.3751 0.3751 0.3975 0.3975 0.4137 0.4137 6.9632 6.9632 8.6945 8.6945 11.0822 11.0822 11.2680 11.2680 12.0139 12.0139 12.1297 12.1297 12.1487 12.1487 12.8725 12.8725 12.9417 12.9417 13.4971 13.4971 13.5647 13.5647 13.7547 13.7547 14.3312 14.3312 14.3509 14.3509 14.5561 14.5561 14.5746 14.5746 14.8476 14.8476 17.9989 17.9989 18.2195 18.2195 k = 0.5000 0.2295 0.2879 ( 3898 PWs) bands (ev): -77.3117 -77.3117 -42.9858 -42.9858 -41.2499 -41.2499 -41.2494 -41.2494 -0.0638 -0.0638 -0.0601 -0.0601 0.3751 0.3751 0.3975 0.3975 0.4139 0.4139 6.9495 6.9495 8.6700 8.6700 11.1079 11.1079 11.2554 11.2554 12.0336 12.0336 12.1260 12.1260 12.1428 12.1428 12.8683 12.8683 12.9339 12.9339 13.5082 13.5082 13.5758 13.5758 13.7492 13.7492 14.3381 14.3381 14.3594 14.3594 14.5474 14.5474 14.5681 14.5681 14.8474 14.8474 18.1573 18.1573 18.3768 18.3768 k = 0.5000 0.2369 0.2774 ( 3896 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2499 -41.2499 -41.2494 -41.2494 -0.0638 -0.0638 -0.0601 -0.0601 0.3751 0.3751 0.3974 0.3974 0.4141 0.4141 6.9373 6.9373 8.6483 8.6483 11.1306 11.1306 11.2441 11.2441 12.0514 12.0514 12.1226 12.1226 12.1377 12.1377 12.8634 12.8634 12.9271 12.9271 13.5182 13.5182 13.5861 13.5861 13.7445 13.7445 14.3436 14.3436 14.3669 14.3669 14.5393 14.5393 14.5620 14.5620 14.8475 14.8475 18.3182 18.3182 18.5332 18.5332 k = 0.5000 0.2443 0.2669 ( 3894 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2499 -41.2499 -41.2493 -41.2493 -0.0638 -0.0638 -0.0601 -0.0601 0.3750 0.3750 0.3973 0.3973 0.4142 0.4142 6.9266 6.9266 8.6294 8.6294 11.1504 11.1504 11.2343 11.2343 12.0674 12.0674 12.1194 12.1194 12.1336 12.1336 12.8584 12.8584 12.9213 12.9213 13.5270 13.5270 13.5956 13.5956 13.7407 13.7407 14.3480 14.3480 14.3734 14.3734 14.5322 14.5322 14.5568 14.5568 14.8476 14.8476 18.4816 18.4816 18.6876 18.6876 k = 0.5000 0.2517 0.2565 ( 3884 PWs) bands (ev): -77.3113 -77.3113 -42.9856 -42.9856 -41.2499 -41.2499 -41.2493 -41.2493 -0.0638 -0.0638 -0.0600 -0.0600 0.3750 0.3750 0.3972 0.3972 0.4144 0.4144 6.9176 6.9176 8.6134 8.6134 11.1675 11.1675 11.2260 11.2260 12.0811 12.0811 12.1168 12.1168 12.1308 12.1308 12.8537 12.8537 12.9163 12.9163 13.5345 13.5345 13.6039 13.6039 13.7377 13.7377 14.3518 14.3518 14.3794 14.3794 14.5264 14.5264 14.5528 14.5528 14.8478 14.8478 18.6471 18.6471 18.8384 18.8384 k = 0.5000 0.2591 0.2460 ( 3878 PWs) bands (ev): -77.3111 -77.3111 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3750 0.3750 0.3972 0.3972 0.4145 0.4145 6.9101 6.9101 8.6003 8.6003 11.1815 11.1815 11.2194 11.2194 12.0925 12.0925 12.1146 12.1146 12.1285 12.1285 12.8494 12.8494 12.9121 12.9121 13.5406 13.5406 13.6110 13.6110 13.7354 13.7354 14.3546 14.3546 14.3841 14.3841 14.5213 14.5213 14.5493 14.5493 14.8483 14.8483 18.8133 18.8133 18.9834 18.9834 k = 0.5000 0.2665 0.2355 ( 3876 PWs) bands (ev): -77.3110 -77.3110 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3750 0.3750 0.3972 0.3972 0.4146 0.4146 6.9043 6.9043 8.5900 8.5900 11.1921 11.1921 11.2142 11.2142 12.1012 12.1012 12.1127 12.1127 12.1271 12.1271 12.8459 12.8459 12.9088 12.9088 13.5454 13.5454 13.6166 13.6166 13.7337 13.7337 14.3563 14.3563 14.3874 14.3874 14.5174 14.5174 14.5468 14.5468 14.8485 14.8485 18.9783 18.9783 19.1183 19.1183 k = 0.5000 0.2739 0.2251 ( 3876 PWs) bands (ev): -77.3111 -77.3111 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3749 0.3749 0.3971 0.3971 0.4147 0.4147 6.9002 6.9002 8.5827 8.5827 11.1993 11.1993 11.2109 11.2109 12.1071 12.1071 12.1114 12.1114 12.1265 12.1265 12.8432 12.8432 12.9063 12.9063 13.5488 13.5488 13.6207 13.6207 13.7327 13.7327 14.3574 14.3574 14.3897 14.3897 14.5145 14.5145 14.5451 14.5451 14.8487 14.8487 19.1377 19.1377 19.2361 19.2361 k = 0.5000 0.2813 0.2146 ( 3876 PWs) bands (ev): -77.3110 -77.3110 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3749 0.3749 0.3971 0.3971 0.4147 0.4147 6.8977 6.8977 8.5783 8.5783 11.2027 11.2027 11.2098 11.2098 12.1099 12.1099 12.1109 12.1109 12.1265 12.1265 12.8416 12.8416 12.9049 12.9049 13.5508 13.5508 13.6232 13.6232 13.7321 13.7321 14.3580 14.3580 14.3910 14.3910 14.5127 14.5127 14.5441 14.5441 14.8488 14.8488 19.2762 19.2762 19.3257 19.3257 k = 0.5000 0.2887 0.2041 ( 3852 PWs) bands (ev): -77.3103 -77.3103 -42.9854 -42.9854 -41.2496 -41.2496 -41.2491 -41.2491 -0.0639 -0.0639 -0.0599 -0.0599 0.3749 0.3749 0.3971 0.3971 0.4148 0.4148 6.8968 6.8968 8.5770 8.5770 11.2036 11.2036 11.2103 11.2103 12.1107 12.1107 12.1121 12.1121 12.1273 12.1273 12.8411 12.8411 12.9044 12.9044 13.5515 13.5515 13.6241 13.6241 13.7319 13.7319 14.3594 14.3594 14.3929 14.3929 14.5125 14.5125 14.5444 14.5444 14.8499 14.8499 19.3358 19.3358 19.3727 19.3727 k = 0.5000 0.2887 0.2041 ( 3852 PWs) bands (ev): -77.3103 -77.3103 -42.9854 -42.9854 -41.2496 -41.2496 -41.2491 -41.2491 -0.0639 -0.0639 -0.0599 -0.0599 0.3749 0.3749 0.3971 0.3971 0.4148 0.4148 6.8968 6.8968 8.5770 8.5770 11.2036 11.2036 11.2103 11.2103 12.1107 12.1107 12.1121 12.1121 12.1273 12.1273 12.8411 12.8411 12.9044 12.9044 13.5515 13.5515 13.6241 13.6241 13.7319 13.7319 14.3594 14.3594 14.3929 14.3929 14.5125 14.5125 14.5444 14.5444 14.8499 14.8499 19.3358 19.3358 19.3727 19.3727 k = 0.4963 0.2866 0.2161 ( 3877 PWs) bands (ev): -77.3111 -77.3111 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3749 0.3749 0.3971 0.3971 0.4147 0.4147 6.8976 6.8976 8.5783 8.5783 11.2027 11.2027 11.2098 11.2098 12.1099 12.1099 12.1109 12.1109 12.1265 12.1265 12.8416 12.8416 12.9048 12.9048 13.5508 13.5508 13.6232 13.6232 13.7321 13.7321 14.3580 14.3580 14.3910 14.3910 14.5127 14.5127 14.5441 14.5441 14.8487 14.8487 19.2768 19.2768 19.3263 19.3263 k = 0.4926 0.2844 0.2281 ( 3877 PWs) bands (ev): -77.3111 -77.3111 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3749 0.3749 0.3971 0.3971 0.4147 0.4147 6.9001 6.9001 8.5826 8.5826 11.1994 11.1994 11.2108 11.2108 12.1072 12.1072 12.1112 12.1112 12.1266 12.1266 12.8432 12.8432 12.9063 12.9063 13.5488 13.5488 13.6208 13.6208 13.7327 13.7327 14.3574 14.3574 14.3896 14.3896 14.5144 14.5144 14.5451 14.5451 14.8485 14.8485 19.1378 19.1378 19.2404 19.2404 k = 0.4890 0.2823 0.2401 ( 3877 PWs) bands (ev): -77.3111 -77.3111 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3750 0.3750 0.3972 0.3972 0.4146 0.4146 6.9042 6.9042 8.5898 8.5898 11.1923 11.1923 11.2141 11.2141 12.1017 12.1017 12.1119 12.1119 12.1275 12.1275 12.8458 12.8458 12.9087 12.9087 13.5455 13.5455 13.6167 13.6167 13.7337 13.7337 14.3563 14.3563 14.3874 14.3874 14.5173 14.5173 14.5468 14.5468 14.8484 14.8484 18.9755 18.9755 19.1311 19.1311 k = 0.4853 0.2802 0.2522 ( 3881 PWs) bands (ev): -77.3112 -77.3112 -42.9856 -42.9856 -41.2498 -41.2498 -41.2492 -41.2492 -0.0639 -0.0639 -0.0600 -0.0600 0.3750 0.3750 0.3972 0.3972 0.4145 0.4145 6.9099 6.9099 8.5999 8.5999 11.1816 11.1816 11.2192 11.2192 12.0936 12.0936 12.1122 12.1122 12.1298 12.1298 12.8493 12.8493 12.9120 12.9120 13.5408 13.5408 13.6111 13.6111 13.7353 13.7353 14.3544 14.3544 14.3840 14.3840 14.5212 14.5212 14.5493 14.5493 14.8480 14.8480 18.8047 18.8047 19.0095 19.0095 k = 0.4816 0.2781 0.2642 ( 3889 PWs) bands (ev): -77.3114 -77.3114 -42.9857 -42.9857 -41.2499 -41.2499 -41.2493 -41.2493 -0.0638 -0.0638 -0.0600 -0.0600 0.3750 0.3750 0.3972 0.3972 0.4144 0.4144 6.9173 6.9173 8.6129 8.6129 11.1678 11.1678 11.2259 11.2259 12.0830 12.0830 12.1117 12.1117 12.1337 12.1337 12.8535 12.8535 12.9161 12.9161 13.5347 13.5347 13.6042 13.6042 13.7375 13.7375 14.3517 14.3517 14.3793 14.3793 14.5259 14.5259 14.5526 14.5526 14.8476 14.8476 18.6304 18.6304 18.8820 18.8820 k = 0.4779 0.2759 0.2762 ( 3895 PWs) bands (ev): -77.3116 -77.3116 -42.9857 -42.9857 -41.2499 -41.2499 -41.2493 -41.2493 -0.0638 -0.0638 -0.0601 -0.0601 0.3750 0.3750 0.3973 0.3973 0.4142 0.4142 6.9262 6.9262 8.6287 8.6287 11.1510 11.1510 11.2341 11.2341 12.0702 12.0702 12.1107 12.1107 12.1396 12.1396 12.8582 12.8582 12.9210 12.9210 13.5273 13.5273 13.5959 13.5959 13.7405 13.7405 14.3480 14.3480 14.3736 14.3736 14.5318 14.5318 14.5570 14.5570 14.8473 14.8473 18.4552 18.4552 18.7517 18.7517 k = 0.4743 0.2738 0.2882 ( 3893 PWs) bands (ev): -77.3115 -77.3115 -42.9857 -42.9857 -41.2499 -41.2499 -41.2493 -41.2493 -0.0638 -0.0638 -0.0601 -0.0601 0.3751 0.3751 0.3974 0.3974 0.4141 0.4141 6.9367 6.9367 8.6474 8.6474 11.1314 11.1314 11.2439 11.2439 12.0553 12.0553 12.1098 12.1098 12.1474 12.1474 12.8632 12.8632 12.9267 12.9267 13.5188 13.5188 13.5866 13.5866 13.7442 13.7442 14.3437 14.3437 14.3672 14.3672 14.5389 14.5389 14.5629 14.5629 14.8472 14.8472 18.2802 18.2802 18.6207 18.6207 k = 0.4706 0.2717 0.3002 ( 3899 PWs) bands (ev): -77.3117 -77.3117 -42.9858 -42.9858 -41.2499 -41.2499 -41.2494 -41.2494 -0.0638 -0.0638 -0.0601 -0.0601 0.3751 0.3751 0.3975 0.3975 0.4139 0.4139 6.9488 6.9488 8.6688 8.6688 11.1087 11.1087 11.2551 11.2551 12.0385 12.0385 12.1082 12.1082 12.1563 12.1563 12.8681 12.8681 12.9333 12.9333 13.5090 13.5090 13.5764 13.5764 13.7487 13.7487 14.3378 14.3378 14.3592 14.3592 14.5466 14.5466 14.5695 14.5695 14.8469 14.8469 18.1063 18.1063 18.4895 18.4895 k = 0.4669 0.2696 0.3122 ( 3902 PWs) bands (ev): -77.3118 -77.3118 -42.9858 -42.9858 -41.2499 -41.2499 -41.2494 -41.2494 -0.0637 -0.0637 -0.0602 -0.0602 0.3751 0.3751 0.3975 0.3975 0.4137 0.4137 6.9624 6.9624 8.6929 8.6929 11.0832 11.0832 11.2679 11.2679 12.0197 12.0197 12.1065 12.1065 12.1669 12.1669 12.8724 12.8724 12.9408 12.9408 13.4983 13.4983 13.5655 13.5655 13.7540 13.7540 14.3309 14.3309 14.3507 14.3507 14.5551 14.5551 14.5774 14.5774 14.8466 14.8466 17.9343 17.9343 18.3590 18.3590 k = 0.4632 0.2674 0.3242 ( 3901 PWs) bands (ev): -77.3118 -77.3118 -42.9858 -42.9858 -41.2499 -41.2499 -41.2494 -41.2494 -0.0637 -0.0637 -0.0602 -0.0602 0.3751 0.3751 0.3976 0.3976 0.4135 0.4135 6.9774 6.9774 8.7198 8.7198 11.0550 11.0550 11.2821 11.2821 11.9995 11.9995 12.1049 12.1049 12.1790 12.1790 12.8758 12.8758 12.9493 12.9493 13.4866 13.4866 13.5543 13.5543 13.7600 13.7600 14.3221 14.3221 14.3415 14.3415 14.5646 14.5646 14.5865 14.5865 14.8466 14.8466 17.7649 17.7649 18.2295 18.2295 k = 0.4596 0.2653 0.3362 ( 3905 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2500 -41.2500 -41.2494 -41.2494 -0.0637 -0.0637 -0.0603 -0.0603 0.3752 0.3752 0.3977 0.3977 0.4132 0.4132 6.9939 6.9939 8.7493 8.7493 11.0239 11.0239 11.2978 11.2978 11.9777 11.9777 12.1031 12.1031 12.1921 12.1921 12.8778 12.8778 12.9591 12.9591 13.4741 13.4741 13.5428 13.5428 13.7667 13.7667 14.3115 14.3115 14.3318 14.3318 14.5745 14.5745 14.5964 14.5964 14.8466 14.8466 17.5984 17.5984 18.1011 18.1011 k = 0.4559 0.2632 0.3482 ( 3899 PWs) bands (ev): -77.3117 -77.3117 -42.9858 -42.9858 -41.2499 -41.2499 -41.2494 -41.2494 -0.0636 -0.0636 -0.0603 -0.0603 0.3752 0.3752 0.3979 0.3979 0.4130 0.4130 7.0117 7.0117 8.7815 8.7815 10.9905 10.9905 11.3149 11.3149 11.9546 11.9546 12.1013 12.1013 12.2074 12.2074 12.8783 12.8783 12.9701 12.9701 13.4608 13.4608 13.5316 13.5316 13.7740 13.7740 14.2995 14.2995 14.3223 14.3223 14.5854 14.5854 14.6071 14.6071 14.8469 14.8469 17.4356 17.4356 17.9742 17.9742 k = 0.4522 0.2611 0.3602 ( 3915 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2500 -41.2500 -41.2495 -41.2495 -0.0636 -0.0636 -0.0604 -0.0604 0.3752 0.3752 0.3980 0.3980 0.4127 0.4127 7.0309 7.0309 8.8162 8.8162 10.9541 10.9541 11.3330 11.3330 11.9298 11.9298 12.0989 12.0989 12.2233 12.2233 12.8769 12.8769 12.9823 12.9823 13.4466 13.4466 13.5209 13.5209 13.7816 13.7816 14.2849 14.2849 14.3117 14.3117 14.5961 14.5961 14.6178 14.6178 14.8467 14.8467 17.2763 17.2763 17.8485 17.8485 k = 0.4485 0.2590 0.3722 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0636 -0.0636 -0.0604 -0.0604 0.3753 0.3753 0.3981 0.3981 0.4125 0.4125 7.0513 7.0513 8.8534 8.8534 10.9155 10.9155 11.3526 11.3526 11.9040 11.9040 12.0970 12.0970 12.2405 12.2405 12.8736 12.8736 12.9956 12.9956 13.4317 13.4317 13.5110 13.5110 13.7897 13.7897 14.2695 14.2695 14.3014 14.3014 14.6074 14.6074 14.6295 14.6295 14.8467 14.8467 17.1216 17.1216 17.7247 17.7247 k = 0.4449 0.2568 0.3842 ( 3921 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0605 -0.0605 0.3753 0.3753 0.3982 0.3982 0.4122 0.4122 7.0729 7.0729 8.8930 8.8930 10.8746 10.8746 11.3735 11.3735 11.8772 11.8772 12.0953 12.0953 12.2589 12.2589 12.8685 12.8685 13.0100 13.0100 13.4158 13.4158 13.5023 13.5023 13.7982 13.7982 14.2532 14.2532 14.2907 14.2907 14.6188 14.6188 14.6419 14.6419 14.8468 14.8468 16.9716 16.9716 17.6027 17.6027 k = 0.4412 0.2547 0.3962 ( 3923 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0605 -0.0605 0.3753 0.3753 0.3983 0.3983 0.4120 0.4120 7.0956 7.0956 8.9349 8.9349 10.8315 10.8315 11.3958 11.3958 11.8493 11.8493 12.0938 12.0938 12.2782 12.2782 12.8616 12.8616 13.0253 13.0253 13.3991 13.3991 13.4948 13.4948 13.8069 13.8069 14.2365 14.2365 14.2796 14.2796 14.6301 14.6301 14.6546 14.6546 14.8466 14.8466 16.8266 16.8266 17.4826 17.4826 k = 0.4375 0.2526 0.4082 ( 3921 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0606 -0.0606 0.3753 0.3753 0.3984 0.3984 0.4118 0.4118 7.1193 7.1193 8.9791 8.9791 10.7863 10.7863 11.4192 11.4192 11.8206 11.8206 12.0925 12.0925 12.2987 12.2987 12.8531 12.8531 13.0413 13.0413 13.3817 13.3817 13.4887 13.4887 13.8157 13.8157 14.2194 14.2194 14.2684 14.2684 14.6413 14.6413 14.6676 14.6676 14.8466 14.8466 16.6871 16.6871 17.3645 17.3645 k = 0.4338 0.2505 0.4203 ( 3925 PWs) bands (ev): -77.3125 -77.3125 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0607 -0.0607 0.3753 0.3753 0.3985 0.3985 0.4116 0.4116 7.1439 7.1439 9.0254 9.0254 10.7391 10.7391 11.4437 11.4437 11.7910 11.7910 12.0912 12.0912 12.3198 12.3198 12.8433 12.8433 13.0578 13.0578 13.3636 13.3636 13.4839 13.4839 13.8246 13.8246 14.2017 14.2017 14.2566 14.2566 14.6518 14.6518 14.6806 14.6806 14.8464 14.8464 16.5533 16.5533 17.2484 17.2484 k = 0.4301 0.2483 0.4323 ( 3920 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0634 -0.0634 -0.0607 -0.0607 0.3753 0.3753 0.3985 0.3985 0.4115 0.4115 7.1693 7.1693 9.0737 9.0737 10.6903 10.6903 11.4693 11.4693 11.7608 11.7608 12.0901 12.0901 12.3418 12.3418 12.8326 12.8326 13.0747 13.0747 13.3451 13.3451 13.4804 13.4804 13.8335 13.8335 14.1852 14.1852 14.2446 14.2446 14.6620 14.6620 14.6937 14.6937 14.8463 14.8463 16.4258 16.4258 17.1345 17.1345 k = 0.4265 0.2462 0.4443 ( 3922 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0634 -0.0634 -0.0608 -0.0608 0.3753 0.3753 0.3986 0.3986 0.4113 0.4113 7.1953 7.1953 9.1238 9.1238 10.6397 10.6397 11.4959 11.4959 11.7301 11.7301 12.0892 12.0892 12.3635 12.3635 12.8212 12.8212 13.0915 13.0915 13.3266 13.3266 13.4779 13.4779 13.8423 13.8423 14.1685 14.1685 14.2321 14.2321 14.6710 14.6710 14.7067 14.7067 14.8461 14.8461 16.3046 16.3046 17.0228 17.0228 k = 0.4228 0.2441 0.4563 ( 3918 PWs) bands (ev): -77.3123 -77.3123 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0634 -0.0634 -0.0608 -0.0608 0.3753 0.3753 0.3986 0.3986 0.4112 0.4112 7.2218 7.2218 9.1756 9.1756 10.5876 10.5876 11.5233 11.5233 11.6993 11.6993 12.0889 12.0889 12.3854 12.3854 12.8097 12.8097 13.1080 13.1080 13.3085 13.3085 13.4763 13.4763 13.8510 13.8510 14.1531 14.1531 14.2191 14.2191 14.6788 14.6788 14.7198 14.7198 14.8461 14.8461 16.1903 16.1903 16.9137 16.9137 k = 0.4191 0.2420 0.4683 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0634 -0.0634 -0.0608 -0.0608 0.3753 0.3753 0.3987 0.3987 0.4111 0.4111 7.2486 7.2486 9.2289 9.2289 10.5341 10.5341 11.5514 11.5514 11.6687 11.6687 12.0889 12.0889 12.4062 12.4062 12.7986 12.7986 13.1232 13.1232 13.2916 13.2916 13.4754 13.4754 13.8594 13.8594 14.1377 14.1377 14.2060 14.2060 14.6849 14.6849 14.7328 14.7328 14.8461 14.8461 16.0830 16.0830 16.8071 16.8071 k = 0.4154 0.2399 0.4803 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0609 -0.0609 0.3752 0.3752 0.3986 0.3986 0.4111 0.4111 7.2756 7.2756 9.2834 9.2834 10.4796 10.4796 11.5794 11.5794 11.6390 11.6390 12.0889 12.0889 12.4260 12.4260 12.7883 12.7883 13.1360 13.1360 13.2772 13.2772 13.4751 13.4751 13.8675 13.8675 14.1239 14.1239 14.1928 14.1928 14.6891 14.6891 14.7452 14.7452 14.8463 14.8463 15.9833 15.9833 16.7032 16.7032 k = 0.4118 0.2377 0.4923 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0609 -0.0609 0.3752 0.3752 0.3986 0.3986 0.4111 0.4111 7.3025 7.3025 9.3388 9.3388 10.4245 10.4245 11.5962 11.5962 11.6216 11.6216 12.0892 12.0892 12.4442 12.4442 12.7797 12.7797 13.1441 13.1441 13.2673 13.2673 13.4751 13.4751 13.8751 13.8751 14.1116 14.1116 14.1797 14.1797 14.6908 14.6908 14.7573 14.7573 14.8467 14.8467 15.8914 15.8914 16.6023 16.6023 k = 0.4081 0.2356 0.5043 ( 3919 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2496 -41.2496 -0.0635 -0.0635 -0.0609 -0.0609 0.3752 0.3752 0.3986 0.3986 0.4111 0.4111 7.3290 7.3290 9.3946 9.3946 10.3692 10.3692 11.5734 11.5734 11.6449 11.6449 12.0899 12.0899 12.4599 12.4599 12.7733 12.7733 13.1452 13.1452 13.2646 13.2646 13.4755 13.4755 13.8825 13.8825 14.1013 14.1013 14.1661 14.1661 14.6900 14.6900 14.7688 14.7688 14.8474 14.8474 15.8077 15.8077 16.5044 16.5044 k = 0.4044 0.2335 0.5163 ( 3921 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0636 -0.0636 -0.0609 -0.0609 0.3751 0.3751 0.3985 0.3985 0.4112 0.4112 7.3549 7.3549 9.4501 9.4501 10.3146 10.3146 11.5452 11.5452 11.6749 11.6749 12.0909 12.0909 12.4728 12.4728 12.7695 12.7695 13.1385 13.1385 13.2697 13.2697 13.4760 13.4760 13.8893 13.8893 14.0927 14.0927 14.1522 14.1522 14.6864 14.6864 14.7797 14.7797 14.8483 14.8483 15.7326 15.7326 16.4098 16.4098 k = 0.4007 0.2314 0.5283 ( 3921 PWs) bands (ev): -77.3123 -77.3123 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0637 -0.0637 -0.0609 -0.0609 0.3751 0.3751 0.3984 0.3984 0.4113 0.4113 7.3799 7.3799 9.5045 9.5045 10.2617 10.2617 11.5174 11.5174 11.7060 11.7060 12.0920 12.0920 12.4824 12.4824 12.7688 12.7688 13.1257 13.1257 13.2808 13.2808 13.4764 13.4764 13.8959 13.8959 14.0866 14.0866 14.1385 14.1385 14.6797 14.6797 14.7896 14.7896 14.8494 14.8494 15.6663 15.6663 16.3189 16.3189 k = 0.3971 0.2292 0.5403 ( 3913 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0637 -0.0637 -0.0609 -0.0609 0.3750 0.3750 0.3983 0.3983 0.4114 0.4114 7.4037 7.4037 9.5563 9.5563 10.2120 10.2120 11.4910 11.4910 11.7376 11.7376 12.0939 12.0939 12.4881 12.4881 12.7716 12.7716 13.1093 13.1093 13.2956 13.2956 13.4770 13.4770 13.9024 13.9024 14.0833 14.0833 14.1249 14.1249 14.6704 14.6704 14.7990 14.7990 14.8504 14.8504 15.6089 15.6089 16.2320 16.2320 k = 0.3934 0.2271 0.5523 ( 3915 PWs) bands (ev): -77.3122 -77.3122 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0638 -0.0638 -0.0609 -0.0609 0.3750 0.3750 0.3981 0.3981 0.4115 0.4115 7.4259 7.4259 9.6032 9.6032 10.1681 10.1681 11.4662 11.4662 11.7692 11.7692 12.0959 12.0959 12.4900 12.4900 12.7769 12.7769 13.0910 13.0910 13.3124 13.3124 13.4775 13.4775 13.9088 13.9088 14.0814 14.0814 14.1110 14.1110 14.6580 14.6580 14.8071 14.8071 14.8511 14.8511 15.5604 15.5604 16.1493 16.1493 k = 0.3897 0.2250 0.5643 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0639 -0.0639 -0.0609 -0.0609 0.3749 0.3749 0.3980 0.3980 0.4117 0.4117 7.4460 7.4460 9.6418 9.6418 10.1338 10.1338 11.4432 11.4432 11.8008 11.8008 12.0985 12.0985 12.4892 12.4892 12.7842 12.7842 13.0719 13.0719 13.3300 13.3300 13.4779 13.4779 13.9157 13.9157 14.0821 14.0821 14.0973 14.0973 14.6432 14.6432 14.8142 14.8142 14.8519 14.8519 15.5208 15.5208 16.0713 16.0713 k = 0.3860 0.2229 0.5764 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0640 -0.0640 -0.0609 -0.0609 0.3748 0.3748 0.3979 0.3979 0.4118 0.4118 7.4635 7.4635 9.6673 9.6673 10.1139 10.1139 11.4225 11.4225 11.8321 11.8321 12.1012 12.1012 12.4855 12.4855 12.7928 12.7928 13.0525 13.0525 13.3478 13.3478 13.4783 13.4783 13.9234 13.9234 14.0809 14.0809 14.0870 14.0870 14.6260 14.6260 14.8196 14.8196 14.8522 14.8522 15.4896 15.4896 15.9985 15.9985 k = 0.3824 0.2208 0.5884 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0641 -0.0641 -0.0609 -0.0609 0.3747 0.3747 0.3977 0.3977 0.4120 0.4120 7.4781 7.4781 9.6756 9.6756 10.1130 10.1130 11.4041 11.4041 11.8627 11.8627 12.1043 12.1043 12.4802 12.4802 12.8014 12.8014 13.0334 13.0334 13.3654 13.3654 13.4788 13.4788 13.9323 13.9323 14.0682 14.0682 14.0901 14.0901 14.6073 14.6073 14.8234 14.8234 14.8526 14.8526 15.4662 15.4662 15.9312 15.9312 k = 0.3787 0.2186 0.6004 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0643 -0.0643 -0.0609 -0.0609 0.3746 0.3746 0.3976 0.3976 0.4122 0.4122 7.4892 7.4892 9.6664 9.6664 10.1318 10.1318 11.3885 11.3885 11.8928 11.8928 12.1075 12.1075 12.4732 12.4732 12.8093 12.8093 13.0147 13.0147 13.3823 13.3823 13.4793 13.4793 13.9428 13.9428 14.0544 14.0544 14.0959 14.0959 14.5873 14.5873 14.8253 14.8253 14.8528 14.8528 15.4499 15.4499 15.8701 15.8701 k = 0.3750 0.2165 0.6124 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0644 -0.0644 -0.0608 -0.0608 0.3746 0.3746 0.3974 0.3974 0.4124 0.4124 7.4961 7.4961 9.6436 9.6436 10.1670 10.1670 11.3757 11.3757 11.9217 11.9217 12.1112 12.1112 12.4658 12.4658 12.8155 12.8155 12.9970 12.9970 13.3983 13.3983 13.4801 13.4801 13.9549 13.9549 14.0404 14.0404 14.1033 14.1033 14.5668 14.5668 14.8255 14.8255 14.8535 14.8535 15.4400 15.4400 15.8155 15.8155 k = 0.6250-0.0722 0.4082 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0644 -0.0644 -0.0608 -0.0608 0.3746 0.3746 0.3974 0.3974 0.4124 0.4124 7.4961 7.4961 9.6436 9.6436 10.1670 10.1670 11.3757 11.3757 11.9217 11.9217 12.1112 12.1112 12.4658 12.4658 12.8155 12.8155 12.9970 12.9970 13.3983 13.3983 13.4801 13.4801 13.9549 13.9549 14.0404 14.0404 14.1032 14.1032 14.5668 14.5668 14.8255 14.8255 14.8535 14.8535 15.4400 15.4400 15.8155 15.8155 k = 0.6188-0.0830 0.4082 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0646 -0.0646 -0.0608 -0.0608 0.3744 0.3744 0.3972 0.3972 0.4127 0.4127 7.5026 7.5026 9.5974 9.5974 10.2386 10.2386 11.3567 11.3567 11.9704 11.9704 12.1180 12.1180 12.4523 12.4523 12.8246 12.8246 12.9681 12.9681 13.4238 13.4238 13.4825 13.4825 13.9740 13.9740 14.0194 14.0194 14.1170 14.1170 14.5330 14.5330 14.8243 14.8243 14.8547 14.8547 15.4290 15.4290 15.7300 15.7300 k = 0.6125-0.0938 0.4082 ( 3909 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0648 -0.0648 -0.0608 -0.0608 0.3742 0.3742 0.3969 0.3969 0.4130 0.4130 7.5064 7.5064 9.5533 9.5533 10.3118 10.3118 11.3383 11.3383 12.0201 12.0201 12.1253 12.1253 12.4382 12.4382 12.8341 12.8341 12.9396 12.9396 13.4464 13.4464 13.4879 13.4879 13.9716 13.9716 14.0184 14.0184 14.1313 14.1313 14.5015 14.5015 14.8229 14.8229 14.8550 14.8550 15.4194 15.4194 15.6473 15.6473 k = 0.6062-0.1046 0.4082 ( 3907 PWs) bands (ev): -77.3119 -77.3119 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0651 -0.0651 -0.0607 -0.0607 0.3741 0.3741 0.3967 0.3967 0.4133 0.4133 7.5078 7.5078 9.5112 9.5112 10.3857 10.3857 11.3206 11.3206 12.0708 12.0708 12.1333 12.1333 12.4242 12.4242 12.8436 12.8436 12.9118 12.9118 13.4634 13.4634 13.4995 13.4995 13.9474 13.9474 14.0383 14.0383 14.1457 14.1457 14.4724 14.4724 14.8216 14.8216 14.8549 14.8549 15.4112 15.4112 15.5675 15.5675 k = 0.6000-0.1155 0.4082 ( 3905 PWs) bands (ev): -77.3119 -77.3119 -42.9858 -42.9858 -41.2499 -41.2499 -41.2496 -41.2496 -0.0653 -0.0653 -0.0607 -0.0607 0.3739 0.3739 0.3964 0.3964 0.4136 0.4136 7.5074 7.5074 9.4714 9.4714 10.4595 10.4595 11.3035 11.3035 12.1218 12.1218 12.1424 12.1424 12.4104 12.4104 12.8520 12.8520 12.8852 12.8852 13.4745 13.4745 13.5181 13.5181 13.9178 13.9178 14.0619 14.0619 14.1597 14.1597 14.4456 14.4456 14.8203 14.8203 14.8541 14.8541 15.4042 15.4042 15.4908 15.4908 k = 0.5938-0.1263 0.4082 ( 3913 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0655 -0.0655 -0.0607 -0.0607 0.3737 0.3737 0.3962 0.3962 0.4139 0.4139 7.5054 7.5054 9.4337 9.4337 10.5321 10.5321 11.2872 11.2872 12.1497 12.1497 12.1757 12.1757 12.3965 12.3965 12.8509 12.8509 12.8678 12.8678 13.4838 13.4838 13.5400 13.5400 13.8855 13.8855 14.0861 14.0861 14.1724 14.1724 14.4210 14.4210 14.8190 14.8190 14.8524 14.8524 15.3982 15.3982 15.4177 15.4177 k = 0.5875-0.1371 0.4082 ( 3927 PWs) bands (ev): -77.3125 -77.3125 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0657 -0.0657 -0.0606 -0.0606 0.3735 0.3735 0.3959 0.3959 0.4142 0.4142 7.5022 7.5022 9.3982 9.3982 10.6030 10.6030 11.2716 11.2716 12.1593 12.1593 12.2280 12.2280 12.3826 12.3826 12.8283 12.8283 12.8717 12.8717 13.4941 13.4941 13.5625 13.5625 13.8510 13.8510 14.1101 14.1101 14.1846 14.1846 14.3981 14.3981 14.8175 14.8175 14.8496 14.8496 15.3476 15.3476 15.3936 15.3936 k = 0.5813-0.1479 0.4082 ( 3927 PWs) bands (ev): -77.3125 -77.3125 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0660 -0.0660 -0.0606 -0.0606 0.3734 0.3734 0.3957 0.3957 0.4145 0.4145 7.4981 7.4981 9.3650 9.3650 10.6718 10.6718 11.2570 11.2570 12.1693 12.1693 12.2811 12.2811 12.3706 12.3706 12.8033 12.8033 12.8778 12.8778 13.5067 13.5067 13.5844 13.5844 13.8160 13.8160 14.1337 14.1337 14.1959 14.1959 14.3779 14.3779 14.8163 14.8163 14.8472 14.8472 15.2816 15.2816 15.3896 15.3896 k = 0.5750-0.1588 0.4082 ( 3923 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0662 -0.0662 -0.0606 -0.0606 0.3732 0.3732 0.3955 0.3955 0.4148 0.4148 7.4935 7.4935 9.3342 9.3342 10.7376 10.7376 11.2433 11.2433 12.1796 12.1796 12.3311 12.3311 12.3629 12.3629 12.7787 12.7787 12.8830 12.8830 13.5219 13.5219 13.6050 13.6050 13.7809 13.7809 14.1565 14.1565 14.2066 14.2066 14.3597 14.3597 14.8153 14.8153 14.8440 14.8440 15.2196 15.2196 15.3864 15.3864 k = 0.5687-0.1696 0.4082 ( 3923 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0664 -0.0664 -0.0606 -0.0606 0.3731 0.3731 0.3953 0.3953 0.4150 0.4150 7.4884 7.4884 9.3057 9.3057 10.7999 10.7999 11.2305 11.2305 12.1900 12.1900 12.3414 12.3414 12.3957 12.3957 12.7548 12.7548 12.8869 12.8869 13.5393 13.5393 13.6229 13.6229 13.7465 13.7465 14.1783 14.1783 14.2159 14.2159 14.3435 14.3435 14.8141 14.8141 14.8404 14.8404 15.1618 15.1618 15.3839 15.3839 k = 0.5625-0.1804 0.4082 ( 3927 PWs) bands (ev): -77.3125 -77.3125 -42.9860 -42.9860 -41.2501 -41.2501 -41.2497 -41.2497 -0.0666 -0.0666 -0.0606 -0.0606 0.3729 0.3729 0.3951 0.3951 0.4153 0.4153 7.4832 7.4832 9.2795 9.2795 10.8580 10.8580 11.2188 11.2188 12.2005 12.2005 12.3319 12.3319 12.4489 12.4489 12.7319 12.7319 12.8894 12.8894 13.5573 13.5573 13.6345 13.6345 13.7178 13.7178 14.1989 14.1989 14.2237 14.2237 14.3292 14.3292 14.8128 14.8128 14.8360 14.8360 15.1084 15.1084 15.3818 15.3818 k = 0.5563-0.1912 0.4082 ( 3921 PWs) bands (ev): -77.3124 -77.3124 -42.9860 -42.9860 -41.2500 -41.2500 -41.2497 -41.2497 -0.0667 -0.0667 -0.0606 -0.0606 0.3728 0.3728 0.3949 0.3949 0.4155 0.4155 7.4780 7.4780 9.2558 9.2558 10.9119 10.9119 11.2081 11.2081 12.2111 12.2111 12.3227 12.3227 12.5034 12.5034 12.7102 12.7102 12.8907 12.8907 13.5704 13.5704 13.6348 13.6348 13.7055 13.7055 14.2181 14.2181 14.2302 14.2302 14.3173 14.3173 14.8116 14.8116 14.8321 14.8321 15.0597 15.0597 15.3803 15.3803 k = 0.5500-0.2021 0.4082 ( 3929 PWs) bands (ev): -77.3126 -77.3126 -42.9861 -42.9861 -41.2501 -41.2501 -41.2497 -41.2497 -0.0669 -0.0669 -0.0606 -0.0606 0.3727 0.3727 0.3947 0.3947 0.4157 0.4157 7.4729 7.4729 9.2345 9.2345 10.9606 10.9606 11.1984 11.1984 12.2215 12.2215 12.3137 12.3137 12.5572 12.5572 12.6899 12.6899 12.8909 12.8909 13.5618 13.5618 13.6372 13.6372 13.7108 13.7108 14.2323 14.2323 14.2375 14.2375 14.3069 14.3069 14.8103 14.8103 14.8274 14.8274 15.0159 15.0159 15.3792 15.3792 k = 0.5437-0.2129 0.4082 ( 3925 PWs) bands (ev): -77.3125 -77.3125 -42.9860 -42.9860 -41.2501 -41.2501 -41.2497 -41.2497 -0.0670 -0.0670 -0.0605 -0.0605 0.3726 0.3726 0.3946 0.3946 0.4159 0.4159 7.4682 7.4682 9.2156 9.2156 11.0044 11.0044 11.1899 11.1899 12.2317 12.2317 12.3058 12.3058 12.6092 12.6092 12.6724 12.6724 12.8904 12.8904 13.5308 13.5308 13.6546 13.6546 13.7233 13.7233 14.2358 14.2358 14.2529 14.2529 14.2991 14.2991 14.8088 14.8088 14.8228 14.8228 14.9773 14.9773 15.3783 15.3783 k = 0.5375-0.2237 0.4082 ( 3925 PWs) bands (ev): -77.3125 -77.3125 -42.9860 -42.9860 -41.2501 -41.2501 -41.2497 -41.2497 -0.0672 -0.0672 -0.0605 -0.0605 0.3725 0.3725 0.3944 0.3944 0.4161 0.4161 7.4639 7.4639 9.1993 9.1993 11.0425 11.0425 11.1825 11.1825 12.2412 12.2412 12.2990 12.2990 12.6423 12.6423 12.6742 12.6742 12.8894 12.8894 13.4914 13.4914 13.6768 13.6768 13.7373 13.7373 14.2363 14.2363 14.2672 14.2672 14.2930 14.2930 14.8070 14.8070 14.8182 14.8182 14.9443 14.9443 15.3777 15.3777 k = 0.5312-0.2345 0.4082 ( 3929 PWs) bands (ev): -77.3126 -77.3126 -42.9861 -42.9861 -41.2501 -41.2501 -41.2497 -41.2497 -0.0673 -0.0673 -0.0605 -0.0605 0.3724 0.3724 0.3943 0.3943 0.4162 0.4162 7.4601 7.4601 9.1854 9.1854 11.0745 11.0745 11.1765 11.1765 12.2500 12.2500 12.2934 12.2934 12.6329 12.6329 12.7180 12.7180 12.8884 12.8884 13.4495 13.4495 13.6987 13.6987 13.7511 13.7511 14.2348 14.2348 14.2795 14.2795 14.2885 14.2885 14.8043 14.8043 14.8141 14.8141 14.9171 14.9171 15.3773 15.3773 k = 0.5250-0.2454 0.4082 ( 3929 PWs) bands (ev): -77.3126 -77.3126 -42.9861 -42.9861 -41.2501 -41.2501 -41.2497 -41.2497 -0.0674 -0.0674 -0.0605 -0.0605 0.3723 0.3723 0.3942 0.3942 0.4164 0.4164 7.4568 7.4568 9.1740 9.1740 11.1009 11.1009 11.1717 11.1717 12.2571 12.2571 12.2895 12.2895 12.6202 12.6202 12.7633 12.7633 12.8881 12.8881 13.4086 13.4086 13.7181 13.7181 13.7643 13.7643 14.2329 14.2329 14.2843 14.2843 14.2909 14.2909 14.8000 14.8000 14.8114 14.8114 14.8959 14.8959 15.3770 15.3770 k = 0.5188-0.2562 0.4082 ( 3911 PWs) bands (ev): -77.3121 -77.3121 -42.9859 -42.9859 -41.2500 -41.2500 -41.2496 -41.2496 -0.0675 -0.0675 -0.0605 -0.0605 0.3723 0.3723 0.3942 0.3942 0.4165 0.4165 7.4543 7.4543 9.1652 9.1652 11.1211 11.1211 11.1685 11.1685 12.2625 12.2625 12.2880 12.2880 12.6095 12.6095 12.8030 12.8030 12.8895 12.8895 13.3725 13.3725 13.7334 13.7334 13.7764 13.7764 14.2324 14.2324 14.2823 14.2823 14.2989 14.2989 14.7951 14.7951 14.8102 14.8102 14.8806 14.8806 15.3768 15.3768 k = 0.5125-0.2670 0.4082 ( 3910 PWs) bands (ev): -77.3120 -77.3120 -42.9859 -42.9859 -41.2499 -41.2499 -41.2496 -41.2496 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3941 0.3941 0.4165 0.4165 7.4525 7.4525 9.1588 9.1588 11.1347 11.1347 11.1671 11.1671 12.2653 12.2653 12.2876 12.2876 12.6013 12.6013 12.8321 12.8321 12.8940 12.8940 13.3409 13.3409 13.7442 13.7442 13.7863 13.7863 14.2306 14.2306 14.2808 14.2808 14.3049 14.3049 14.7902 14.7902 14.8091 14.8091 14.8705 14.8705 15.3767 15.3767 k = 0.5062-0.2778 0.4082 ( 3900 PWs) bands (ev): -77.3117 -77.3117 -42.9858 -42.9858 -41.2499 -41.2499 -41.2495 -41.2495 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3941 0.3941 0.4166 0.4166 7.4513 7.4513 9.1550 9.1550 11.1421 11.1421 11.1672 11.1672 12.2668 12.2668 12.2884 12.2884 12.5963 12.5963 12.8476 12.8476 12.9011 12.9011 13.3200 13.3200 13.7504 13.7504 13.7929 13.7929 14.2298 14.2298 14.2802 14.2802 14.3085 14.3085 14.7869 14.7869 14.8089 14.8089 14.8650 14.8650 15.3767 15.3767 k = 0.5000-0.2887 0.4082 ( 3892 PWs) bands (ev): -77.3115 -77.3115 -42.9857 -42.9857 -41.2498 -41.2498 -41.2495 -41.2495 -0.0675 -0.0675 -0.0605 -0.0605 0.3722 0.3722 0.3941 0.3941 0.4166 0.4166 7.4510 7.4510 9.1537 9.1537 11.1444 11.1444 11.1676 11.1676 12.2673 12.2673 12.2890 12.2890 12.5946 12.5946 12.8519 12.8519 12.9049 12.9049 13.3129 13.3129 13.7525 13.7525 13.7953 13.7953 14.2296 14.2296 14.2802 14.2802 14.3097 14.3097 14.7858 14.7858 14.8090 14.8090 14.8633 14.8633 15.3767 15.3767 Writing output data file GaFe2Co.save init_run : 0.22s CPU 0.37s WALL ( 1 calls) electrons : 157.69s CPU 160.86s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.05s WALL ( 1 calls) potinit : 0.01s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 157.68s CPU 160.85s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.05s CPU 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.07s WALL ( 366 calls) cegterg : 140.10s CPU 141.84s WALL ( 409 calls) Called by sum_band: Called by *egterg: h_psi : 95.80s CPU 97.27s WALL ( 5769 calls) s_psi : 4.35s CPU 4.39s WALL ( 5769 calls) g_psi : 0.20s CPU 0.22s WALL ( 4994 calls) cdiaghg : 40.44s CPU 40.66s WALL ( 5360 calls) cegterg:over : 5.19s CPU 5.28s WALL ( 4994 calls) cegterg:upda : 3.82s CPU 3.88s WALL ( 4994 calls) cegterg:last : 2.77s CPU 2.89s WALL ( 1141 calls) cdiaghg:chol : 2.27s CPU 2.27s WALL ( 5360 calls) cdiaghg:inve : 1.50s CPU 1.53s WALL ( 5360 calls) cdiaghg:para : 2.40s CPU 2.48s WALL ( 10720 calls) Called by h_psi: h_psi:vloc : 84.62s CPU 86.07s WALL ( 5769 calls) h_psi:vnl : 10.99s CPU 11.01s WALL ( 5769 calls) add_vuspsi : 5.99s CPU 5.87s WALL ( 5769 calls) General routines calbec : 4.99s CPU 5.13s WALL ( 5769 calls) fft : 0.00s CPU 0.00s WALL ( 15 calls) fftw : 80.30s CPU 81.78s WALL ( 804280 calls) davcio : 0.20s CPU 0.22s WALL ( 732 calls) Parallel routines fft_scatter : 25.63s CPU 26.09s WALL ( 804295 calls) PWSCF : 2m55.32s CPU 3m20.11s WALL This run was terminated on: 17:19:20 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=