Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:11:39 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: ./MgTexPbO3x2.save/ file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized file Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized file Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2P 2P 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 84 51 14 3054 1447 216 Max 85 52 15 3057 1473 220 Sum 3037 1843 511 110011 52393 7799 bravais-lattice index = 14 lattice parameter (alat) = 10.6683 a.u. unit-cell volume = 858.5497 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 4 number of electrons = 80.00 number of Kohn-Sham states= 96 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 386.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.668257 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 O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Te read from file: /users/gautes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Pb read from file: /users/gautes/Pseudo/Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 75f9fe62f948a5acf869e43db2c29526 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 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. # 4 for Mg read from file: /users/gautes/Pseudo/Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 99618f2d1dea131ec68d28ce241ef835 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1129 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Te 6.00 127.60000 Te( 1.00) Pb 14.00 207.20000 Pb( 1.00) Mg 10.00 24.30500 Mg( 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= 267 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 2) = ( 0.0125000 -0.0072169 0.0102062), wk = 0.0037453 k( 3) = ( 0.0250000 -0.0144338 0.0204124), wk = 0.0037453 k( 4) = ( 0.0375000 -0.0216506 0.0306186), wk = 0.0037453 k( 5) = ( 0.0500000 -0.0288675 0.0408248), wk = 0.0037453 k( 6) = ( 0.0625000 -0.0360844 0.0510310), wk = 0.0037453 k( 7) = ( 0.0750000 -0.0433013 0.0612372), wk = 0.0037453 k( 8) = ( 0.0875000 -0.0505181 0.0714435), wk = 0.0037453 k( 9) = ( 0.1000000 -0.0577350 0.0816497), wk = 0.0037453 k( 10) = ( 0.1125000 -0.0649519 0.0918559), wk = 0.0037453 k( 11) = ( 0.1250000 -0.0721688 0.1020621), wk = 0.0037453 k( 12) = ( 0.1375000 -0.0793857 0.1122683), wk = 0.0037453 k( 13) = ( 0.1500000 -0.0866025 0.1224745), wk = 0.0037453 k( 14) = ( 0.1625000 -0.0938194 0.1326807), wk = 0.0037453 k( 15) = ( 0.1750000 -0.1010363 0.1428869), wk = 0.0037453 k( 16) = ( 0.1875000 -0.1082532 0.1530931), wk = 0.0037453 k( 17) = ( 0.2000000 -0.1154701 0.1632993), wk = 0.0037453 k( 18) = ( 0.2125000 -0.1226869 0.1735055), wk = 0.0037453 k( 19) = ( 0.2250000 -0.1299038 0.1837117), wk = 0.0037453 k( 20) = ( 0.2375000 -0.1371207 0.1939179), wk = 0.0037453 k( 21) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0037453 k( 22) = ( 0.2625000 -0.1515544 0.2143304), wk = 0.0037453 k( 23) = ( 0.2750000 -0.1587713 0.2245366), wk = 0.0037453 k( 24) = ( 0.2875000 -0.1659882 0.2347428), wk = 0.0037453 k( 25) = ( 0.3000000 -0.1732051 0.2449490), wk = 0.0037453 k( 26) = ( 0.3125000 -0.1804220 0.2551552), wk = 0.0037453 k( 27) = ( 0.3250000 -0.1876388 0.2653614), wk = 0.0037453 k( 28) = ( 0.3375000 -0.1948557 0.2755676), wk = 0.0037453 k( 29) = ( 0.3500000 -0.2020726 0.2857738), wk = 0.0037453 k( 30) = ( 0.3625000 -0.2092895 0.2959800), wk = 0.0037453 k( 31) = ( 0.3750000 -0.2165064 0.3061862), wk = 0.0037453 k( 32) = ( 0.3875000 -0.2237232 0.3163924), wk = 0.0037453 k( 33) = ( 0.4000000 -0.2309401 0.3265986), wk = 0.0037453 k( 34) = ( 0.4125000 -0.2381570 0.3368048), wk = 0.0037453 k( 35) = ( 0.4250000 -0.2453739 0.3470110), wk = 0.0037453 k( 36) = ( 0.4375000 -0.2525907 0.3572173), wk = 0.0037453 k( 37) = ( 0.4500000 -0.2598076 0.3674235), wk = 0.0037453 k( 38) = ( 0.4625000 -0.2670245 0.3776297), wk = 0.0037453 k( 39) = ( 0.4750000 -0.2742414 0.3878359), wk = 0.0037453 k( 40) = ( 0.4875000 -0.2814583 0.3980421), wk = 0.0037453 k( 41) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0037453 k( 42) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0037453 k( 43) = ( 0.5000000 -0.2742414 0.4184545), wk = 0.0037453 k( 44) = ( 0.5000000 -0.2598076 0.4286607), wk = 0.0037453 k( 45) = ( 0.5000000 -0.2453739 0.4388669), wk = 0.0037453 k( 46) = ( 0.5000000 -0.2309401 0.4490731), wk = 0.0037453 k( 47) = ( 0.5000000 -0.2165064 0.4592793), wk = 0.0037453 k( 48) = ( 0.5000000 -0.2020726 0.4694855), wk = 0.0037453 k( 49) = ( 0.5000000 -0.1876388 0.4796917), wk = 0.0037453 k( 50) = ( 0.5000000 -0.1732051 0.4898979), wk = 0.0037453 k( 51) = ( 0.5000000 -0.1587713 0.5001042), wk = 0.0037453 k( 52) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0037453 k( 53) = ( 0.5000000 -0.1299038 0.5205166), wk = 0.0037453 k( 54) = ( 0.5000000 -0.1154701 0.5307228), wk = 0.0037453 k( 55) = ( 0.5000000 -0.1010363 0.5409290), wk = 0.0037453 k( 56) = ( 0.5000000 -0.0866025 0.5511352), wk = 0.0037453 k( 57) = ( 0.5000000 -0.0721688 0.5613414), wk = 0.0037453 k( 58) = ( 0.5000000 -0.0577350 0.5715476), wk = 0.0037453 k( 59) = ( 0.5000000 -0.0433013 0.5817538), wk = 0.0037453 k( 60) = ( 0.5000000 -0.0288675 0.5919600), wk = 0.0037453 k( 61) = ( 0.5000000 -0.0144338 0.6021662), wk = 0.0037453 k( 62) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0037453 k( 63) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0037453 k( 64) = ( 0.4910714 0.0154647 0.6123724), wk = 0.0037453 k( 65) = ( 0.4821429 0.0309295 0.6123724), wk = 0.0037453 k( 66) = ( 0.4732143 0.0463942 0.6123724), wk = 0.0037453 k( 67) = ( 0.4642857 0.0618590 0.6123724), wk = 0.0037453 k( 68) = ( 0.4553571 0.0773237 0.6123724), wk = 0.0037453 k( 69) = ( 0.4464286 0.0927884 0.6123724), wk = 0.0037453 k( 70) = ( 0.4375000 0.1082532 0.6123724), wk = 0.0037453 k( 71) = ( 0.4285714 0.1237179 0.6123724), wk = 0.0037453 k( 72) = ( 0.4196429 0.1391826 0.6123724), wk = 0.0037453 k( 73) = ( 0.4107143 0.1546474 0.6123724), wk = 0.0037453 k( 74) = ( 0.4017857 0.1701121 0.6123724), wk = 0.0037453 k( 75) = ( 0.3928571 0.1855769 0.6123724), wk = 0.0037453 k( 76) = ( 0.3839286 0.2010416 0.6123724), wk = 0.0037453 k( 77) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0037453 k( 78) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0037453 k( 79) = ( 0.3660714 0.2113514 0.5977921), wk = 0.0037453 k( 80) = ( 0.3571429 0.2061965 0.5832118), wk = 0.0037453 k( 81) = ( 0.3482143 0.2010416 0.5686315), wk = 0.0037453 k( 82) = ( 0.3392857 0.1958867 0.5540513), wk = 0.0037453 k( 83) = ( 0.3303571 0.1907318 0.5394710), wk = 0.0037453 k( 84) = ( 0.3214286 0.1855769 0.5248907), wk = 0.0037453 k( 85) = ( 0.3125000 0.1804220 0.5103104), wk = 0.0037453 k( 86) = ( 0.3035714 0.1752670 0.4957301), wk = 0.0037453 k( 87) = ( 0.2946429 0.1701121 0.4811498), wk = 0.0037453 k( 88) = ( 0.2857143 0.1649572 0.4665695), wk = 0.0037453 k( 89) = ( 0.2767857 0.1598023 0.4519892), wk = 0.0037453 k( 90) = ( 0.2678571 0.1546474 0.4374089), wk = 0.0037453 k( 91) = ( 0.2589286 0.1494925 0.4228286), wk = 0.0037453 k( 92) = ( 0.2500000 0.1443376 0.4082483), wk = 0.0037453 k( 93) = ( 0.2410714 0.1391827 0.3936680), wk = 0.0037453 k( 94) = ( 0.2321429 0.1340277 0.3790877), wk = 0.0037453 k( 95) = ( 0.2232143 0.1288728 0.3645074), wk = 0.0037453 k( 96) = ( 0.2142857 0.1237179 0.3499271), wk = 0.0037453 k( 97) = ( 0.2053571 0.1185630 0.3353468), wk = 0.0037453 k( 98) = ( 0.1964286 0.1134081 0.3207665), wk = 0.0037453 k( 99) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0037453 k( 100) = ( 0.1785714 0.1030983 0.2916059), wk = 0.0037453 k( 101) = ( 0.1696429 0.0979434 0.2770256), wk = 0.0037453 k( 102) = ( 0.1607143 0.0927884 0.2624453), wk = 0.0037453 k( 103) = ( 0.1517857 0.0876335 0.2478650), wk = 0.0037453 k( 104) = ( 0.1428571 0.0824786 0.2332847), wk = 0.0037453 k( 105) = ( 0.1339286 0.0773237 0.2187044), wk = 0.0037453 k( 106) = ( 0.1250000 0.0721688 0.2041241), wk = 0.0037453 k( 107) = ( 0.1160714 0.0670139 0.1895439), wk = 0.0037453 k( 108) = ( 0.1071429 0.0618590 0.1749635), wk = 0.0037453 k( 109) = ( 0.0982143 0.0567040 0.1603833), wk = 0.0037453 k( 110) = ( 0.0892857 0.0515491 0.1458030), wk = 0.0037453 k( 111) = ( 0.0803571 0.0463942 0.1312227), wk = 0.0037453 k( 112) = ( 0.0714286 0.0412393 0.1166424), wk = 0.0037453 k( 113) = ( 0.0625000 0.0360844 0.1020621), wk = 0.0037453 k( 114) = ( 0.0535714 0.0309295 0.0874818), wk = 0.0037453 k( 115) = ( 0.0446429 0.0257746 0.0729015), wk = 0.0037453 k( 116) = ( 0.0357143 0.0206197 0.0583212), wk = 0.0037453 k( 117) = ( 0.0267857 0.0154647 0.0437409), wk = 0.0037453 k( 118) = ( 0.0178571 0.0103098 0.0291606), wk = 0.0037453 k( 119) = ( 0.0089286 0.0051549 0.0145803), wk = 0.0037453 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 121) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 122) = ( 0.0142857 0.0082479 0.0058321), wk = 0.0037453 k( 123) = ( 0.0285714 0.0164957 0.0116642), wk = 0.0037453 k( 124) = ( 0.0428571 0.0247436 0.0174964), wk = 0.0037453 k( 125) = ( 0.0571429 0.0329914 0.0233285), wk = 0.0037453 k( 126) = ( 0.0714286 0.0412393 0.0291606), wk = 0.0037453 k( 127) = ( 0.0857143 0.0494872 0.0349927), wk = 0.0037453 k( 128) = ( 0.1000000 0.0577350 0.0408248), wk = 0.0037453 k( 129) = ( 0.1142857 0.0659829 0.0466569), wk = 0.0037453 k( 130) = ( 0.1285714 0.0742307 0.0524891), wk = 0.0037453 k( 131) = ( 0.1428571 0.0824786 0.0583212), wk = 0.0037453 k( 132) = ( 0.1571429 0.0907265 0.0641533), wk = 0.0037453 k( 133) = ( 0.1714286 0.0989743 0.0699854), wk = 0.0037453 k( 134) = ( 0.1857143 0.1072222 0.0758175), wk = 0.0037453 k( 135) = ( 0.2000000 0.1154701 0.0816497), wk = 0.0037453 k( 136) = ( 0.2142857 0.1237179 0.0874818), wk = 0.0037453 k( 137) = ( 0.2285714 0.1319658 0.0933139), wk = 0.0037453 k( 138) = ( 0.2428571 0.1402136 0.0991460), wk = 0.0037453 k( 139) = ( 0.2571429 0.1484615 0.1049781), wk = 0.0037453 k( 140) = ( 0.2714286 0.1567094 0.1108102), wk = 0.0037453 k( 141) = ( 0.2857143 0.1649572 0.1166424), wk = 0.0037453 k( 142) = ( 0.3000000 0.1732051 0.1224745), wk = 0.0037453 k( 143) = ( 0.3142857 0.1814529 0.1283066), wk = 0.0037453 k( 144) = ( 0.3285714 0.1897008 0.1341387), wk = 0.0037453 k( 145) = ( 0.3428571 0.1979487 0.1399708), wk = 0.0037453 k( 146) = ( 0.3571429 0.2061965 0.1458030), wk = 0.0037453 k( 147) = ( 0.3714286 0.2144444 0.1516351), wk = 0.0037453 k( 148) = ( 0.3857143 0.2226922 0.1574672), wk = 0.0037453 k( 149) = ( 0.4000000 0.2309401 0.1632993), wk = 0.0037453 k( 150) = ( 0.4142857 0.2391880 0.1691314), wk = 0.0037453 k( 151) = ( 0.4285714 0.2474358 0.1749636), wk = 0.0037453 k( 152) = ( 0.4428571 0.2556837 0.1807957), wk = 0.0037453 k( 153) = ( 0.4571429 0.2639316 0.1866278), wk = 0.0037453 k( 154) = ( 0.4714286 0.2721794 0.1924599), wk = 0.0037453 k( 155) = ( 0.4857143 0.2804273 0.1982920), wk = 0.0037453 k( 156) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0037453 k( 157) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0037453 k( 158) = ( 0.5050000 0.2742414 0.2122891), wk = 0.0037453 k( 159) = ( 0.5100000 0.2598076 0.2204541), wk = 0.0037453 k( 160) = ( 0.5150000 0.2453739 0.2286190), wk = 0.0037453 k( 161) = ( 0.5200000 0.2309401 0.2367840), wk = 0.0037453 k( 162) = ( 0.5250000 0.2165064 0.2449490), wk = 0.0037453 k( 163) = ( 0.5300000 0.2020726 0.2531139), wk = 0.0037453 k( 164) = ( 0.5350000 0.1876388 0.2612789), wk = 0.0037453 k( 165) = ( 0.5400000 0.1732051 0.2694439), wk = 0.0037453 k( 166) = ( 0.5450000 0.1587713 0.2776088), wk = 0.0037453 k( 167) = ( 0.5500000 0.1443376 0.2857738), wk = 0.0037453 k( 168) = ( 0.5550000 0.1299038 0.2939388), wk = 0.0037453 k( 169) = ( 0.5600000 0.1154701 0.3021037), wk = 0.0037453 k( 170) = ( 0.5650000 0.1010363 0.3102687), wk = 0.0037453 k( 171) = ( 0.5700000 0.0866025 0.3184337), wk = 0.0037453 k( 172) = ( 0.5750000 0.0721688 0.3265986), wk = 0.0037453 k( 173) = ( 0.5800000 0.0577350 0.3347636), wk = 0.0037453 k( 174) = ( 0.5850000 0.0433013 0.3429286), wk = 0.0037453 k( 175) = ( 0.5900000 0.0288675 0.3510935), wk = 0.0037453 k( 176) = ( 0.5950000 0.0144338 0.3592585), wk = 0.0037453 k( 177) = ( 0.6000000 0.0000000 0.3674235), wk = 0.0037453 k( 178) = ( 0.6050000 -0.0144338 0.3755884), wk = 0.0037453 k( 179) = ( 0.6100000 -0.0288675 0.3837534), wk = 0.0037453 k( 180) = ( 0.6150000 -0.0433013 0.3919184), wk = 0.0037453 k( 181) = ( 0.6200000 -0.0577350 0.4000833), wk = 0.0037453 k( 182) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0037453 k( 183) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0037453 k( 184) = ( 0.6160714 -0.0670139 0.4228286), wk = 0.0037453 k( 185) = ( 0.6071429 -0.0618590 0.4374089), wk = 0.0037453 k( 186) = ( 0.5982143 -0.0567040 0.4519892), wk = 0.0037453 k( 187) = ( 0.5892857 -0.0515491 0.4665695), wk = 0.0037453 k( 188) = ( 0.5803571 -0.0463942 0.4811498), wk = 0.0037453 k( 189) = ( 0.5714286 -0.0412393 0.4957301), wk = 0.0037453 k( 190) = ( 0.5625000 -0.0360844 0.5103104), wk = 0.0037453 k( 191) = ( 0.5535714 -0.0309295 0.5248907), wk = 0.0037453 k( 192) = ( 0.5446429 -0.0257746 0.5394710), wk = 0.0037453 k( 193) = ( 0.5357143 -0.0206197 0.5540512), wk = 0.0037453 k( 194) = ( 0.5267857 -0.0154647 0.5686316), wk = 0.0037453 k( 195) = ( 0.5178571 -0.0103098 0.5832118), wk = 0.0037453 k( 196) = ( 0.5089286 -0.0051549 0.5977921), wk = 0.0037453 k( 197) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0037453 k( 198) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0037453 k( 199) = ( 0.5000000 0.0103098 0.5977921), wk = 0.0037453 k( 200) = ( 0.5000000 0.0206196 0.5832118), wk = 0.0037453 k( 201) = ( 0.5000000 0.0309295 0.5686316), wk = 0.0037453 k( 202) = ( 0.5000000 0.0412393 0.5540512), wk = 0.0037453 k( 203) = ( 0.5000000 0.0515491 0.5394710), wk = 0.0037453 k( 204) = ( 0.5000000 0.0618590 0.5248907), wk = 0.0037453 k( 205) = ( 0.5000000 0.0721688 0.5103104), wk = 0.0037453 k( 206) = ( 0.5000000 0.0824786 0.4957301), wk = 0.0037453 k( 207) = ( 0.5000000 0.0927884 0.4811498), wk = 0.0037453 k( 208) = ( 0.5000000 0.1030983 0.4665695), wk = 0.0037453 k( 209) = ( 0.5000000 0.1134081 0.4519892), wk = 0.0037453 k( 210) = ( 0.5000000 0.1237179 0.4374089), wk = 0.0037453 k( 211) = ( 0.5000000 0.1340277 0.4228286), wk = 0.0037453 k( 212) = ( 0.5000000 0.1443376 0.4082483), wk = 0.0037453 k( 213) = ( 0.5000000 0.1546474 0.3936680), wk = 0.0037453 k( 214) = ( 0.5000000 0.1649572 0.3790877), wk = 0.0037453 k( 215) = ( 0.5000000 0.1752670 0.3645074), wk = 0.0037453 k( 216) = ( 0.5000000 0.1855769 0.3499271), wk = 0.0037453 k( 217) = ( 0.5000000 0.1958867 0.3353468), wk = 0.0037453 k( 218) = ( 0.5000000 0.2061965 0.3207665), wk = 0.0037453 k( 219) = ( 0.5000000 0.2165064 0.3061862), wk = 0.0037453 k( 220) = ( 0.5000000 0.2268162 0.2916059), wk = 0.0037453 k( 221) = ( 0.5000000 0.2371260 0.2770256), wk = 0.0037453 k( 222) = ( 0.5000000 0.2474358 0.2624453), wk = 0.0037453 k( 223) = ( 0.5000000 0.2577457 0.2478650), wk = 0.0037453 k( 224) = ( 0.5000000 0.2680555 0.2332847), wk = 0.0037453 k( 225) = ( 0.5000000 0.2783653 0.2187044), wk = 0.0037453 k( 226) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0037453 k( 227) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0037453 k( 228) = ( 0.4950000 0.2857884 0.2204541), wk = 0.0037453 k( 229) = ( 0.4900000 0.2829016 0.2367840), wk = 0.0037453 k( 230) = ( 0.4850000 0.2800149 0.2531139), wk = 0.0037453 k( 231) = ( 0.4800000 0.2771281 0.2694439), wk = 0.0037453 k( 232) = ( 0.4750000 0.2742414 0.2857738), wk = 0.0037453 k( 233) = ( 0.4700000 0.2713546 0.3021037), wk = 0.0037453 k( 234) = ( 0.4650000 0.2684679 0.3184337), wk = 0.0037453 k( 235) = ( 0.4600000 0.2655811 0.3347636), wk = 0.0037453 k( 236) = ( 0.4550000 0.2626944 0.3510935), wk = 0.0037453 k( 237) = ( 0.4500000 0.2598076 0.3674235), wk = 0.0037453 k( 238) = ( 0.4450000 0.2569209 0.3837534), wk = 0.0037453 k( 239) = ( 0.4400000 0.2540341 0.4000833), wk = 0.0037453 k( 240) = ( 0.4350000 0.2511474 0.4164133), wk = 0.0037453 k( 241) = ( 0.4300000 0.2482606 0.4327432), wk = 0.0037453 k( 242) = ( 0.4250000 0.2453739 0.4490731), wk = 0.0037453 k( 243) = ( 0.4200000 0.2424871 0.4654031), wk = 0.0037453 k( 244) = ( 0.4150000 0.2396004 0.4817330), wk = 0.0037453 k( 245) = ( 0.4100000 0.2367136 0.4980629), wk = 0.0037453 k( 246) = ( 0.4050000 0.2338269 0.5143928), wk = 0.0037453 k( 247) = ( 0.4000000 0.2309401 0.5307228), wk = 0.0037453 k( 248) = ( 0.3950000 0.2280534 0.5470527), wk = 0.0037453 k( 249) = ( 0.3900000 0.2251666 0.5633826), wk = 0.0037453 k( 250) = ( 0.3850000 0.2222799 0.5797126), wk = 0.0037453 k( 251) = ( 0.3800000 0.2193931 0.5960425), wk = 0.0037453 k( 252) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0037453 k( 253) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0037453 k( 254) = ( 0.6160714 -0.0876335 0.4082483), wk = 0.0037453 k( 255) = ( 0.6071429 -0.1030983 0.4082483), wk = 0.0037453 k( 256) = ( 0.5982143 -0.1185630 0.4082483), wk = 0.0037453 k( 257) = ( 0.5892857 -0.1340277 0.4082483), wk = 0.0037453 k( 258) = ( 0.5803571 -0.1494925 0.4082483), wk = 0.0037453 k( 259) = ( 0.5714286 -0.1649572 0.4082483), wk = 0.0037453 k( 260) = ( 0.5625000 -0.1804220 0.4082483), wk = 0.0037453 k( 261) = ( 0.5535714 -0.1958867 0.4082483), wk = 0.0037453 k( 262) = ( 0.5446429 -0.2113514 0.4082483), wk = 0.0037453 k( 263) = ( 0.5357143 -0.2268162 0.4082483), wk = 0.0037453 k( 264) = ( 0.5267857 -0.2422809 0.4082483), wk = 0.0037453 k( 265) = ( 0.5178571 -0.2577456 0.4082483), wk = 0.0037453 k( 266) = ( 0.5089286 -0.2732104 0.4082483), wk = 0.0037453 k( 267) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0037453 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 2) = ( 0.0125000 0.0000000 0.0125000), wk = 0.0037453 k( 3) = ( 0.0250000 0.0000000 0.0250000), wk = 0.0037453 k( 4) = ( 0.0375000 0.0000000 0.0375000), wk = 0.0037453 k( 5) = ( 0.0500000 0.0000000 0.0500000), wk = 0.0037453 k( 6) = ( 0.0625000 0.0000000 0.0625000), wk = 0.0037453 k( 7) = ( 0.0750000 0.0000000 0.0750000), wk = 0.0037453 k( 8) = ( 0.0875000 0.0000000 0.0875000), wk = 0.0037453 k( 9) = ( 0.1000000 0.0000000 0.1000000), wk = 0.0037453 k( 10) = ( 0.1125000 0.0000000 0.1125000), wk = 0.0037453 k( 11) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0037453 k( 12) = ( 0.1375000 0.0000000 0.1375000), wk = 0.0037453 k( 13) = ( 0.1500000 0.0000000 0.1500000), wk = 0.0037453 k( 14) = ( 0.1625000 0.0000000 0.1625000), wk = 0.0037453 k( 15) = ( 0.1750000 0.0000000 0.1750000), wk = 0.0037453 k( 16) = ( 0.1875000 0.0000000 0.1875000), wk = 0.0037453 k( 17) = ( 0.2000000 0.0000000 0.2000000), wk = 0.0037453 k( 18) = ( 0.2125000 0.0000000 0.2125000), wk = 0.0037453 k( 19) = ( 0.2250000 0.0000000 0.2250000), wk = 0.0037453 k( 20) = ( 0.2375000 0.0000000 0.2375000), wk = 0.0037453 k( 21) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0037453 k( 22) = ( 0.2625000 0.0000000 0.2625000), wk = 0.0037453 k( 23) = ( 0.2750000 0.0000000 0.2750000), wk = 0.0037453 k( 24) = ( 0.2875000 0.0000000 0.2875000), wk = 0.0037453 k( 25) = ( 0.3000000 0.0000000 0.3000000), wk = 0.0037453 k( 26) = ( 0.3125000 0.0000000 0.3125000), wk = 0.0037453 k( 27) = ( 0.3250000 0.0000000 0.3250000), wk = 0.0037453 k( 28) = ( 0.3375000 0.0000000 0.3375000), wk = 0.0037453 k( 29) = ( 0.3500000 0.0000000 0.3500000), wk = 0.0037453 k( 30) = ( 0.3625000 0.0000000 0.3625000), wk = 0.0037453 k( 31) = ( 0.3750000 0.0000000 0.3750000), wk = 0.0037453 k( 32) = ( 0.3875000 0.0000000 0.3875000), wk = 0.0037453 k( 33) = ( 0.4000000 0.0000000 0.4000000), wk = 0.0037453 k( 34) = ( 0.4125000 0.0000000 0.4125000), wk = 0.0037453 k( 35) = ( 0.4250000 0.0000000 0.4250000), wk = 0.0037453 k( 36) = ( 0.4375000 0.0000000 0.4375000), wk = 0.0037453 k( 37) = ( 0.4500000 0.0000000 0.4500000), wk = 0.0037453 k( 38) = ( 0.4625000 0.0000000 0.4625000), wk = 0.0037453 k( 39) = ( 0.4750000 0.0000000 0.4750000), wk = 0.0037453 k( 40) = ( 0.4875000 0.0000000 0.4875000), wk = 0.0037453 k( 41) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0037453 k( 42) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0037453 k( 43) = ( 0.5000000 0.0125000 0.5125000), wk = 0.0037453 k( 44) = ( 0.5000000 0.0250000 0.5250000), wk = 0.0037453 k( 45) = ( 0.5000000 0.0375000 0.5375000), wk = 0.0037453 k( 46) = ( 0.5000000 0.0500000 0.5500000), wk = 0.0037453 k( 47) = ( 0.5000000 0.0625000 0.5625000), wk = 0.0037453 k( 48) = ( 0.5000000 0.0750000 0.5750000), wk = 0.0037453 k( 49) = ( 0.5000000 0.0875000 0.5875000), wk = 0.0037453 k( 50) = ( 0.5000000 0.1000000 0.6000000), wk = 0.0037453 k( 51) = ( 0.5000000 0.1125000 0.6125000), wk = 0.0037453 k( 52) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0037453 k( 53) = ( 0.5000000 0.1375000 0.6375000), wk = 0.0037453 k( 54) = ( 0.5000000 0.1500000 0.6500000), wk = 0.0037453 k( 55) = ( 0.5000000 0.1625000 0.6625000), wk = 0.0037453 k( 56) = ( 0.5000000 0.1750000 0.6750000), wk = 0.0037453 k( 57) = ( 0.5000000 0.1875000 0.6875000), wk = 0.0037453 k( 58) = ( 0.5000000 0.2000000 0.7000000), wk = 0.0037453 k( 59) = ( 0.5000000 0.2125000 0.7125000), wk = 0.0037453 k( 60) = ( 0.5000000 0.2250000 0.7250000), wk = 0.0037453 k( 61) = ( 0.5000000 0.2375000 0.7375000), wk = 0.0037453 k( 62) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0037453 k( 63) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0037453 k( 64) = ( 0.4910714 0.2589286 0.7500000), wk = 0.0037453 k( 65) = ( 0.4821429 0.2678571 0.7500000), wk = 0.0037453 k( 66) = ( 0.4732143 0.2767857 0.7500000), wk = 0.0037453 k( 67) = ( 0.4642857 0.2857143 0.7500000), wk = 0.0037453 k( 68) = ( 0.4553571 0.2946429 0.7500000), wk = 0.0037453 k( 69) = ( 0.4464286 0.3035714 0.7500000), wk = 0.0037453 k( 70) = ( 0.4375000 0.3125000 0.7500000), wk = 0.0037453 k( 71) = ( 0.4285714 0.3214286 0.7500000), wk = 0.0037453 k( 72) = ( 0.4196429 0.3303571 0.7500000), wk = 0.0037453 k( 73) = ( 0.4107143 0.3392857 0.7500000), wk = 0.0037453 k( 74) = ( 0.4017857 0.3482143 0.7500000), wk = 0.0037453 k( 75) = ( 0.3928571 0.3571429 0.7500000), wk = 0.0037453 k( 76) = ( 0.3839286 0.3660714 0.7500000), wk = 0.0037453 k( 77) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0037453 k( 78) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0037453 k( 79) = ( 0.3660714 0.3660714 0.7321429), wk = 0.0037453 k( 80) = ( 0.3571429 0.3571429 0.7142857), wk = 0.0037453 k( 81) = ( 0.3482143 0.3482143 0.6964286), wk = 0.0037453 k( 82) = ( 0.3392857 0.3392857 0.6785714), wk = 0.0037453 k( 83) = ( 0.3303571 0.3303571 0.6607143), wk = 0.0037453 k( 84) = ( 0.3214286 0.3214286 0.6428571), wk = 0.0037453 k( 85) = ( 0.3125000 0.3125000 0.6250000), wk = 0.0037453 k( 86) = ( 0.3035714 0.3035714 0.6071429), wk = 0.0037453 k( 87) = ( 0.2946429 0.2946429 0.5892857), wk = 0.0037453 k( 88) = ( 0.2857143 0.2857143 0.5714286), wk = 0.0037453 k( 89) = ( 0.2767857 0.2767857 0.5535714), wk = 0.0037453 k( 90) = ( 0.2678571 0.2678571 0.5357143), wk = 0.0037453 k( 91) = ( 0.2589286 0.2589286 0.5178571), wk = 0.0037453 k( 92) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0037453 k( 93) = ( 0.2410714 0.2410714 0.4821429), wk = 0.0037453 k( 94) = ( 0.2321429 0.2321429 0.4642857), wk = 0.0037453 k( 95) = ( 0.2232143 0.2232143 0.4464286), wk = 0.0037453 k( 96) = ( 0.2142857 0.2142857 0.4285714), wk = 0.0037453 k( 97) = ( 0.2053571 0.2053571 0.4107143), wk = 0.0037453 k( 98) = ( 0.1964286 0.1964286 0.3928571), wk = 0.0037453 k( 99) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0037453 k( 100) = ( 0.1785714 0.1785714 0.3571429), wk = 0.0037453 k( 101) = ( 0.1696429 0.1696429 0.3392857), wk = 0.0037453 k( 102) = ( 0.1607143 0.1607143 0.3214286), wk = 0.0037453 k( 103) = ( 0.1517857 0.1517857 0.3035714), wk = 0.0037453 k( 104) = ( 0.1428571 0.1428571 0.2857143), wk = 0.0037453 k( 105) = ( 0.1339286 0.1339286 0.2678571), wk = 0.0037453 k( 106) = ( 0.1250000 0.1250000 0.2500000), wk = 0.0037453 k( 107) = ( 0.1160714 0.1160714 0.2321429), wk = 0.0037453 k( 108) = ( 0.1071429 0.1071429 0.2142857), wk = 0.0037453 k( 109) = ( 0.0982143 0.0982143 0.1964286), wk = 0.0037453 k( 110) = ( 0.0892857 0.0892857 0.1785714), wk = 0.0037453 k( 111) = ( 0.0803571 0.0803571 0.1607143), wk = 0.0037453 k( 112) = ( 0.0714286 0.0714286 0.1428571), wk = 0.0037453 k( 113) = ( 0.0625000 0.0625000 0.1250000), wk = 0.0037453 k( 114) = ( 0.0535714 0.0535714 0.1071429), wk = 0.0037453 k( 115) = ( 0.0446429 0.0446429 0.0892857), wk = 0.0037453 k( 116) = ( 0.0357143 0.0357143 0.0714286), wk = 0.0037453 k( 117) = ( 0.0267857 0.0267857 0.0535714), wk = 0.0037453 k( 118) = ( 0.0178571 0.0178571 0.0357143), wk = 0.0037453 k( 119) = ( 0.0089286 0.0089286 0.0178571), wk = 0.0037453 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 121) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 122) = ( 0.0142857 0.0142857 0.0142857), wk = 0.0037453 k( 123) = ( 0.0285714 0.0285714 0.0285714), wk = 0.0037453 k( 124) = ( 0.0428571 0.0428571 0.0428571), wk = 0.0037453 k( 125) = ( 0.0571429 0.0571429 0.0571429), wk = 0.0037453 k( 126) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0037453 k( 127) = ( 0.0857143 0.0857143 0.0857143), wk = 0.0037453 k( 128) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0037453 k( 129) = ( 0.1142857 0.1142857 0.1142857), wk = 0.0037453 k( 130) = ( 0.1285714 0.1285714 0.1285714), wk = 0.0037453 k( 131) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0037453 k( 132) = ( 0.1571429 0.1571429 0.1571429), wk = 0.0037453 k( 133) = ( 0.1714286 0.1714286 0.1714286), wk = 0.0037453 k( 134) = ( 0.1857143 0.1857143 0.1857143), wk = 0.0037453 k( 135) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0037453 k( 136) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0037453 k( 137) = ( 0.2285714 0.2285714 0.2285714), wk = 0.0037453 k( 138) = ( 0.2428571 0.2428571 0.2428571), wk = 0.0037453 k( 139) = ( 0.2571429 0.2571429 0.2571429), wk = 0.0037453 k( 140) = ( 0.2714286 0.2714286 0.2714286), wk = 0.0037453 k( 141) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0037453 k( 142) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0037453 k( 143) = ( 0.3142857 0.3142857 0.3142857), wk = 0.0037453 k( 144) = ( 0.3285714 0.3285714 0.3285714), wk = 0.0037453 k( 145) = ( 0.3428571 0.3428571 0.3428571), wk = 0.0037453 k( 146) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0037453 k( 147) = ( 0.3714286 0.3714286 0.3714286), wk = 0.0037453 k( 148) = ( 0.3857143 0.3857143 0.3857143), wk = 0.0037453 k( 149) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0037453 k( 150) = ( 0.4142857 0.4142857 0.4142857), wk = 0.0037453 k( 151) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0037453 k( 152) = ( 0.4428571 0.4428571 0.4428571), wk = 0.0037453 k( 153) = ( 0.4571429 0.4571429 0.4571429), wk = 0.0037453 k( 154) = ( 0.4714286 0.4714286 0.4714286), wk = 0.0037453 k( 155) = ( 0.4857143 0.4857143 0.4857143), wk = 0.0037453 k( 156) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037453 k( 157) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037453 k( 158) = ( 0.5050000 0.4900000 0.5050000), wk = 0.0037453 k( 159) = ( 0.5100000 0.4800000 0.5100000), wk = 0.0037453 k( 160) = ( 0.5150000 0.4700000 0.5150000), wk = 0.0037453 k( 161) = ( 0.5200000 0.4600000 0.5200000), wk = 0.0037453 k( 162) = ( 0.5250000 0.4500000 0.5250000), wk = 0.0037453 k( 163) = ( 0.5300000 0.4400000 0.5300000), wk = 0.0037453 k( 164) = ( 0.5350000 0.4300000 0.5350000), wk = 0.0037453 k( 165) = ( 0.5400000 0.4200000 0.5400000), wk = 0.0037453 k( 166) = ( 0.5450000 0.4100000 0.5450000), wk = 0.0037453 k( 167) = ( 0.5500000 0.4000000 0.5500000), wk = 0.0037453 k( 168) = ( 0.5550000 0.3900000 0.5550000), wk = 0.0037453 k( 169) = ( 0.5600000 0.3800000 0.5600000), wk = 0.0037453 k( 170) = ( 0.5650000 0.3700000 0.5650000), wk = 0.0037453 k( 171) = ( 0.5700000 0.3600000 0.5700000), wk = 0.0037453 k( 172) = ( 0.5750000 0.3500000 0.5750000), wk = 0.0037453 k( 173) = ( 0.5800000 0.3400000 0.5800000), wk = 0.0037453 k( 174) = ( 0.5850000 0.3300000 0.5850000), wk = 0.0037453 k( 175) = ( 0.5900000 0.3200000 0.5900000), wk = 0.0037453 k( 176) = ( 0.5950000 0.3100000 0.5950000), wk = 0.0037453 k( 177) = ( 0.6000000 0.3000000 0.6000000), wk = 0.0037453 k( 178) = ( 0.6050000 0.2900000 0.6050000), wk = 0.0037453 k( 179) = ( 0.6100000 0.2800000 0.6100000), wk = 0.0037453 k( 180) = ( 0.6150000 0.2700000 0.6150000), wk = 0.0037453 k( 181) = ( 0.6200000 0.2600000 0.6200000), wk = 0.0037453 k( 182) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0037453 k( 183) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0037453 k( 184) = ( 0.6160714 0.2500000 0.6339286), wk = 0.0037453 k( 185) = ( 0.6071429 0.2500000 0.6428571), wk = 0.0037453 k( 186) = ( 0.5982143 0.2500000 0.6517857), wk = 0.0037453 k( 187) = ( 0.5892857 0.2500000 0.6607143), wk = 0.0037453 k( 188) = ( 0.5803571 0.2500000 0.6696429), wk = 0.0037453 k( 189) = ( 0.5714286 0.2500000 0.6785714), wk = 0.0037453 k( 190) = ( 0.5625000 0.2500000 0.6875000), wk = 0.0037453 k( 191) = ( 0.5535714 0.2500000 0.6964286), wk = 0.0037453 k( 192) = ( 0.5446429 0.2500000 0.7053571), wk = 0.0037453 k( 193) = ( 0.5357143 0.2500000 0.7142857), wk = 0.0037453 k( 194) = ( 0.5267857 0.2500000 0.7232143), wk = 0.0037453 k( 195) = ( 0.5178571 0.2500000 0.7321429), wk = 0.0037453 k( 196) = ( 0.5089286 0.2500000 0.7410714), wk = 0.0037453 k( 197) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0037453 k( 198) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0037453 k( 199) = ( 0.5000000 0.2589286 0.7410714), wk = 0.0037453 k( 200) = ( 0.5000000 0.2678571 0.7321429), wk = 0.0037453 k( 201) = ( 0.5000000 0.2767857 0.7232143), wk = 0.0037453 k( 202) = ( 0.5000000 0.2857143 0.7142857), wk = 0.0037453 k( 203) = ( 0.5000000 0.2946429 0.7053571), wk = 0.0037453 k( 204) = ( 0.5000000 0.3035714 0.6964286), wk = 0.0037453 k( 205) = ( 0.5000000 0.3125000 0.6875000), wk = 0.0037453 k( 206) = ( 0.5000000 0.3214286 0.6785714), wk = 0.0037453 k( 207) = ( 0.5000000 0.3303571 0.6696429), wk = 0.0037453 k( 208) = ( 0.5000000 0.3392857 0.6607143), wk = 0.0037453 k( 209) = ( 0.5000000 0.3482143 0.6517857), wk = 0.0037453 k( 210) = ( 0.5000000 0.3571429 0.6428571), wk = 0.0037453 k( 211) = ( 0.5000000 0.3660714 0.6339286), wk = 0.0037453 k( 212) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0037453 k( 213) = ( 0.5000000 0.3839286 0.6160714), wk = 0.0037453 k( 214) = ( 0.5000000 0.3928571 0.6071429), wk = 0.0037453 k( 215) = ( 0.5000000 0.4017857 0.5982143), wk = 0.0037453 k( 216) = ( 0.5000000 0.4107143 0.5892857), wk = 0.0037453 k( 217) = ( 0.5000000 0.4196429 0.5803571), wk = 0.0037453 k( 218) = ( 0.5000000 0.4285714 0.5714286), wk = 0.0037453 k( 219) = ( 0.5000000 0.4375000 0.5625000), wk = 0.0037453 k( 220) = ( 0.5000000 0.4464286 0.5535714), wk = 0.0037453 k( 221) = ( 0.5000000 0.4553571 0.5446429), wk = 0.0037453 k( 222) = ( 0.5000000 0.4642857 0.5357143), wk = 0.0037453 k( 223) = ( 0.5000000 0.4732143 0.5267857), wk = 0.0037453 k( 224) = ( 0.5000000 0.4821429 0.5178571), wk = 0.0037453 k( 225) = ( 0.5000000 0.4910714 0.5089286), wk = 0.0037453 k( 226) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037453 k( 227) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037453 k( 228) = ( 0.4950000 0.4950000 0.5100000), wk = 0.0037453 k( 229) = ( 0.4900000 0.4900000 0.5200000), wk = 0.0037453 k( 230) = ( 0.4850000 0.4850000 0.5300000), wk = 0.0037453 k( 231) = ( 0.4800000 0.4800000 0.5400000), wk = 0.0037453 k( 232) = ( 0.4750000 0.4750000 0.5500000), wk = 0.0037453 k( 233) = ( 0.4700000 0.4700000 0.5600000), wk = 0.0037453 k( 234) = ( 0.4650000 0.4650000 0.5700000), wk = 0.0037453 k( 235) = ( 0.4600000 0.4600000 0.5800000), wk = 0.0037453 k( 236) = ( 0.4550000 0.4550000 0.5900000), wk = 0.0037453 k( 237) = ( 0.4500000 0.4500000 0.6000000), wk = 0.0037453 k( 238) = ( 0.4450000 0.4450000 0.6100000), wk = 0.0037453 k( 239) = ( 0.4400000 0.4400000 0.6200000), wk = 0.0037453 k( 240) = ( 0.4350000 0.4350000 0.6300000), wk = 0.0037453 k( 241) = ( 0.4300000 0.4300000 0.6400000), wk = 0.0037453 k( 242) = ( 0.4250000 0.4250000 0.6500000), wk = 0.0037453 k( 243) = ( 0.4200000 0.4200000 0.6600000), wk = 0.0037453 k( 244) = ( 0.4150000 0.4150000 0.6700000), wk = 0.0037453 k( 245) = ( 0.4100000 0.4100000 0.6800000), wk = 0.0037453 k( 246) = ( 0.4050000 0.4050000 0.6900000), wk = 0.0037453 k( 247) = ( 0.4000000 0.4000000 0.7000000), wk = 0.0037453 k( 248) = ( 0.3950000 0.3950000 0.7100000), wk = 0.0037453 k( 249) = ( 0.3900000 0.3900000 0.7200000), wk = 0.0037453 k( 250) = ( 0.3850000 0.3850000 0.7300000), wk = 0.0037453 k( 251) = ( 0.3800000 0.3800000 0.7400000), wk = 0.0037453 k( 252) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0037453 k( 253) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0037453 k( 254) = ( 0.6160714 0.2321429 0.6160714), wk = 0.0037453 k( 255) = ( 0.6071429 0.2142857 0.6071429), wk = 0.0037453 k( 256) = ( 0.5982143 0.1964286 0.5982143), wk = 0.0037453 k( 257) = ( 0.5892857 0.1785714 0.5892857), wk = 0.0037453 k( 258) = ( 0.5803571 0.1607143 0.5803571), wk = 0.0037453 k( 259) = ( 0.5714286 0.1428571 0.5714286), wk = 0.0037453 k( 260) = ( 0.5625000 0.1250000 0.5625000), wk = 0.0037453 k( 261) = ( 0.5535714 0.1071429 0.5535714), wk = 0.0037453 k( 262) = ( 0.5446429 0.0892857 0.5446429), wk = 0.0037453 k( 263) = ( 0.5357143 0.0714286 0.5357143), wk = 0.0037453 k( 264) = ( 0.5267857 0.0535714 0.5267857), wk = 0.0037453 k( 265) = ( 0.5178571 0.0357143 0.5178571), wk = 0.0037453 k( 266) = ( 0.5089286 0.0178571 0.5089286), wk = 0.0037453 k( 267) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0037453 Dense grid: 110011 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 52393 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.56 Mb ( 380, 96) NL pseudopotentials 0.58 Mb ( 190, 200) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 3057) G-vector shells 0.01 Mb ( 680) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.23 Mb ( 380, 384) Each subspace H/S matrix 0.14 Mb ( 96, 96) Each matrix 0.59 Mb ( 200, 2, 96) Check: negative/imaginary core charge= -0.000005 0.000000 The potential is recalculated from file : ./MgTexPbO3x2.save/charge-density.dat Starting wfc are 102 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.4 secs Computing kpt #: 2 total cpu time spent up to now is 6.0 secs Computing kpt #: 3 total cpu time spent up to now is 7.5 secs Computing kpt #: 4 total cpu time spent up to now is 9.0 secs Computing kpt #: 5 total cpu time spent up to now is 10.5 secs Computing kpt #: 6 total cpu time spent up to now is 12.0 secs Computing kpt #: 7 total cpu time spent up to now is 13.6 secs Computing kpt #: 8 total cpu time spent up to now is 15.1 secs Computing kpt #: 9 total cpu time spent up to now is 16.6 secs Computing kpt #: 10 total cpu time spent up to now is 18.2 secs Computing kpt #: 11 total cpu time spent up to now is 19.7 secs Computing kpt #: 12 total cpu time spent up to now is 21.3 secs Computing kpt #: 13 total cpu time spent up to now is 22.8 secs Computing kpt #: 14 total cpu time spent up to now is 24.3 secs Computing kpt #: 15 total cpu time spent up to now is 25.8 secs Computing kpt #: 16 total cpu time spent up to now is 27.3 secs Computing kpt #: 17 total cpu time spent up to now is 28.8 secs Computing kpt #: 18 total cpu time spent up to now is 30.3 secs Computing kpt #: 19 total cpu time spent up to now is 31.7 secs Computing kpt #: 20 total cpu time spent up to now is 33.3 secs Computing kpt #: 21 total cpu time spent up to now is 34.7 secs Computing kpt #: 22 total cpu time spent up to now is 36.2 secs Computing kpt #: 23 total cpu time spent up to now is 37.6 secs Computing kpt #: 24 total cpu time spent up to now is 39.0 secs Computing kpt #: 25 total cpu time spent up to now is 40.4 secs Computing kpt #: 26 total cpu time spent up to now is 41.8 secs Computing kpt #: 27 total cpu time spent up to now is 43.2 secs Computing kpt #: 28 total cpu time spent up to now is 44.6 secs Computing kpt #: 29 total cpu time spent up to now is 46.2 secs Computing kpt #: 30 total cpu time spent up to now is 47.6 secs Computing kpt #: 31 total cpu time spent up to now is 49.7 secs Computing kpt #: 32 total cpu time spent up to now is 51.3 secs Computing kpt #: 33 total cpu time spent up to now is 53.2 secs Computing kpt #: 34 total cpu time spent up to now is 54.7 secs Computing kpt #: 35 total cpu time spent up to now is 56.2 secs Computing kpt #: 36 total cpu time spent up to now is 57.6 secs Computing kpt #: 37 total cpu time spent up to now is 59.2 secs Computing kpt #: 38 total cpu time spent up to now is 60.7 secs Computing kpt #: 39 total cpu time spent up to now is 62.2 secs Computing kpt #: 40 total cpu time spent up to now is 63.7 secs Computing kpt #: 41 total cpu time spent up to now is 65.3 secs Computing kpt #: 42 total cpu time spent up to now is 66.8 secs Computing kpt #: 43 total cpu time spent up to now is 68.3 secs Computing kpt #: 44 total cpu time spent up to now is 69.8 secs Computing kpt #: 45 total cpu time spent up to now is 71.4 secs Computing kpt #: 46 total cpu time spent up to now is 73.3 secs Computing kpt #: 47 total cpu time spent up to now is 75.2 secs Computing kpt #: 48 total cpu time spent up to now is 77.1 secs Computing kpt #: 49 total cpu time spent up to now is 79.0 secs Computing kpt #: 50 total cpu time spent up to now is 81.1 secs Computing kpt #: 51 total cpu time spent up to now is 83.4 secs Computing kpt #: 52 total cpu time spent up to now is 85.6 secs Computing kpt #: 53 total cpu time spent up to now is 87.7 secs Computing kpt #: 54 total cpu time spent up to now is 89.9 secs Computing kpt #: 55 total cpu time spent up to now is 92.0 secs Computing kpt #: 56 total cpu time spent up to now is 93.9 secs Computing kpt #: 57 total cpu time spent up to now is 96.0 secs Computing kpt #: 58 total cpu time spent up to now is 98.1 secs Computing kpt #: 59 total cpu time spent up to now is 99.8 secs Computing kpt #: 60 total cpu time spent up to now is 101.5 secs Computing kpt #: 61 total cpu time spent up to now is 102.9 secs Computing kpt #: 62 total cpu time spent up to now is 104.2 secs Computing kpt #: 63 total cpu time spent up to now is 105.7 secs Computing kpt #: 64 total cpu time spent up to now is 107.3 secs Computing kpt #: 65 total cpu time spent up to now is 108.9 secs Computing kpt #: 66 total cpu time spent up to now is 110.6 secs Computing kpt #: 67 total cpu time spent up to now is 112.8 secs Computing kpt #: 68 total cpu time spent up to now is 114.7 secs Computing kpt #: 69 total cpu time spent up to now is 116.9 secs Computing kpt #: 70 total cpu time spent up to now is 119.1 secs Computing kpt #: 71 total cpu time spent up to now is 121.3 secs Computing kpt #: 72 total cpu time spent up to now is 123.6 secs Computing kpt #: 73 total cpu time spent up to now is 125.8 secs Computing kpt #: 74 total cpu time spent up to now is 128.1 secs Computing kpt #: 75 total cpu time spent up to now is 129.9 secs Computing kpt #: 76 total cpu time spent up to now is 132.2 secs Computing kpt #: 77 total cpu time spent up to now is 134.0 secs Computing kpt #: 78 total cpu time spent up to now is 135.9 secs Computing kpt #: 79 total cpu time spent up to now is 137.7 secs Computing kpt #: 80 total cpu time spent up to now is 139.6 secs Computing kpt #: 81 total cpu time spent up to now is 141.4 secs Computing kpt #: 82 total cpu time spent up to now is 143.3 secs Computing kpt #: 83 total cpu time spent up to now is 145.1 secs Computing kpt #: 84 total cpu time spent up to now is 146.8 secs Computing kpt #: 85 total cpu time spent up to now is 148.6 secs Computing kpt #: 86 total cpu time spent up to now is 150.3 secs Computing kpt #: 87 total cpu time spent up to now is 152.2 secs Computing kpt #: 88 total cpu time spent up to now is 154.0 secs Computing kpt #: 89 total cpu time spent up to now is 155.9 secs Computing kpt #: 90 total cpu time spent up to now is 157.7 secs Computing kpt #: 91 total cpu time spent up to now is 159.6 secs Computing kpt #: 92 total cpu time spent up to now is 161.4 secs Computing kpt #: 93 total cpu time spent up to now is 163.3 secs Computing kpt #: 94 total cpu time spent up to now is 165.2 secs Computing kpt #: 95 total cpu time spent up to now is 166.6 secs Computing kpt #: 96 total cpu time spent up to now is 168.6 secs Computing kpt #: 97 total cpu time spent up to now is 170.0 secs Computing kpt #: 98 total cpu time spent up to now is 172.0 secs Computing kpt #: 99 total cpu time spent up to now is 173.4 secs Computing kpt #: 100 total cpu time spent up to now is 175.3 secs Computing kpt #: 101 total cpu time spent up to now is 176.8 secs Computing kpt #: 102 total cpu time spent up to now is 178.4 secs Computing kpt #: 103 total cpu time spent up to now is 179.9 secs Computing kpt #: 104 total cpu time spent up to now is 181.3 secs Computing kpt #: 105 total cpu time spent up to now is 182.7 secs Computing kpt #: 106 total cpu time spent up to now is 184.2 secs Computing kpt #: 107 total cpu time spent up to now is 185.7 secs Computing kpt #: 108 total cpu time spent up to now is 187.2 secs Computing kpt #: 109 total cpu time spent up to now is 188.7 secs Computing kpt #: 110 total cpu time spent up to now is 190.2 secs Computing kpt #: 111 total cpu time spent up to now is 191.8 secs Computing kpt #: 112 total cpu time spent up to now is 193.3 secs Computing kpt #: 113 total cpu time spent up to now is 194.8 secs Computing kpt #: 114 total cpu time spent up to now is 196.4 secs Computing kpt #: 115 total cpu time spent up to now is 197.9 secs Computing kpt #: 116 total cpu time spent up to now is 199.3 secs Computing kpt #: 117 total cpu time spent up to now is 200.8 secs Computing kpt #: 118 total cpu time spent up to now is 202.3 secs Computing kpt #: 119 total cpu time spent up to now is 203.8 secs Computing kpt #: 120 total cpu time spent up to now is 205.3 secs Computing kpt #: 121 total cpu time spent up to now is 206.8 secs Computing kpt #: 122 total cpu time spent up to now is 208.3 secs Computing kpt #: 123 total cpu time spent up to now is 209.8 secs Computing kpt #: 124 total cpu time spent up to now is 211.3 secs Computing kpt #: 125 total cpu time spent up to now is 212.8 secs Computing kpt #: 126 total cpu time spent up to now is 214.3 secs Computing kpt #: 127 total cpu time spent up to now is 215.8 secs Computing kpt #: 128 total cpu time spent up to now is 217.3 secs Computing kpt #: 129 total cpu time spent up to now is 218.8 secs Computing kpt #: 130 total cpu time spent up to now is 220.4 secs Computing kpt #: 131 total cpu time spent up to now is 221.9 secs Computing kpt #: 132 total cpu time spent up to now is 223.4 secs Computing kpt #: 133 total cpu time spent up to now is 224.9 secs Computing kpt #: 134 total cpu time spent up to now is 226.4 secs Computing kpt #: 135 total cpu time spent up to now is 227.9 secs Computing kpt #: 136 total cpu time spent up to now is 229.4 secs Computing kpt #: 137 total cpu time spent up to now is 230.8 secs Computing kpt #: 138 total cpu time spent up to now is 232.2 secs Computing kpt #: 139 total cpu time spent up to now is 233.7 secs Computing kpt #: 140 total cpu time spent up to now is 235.1 secs Computing kpt #: 141 total cpu time spent up to now is 236.6 secs Computing kpt #: 142 total cpu time spent up to now is 238.1 secs Computing kpt #: 143 total cpu time spent up to now is 239.6 secs Computing kpt #: 144 total cpu time spent up to now is 241.0 secs Computing kpt #: 145 total cpu time spent up to now is 242.5 secs Computing kpt #: 146 total cpu time spent up to now is 244.0 secs Computing kpt #: 147 total cpu time spent up to now is 245.4 secs Computing kpt #: 148 total cpu time spent up to now is 246.9 secs Computing kpt #: 149 total cpu time spent up to now is 248.3 secs Computing kpt #: 150 total cpu time spent up to now is 249.8 secs Computing kpt #: 151 total cpu time spent up to now is 251.2 secs Computing kpt #: 152 total cpu time spent up to now is 252.7 secs Computing kpt #: 153 total cpu time spent up to now is 254.1 secs Computing kpt #: 154 total cpu time spent up to now is 255.6 secs Computing kpt #: 155 total cpu time spent up to now is 256.9 secs Computing kpt #: 156 total cpu time spent up to now is 258.3 secs Computing kpt #: 157 total cpu time spent up to now is 259.7 secs Computing kpt #: 158 total cpu time spent up to now is 261.0 secs Computing kpt #: 159 total cpu time spent up to now is 262.4 secs Computing kpt #: 160 total cpu time spent up to now is 263.9 secs Computing kpt #: 161 total cpu time spent up to now is 265.3 secs Computing kpt #: 162 total cpu time spent up to now is 266.7 secs Computing kpt #: 163 total cpu time spent up to now is 268.1 secs Computing kpt #: 164 total cpu time spent up to now is 269.6 secs Computing kpt #: 165 total cpu time spent up to now is 271.0 secs Computing kpt #: 166 total cpu time spent up to now is 272.5 secs Computing kpt #: 167 total cpu time spent up to now is 273.9 secs Computing kpt #: 168 total cpu time spent up to now is 275.3 secs Computing kpt #: 169 total cpu time spent up to now is 276.8 secs Computing kpt #: 170 total cpu time spent up to now is 278.2 secs Computing kpt #: 171 total cpu time spent up to now is 279.9 secs Computing kpt #: 172 total cpu time spent up to now is 281.3 secs Computing kpt #: 173 total cpu time spent up to now is 282.7 secs Computing kpt #: 174 total cpu time spent up to now is 284.5 secs Computing kpt #: 175 total cpu time spent up to now is 286.6 secs Computing kpt #: 176 total cpu time spent up to now is 288.5 secs Computing kpt #: 177 total cpu time spent up to now is 290.3 secs Computing kpt #: 178 total cpu time spent up to now is 292.1 secs Computing kpt #: 179 total cpu time spent up to now is 294.0 secs Computing kpt #: 180 total cpu time spent up to now is 296.2 secs Computing kpt #: 181 total cpu time spent up to now is 298.5 secs Computing kpt #: 182 total cpu time spent up to now is 300.4 secs Computing kpt #: 183 total cpu time spent up to now is 302.6 secs Computing kpt #: 184 total cpu time spent up to now is 304.5 secs Computing kpt #: 185 total cpu time spent up to now is 306.8 secs Computing kpt #: 186 total cpu time spent up to now is 309.1 secs Computing kpt #: 187 total cpu time spent up to now is 311.3 secs Computing kpt #: 188 total cpu time spent up to now is 313.6 secs Computing kpt #: 189 total cpu time spent up to now is 315.9 secs Computing kpt #: 190 total cpu time spent up to now is 318.1 secs Computing kpt #: 191 total cpu time spent up to now is 320.3 secs Computing kpt #: 192 total cpu time spent up to now is 322.5 secs Computing kpt #: 193 total cpu time spent up to now is 324.7 secs Computing kpt #: 194 total cpu time spent up to now is 326.5 secs Computing kpt #: 195 total cpu time spent up to now is 327.9 secs Computing kpt #: 196 total cpu time spent up to now is 329.3 secs Computing kpt #: 197 total cpu time spent up to now is 330.8 secs Computing kpt #: 198 total cpu time spent up to now is 332.3 secs Computing kpt #: 199 total cpu time spent up to now is 333.7 secs Computing kpt #: 200 total cpu time spent up to now is 335.2 secs Computing kpt #: 201 total cpu time spent up to now is 337.1 secs Computing kpt #: 202 total cpu time spent up to now is 338.5 secs Computing kpt #: 203 total cpu time spent up to now is 340.3 secs Computing kpt #: 204 total cpu time spent up to now is 342.4 secs Computing kpt #: 205 total cpu time spent up to now is 344.2 secs Computing kpt #: 206 total cpu time spent up to now is 346.1 secs Computing kpt #: 207 total cpu time spent up to now is 348.1 secs Computing kpt #: 208 total cpu time spent up to now is 349.9 secs Computing kpt #: 209 total cpu time spent up to now is 351.8 secs Computing kpt #: 210 total cpu time spent up to now is 353.6 secs Computing kpt #: 211 total cpu time spent up to now is 355.0 secs Computing kpt #: 212 total cpu time spent up to now is 356.4 secs Computing kpt #: 213 total cpu time spent up to now is 357.7 secs Computing kpt #: 214 total cpu time spent up to now is 359.1 secs Computing kpt #: 215 total cpu time spent up to now is 360.6 secs Computing kpt #: 216 total cpu time spent up to now is 362.1 secs Computing kpt #: 217 total cpu time spent up to now is 363.5 secs Computing kpt #: 218 total cpu time spent up to now is 364.9 secs Computing kpt #: 219 total cpu time spent up to now is 366.4 secs Computing kpt #: 220 total cpu time spent up to now is 367.9 secs Computing kpt #: 221 total cpu time spent up to now is 369.3 secs Computing kpt #: 222 total cpu time spent up to now is 370.7 secs Computing kpt #: 223 total cpu time spent up to now is 372.1 secs Computing kpt #: 224 total cpu time spent up to now is 373.5 secs Computing kpt #: 225 total cpu time spent up to now is 374.9 secs Computing kpt #: 226 total cpu time spent up to now is 376.3 secs Computing kpt #: 227 total cpu time spent up to now is 377.6 secs Computing kpt #: 228 total cpu time spent up to now is 379.0 secs Computing kpt #: 229 total cpu time spent up to now is 380.5 secs Computing kpt #: 230 total cpu time spent up to now is 381.9 secs Computing kpt #: 231 total cpu time spent up to now is 383.3 secs Computing kpt #: 232 total cpu time spent up to now is 384.7 secs Computing kpt #: 233 total cpu time spent up to now is 386.2 secs Computing kpt #: 234 total cpu time spent up to now is 387.7 secs Computing kpt #: 235 total cpu time spent up to now is 389.1 secs Computing kpt #: 236 total cpu time spent up to now is 390.5 secs Computing kpt #: 237 total cpu time spent up to now is 392.0 secs Computing kpt #: 238 total cpu time spent up to now is 393.3 secs Computing kpt #: 239 total cpu time spent up to now is 394.8 secs Computing kpt #: 240 total cpu time spent up to now is 396.3 secs Computing kpt #: 241 total cpu time spent up to now is 397.7 secs Computing kpt #: 242 total cpu time spent up to now is 399.1 secs Computing kpt #: 243 total cpu time spent up to now is 400.9 secs Computing kpt #: 244 total cpu time spent up to now is 402.5 secs Computing kpt #: 245 total cpu time spent up to now is 404.4 secs Computing kpt #: 246 total cpu time spent up to now is 406.2 secs Computing kpt #: 247 total cpu time spent up to now is 408.0 secs Computing kpt #: 248 total cpu time spent up to now is 409.8 secs Computing kpt #: 249 total cpu time spent up to now is 412.0 secs Computing kpt #: 250 total cpu time spent up to now is 413.9 secs Computing kpt #: 251 total cpu time spent up to now is 415.7 secs Computing kpt #: 252 total cpu time spent up to now is 418.0 secs Computing kpt #: 253 total cpu time spent up to now is 420.2 secs Computing kpt #: 254 total cpu time spent up to now is 422.1 secs Computing kpt #: 255 total cpu time spent up to now is 424.4 secs Computing kpt #: 256 total cpu time spent up to now is 426.4 secs Computing kpt #: 257 total cpu time spent up to now is 428.7 secs Computing kpt #: 258 total cpu time spent up to now is 430.6 secs Computing kpt #: 259 total cpu time spent up to now is 432.8 secs Computing kpt #: 260 total cpu time spent up to now is 435.0 secs Computing kpt #: 261 total cpu time spent up to now is 437.2 secs Computing kpt #: 262 total cpu time spent up to now is 439.1 secs Computing kpt #: 263 total cpu time spent up to now is 440.7 secs Computing kpt #: 264 total cpu time spent up to now is 442.3 secs Computing kpt #: 265 total cpu time spent up to now is 443.8 secs Computing kpt #: 266 total cpu time spent up to now is 445.3 secs Computing kpt #: 267 total cpu time spent up to now is 446.8 secs ethr = 1.25E-08, avg # of iterations = 24.9 total cpu time spent up to now is 446.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6615 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4744 -10.4744 -8.1631 -8.1631 -8.1631 -8.1631 -8.0986 -8.0986 -7.4369 -7.4369 -7.4369 -7.4369 -7.0452 -7.0452 -7.0452 -7.0452 -6.7553 -6.7553 -6.7553 -6.7553 -4.7168 -4.7168 -4.6872 -4.6872 -4.6872 -4.6872 -4.6329 -4.6329 -4.6329 -4.6329 -4.5915 -4.5915 -0.7347 -0.7347 3.3010 3.3010 3.6446 3.6446 3.6446 3.6446 3.8895 3.8895 4.0616 4.0616 4.6641 4.6641 4.9841 4.9841 4.9841 4.9841 7.5883 7.5883 7.5883 7.5883 7.7243 7.7243 7.9716 7.9716 7.9716 7.9716 8.1270 8.1270 8.1270 8.1270 8.1430 8.1430 9.2697 9.2697 9.2884 9.2884 9.2884 9.2884 12.1238 12.1238 14.6423 14.6423 14.8826 14.8826 16.5232 16.5232 16.5232 16.5232 16.7364 16.7364 16.8951 16.8951 16.8951 16.8951 k = 0.0125-0.0072 0.0102 ( 6599 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4741 -10.4741 -8.1631 -8.1631 -8.1629 -8.1629 -8.0986 -8.0986 -7.4368 -7.4368 -7.4367 -7.4367 -7.0456 -7.0456 -7.0455 -7.0455 -6.7557 -6.7557 -6.7554 -6.7554 -4.7167 -4.7167 -4.6872 -4.6872 -4.6870 -4.6870 -4.6331 -4.6331 -4.6329 -4.6329 -4.5917 -4.5917 -0.7332 -0.7332 3.3006 3.3006 3.6398 3.6398 3.6453 3.6453 3.8947 3.8947 4.0485 4.0485 4.6712 4.6712 4.9856 4.9856 4.9939 4.9939 7.5842 7.5842 7.5883 7.5883 7.7256 7.7256 7.9711 7.9711 7.9724 7.9724 8.1266 8.1266 8.1267 8.1267 8.1427 8.1427 9.2688 9.2688 9.2870 9.2870 9.2880 9.2880 12.1269 12.1269 14.6399 14.6399 14.8797 14.8797 16.5131 16.5131 16.5199 16.5199 16.7437 16.7437 16.8957 16.8957 16.8981 16.8981 k = 0.0250-0.0144 0.0204 ( 6571 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4729 -10.4729 -8.1631 -8.1631 -8.1621 -8.1621 -8.0987 -8.0987 -7.4369 -7.4369 -7.4362 -7.4362 -7.0463 -7.0463 -7.0462 -7.0462 -6.7570 -6.7570 -6.7556 -6.7556 -4.7169 -4.7169 -4.6876 -4.6876 -4.6872 -4.6872 -4.6334 -4.6334 -4.6329 -4.6329 -4.5920 -4.5920 -0.7287 -0.7287 3.2996 3.2996 3.6267 3.6267 3.6474 3.6474 3.9091 3.9091 4.0120 4.0120 4.6897 4.6897 4.9902 4.9902 5.0233 5.0233 7.5723 7.5723 7.5882 7.5882 7.7288 7.7288 7.9698 7.9698 7.9748 7.9748 8.1254 8.1254 8.1257 8.1257 8.1415 8.1415 9.2658 9.2658 9.2829 9.2829 9.2871 9.2871 12.1361 12.1361 14.6327 14.6327 14.8709 14.8709 16.4861 16.4861 16.5102 16.5102 16.7621 16.7621 16.8974 16.8974 16.9070 16.9070 k = 0.0375-0.0217 0.0306 ( 6563 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4711 -10.4711 -8.1632 -8.1632 -8.1609 -8.1609 -8.0989 -8.0989 -7.4371 -7.4371 -7.4354 -7.4354 -7.0480 -7.0480 -7.0474 -7.0474 -6.7591 -6.7591 -6.7559 -6.7559 -4.7172 -4.7172 -4.6884 -4.6884 -4.6874 -4.6874 -4.6344 -4.6344 -4.6330 -4.6330 -4.5927 -4.5927 -0.7212 -0.7212 3.2974 3.2974 3.6083 3.6083 3.6508 3.6508 3.9298 3.9298 3.9583 3.9583 4.7138 4.7138 4.9978 4.9978 5.0718 5.0718 7.5539 7.5539 7.5881 7.5881 7.7328 7.7328 7.9675 7.9675 7.9787 7.9787 8.1236 8.1236 8.1241 8.1241 8.1397 8.1397 9.2600 9.2600 9.2759 9.2759 9.2862 9.2862 12.1513 12.1513 14.6207 14.6207 14.8562 14.8562 16.4483 16.4483 16.4951 16.4951 16.7855 16.7855 16.8992 16.8992 16.9204 16.9204 k = 0.0500-0.0289 0.0408 ( 6547 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4685 -10.4685 -8.1633 -8.1633 -8.1592 -8.1592 -8.0991 -8.0991 -7.4374 -7.4374 -7.4343 -7.4343 -7.0504 -7.0504 -7.0491 -7.0491 -6.7620 -6.7620 -6.7564 -6.7564 -4.7176 -4.7176 -4.6893 -4.6893 -4.6876 -4.6876 -4.6357 -4.6357 -4.6331 -4.6331 -4.5937 -4.5937 -0.7108 -0.7108 3.2939 3.2939 3.5876 3.5876 3.6556 3.6556 3.8935 3.8935 3.9541 3.9541 4.7394 4.7394 5.0085 5.0085 5.1375 5.1375 7.5305 7.5305 7.5879 7.5879 7.7363 7.7363 7.9639 7.9639 7.9840 7.9840 8.1212 8.1212 8.1219 8.1219 8.1374 8.1374 9.2513 9.2513 9.2662 9.2662 9.2857 9.2857 12.1724 12.1724 14.6041 14.6041 14.8357 14.8357 16.4041 16.4041 16.4754 16.4754 16.8093 16.8093 16.8999 16.8999 16.9371 16.9371 k = 0.0625-0.0361 0.0510 ( 6547 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4653 -10.4653 -8.1635 -8.1635 -8.1571 -8.1571 -8.0992 -8.0992 -7.4380 -7.4380 -7.4329 -7.4329 -7.0535 -7.0535 -7.0514 -7.0514 -6.7657 -6.7657 -6.7571 -6.7571 -4.7181 -4.7181 -4.6906 -4.6906 -4.6882 -4.6882 -4.6375 -4.6375 -4.6334 -4.6334 -4.5952 -4.5952 -0.6975 -0.6975 3.2883 3.2883 3.5671 3.5671 3.6616 3.6616 3.8222 3.8222 3.9801 3.9801 4.7649 4.7649 5.0221 5.0221 5.2173 5.2173 7.5029 7.5029 7.5877 7.5877 7.7388 7.7388 7.9589 7.9589 7.9905 7.9905 8.1185 8.1185 8.1192 8.1192 8.1347 8.1347 9.2396 9.2396 9.2537 9.2537 9.2855 9.2855 12.1992 12.1992 14.5832 14.5832 14.8092 14.8092 16.3559 16.3559 16.4521 16.4521 16.8297 16.8297 16.8993 16.8993 16.9555 16.9555 k = 0.0750-0.0433 0.0612 ( 6547 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4613 -10.4613 -8.1638 -8.1638 -8.1546 -8.1546 -8.0994 -8.0994 -7.4384 -7.4384 -7.4312 -7.4312 -7.0573 -7.0573 -7.0543 -7.0543 -6.7702 -6.7702 -6.7578 -6.7578 -4.7187 -4.7187 -4.6922 -4.6922 -4.6885 -4.6885 -4.6397 -4.6397 -4.6339 -4.6339 -4.5969 -4.5969 -0.6814 -0.6814 3.2800 3.2800 3.5487 3.5487 3.6690 3.6690 3.7471 3.7471 4.0065 4.0065 4.7906 4.7906 5.0388 5.0388 5.3080 5.3080 7.4718 7.4718 7.5874 7.5874 7.7396 7.7396 7.9522 7.9522 7.9981 7.9981 8.1157 8.1157 8.1161 8.1161 8.1321 8.1321 9.2248 9.2248 9.2385 9.2385 9.2856 9.2856 12.2315 12.2315 14.5581 14.5581 14.7769 14.7769 16.3049 16.3049 16.4260 16.4260 16.8382 16.8382 16.9020 16.9020 16.9741 16.9741 k = 0.0875-0.0505 0.0714 ( 6559 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4566 -10.4566 -8.1643 -8.1643 -8.1516 -8.1516 -8.0994 -8.0994 -7.4392 -7.4392 -7.4292 -7.4292 -7.0618 -7.0618 -7.0577 -7.0577 -6.7755 -6.7755 -6.7587 -6.7587 -4.7196 -4.7196 -4.6940 -4.6940 -4.6891 -4.6891 -4.6423 -4.6423 -4.6346 -4.6346 -4.5988 -4.5988 -0.6625 -0.6625 3.2686 3.2686 3.5339 3.5339 3.6704 3.6704 3.6777 3.6777 4.0323 4.0323 4.8170 4.8170 5.0583 5.0583 5.4068 5.4068 7.4377 7.4377 7.5871 7.5871 7.7384 7.7384 7.9434 7.9434 8.0067 8.0067 8.1125 8.1125 8.1132 8.1132 8.1298 8.1298 9.2073 9.2073 9.2205 9.2205 9.2860 9.2860 12.2689 12.2689 14.5291 14.5291 14.7387 14.7387 16.2520 16.2520 16.3976 16.3976 16.8240 16.8240 16.9161 16.9161 16.9915 16.9915 k = 0.1000-0.0577 0.0816 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4513 -10.4513 -8.1649 -8.1649 -8.1481 -8.1481 -8.0992 -8.0992 -7.4400 -7.4400 -7.4270 -7.4270 -7.0669 -7.0669 -7.0616 -7.0616 -6.7815 -6.7815 -6.7598 -6.7598 -4.7205 -4.7205 -4.6961 -4.6961 -4.6897 -4.6897 -4.6453 -4.6453 -4.6354 -4.6354 -4.6009 -4.6009 -0.6409 -0.6409 3.2536 3.2536 3.5233 3.5233 3.5932 3.5932 3.6875 3.6875 4.0569 4.0569 4.8447 4.8447 5.0807 5.0807 5.5120 5.5120 7.4009 7.4009 7.5866 7.5866 7.7352 7.7352 7.9323 7.9323 8.0163 8.0163 8.1082 8.1082 8.1113 8.1113 8.1284 8.1284 9.1871 9.1871 9.1999 9.1999 9.2865 9.2865 12.3112 12.3112 14.4965 14.4965 14.6947 14.6947 16.1978 16.1978 16.3671 16.3671 16.7887 16.7887 16.9388 16.9388 17.0065 17.0065 k = 0.1125-0.0650 0.0919 ( 6575 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4454 -10.4454 -8.1657 -8.1657 -8.1443 -8.1443 -8.0989 -8.0989 -7.4409 -7.4409 -7.4244 -7.4244 -7.0728 -7.0728 -7.0660 -7.0660 -6.7881 -6.7881 -6.7609 -6.7609 -4.7215 -4.7215 -4.6983 -4.6983 -4.6902 -4.6902 -4.6487 -4.6487 -4.6366 -4.6366 -4.6031 -4.6031 -0.6167 -0.6167 3.2352 3.2352 3.5164 3.5164 3.5173 3.5173 3.6986 3.6986 4.0798 4.0798 4.8743 4.8743 5.1060 5.1060 5.6220 5.6220 7.3614 7.3614 7.5862 7.5862 7.7295 7.7295 7.9188 7.9188 8.0270 8.0270 8.1033 8.1033 8.1106 8.1106 8.1281 8.1281 9.1642 9.1642 9.1767 9.1767 9.2873 9.2873 12.3579 12.3579 14.4607 14.4607 14.6449 14.6449 16.1428 16.1428 16.3348 16.3348 16.7373 16.7373 16.9655 16.9655 17.0179 17.0179 k = 0.1250-0.0722 0.1021 ( 6579 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4389 -10.4389 -8.1667 -8.1667 -8.1400 -8.1400 -8.0982 -8.0982 -7.4419 -7.4419 -7.4216 -7.4216 -7.0792 -7.0792 -7.0708 -7.0708 -6.7954 -6.7954 -6.7622 -6.7622 -4.7225 -4.7225 -4.7007 -4.7007 -4.6908 -4.6908 -4.6524 -4.6524 -4.6380 -4.6380 -4.6054 -4.6054 -0.5900 -0.5900 3.2138 3.2138 3.4405 3.4405 3.5157 3.5157 3.7109 3.7109 4.1008 4.1008 4.9059 4.9059 5.1341 5.1341 5.7357 5.7357 7.3196 7.3196 7.5857 7.5857 7.7214 7.7214 7.9027 7.9027 8.0388 8.0388 8.0976 8.0976 8.1114 8.1114 8.1291 8.1291 9.1388 9.1388 9.1509 9.1509 9.2881 9.2881 12.4086 12.4086 14.4218 14.4218 14.5895 14.5895 16.0872 16.0872 16.3009 16.3009 16.6736 16.6736 16.9949 16.9949 17.0247 17.0247 k = 0.1375-0.0794 0.1123 ( 6579 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4319 -10.4319 -8.1679 -8.1679 -8.1353 -8.1353 -8.0973 -8.0973 -7.4431 -7.4431 -7.4184 -7.4184 -7.0862 -7.0862 -7.0762 -7.0762 -6.8033 -6.8033 -6.7636 -6.7636 -4.7237 -4.7237 -4.7031 -4.7031 -4.6914 -4.6914 -4.6563 -4.6563 -4.6399 -4.6399 -4.6075 -4.6075 -0.5609 -0.5609 3.1902 3.1902 3.3661 3.3661 3.5179 3.5179 3.7243 3.7243 4.1197 4.1197 4.9398 4.9398 5.1649 5.1649 5.8525 5.8525 7.2753 7.2753 7.5852 7.5852 7.7106 7.7106 7.8842 7.8842 8.0514 8.0514 8.0913 8.0913 8.1147 8.1147 8.1315 8.1315 9.1109 9.1109 9.1227 9.1227 9.2890 9.2890 12.4629 12.4629 14.3804 14.3804 14.5286 14.5286 16.0315 16.0315 16.2653 16.2653 16.6008 16.6008 17.0264 17.0264 17.0266 17.0266 k = 0.1500-0.0866 0.1225 ( 6571 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4243 -10.4243 -8.1692 -8.1692 -8.1303 -8.1303 -8.0961 -8.0961 -7.4444 -7.4444 -7.4151 -7.4151 -7.0936 -7.0936 -7.0820 -7.0820 -6.8117 -6.8117 -6.7651 -6.7651 -4.7249 -4.7249 -4.7058 -4.7058 -4.6920 -4.6920 -4.6605 -4.6605 -4.6421 -4.6421 -4.6095 -4.6095 -0.5296 -0.5296 3.1650 3.1650 3.2933 3.2933 3.5233 3.5233 3.7387 3.7387 4.1364 4.1364 4.9760 4.9760 5.1983 5.1983 5.9718 5.9718 7.2287 7.2287 7.5847 7.5847 7.6971 7.6971 7.8634 7.8634 8.0644 8.0644 8.0844 8.0844 8.1214 8.1214 8.1350 8.1350 9.0807 9.0807 9.0921 9.0921 9.2900 9.2900 12.5203 12.5203 14.3366 14.3366 14.4624 14.4624 15.9758 15.9758 16.2281 16.2281 16.5219 16.5219 17.0224 17.0224 17.0605 17.0605 k = 0.1625-0.0938 0.1327 ( 6571 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4163 -10.4163 -8.1706 -8.1706 -8.1248 -8.1248 -8.0946 -8.0946 -7.4461 -7.4461 -7.4116 -7.4116 -7.1015 -7.1015 -7.0883 -7.0883 -6.8206 -6.8206 -6.7667 -6.7667 -4.7264 -4.7264 -4.7085 -4.7085 -4.6927 -4.6927 -4.6648 -4.6648 -4.6447 -4.6447 -4.6113 -4.6113 -0.4961 -0.4961 3.1389 3.1389 3.2224 3.2224 3.5313 3.5313 3.7541 3.7541 4.1508 4.1508 5.0146 5.0146 5.2344 5.2344 6.0931 6.0931 7.1798 7.1798 7.5841 7.5841 7.6809 7.6809 7.8403 7.8403 8.0765 8.0765 8.0771 8.0771 8.1331 8.1331 8.1395 8.1395 9.0482 9.0482 9.0591 9.0591 9.2911 9.2911 12.5801 12.5801 14.2909 14.2909 14.3914 14.3914 15.9203 15.9203 16.1893 16.1893 16.4393 16.4393 17.0129 17.0129 17.0965 17.0965 k = 0.1750-0.1010 0.1429 ( 6563 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4078 -10.4078 -8.1721 -8.1721 -8.1190 -8.1190 -8.0928 -8.0928 -7.4480 -7.4480 -7.4078 -7.4078 -7.1099 -7.1099 -7.0949 -7.0949 -6.8298 -6.8298 -6.7684 -6.7684 -4.7281 -4.7281 -4.7113 -4.7113 -4.6933 -4.6933 -4.6694 -4.6694 -4.6478 -4.6478 -4.6128 -4.6128 -0.4607 -0.4607 3.1121 3.1121 3.1535 3.1535 3.5415 3.5415 3.7704 3.7704 4.1631 4.1631 5.0556 5.0556 5.2729 5.2729 6.2159 6.2159 7.1285 7.1285 7.5835 7.5835 7.6621 7.6621 7.8151 7.8151 8.0694 8.0694 8.0872 8.0872 8.1450 8.1450 8.1506 8.1506 9.0134 9.0134 9.0238 9.0238 9.2923 9.2923 12.6419 12.6419 14.2434 14.2434 14.3159 14.3159 15.8654 15.8654 16.1489 16.1489 16.3550 16.3550 16.9983 16.9983 17.1345 17.1345 k = 0.1875-0.1083 0.1531 ( 6563 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3990 -10.3990 -8.1737 -8.1737 -8.1129 -8.1129 -8.0906 -8.0906 -7.4502 -7.4502 -7.4039 -7.4039 -7.1187 -7.1187 -7.1020 -7.1020 -6.8394 -6.8394 -6.7702 -6.7702 -4.7300 -4.7300 -4.7140 -4.7140 -4.6940 -4.6940 -4.6742 -4.6742 -4.6512 -4.6512 -4.6142 -4.6142 -0.4234 -0.4234 3.0851 3.0851 3.0869 3.0869 3.5534 3.5534 3.7876 3.7876 4.1733 4.1733 5.0990 5.0990 5.3138 5.3138 6.3399 6.3399 7.0750 7.0750 7.5828 7.5828 7.6408 7.6408 7.7879 7.7879 8.0614 8.0614 8.0965 8.0965 8.1513 8.1513 8.1743 8.1743 8.9766 8.9766 8.9864 8.9864 9.2935 9.2935 12.7049 12.7049 14.1945 14.1945 14.2365 14.2365 15.8111 15.8111 16.1069 16.1069 16.2704 16.2704 16.9790 16.9790 17.1746 17.1746 k = 0.2000-0.1155 0.1633 ( 6559 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3898 -10.3898 -8.1752 -8.1752 -8.1064 -8.1064 -8.0882 -8.0882 -7.4527 -7.4527 -7.3998 -7.3998 -7.1279 -7.1279 -7.1094 -7.1094 -6.8493 -6.8493 -6.7721 -6.7721 -4.7321 -4.7321 -4.7167 -4.7167 -4.6946 -4.6946 -4.6791 -4.6791 -4.6551 -4.6551 -4.6153 -4.6153 -0.3845 -0.3845 3.0226 3.0226 3.0581 3.0581 3.5668 3.5668 3.8056 3.8056 4.1817 4.1817 5.1447 5.1447 5.3571 5.3571 6.4648 6.4648 7.0192 7.0192 7.5822 7.5822 7.6171 7.6171 7.7591 7.7591 8.0531 8.0531 8.1050 8.1050 8.1583 8.1583 8.2034 8.2034 8.9377 8.9377 8.9469 8.9469 9.2948 9.2948 12.7683 12.7683 14.1444 14.1444 14.1538 14.1538 15.7577 15.7577 16.0633 16.0633 16.1867 16.1867 16.9558 16.9558 17.2165 17.2165 k = 0.2125-0.1227 0.1735 ( 6535 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3803 -10.3803 -8.1767 -8.1767 -8.0997 -8.0997 -8.0855 -8.0855 -7.4555 -7.4555 -7.3953 -7.3953 -7.1375 -7.1375 -7.1171 -7.1171 -6.8593 -6.8593 -6.7740 -6.7740 -4.7343 -4.7343 -4.7189 -4.7189 -4.6952 -4.6952 -4.6842 -4.6842 -4.6592 -4.6592 -4.6162 -4.6162 -0.3441 -0.3441 2.9606 2.9606 3.0312 3.0312 3.5814 3.5814 3.8243 3.8243 4.1886 4.1886 5.1926 5.1926 5.4026 5.4026 6.5902 6.5902 6.9613 6.9613 7.5815 7.5815 7.5913 7.5913 7.7286 7.7286 8.0447 8.0447 8.1134 8.1134 8.1658 8.1658 8.2375 8.2375 8.8970 8.8970 8.9056 8.9056 9.2961 9.2961 12.8311 12.8311 14.0690 14.0690 14.0934 14.0934 15.7052 15.7052 16.0183 16.0183 16.1048 16.1048 16.9294 16.9294 17.2603 17.2603 k = 0.2250-0.1299 0.1837 ( 6538 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3707 -10.3707 -8.1780 -8.1780 -8.0927 -8.0927 -8.0826 -8.0826 -7.4588 -7.4588 -7.3910 -7.3910 -7.1474 -7.1474 -7.1252 -7.1252 -6.8694 -6.8694 -6.7761 -6.7761 -4.7370 -4.7370 -4.7213 -4.7213 -4.6960 -4.6960 -4.6893 -4.6893 -4.6636 -4.6636 -4.6170 -4.6170 -0.3024 -0.3024 2.9011 2.9011 3.0044 3.0044 3.5969 3.5969 3.8435 3.8435 4.1944 4.1944 5.2426 5.2426 5.4502 5.4502 6.7157 6.7157 6.9013 6.9013 7.5636 7.5636 7.5809 7.5809 7.6967 7.6967 8.0361 8.0361 8.1219 8.1219 8.1738 8.1738 8.2760 8.2760 8.8545 8.8545 8.8624 8.8624 9.2975 9.2975 12.8921 12.8921 13.9832 13.9832 14.0418 14.0418 15.6538 15.6538 15.9719 15.9719 16.0250 16.0250 16.9005 16.9005 17.3057 17.3057 k = 0.2375-0.1371 0.1939 ( 6538 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3608 -10.3608 -8.1792 -8.1792 -8.0854 -8.0854 -8.0795 -8.0795 -7.4625 -7.4625 -7.3866 -7.3866 -7.1576 -7.1576 -7.1335 -7.1335 -6.8795 -6.8795 -6.7782 -6.7782 -4.7399 -4.7399 -4.7235 -4.7235 -4.6967 -4.6967 -4.6946 -4.6946 -4.6681 -4.6681 -4.6177 -4.6177 -0.2596 -0.2596 2.8440 2.8440 2.9778 2.9778 3.6132 3.6132 3.8633 3.8633 4.1992 4.1992 5.2947 5.2947 5.4998 5.4998 6.8394 6.8394 6.8410 6.8410 7.5342 7.5342 7.5801 7.5801 7.6636 7.6636 8.0274 8.0274 8.1306 8.1306 8.1822 8.1822 8.3187 8.3187 8.8105 8.8105 8.8176 8.8176 9.2989 9.2989 12.9494 12.9494 13.8983 13.8983 13.9897 13.9897 15.6037 15.6037 15.9242 15.9242 15.9479 15.9479 16.8697 16.8697 17.3525 17.3525 k = 0.2500-0.1443 0.2041 ( 6486 PWs) bands (ev): -63.7348 -63.7348 -30.6843 -30.6843 -30.3966 -30.3966 -30.3966 -30.3966 -10.3509 -10.3509 -8.1801 -8.1801 -8.0779 -8.0779 -8.0761 -8.0761 -7.4666 -7.4666 -7.3820 -7.3820 -7.1676 -7.1676 -7.1418 -7.1418 -6.8894 -6.8894 -6.7803 -6.7803 -4.7429 -4.7429 -4.7254 -4.7254 -4.6995 -4.6995 -4.6973 -4.6973 -4.6725 -4.6725 -4.6179 -4.6179 -0.2158 -0.2158 2.7895 2.7895 2.9513 2.9513 3.6301 3.6301 3.8835 3.8835 4.2037 4.2037 5.3488 5.3488 5.5513 5.5513 6.7759 6.7759 6.9658 6.9658 7.5034 7.5034 7.5794 7.5794 7.6295 7.6295 8.0188 8.0188 8.1396 8.1396 8.1908 8.1908 8.3653 8.3653 8.7651 8.7651 8.7713 8.7713 9.3003 9.3003 13.0005 13.0005 13.8170 13.8170 13.9374 13.9374 15.5551 15.5551 15.8738 15.8738 15.8754 15.8754 16.8378 16.8378 17.4006 17.4006 k = 0.2625-0.1516 0.2143 ( 6538 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3409 -10.3409 -8.1807 -8.1807 -8.0727 -8.0727 -8.0704 -8.0704 -7.4714 -7.4714 -7.3777 -7.3777 -7.1784 -7.1784 -7.1506 -7.1506 -6.8994 -6.8994 -6.7825 -6.7825 -4.7464 -4.7464 -4.7274 -4.7274 -4.7049 -4.7049 -4.6983 -4.6983 -4.6774 -4.6774 -4.6185 -4.6185 -0.1715 -0.1715 2.7376 2.7376 2.9248 2.9248 3.6474 3.6474 3.9038 3.9038 4.2081 4.2081 5.4046 5.4046 5.6045 5.6045 6.7108 6.7108 7.0895 7.0895 7.4712 7.4712 7.5783 7.5783 7.5947 7.5947 8.0100 8.0100 8.1487 8.1487 8.1996 8.1996 8.4153 8.4153 8.7184 8.7184 8.7237 8.7237 9.3016 9.3016 13.0413 13.0413 13.7433 13.7433 13.8851 13.8851 15.5078 15.5078 15.8029 15.8029 15.8256 15.8256 16.8051 16.8051 17.4497 17.4497 k = 0.2750-0.1588 0.2245 ( 6538 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3310 -10.3310 -8.1811 -8.1811 -8.0691 -8.0691 -8.0627 -8.0627 -7.4766 -7.4766 -7.3731 -7.3731 -7.1890 -7.1890 -7.1593 -7.1593 -6.9091 -6.9091 -6.7847 -6.7847 -4.7498 -4.7498 -4.7292 -4.7292 -4.7101 -4.7101 -4.6992 -4.6992 -4.6819 -4.6819 -4.6189 -4.6189 -0.1267 -0.1267 2.6882 2.6882 2.8984 2.8984 3.6650 3.6650 3.9244 3.9244 4.2129 4.2129 5.4622 5.4622 5.6593 5.6593 6.6445 6.6445 7.2115 7.2115 7.4379 7.4379 7.5578 7.5578 7.5787 7.5787 8.0014 8.0014 8.1580 8.1580 8.2085 8.2085 8.4685 8.4685 8.6710 8.6710 8.6751 8.6751 9.3030 9.3030 13.0661 13.0661 13.6834 13.6834 13.8330 13.8330 15.4622 15.4622 15.7353 15.7353 15.7751 15.7751 16.7721 16.7721 17.4995 17.4995 k = 0.2875-0.1660 0.2347 ( 6534 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3211 -10.3211 -8.1811 -8.1811 -8.0655 -8.0655 -8.0549 -8.0549 -7.4824 -7.4824 -7.3686 -7.3686 -7.1996 -7.1996 -7.1679 -7.1679 -6.9185 -6.9185 -6.7869 -6.7869 -4.7532 -4.7532 -4.7309 -4.7309 -4.7151 -4.7151 -4.7002 -4.7002 -4.6863 -4.6863 -4.6193 -4.6193 -0.0816 -0.0816 2.6415 2.6415 2.8720 2.8720 3.6828 3.6828 3.9450 3.9450 4.2184 4.2184 5.5214 5.5214 5.7156 5.7156 6.5772 6.5772 7.3307 7.3307 7.4038 7.4038 7.5229 7.5229 7.5777 7.5777 7.9929 7.9929 8.1674 8.1674 8.2174 8.2174 8.5234 8.5234 8.6240 8.6240 8.6257 8.6257 9.3044 9.3044 13.0678 13.0678 13.6442 13.6442 13.7813 13.7813 15.4182 15.4182 15.6712 15.6712 15.7241 15.7241 16.7392 16.7392 17.5497 17.5497 k = 0.3000-0.1732 0.2449 ( 6542 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3114 -10.3114 -8.1807 -8.1807 -8.0618 -8.0618 -8.0471 -8.0471 -7.4887 -7.4887 -7.3642 -7.3642 -7.2103 -7.2103 -7.1765 -7.1765 -6.9276 -6.9276 -6.7892 -6.7892 -4.7567 -4.7567 -4.7326 -4.7326 -4.7200 -4.7200 -4.7016 -4.7016 -4.6902 -4.6902 -4.6196 -4.6196 -0.0366 -0.0366 2.5974 2.5974 2.8456 2.8456 3.7007 3.7007 3.9655 3.9655 4.2249 4.2249 5.5819 5.5819 5.7732 5.7732 6.5092 6.5092 7.3690 7.3690 7.4351 7.4351 7.4995 7.4995 7.5770 7.5770 7.9847 7.9847 8.1766 8.1766 8.2262 8.2262 8.5588 8.5588 8.5757 8.5757 8.5985 8.5985 9.3057 9.3057 13.0423 13.0423 13.6301 13.6301 13.7301 13.7301 15.3761 15.3761 15.6107 15.6107 15.6729 15.6729 16.7068 16.7068 17.6000 17.6000 k = 0.3125-0.1804 0.2552 ( 6542 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3019 -10.3019 -8.1800 -8.1800 -8.0580 -8.0580 -8.0393 -8.0393 -7.4956 -7.4956 -7.3597 -7.3597 -7.2209 -7.2209 -7.1847 -7.1847 -6.9362 -6.9362 -6.7914 -6.7914 -4.7601 -4.7601 -4.7343 -4.7343 -4.7247 -4.7247 -4.7035 -4.7035 -4.6934 -4.6934 -4.6199 -4.6199 0.0081 0.0081 2.5559 2.5559 2.8191 2.8191 3.7186 3.7186 3.9858 3.9858 4.2326 4.2326 5.6437 5.6437 5.8320 5.8320 6.4410 6.4410 7.3336 7.3336 7.4350 7.4350 7.5762 7.5762 7.5775 7.5775 7.9767 7.9767 8.1857 8.1857 8.2348 8.2348 8.5187 8.5187 8.5255 8.5255 8.6502 8.6502 9.3070 9.3070 12.9920 12.9920 13.6392 13.6392 13.6798 13.6798 15.3359 15.3359 15.5537 15.5537 15.6219 15.6219 16.6752 16.6752 17.6500 17.6500 k = 0.3250-0.1876 0.2654 ( 6542 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2927 -10.2927 -8.1789 -8.1789 -8.0542 -8.0542 -8.0315 -8.0315 -7.5030 -7.5030 -7.3554 -7.3554 -7.2313 -7.2313 -7.1927 -7.1927 -6.9444 -6.9444 -6.7935 -6.7935 -4.7634 -4.7634 -4.7362 -4.7362 -4.7288 -4.7288 -4.7062 -4.7062 -4.6957 -4.6957 -4.6201 -4.6201 0.0522 0.0522 2.5171 2.5171 2.7925 2.7925 3.7363 3.7363 4.0058 4.0058 4.2418 4.2418 5.7065 5.7065 5.8917 5.8917 6.3728 6.3728 7.2977 7.2977 7.3990 7.3990 7.5757 7.5757 7.6875 7.6875 7.9689 7.9689 8.1945 8.1945 8.2433 8.2433 8.4701 8.4701 8.4754 8.4754 8.7120 8.7120 9.3083 9.3083 12.9237 12.9237 13.6304 13.6304 13.6645 13.6645 15.2978 15.2978 15.5003 15.5003 15.5715 15.5715 16.6445 16.6445 17.6992 17.6992 k = 0.3375-0.1949 0.2756 ( 6542 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2838 -10.2838 -8.1775 -8.1775 -8.0504 -8.0504 -8.0239 -8.0239 -7.5108 -7.5108 -7.3511 -7.3511 -7.2414 -7.2414 -7.2003 -7.2003 -6.9522 -6.9522 -6.7956 -6.7956 -4.7665 -4.7665 -4.7387 -4.7387 -4.7321 -4.7321 -4.7095 -4.7095 -4.6972 -4.6972 -4.6203 -4.6203 0.0955 0.0955 2.4809 2.4809 2.7661 2.7661 3.7538 3.7538 4.0252 4.0252 4.2526 4.2526 5.7702 5.7702 5.9521 5.9521 6.3052 6.3052 7.2615 7.2615 7.3601 7.3601 7.5751 7.5751 7.7962 7.7962 7.9616 7.9616 8.2027 8.2027 8.2513 8.2513 8.4213 8.4213 8.4258 8.4258 8.7757 8.7757 9.3095 9.3095 12.8447 12.8447 13.5823 13.5823 13.6993 13.6993 15.2617 15.2617 15.4505 15.4505 15.5220 15.5220 16.6151 16.6151 17.7471 17.7471 k = 0.3500-0.2021 0.2858 ( 6566 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2753 -10.2753 -8.1758 -8.1758 -8.0467 -8.0467 -8.0165 -8.0165 -7.5192 -7.5192 -7.3472 -7.3472 -7.2514 -7.2514 -7.2076 -7.2076 -6.9595 -6.9595 -6.7977 -6.7977 -4.7697 -4.7697 -4.7420 -4.7420 -4.7346 -4.7346 -4.7132 -4.7132 -4.6983 -4.6983 -4.6206 -4.6206 0.1376 0.1376 2.4474 2.4474 2.7399 2.7399 3.7710 3.7710 4.0439 4.0439 4.2648 4.2648 5.8345 5.8345 6.0129 6.0129 6.2386 6.2386 7.2249 7.2249 7.3201 7.3201 7.5746 7.5746 7.9013 7.9013 7.9545 7.9545 8.2099 8.2099 8.2588 8.2588 8.3734 8.3734 8.3773 8.3773 8.8401 8.8401 9.3106 9.3106 12.7601 12.7601 13.5356 13.5356 13.7388 13.7388 15.2279 15.2279 15.4044 15.4044 15.4738 15.4738 16.5872 16.5872 17.7934 17.7934 k = 0.3625-0.2093 0.2960 ( 6566 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2672 -10.2672 -8.1738 -8.1738 -8.0430 -8.0430 -8.0093 -8.0093 -7.5277 -7.5277 -7.3434 -7.3434 -7.2609 -7.2609 -7.2142 -7.2142 -6.9662 -6.9662 -6.7996 -6.7996 -4.7726 -4.7726 -4.7456 -4.7456 -4.7363 -4.7363 -4.7168 -4.7168 -4.6989 -4.6989 -4.6208 -4.6208 0.1781 0.1781 2.4166 2.4166 2.7141 2.7141 3.7876 3.7876 4.0619 4.0619 4.2785 4.2785 5.8992 5.8992 6.0733 6.0733 6.1743 6.1743 7.1880 7.1880 7.2794 7.2794 7.5740 7.5740 7.9478 7.9478 8.0018 8.0018 8.2153 8.2153 8.2650 8.2650 8.3279 8.3279 8.3309 8.3309 8.9044 8.9044 9.3117 9.3117 12.6735 12.6735 13.4906 13.4906 13.7798 13.7798 15.1964 15.1964 15.3619 15.3619 15.4273 15.4273 16.5608 16.5608 17.8376 17.8376 k = 0.3750-0.2165 0.3062 ( 6566 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2597 -10.2597 -8.1716 -8.1716 -8.0394 -8.0394 -8.0024 -8.0024 -7.5365 -7.5365 -7.3398 -7.3398 -7.2698 -7.2698 -7.2204 -7.2204 -6.9724 -6.9724 -6.8015 -6.8015 -4.7753 -4.7753 -4.7490 -4.7490 -4.7376 -4.7376 -4.7202 -4.7202 -4.6995 -4.6995 -4.6210 -4.6210 0.2169 0.2169 2.3885 2.3885 2.6889 2.6889 3.8037 3.8037 4.0789 4.0789 4.2936 4.2936 5.9639 5.9639 6.1028 6.1028 6.1431 6.1431 7.1509 7.1509 7.2381 7.2381 7.5735 7.5735 7.9416 7.9416 8.0968 8.0968 8.2157 8.2157 8.2643 8.2643 8.2882 8.2882 8.2928 8.2928 8.9679 8.9679 9.3127 9.3127 12.5873 12.5873 13.4478 13.4478 13.8204 13.8204 15.1672 15.1672 15.3232 15.3232 15.3831 15.3831 16.5363 16.5363 17.8792 17.8792 k = 0.3875-0.2237 0.3164 ( 6558 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2527 -10.2527 -8.1692 -8.1692 -8.0359 -8.0359 -7.9958 -7.9958 -7.5453 -7.5453 -7.3364 -7.3364 -7.2782 -7.2782 -7.2259 -7.2259 -6.9780 -6.9780 -6.8032 -6.8032 -4.7778 -4.7778 -4.7524 -4.7524 -4.7387 -4.7387 -4.7234 -4.7234 -4.6999 -4.6999 -4.6211 -4.6211 0.2535 0.2535 2.3630 2.3630 2.6646 2.6646 3.8190 3.8190 4.0949 4.0949 4.3097 4.3097 6.0284 6.0284 6.0464 6.0464 6.2001 6.2001 7.1135 7.1135 7.1963 7.1963 7.5731 7.5731 7.9360 7.9360 8.1850 8.1850 8.2020 8.2020 8.2349 8.2349 8.2639 8.2639 8.2859 8.2859 9.0299 9.0299 9.3137 9.3137 12.5035 12.5035 13.4073 13.4073 13.8593 13.8593 15.1406 15.1406 15.2881 15.2881 15.3415 15.3415 16.5137 16.5137 17.9178 17.9178 k = 0.4000-0.2309 0.3266 ( 6562 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2463 -10.2463 -8.1668 -8.1668 -8.0326 -8.0326 -7.9898 -7.9898 -7.5539 -7.5539 -7.3333 -7.3333 -7.2861 -7.2861 -7.2308 -7.2308 -6.9831 -6.9831 -6.8048 -6.8048 -4.7801 -4.7801 -4.7556 -4.7556 -4.7397 -4.7397 -4.7264 -4.7264 -4.7002 -4.7002 -4.6212 -4.6212 0.2875 0.2875 2.3402 2.3402 2.6416 2.6416 3.8333 3.8333 4.1096 4.1096 4.3265 4.3265 5.9892 5.9892 6.0922 6.0922 6.2608 6.2608 7.0756 7.0756 7.1542 7.1542 7.5727 7.5727 7.9308 7.9308 8.1712 8.1712 8.1936 8.1936 8.2585 8.2585 8.2691 8.2691 8.2902 8.2902 9.0893 9.0893 9.3146 9.3146 12.4234 12.4234 13.3695 13.3695 13.8955 13.8955 15.1166 15.1166 15.2567 15.2567 15.3030 15.3030 16.4932 16.4932 17.9531 17.9531 k = 0.4125-0.2382 0.3368 ( 6554 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2405 -10.2405 -8.1643 -8.1643 -8.0295 -8.0295 -7.9842 -7.9842 -7.5622 -7.5622 -7.3305 -7.3305 -7.2932 -7.2932 -7.2351 -7.2351 -6.9876 -6.9876 -6.8063 -6.8063 -4.7822 -4.7822 -4.7585 -4.7585 -4.7405 -4.7405 -4.7291 -4.7291 -4.7005 -4.7005 -4.6213 -4.6213 0.3186 0.3186 2.3201 2.3201 2.6201 2.6201 3.8466 3.8466 4.1229 4.1229 4.3436 4.3436 5.9355 5.9355 6.1548 6.1548 6.3213 6.3213 7.0372 7.0372 7.1118 7.1118 7.5723 7.5723 7.9261 7.9261 8.1356 8.1356 8.1568 8.1568 8.2603 8.2603 8.2947 8.2947 8.3438 8.3438 9.1453 9.1453 9.3153 9.3153 12.3487 12.3487 13.3348 13.3348 13.9285 13.9285 15.0951 15.0951 15.2290 15.2290 15.2679 15.2679 16.4748 16.4748 17.9849 17.9849 k = 0.4250-0.2454 0.3470 ( 6558 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2355 -10.2355 -8.1620 -8.1620 -8.0267 -8.0267 -7.9792 -7.9792 -7.5699 -7.5699 -7.3281 -7.3281 -7.2997 -7.2997 -7.2388 -7.2388 -6.9914 -6.9914 -6.8076 -6.8076 -4.7840 -4.7840 -4.7612 -4.7612 -4.7412 -4.7412 -4.7314 -4.7314 -4.7007 -4.7007 -4.6213 -4.6213 0.3465 0.3465 2.3027 2.3027 2.6005 2.6005 3.8585 3.8585 4.1348 4.1348 4.3603 4.3603 5.8864 5.8864 6.2154 6.2154 6.3808 6.3808 6.9981 6.9981 7.0696 7.0696 7.5720 7.5720 7.9221 7.9221 8.1012 8.1012 8.1229 8.1229 8.2637 8.2637 8.2992 8.2992 8.4102 8.4102 9.1969 9.1969 9.3161 9.3161 12.2804 12.2804 13.3037 13.3037 13.9578 13.9578 15.0764 15.0764 15.2050 15.2050 15.2367 15.2367 16.4587 16.4587 18.0127 18.0127 k = 0.4375-0.2526 0.3572 ( 6566 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2311 -10.2311 -8.1598 -8.1598 -8.0242 -8.0242 -7.9749 -7.9749 -7.5770 -7.5770 -7.3259 -7.3259 -7.3053 -7.3053 -7.2419 -7.2419 -6.9948 -6.9948 -6.8087 -6.8087 -4.7855 -4.7855 -4.7634 -4.7634 -4.7418 -4.7418 -4.7336 -4.7336 -4.7009 -4.7009 -4.6215 -4.6215 0.3708 0.3708 2.2879 2.2879 2.5832 2.5832 3.8690 3.8690 4.1450 4.1450 4.3762 4.3762 5.8428 5.8428 6.2733 6.2733 6.4391 6.4391 6.9584 6.9584 7.0281 7.0281 7.5717 7.5717 7.9186 7.9186 8.0701 8.0701 8.0932 8.0932 8.2673 8.2673 8.3032 8.3032 8.4678 8.4678 9.2430 9.2430 9.3166 9.3166 12.2200 12.2200 13.2764 13.2764 13.9830 13.9830 15.0605 15.0605 15.1847 15.1847 15.2097 15.2097 16.4449 16.4449 18.0366 18.0366 k = 0.4500-0.2598 0.3674 ( 6566 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2275 -10.2275 -8.1579 -8.1579 -8.0220 -8.0220 -7.9712 -7.9712 -7.5831 -7.5831 -7.3241 -7.3241 -7.3100 -7.3100 -7.2444 -7.2444 -6.9975 -6.9975 -6.8097 -6.8097 -4.7868 -4.7868 -4.7653 -4.7653 -4.7423 -4.7423 -4.7353 -4.7353 -4.7010 -4.7010 -4.6215 -4.6215 0.3912 0.3912 2.2759 2.2759 2.5685 2.5685 3.8778 3.8778 4.1536 4.1536 4.3906 4.3906 5.8056 5.8056 6.3269 6.3269 6.4955 6.4955 6.9179 6.9179 6.9883 6.9883 7.5715 7.5715 7.9157 7.9157 8.0433 8.0433 8.0681 8.0681 8.2706 8.2706 8.3066 8.3066 8.5160 8.5160 9.2826 9.2826 9.3171 9.3171 12.1685 12.1685 13.2535 13.2535 14.0039 14.0039 15.0474 15.0474 15.1681 15.1681 15.1871 15.1871 16.4336 16.4336 18.0563 18.0563 k = 0.4625-0.2670 0.3776 ( 6570 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2247 -10.2247 -8.1564 -8.1564 -8.0202 -8.0202 -7.9683 -7.9683 -7.5880 -7.5880 -7.3227 -7.3227 -7.3138 -7.3138 -7.2464 -7.2464 -6.9996 -6.9996 -6.8104 -6.8104 -4.7878 -4.7878 -4.7668 -4.7668 -4.7426 -4.7426 -4.7367 -4.7367 -4.7011 -4.7011 -4.6216 -4.6216 0.4074 0.4074 2.2665 2.2665 2.5567 2.5567 3.8848 3.8848 4.1603 4.1603 4.4026 4.4026 5.7755 5.7755 6.3745 6.3745 6.5494 6.5494 6.8771 6.8771 6.9519 6.9519 7.5713 7.5713 7.9135 7.9135 8.0218 8.0218 8.0481 8.0481 8.2732 8.2732 8.3092 8.3092 8.5541 8.5541 9.3147 9.3147 9.3175 9.3175 12.1271 12.1271 13.2353 13.2353 14.0204 14.0204 15.0371 15.0371 15.1552 15.1552 15.1693 15.1693 16.4247 16.4247 18.0717 18.0717 k = 0.4750-0.2742 0.3878 ( 6558 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2227 -10.2227 -8.1552 -8.1552 -8.0189 -8.0189 -7.9662 -7.9662 -7.5916 -7.5916 -7.3214 -7.3214 -7.3165 -7.3165 -7.2477 -7.2477 -7.0011 -7.0011 -6.8109 -6.8109 -4.7884 -4.7884 -4.7678 -4.7678 -4.7428 -4.7428 -4.7376 -4.7376 -4.7011 -4.7011 -4.6216 -4.6216 0.4192 0.4192 2.2598 2.2598 2.5481 2.5481 3.8899 3.8899 4.1651 4.1651 4.4119 4.4119 5.7534 5.7534 6.4130 6.4130 6.5990 6.5990 6.8370 6.8370 6.9215 6.9215 7.5712 7.5712 7.9118 7.9118 8.0059 8.0059 8.0336 8.0336 8.2752 8.2752 8.3111 8.3111 8.5817 8.5817 9.3178 9.3178 9.3384 9.3384 12.0968 12.0968 13.2220 13.2220 14.0323 14.0323 15.0298 15.0298 15.1460 15.1460 15.1565 15.1565 16.4183 16.4183 18.0827 18.0827 k = 0.4875-0.2815 0.3980 ( 6534 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3966 -30.3966 -10.2214 -10.2214 -8.1545 -8.1545 -8.0181 -8.0181 -7.9649 -7.9649 -7.5939 -7.5939 -7.3204 -7.3204 -7.3183 -7.3183 -7.2483 -7.2483 -7.0020 -7.0020 -6.8112 -6.8112 -4.7886 -4.7886 -4.7684 -4.7684 -4.7428 -4.7428 -4.7382 -4.7382 -4.7010 -4.7010 -4.6216 -4.6216 0.4263 0.4263 2.2558 2.2558 2.5428 2.5428 3.8930 3.8930 4.1681 4.1681 4.4176 4.4176 5.7398 5.7398 6.4388 6.4388 6.6402 6.6402 6.8019 6.8019 6.9008 6.9008 7.5712 7.5712 7.9110 7.9110 7.9963 7.9963 8.0248 8.0248 8.2764 8.2764 8.3123 8.3123 8.5983 8.5983 9.3180 9.3180 9.3529 9.3529 12.0782 12.0782 13.2139 13.2139 14.0394 14.0394 15.0254 15.0254 15.1405 15.1405 15.1487 15.1487 16.4144 16.4144 18.0894 18.0894 k = 0.5000-0.2887 0.4082 ( 6526 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3966 -30.3966 -10.2210 -10.2210 -8.1542 -8.1542 -8.0179 -8.0179 -7.9645 -7.9645 -7.5946 -7.5946 -7.3197 -7.3197 -7.3193 -7.3193 -7.2485 -7.2485 -7.0023 -7.0023 -6.8113 -6.8113 -4.7887 -4.7887 -4.7686 -4.7686 -4.7428 -4.7428 -4.7384 -4.7384 -4.7008 -4.7008 -4.6216 -4.6216 0.4287 0.4287 2.2544 2.2544 2.5410 2.5410 3.8941 3.8941 4.1691 4.1691 4.4197 4.4197 5.7353 5.7353 6.4479 6.4479 6.6588 6.6588 6.7852 6.7852 6.8933 6.8933 7.5712 7.5712 7.9107 7.9107 7.9930 7.9930 8.0218 8.0218 8.2768 8.2768 8.3127 8.3127 8.6039 8.6039 9.3180 9.3180 9.3578 9.3578 12.0720 12.0720 13.2112 13.2112 14.0418 14.0418 15.0239 15.0239 15.1387 15.1387 15.1461 15.1461 16.4132 16.4132 18.0916 18.0916 k = 0.5000-0.2887 0.4082 ( 6526 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3966 -30.3966 -10.2210 -10.2210 -8.1542 -8.1542 -8.0179 -8.0179 -7.9645 -7.9645 -7.5946 -7.5946 -7.3197 -7.3197 -7.3193 -7.3193 -7.2485 -7.2485 -7.0023 -7.0023 -6.8113 -6.8113 -4.7887 -4.7887 -4.7686 -4.7686 -4.7428 -4.7428 -4.7384 -4.7384 -4.7008 -4.7008 -4.6216 -4.6216 0.4287 0.4287 2.2544 2.2544 2.5410 2.5410 3.8941 3.8941 4.1691 4.1691 4.4197 4.4197 5.7353 5.7353 6.4479 6.4479 6.6588 6.6588 6.7852 6.7852 6.8933 6.8933 7.5712 7.5712 7.9107 7.9107 7.9930 7.9930 8.0218 8.0218 8.2768 8.2768 8.3127 8.3127 8.6039 8.6039 9.3180 9.3180 9.3578 9.3578 12.0720 12.0720 13.2112 13.2112 14.0418 14.0418 15.0239 15.0239 15.1387 15.1387 15.1461 15.1461 16.4132 16.4132 18.0916 18.0916 k = 0.5000-0.2742 0.4185 ( 6530 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3966 -30.3966 -10.2210 -10.2210 -8.1540 -8.1540 -8.0182 -8.0182 -7.9649 -7.9649 -7.5939 -7.5939 -7.3198 -7.3198 -7.3193 -7.3193 -7.2486 -7.2486 -7.0021 -7.0021 -6.8116 -6.8116 -4.7887 -4.7887 -4.7686 -4.7686 -4.7428 -4.7428 -4.7384 -4.7384 -4.7008 -4.7008 -4.6218 -4.6218 0.4289 0.4289 2.2549 2.2549 2.5406 2.5406 3.8935 3.8935 4.1684 4.1684 4.4191 4.4191 5.7377 5.7377 6.4484 6.4484 6.6590 6.6590 6.7850 6.7850 6.8930 6.8930 7.5709 7.5709 7.9038 7.9038 7.9970 7.9970 8.0270 8.0270 8.2748 8.2748 8.3107 8.3107 8.6059 8.6059 9.3166 9.3166 9.3568 9.3568 12.0752 12.0752 13.2113 13.2113 14.0421 14.0421 15.0231 15.0231 15.1336 15.1336 15.1505 15.1505 16.4106 16.4106 18.0912 18.0912 k = 0.5000-0.2598 0.4287 ( 6554 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2209 -10.2209 -8.1535 -8.1535 -8.0194 -8.0194 -7.9661 -7.9661 -7.5918 -7.5918 -7.3201 -7.3201 -7.3192 -7.3192 -7.2493 -7.2493 -7.0013 -7.0013 -6.8123 -6.8123 -4.7885 -4.7885 -4.7686 -4.7686 -4.7430 -4.7430 -4.7384 -4.7384 -4.7009 -4.7009 -4.6223 -4.6223 0.4293 0.4293 2.2562 2.2562 2.5393 2.5393 3.8918 3.8918 4.1664 4.1664 4.4173 4.4173 5.7450 5.7450 6.4499 6.4499 6.6597 6.6597 6.7844 6.7844 6.8923 6.8923 7.5699 7.5699 7.8884 7.8884 8.0007 8.0007 8.0454 8.0454 8.2689 8.2689 8.3046 8.3046 8.6118 8.6118 9.3125 9.3125 9.3540 9.3540 12.0850 12.0850 13.2117 13.2117 14.0427 14.0427 15.0204 15.0204 15.1251 15.1251 15.1572 15.1572 16.4029 16.4029 18.0900 18.0900 k = 0.5000-0.2454 0.4389 ( 6572 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2208 -10.2208 -8.1527 -8.1527 -8.0212 -8.0212 -7.9679 -7.9679 -7.5885 -7.5885 -7.3205 -7.3205 -7.3190 -7.3190 -7.2503 -7.2503 -7.0002 -7.0002 -6.8135 -6.8135 -4.7880 -4.7880 -4.7686 -4.7686 -4.7429 -4.7429 -4.7384 -4.7384 -4.7008 -4.7008 -4.6232 -4.6232 0.4300 0.4300 2.2584 2.2584 2.5371 2.5371 3.8889 3.8889 4.1633 4.1633 4.4144 4.4144 5.7570 5.7570 6.4523 6.4523 6.6607 6.6607 6.7834 6.7834 6.8913 6.8913 7.5684 7.5684 7.8713 7.8713 8.0003 8.0003 8.0742 8.0742 8.2591 8.2591 8.2948 8.2948 8.6213 8.6213 9.3056 9.3056 9.3494 9.3494 12.1010 12.1010 13.2122 13.2122 14.0438 14.0438 15.0154 15.0154 15.1155 15.1155 15.1647 15.1647 16.3903 16.3903 18.0879 18.0879 k = 0.5000-0.2309 0.4491 ( 6568 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2205 -10.2205 -8.1515 -8.1515 -8.0236 -8.0236 -7.9704 -7.9704 -7.5839 -7.5839 -7.3207 -7.3207 -7.3188 -7.3188 -7.2514 -7.2514 -6.9985 -6.9985 -6.8152 -6.8152 -4.7871 -4.7871 -4.7685 -4.7685 -4.7427 -4.7427 -4.7384 -4.7384 -4.7005 -4.7005 -4.6243 -4.6243 0.4310 0.4310 2.2614 2.2614 2.5340 2.5340 3.8848 3.8848 4.1595 4.1595 4.4104 4.4104 5.7732 5.7732 6.4557 6.4557 6.6622 6.6622 6.7817 6.7817 6.8900 6.8900 7.5665 7.5665 7.8553 7.8553 7.9977 7.9977 8.1084 8.1084 8.2457 8.2457 8.2821 8.2821 8.6339 8.6339 9.2960 9.2960 9.3428 9.3428 12.1232 12.1232 13.2127 13.2127 14.0453 14.0453 15.0076 15.0076 15.1047 15.1047 15.1738 15.1738 16.3728 16.3728 18.0849 18.0849 k = 0.5000-0.2165 0.4593 ( 6580 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2203 -10.2203 -8.1500 -8.1500 -8.0266 -8.0266 -7.9735 -7.9735 -7.5783 -7.5783 -7.3210 -7.3210 -7.3186 -7.3186 -7.2530 -7.2530 -6.9964 -6.9964 -6.8173 -6.8173 -4.7862 -4.7862 -4.7684 -4.7684 -4.7424 -4.7424 -4.7383 -4.7383 -4.7003 -4.7003 -4.6258 -4.6258 0.4322 0.4322 2.2652 2.2652 2.5301 2.5301 3.8794 3.8794 4.1552 4.1552 4.4055 4.4055 5.7933 5.7933 6.4600 6.4600 6.6641 6.6641 6.7792 6.7792 6.8887 6.8887 7.5642 7.5642 7.8417 7.8417 7.9938 7.9938 8.1458 8.1458 8.2285 8.2285 8.2668 8.2668 8.6494 8.6494 9.2837 9.2837 9.3345 9.3345 12.1510 12.1510 13.2131 13.2131 14.0471 14.0471 14.9965 14.9965 15.0929 15.0929 15.1852 15.1852 16.3509 16.3509 18.0808 18.0809 k = 0.5000-0.2021 0.4695 ( 6580 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2200 -10.2200 -8.1482 -8.1482 -8.0301 -8.0301 -7.9771 -7.9771 -7.5717 -7.5717 -7.3212 -7.3212 -7.3184 -7.3184 -7.2547 -7.2547 -6.9939 -6.9939 -6.8198 -6.8198 -4.7850 -4.7850 -4.7683 -4.7683 -4.7420 -4.7420 -4.7382 -4.7382 -4.6998 -4.6998 -4.6275 -4.6275 0.4336 0.4336 2.2699 2.2699 2.5254 2.5254 3.8727 3.8727 4.1508 4.1508 4.3997 4.3997 5.8168 5.8168 6.4651 6.4651 6.6663 6.6663 6.7758 6.7758 6.8877 6.8877 7.5617 7.5617 7.8309 7.8309 7.9890 7.9890 8.1843 8.1843 8.2090 8.2090 8.2499 8.2499 8.6672 8.6672 9.2688 9.2688 9.3244 9.3244 12.1841 12.1841 13.2130 13.2130 14.0492 14.0492 14.9822 14.9822 15.0799 15.0799 15.1994 15.1994 16.3247 16.3247 18.0758 18.0758 k = 0.5000-0.1876 0.4797 ( 6582 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2196 -10.2196 -8.1462 -8.1462 -8.0339 -8.0339 -7.9811 -7.9811 -7.5644 -7.5644 -7.3216 -7.3216 -7.3182 -7.3182 -7.2568 -7.2568 -6.9910 -6.9910 -6.8228 -6.8228 -4.7838 -4.7838 -4.7682 -4.7682 -4.7418 -4.7418 -4.7381 -4.7381 -4.6992 -4.6992 -4.6295 -4.6295 0.4352 0.4352 2.2754 2.2754 2.5198 2.5198 3.8647 3.8647 4.1469 4.1469 4.3932 4.3932 5.8430 5.8430 6.4709 6.4709 6.6687 6.6687 6.7712 6.7712 6.8870 6.8870 7.5592 7.5592 7.8231 7.8231 7.9833 7.9833 8.1815 8.1815 8.2288 8.2288 8.2323 8.2323 8.6870 8.6870 9.2513 9.2513 9.3126 9.3126 12.2220 12.2220 13.2124 13.2124 14.0515 14.0515 14.9651 14.9651 15.0658 15.0658 15.2167 15.2167 16.2946 16.2946 18.0696 18.0696 k = 0.5000-0.1732 0.4899 ( 6582 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2193 -10.2193 -8.1439 -8.1439 -8.0379 -8.0379 -7.9854 -7.9854 -7.5566 -7.5566 -7.3219 -7.3219 -7.3180 -7.3180 -7.2590 -7.2590 -6.9877 -6.9877 -6.8261 -6.8261 -4.7824 -4.7824 -4.7681 -4.7681 -4.7414 -4.7414 -4.7380 -4.7380 -4.6985 -4.6985 -4.6317 -4.6317 0.4369 0.4369 2.2816 2.2816 2.5136 2.5136 3.8555 3.8555 4.1436 4.1436 4.3861 4.3861 5.8713 5.8713 6.4775 6.4775 6.6713 6.6713 6.7654 6.7654 6.8868 6.8868 7.5568 7.5568 7.8184 7.8184 7.9769 7.9769 8.1547 8.1547 8.2126 8.2126 8.2723 8.2723 8.7085 8.7085 9.2314 9.2314 9.2991 9.2991 12.2641 12.2641 13.2107 13.2107 14.0538 14.0538 14.9458 14.9458 15.0504 15.0504 15.2373 15.2373 16.2609 16.2609 18.0624 18.0624 k = 0.5000-0.1588 0.5001 ( 6578 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2189 -10.2189 -8.1415 -8.1415 -8.0419 -8.0419 -7.9901 -7.9901 -7.5484 -7.5484 -7.3222 -7.3222 -7.3178 -7.3178 -7.2614 -7.2614 -6.9840 -6.9840 -6.8297 -6.8297 -4.7811 -4.7811 -4.7679 -4.7679 -4.7409 -4.7409 -4.7377 -4.7377 -4.6976 -4.6976 -4.6342 -4.6342 0.4388 0.4388 2.2885 2.2885 2.5066 2.5066 3.8454 3.8454 4.1411 4.1411 4.3785 4.3785 5.9010 5.9010 6.4848 6.4848 6.6739 6.6739 6.7584 6.7584 6.8873 6.8873 7.5547 7.5547 7.8168 7.8168 7.9700 7.9700 8.1253 8.1253 8.1928 8.1928 8.3169 8.3169 8.7314 8.7314 9.2089 9.2089 9.2839 9.2839 12.3098 12.3098 13.2077 13.2077 14.0562 14.0562 14.9251 14.9251 15.0340 15.0340 15.2610 15.2610 16.2242 16.2242 18.0542 18.0542 k = 0.5000-0.1443 0.5103 ( 6588 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2185 -10.2185 -8.1390 -8.1390 -8.0458 -8.0458 -7.9950 -7.9950 -7.5400 -7.5400 -7.3227 -7.3227 -7.3177 -7.3177 -7.2640 -7.2640 -6.9801 -6.9801 -6.8336 -6.8336 -4.7798 -4.7798 -4.7678 -4.7678 -4.7406 -4.7406 -4.7374 -4.7374 -4.6966 -4.6966 -4.6370 -4.6370 0.4407 0.4407 2.2961 2.2961 2.4989 2.4989 3.8344 3.8344 4.1397 4.1397 4.3705 4.3705 5.9316 5.9316 6.4926 6.4926 6.6763 6.6763 6.7503 6.7503 6.8883 6.8883 7.5532 7.5532 7.8181 7.8181 7.9625 7.9625 8.0943 8.0943 8.1724 8.1724 8.3624 8.3624 8.7557 8.7557 9.1841 9.1841 9.2672 9.2672 12.3585 12.3585 13.2030 13.2030 14.0585 14.0585 14.9036 14.9036 15.0168 15.0168 15.2878 15.2878 16.1848 16.1848 18.0451 18.0451 k = 0.5000-0.1299 0.5205 ( 6590 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2181 -10.2181 -8.1365 -8.1365 -8.0494 -8.0494 -8.0000 -8.0000 -7.5317 -7.5317 -7.3231 -7.3231 -7.3176 -7.3176 -7.2666 -7.2666 -6.9760 -6.9760 -6.8378 -6.8378 -4.7784 -4.7784 -4.7677 -4.7677 -4.7402 -4.7402 -4.7370 -4.7370 -4.6953 -4.6953 -4.6400 -4.6400 0.4426 0.4426 2.3043 2.3043 2.4906 2.4906 3.8231 3.8231 4.1393 4.1393 4.3624 4.3624 5.9622 5.9622 6.5011 6.5011 6.6783 6.6783 6.7414 6.7414 6.8898 6.8898 7.5525 7.5525 7.8223 7.8223 7.9543 7.9543 8.0628 8.0628 8.1514 8.1514 8.4087 8.4087 8.7809 8.7809 9.1570 9.1570 9.2490 9.2490 12.4094 12.4094 13.1963 13.1963 14.0606 14.0606 14.8821 14.8821 14.9990 14.9990 15.3173 15.3173 16.1430 16.1430 18.0354 18.0354 k = 0.5000-0.1155 0.5307 ( 6590 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2177 -10.2177 -8.1341 -8.1341 -8.0525 -8.0525 -8.0052 -8.0052 -7.5235 -7.5235 -7.3236 -7.3236 -7.3176 -7.3176 -7.2692 -7.2692 -6.9717 -6.9717 -6.8420 -6.8420 -4.7771 -4.7771 -4.7676 -4.7676 -4.7400 -4.7400 -4.7366 -4.7366 -4.6937 -4.6937 -4.6432 -4.6432 0.4444 0.4444 2.3131 2.3131 2.4817 2.4817 3.8117 3.8117 4.1398 4.1398 4.3541 4.3541 5.9923 5.9923 6.5101 6.5101 6.6796 6.6796 6.7321 6.7321 6.8917 6.8917 7.5529 7.5529 7.8291 7.8291 7.9451 7.9451 8.0319 8.0319 8.1300 8.1300 8.4555 8.4555 8.8070 8.8070 9.1278 9.1278 9.2293 9.2293 12.4618 12.4618 13.1872 13.1872 14.0625 14.0625 14.8613 14.8613 14.9812 14.9812 15.3494 15.3494 16.0995 16.0995 18.0254 18.0254 k = 0.5000-0.1010 0.5409 ( 6598 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2173 -10.2173 -8.1318 -8.1318 -8.0550 -8.0550 -8.0104 -8.0104 -7.5157 -7.5157 -7.3242 -7.3242 -7.3176 -7.3176 -7.2718 -7.2718 -6.9674 -6.9674 -6.8464 -6.8464 -4.7759 -4.7759 -4.7676 -4.7676 -4.7398 -4.7398 -4.7360 -4.7360 -4.6920 -4.6920 -4.6465 -4.6465 0.4462 0.4462 2.3224 2.3224 2.4723 2.4723 3.8006 3.8006 4.1411 4.1411 4.3460 4.3460 6.0210 6.0210 6.5196 6.5196 6.6796 6.6796 6.7230 6.7230 6.8938 6.8938 7.5544 7.5544 7.8383 7.8383 7.9340 7.9340 8.0035 8.0035 8.1082 8.1082 8.5026 8.5026 8.8337 8.8337 9.0965 9.0965 9.2084 9.2084 12.5148 12.5148 13.1755 13.1755 14.0641 14.0641 14.8418 14.8418 14.9637 14.9637 15.3838 15.3838 16.0545 16.0545 18.0154 18.0154 k = 0.5000-0.0866 0.5511 ( 6610 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2170 -10.2170 -8.1298 -8.1298 -8.0566 -8.0566 -8.0157 -8.0157 -7.5084 -7.5084 -7.3247 -7.3247 -7.3177 -7.3177 -7.2742 -7.2742 -6.9631 -6.9631 -6.8507 -6.8507 -4.7748 -4.7748 -4.7676 -4.7676 -4.7397 -4.7397 -4.7355 -4.7355 -4.6899 -4.6899 -4.6501 -4.6501 0.4478 0.4478 2.3322 2.3322 2.4625 2.4625 3.7902 3.7902 4.1431 4.1431 4.3383 4.3383 6.0477 6.0477 6.5296 6.5296 6.6774 6.6774 6.7151 6.7151 6.8959 6.8959 7.5572 7.5572 7.8496 7.8496 7.9196 7.9196 7.9799 7.9799 8.0861 8.0861 8.5497 8.5497 8.8609 8.8609 9.0634 9.0634 9.1861 9.1861 12.5674 12.5674 13.1611 13.1611 14.0654 14.0654 14.8242 14.8242 14.9471 14.9471 15.4201 15.4201 16.0086 16.0086 18.0058 18.0058 k = 0.5000-0.0722 0.5613 ( 6618 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2167 -10.2167 -8.1281 -8.1281 -8.0575 -8.0575 -8.0209 -8.0209 -7.5019 -7.5019 -7.3254 -7.3254 -7.3177 -7.3177 -7.2763 -7.2763 -6.9590 -6.9590 -6.8549 -6.8549 -4.7739 -4.7739 -4.7675 -4.7675 -4.7396 -4.7396 -4.7350 -4.7350 -4.6877 -4.6877 -4.6537 -4.6537 0.4493 0.4493 2.3424 2.3424 2.4522 2.4522 3.7808 3.7808 4.1454 4.1454 4.3310 4.3310 6.0718 6.0718 6.5399 6.5399 6.6723 6.6723 6.7094 6.7094 6.8979 6.8979 7.5611 7.5611 7.8625 7.8625 7.9015 7.9015 7.9631 7.9631 8.0638 8.0638 8.5968 8.5968 8.8881 8.8881 9.0287 9.0287 9.1628 9.1628 12.6186 12.6186 13.1442 13.1442 14.0664 14.0664 14.8089 14.8089 14.9318 14.9318 15.4579 15.4579 15.9625 15.9625 17.9969 17.9969 k = 0.5000-0.0577 0.5715 ( 6622 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2164 -10.2164 -8.1267 -8.1267 -8.0574 -8.0574 -8.0260 -8.0260 -7.4962 -7.4962 -7.3260 -7.3260 -7.3178 -7.3178 -7.2782 -7.2782 -6.9551 -6.9551 -6.8587 -6.8587 -4.7731 -4.7731 -4.7675 -4.7675 -4.7395 -4.7395 -4.7345 -4.7345 -4.6851 -4.6851 -4.6574 -4.6574 0.4506 0.4506 2.3529 2.3529 2.4416 2.4416 3.7726 3.7726 4.1479 4.1479 4.3246 4.3246 6.0926 6.0926 6.5505 6.5505 6.6645 6.6645 6.7061 6.7061 6.8998 6.8998 7.5660 7.5660 7.8718 7.8718 7.8863 7.8863 7.9522 7.9522 8.0415 8.0415 8.6435 8.6435 8.9143 8.9143 8.9936 8.9936 9.1384 9.1384 12.6668 12.6668 13.1252 13.1252 14.0672 14.0672 14.7961 14.7961 14.9183 14.9183 15.4967 15.4967 15.9167 15.9167 17.9891 17.9891 k = 0.5000-0.0433 0.5818 ( 6628 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2162 -10.2162 -8.1257 -8.1257 -8.0565 -8.0565 -8.0308 -8.0308 -7.4916 -7.4916 -7.3266 -7.3266 -7.3178 -7.3178 -7.2798 -7.2798 -6.9518 -6.9518 -6.8620 -6.8620 -4.7725 -4.7725 -4.7675 -4.7675 -4.7395 -4.7395 -4.7340 -4.7340 -4.6824 -4.6824 -4.6611 -4.6611 0.4516 0.4516 2.3638 2.3638 2.4308 2.4308 3.7661 3.7661 4.1503 4.1503 4.3192 4.3192 6.1094 6.1094 6.5609 6.5609 6.6551 6.6551 6.7044 6.7044 6.9013 6.9013 7.5713 7.5713 7.8573 7.8573 7.8974 7.8974 7.9452 7.9452 8.0193 8.0193 8.6898 8.6898 8.9305 8.9305 8.9669 8.9669 9.1132 9.1132 12.7103 12.7103 13.1054 13.1054 14.0677 14.0677 14.7861 14.7861 14.9071 14.9071 15.5352 15.5352 15.8726 15.8726 17.9827 17.9827 k = 0.5000-0.0289 0.5920 ( 6624 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2160 -10.2160 -8.1251 -8.1251 -8.0549 -8.0549 -8.0351 -8.0351 -7.4881 -7.4881 -7.3271 -7.3271 -7.3179 -7.3179 -7.2808 -7.2808 -6.9492 -6.9492 -6.8646 -6.8646 -4.7721 -4.7721 -4.7675 -4.7675 -4.7395 -4.7395 -4.7337 -4.7337 -4.6793 -4.6793 -4.6648 -4.6648 0.4523 0.4523 2.3748 2.3748 2.4197 2.4197 3.7612 3.7612 4.1522 4.1522 4.3151 4.3151 6.1219 6.1219 6.5707 6.5707 6.6456 6.6456 6.7035 6.7035 6.9025 6.9025 7.5762 7.5762 7.8414 7.8414 7.9149 7.9149 7.9408 7.9408 7.9974 7.9974 8.7353 8.7353 8.9054 8.9054 8.9801 8.9801 9.0871 9.0871 12.7461 12.7461 13.0869 13.0869 14.0680 14.0680 14.7789 14.7789 14.8988 14.8988 15.5714 15.5714 15.8324 15.8324 17.9779 17.9779 k = 0.5000-0.0144 0.6022 ( 6620 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2159 -10.2159 -8.1247 -8.1247 -8.0532 -8.0532 -8.0384 -8.0384 -7.4860 -7.4860 -7.3273 -7.3273 -7.3178 -7.3178 -7.2815 -7.2815 -6.9475 -6.9475 -6.8663 -6.8663 -4.7718 -4.7718 -4.7674 -4.7674 -4.7394 -4.7394 -4.7334 -4.7334 -4.6762 -4.6762 -4.6683 -4.6683 0.4528 0.4528 2.3860 2.3860 2.4085 2.4085 3.7583 3.7583 4.1534 4.1534 4.3126 4.3126 6.1295 6.1295 6.5783 6.5783 6.6380 6.6380 6.7031 6.7031 6.9032 6.9032 7.5797 7.5797 7.8308 7.8308 7.9327 7.9327 7.9395 7.9395 7.9760 7.9760 8.7800 8.7800 8.8661 8.8661 9.0059 9.0059 9.0606 9.0606 12.7705 12.7705 13.0731 13.0731 14.0682 14.0682 14.7747 14.7747 14.8936 14.8936 15.6004 15.6004 15.8010 15.8010 17.9749 17.9749 k = 0.5000 0.0000 0.6124 ( 6620 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2159 -10.2159 -8.1246 -8.1246 -8.0524 -8.0524 -8.0398 -8.0398 -7.4853 -7.4853 -7.3274 -7.3274 -7.3179 -7.3179 -7.2817 -7.2817 -6.9470 -6.9470 -6.8669 -6.8669 -4.7717 -4.7717 -4.7674 -4.7674 -4.7394 -4.7394 -4.7334 -4.7334 -4.6741 -4.6741 -4.6705 -4.6705 0.4529 0.4529 2.3971 2.3971 2.3973 2.3973 3.7573 3.7573 4.1539 4.1539 4.3117 4.3117 6.1321 6.1321 6.5814 6.5814 6.6349 6.6349 6.7030 6.7030 6.9034 6.9034 7.5810 7.5810 7.8270 7.8270 7.9364 7.9364 7.9531 7.9531 7.9572 7.9572 8.8205 8.8205 8.8270 8.8270 9.0292 9.0292 9.0373 9.0373 12.7793 12.7793 13.0679 13.0679 14.0682 14.0682 14.7732 14.7732 14.8919 14.8919 15.6124 15.6124 15.7882 15.7882 17.9739 17.9739 k = 0.5000 0.0000 0.6124 ( 6620 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2159 -10.2159 -8.1246 -8.1246 -8.0524 -8.0524 -8.0398 -8.0398 -7.4853 -7.4853 -7.3274 -7.3274 -7.3179 -7.3179 -7.2817 -7.2817 -6.9470 -6.9470 -6.8669 -6.8669 -4.7717 -4.7717 -4.7674 -4.7674 -4.7394 -4.7394 -4.7334 -4.7334 -4.6741 -4.6741 -4.6705 -4.6705 0.4529 0.4529 2.3971 2.3971 2.3973 2.3973 3.7573 3.7573 4.1539 4.1539 4.3117 4.3117 6.1321 6.1321 6.5814 6.5814 6.6349 6.6349 6.7030 6.7030 6.9034 6.9034 7.5810 7.5810 7.8270 7.8270 7.9364 7.9364 7.9531 7.9531 7.9572 7.9572 8.8205 8.8205 8.8270 8.8270 9.0292 9.0292 9.0373 9.0373 12.7793 12.7793 13.0679 13.0679 14.0682 14.0682 14.7732 14.7732 14.8919 14.8919 15.6124 15.6124 15.7882 15.7882 17.9739 17.9739 k = 0.4911 0.0155 0.6124 ( 6620 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2160 -10.2160 -8.1254 -8.1254 -8.0541 -8.0541 -8.0373 -8.0373 -7.4856 -7.4856 -7.3274 -7.3274 -7.3178 -7.3178 -7.2815 -7.2815 -6.9473 -6.9473 -6.8665 -6.8665 -4.7717 -4.7717 -4.7674 -4.7674 -4.7394 -4.7394 -4.7334 -4.7334 -4.6754 -4.6754 -4.6692 -4.6692 0.4523 0.4523 2.3898 2.3898 2.4056 2.4056 3.7562 3.7562 4.1541 4.1541 4.3128 4.3128 6.1309 6.1309 6.5751 6.5751 6.6326 6.6326 6.7050 6.7050 6.9099 6.9099 7.5786 7.5786 7.8249 7.8249 7.9339 7.9339 7.9425 7.9425 7.9775 7.9775 8.7927 8.7927 8.8543 8.8543 9.0133 9.0133 9.0517 9.0517 12.7755 12.7755 13.0711 13.0711 14.0676 14.0676 14.7738 14.7738 14.8926 14.8926 15.6070 15.6070 15.7961 15.7961 17.9725 17.9725 k = 0.4821 0.0309 0.6124 ( 6620 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2163 -10.2163 -8.1274 -8.1274 -8.0578 -8.0578 -8.0313 -8.0313 -7.4863 -7.4863 -7.3273 -7.3273 -7.3176 -7.3176 -7.2808 -7.2808 -6.9483 -6.9483 -6.8653 -6.8653 -4.7717 -4.7717 -4.7673 -4.7673 -4.7393 -4.7393 -4.7334 -4.7334 -4.6775 -4.6775 -4.6669 -4.6669 0.4504 0.4504 2.3837 2.3837 2.4143 2.4143 3.7530 3.7530 4.1550 4.1550 4.3158 4.3158 6.1276 6.1276 6.5603 6.5603 6.6233 6.6233 6.7109 6.7109 6.9278 6.9278 7.5728 7.5728 7.8182 7.8182 7.9216 7.9216 7.9423 7.9423 8.0103 8.0103 8.7614 8.7614 8.8833 8.8833 8.9940 8.9940 9.0669 9.0669 12.7647 12.7647 13.0798 13.0798 14.0661 14.0661 14.7757 14.7757 14.8945 14.8945 15.5926 15.5926 15.8177 15.8177 17.9684 17.9684 k = 0.4732 0.0464 0.6124 ( 6622 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2167 -10.2167 -8.1303 -8.1303 -8.0620 -8.0620 -8.0238 -8.0238 -7.4875 -7.4875 -7.3271 -7.3271 -7.3174 -7.3174 -7.2798 -7.2798 -6.9499 -6.9499 -6.8634 -6.8634 -4.7717 -4.7717 -4.7672 -4.7672 -4.7392 -4.7392 -4.7334 -4.7334 -4.6795 -4.6795 -4.6645 -4.6645 0.4475 0.4475 2.3787 2.3787 2.4233 2.4233 3.7479 3.7479 4.1571 4.1571 4.3203 4.3203 6.1225 6.1225 6.5420 6.5420 6.6059 6.6059 6.7208 6.7208 6.9532 6.9532 7.5657 7.5657 7.8080 7.8080 7.9062 7.9062 7.9483 7.9483 8.0493 8.0493 8.7298 8.7298 8.9101 8.9101 8.9758 8.9758 9.0799 9.0799 12.7485 12.7485 13.0926 13.0926 14.0637 14.0637 14.7789 14.7789 14.8970 14.8970 15.5727 15.5727 15.8486 15.8486 17.9617 17.9617 k = 0.4643 0.0619 0.6124 ( 6610 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2172 -10.2172 -8.1336 -8.1336 -8.0663 -8.0663 -8.0157 -8.0157 -7.4891 -7.4891 -7.3267 -7.3267 -7.3171 -7.3171 -7.2784 -7.2784 -6.9519 -6.9519 -6.8611 -6.8611 -4.7715 -4.7715 -4.7670 -4.7670 -4.7390 -4.7390 -4.7335 -4.7335 -4.6815 -4.6815 -4.6621 -4.6621 0.4440 0.4440 2.3748 2.3748 2.4324 2.4324 3.7411 3.7411 4.1603 4.1603 4.3257 4.3257 6.1160 6.1160 6.5230 6.5230 6.5831 6.5831 6.7329 6.7329 6.9827 6.9827 7.5585 7.5585 7.7955 7.7955 7.8905 7.8905 7.9577 7.9577 8.0913 8.0913 8.6982 8.6982 8.9294 8.9294 8.9642 8.9642 9.0909 9.0909 12.7287 12.7287 13.1074 13.1074 14.0607 14.0607 14.7834 14.7834 14.8999 14.8999 15.5504 15.5504 15.8849 15.8849 17.9528 17.9528 k = 0.4554 0.0773 0.6124 ( 6610 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2178 -10.2178 -8.1372 -8.1372 -8.0703 -8.0703 -8.0073 -8.0073 -7.4909 -7.4909 -7.3263 -7.3263 -7.3169 -7.3169 -7.2768 -7.2768 -6.9542 -6.9542 -6.8584 -6.8584 -4.7715 -4.7715 -4.7669 -4.7669 -4.7388 -4.7388 -4.7336 -4.7336 -4.6832 -4.6832 -4.6598 -4.6598 0.4399 0.4399 2.3717 2.3717 2.4413 2.4413 3.7330 3.7330 4.1644 4.1644 4.3318 4.3318 6.1086 6.1086 6.5043 6.5043 6.5577 6.5577 6.7455 6.7455 7.0137 7.0137 7.5523 7.5523 7.7816 7.7816 7.8749 7.8749 7.9697 7.9697 8.1342 8.1342 8.6669 8.6669 8.9254 8.9254 8.9748 8.9748 9.1000 9.1000 12.7069 12.7069 13.1229 13.1229 14.0573 14.0573 14.7888 14.7888 14.9031 14.9031 15.5277 15.5277 15.9240 15.9240 17.9421 17.9421 k = 0.4464 0.0928 0.6124 ( 6600 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2185 -10.2185 -8.1408 -8.1408 -8.0741 -8.0741 -7.9992 -7.9992 -7.4929 -7.4929 -7.3258 -7.3258 -7.3166 -7.3166 -7.2751 -7.2751 -6.9567 -6.9567 -6.8556 -6.8556 -4.7713 -4.7713 -4.7668 -4.7668 -4.7385 -4.7385 -4.7338 -4.7338 -4.6848 -4.6848 -4.6576 -4.6576 0.4356 0.4356 2.3694 2.3694 2.4499 2.4499 3.7243 3.7243 4.1692 4.1692 4.3383 4.3383 6.1007 6.1007 6.4866 6.4866 6.5320 6.5320 6.7577 6.7577 7.0445 7.0445 7.5476 7.5476 7.7670 7.7670 7.8597 7.8597 7.9838 7.9838 8.1765 8.1765 8.6361 8.6361 8.9100 8.9100 8.9958 8.9958 9.1075 9.1075 12.6846 12.6846 13.1379 13.1379 14.0536 14.0536 14.7949 14.7949 14.9067 14.9067 15.5054 15.5054 15.9637 15.9637 17.9304 17.9304 k = 0.4375 0.1083 0.6124 ( 6602 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2191 -10.2191 -8.1442 -8.1442 -8.0776 -8.0776 -7.9915 -7.9915 -7.4951 -7.4951 -7.3254 -7.3254 -7.3165 -7.3165 -7.2734 -7.2734 -6.9592 -6.9592 -6.8528 -6.8528 -4.7711 -4.7711 -4.7668 -4.7668 -4.7383 -4.7383 -4.7340 -4.7340 -4.6862 -4.6862 -4.6557 -4.6557 0.4312 0.4312 2.3678 2.3678 2.4580 2.4580 3.7154 3.7154 4.1743 4.1743 4.3448 4.3448 6.0926 6.0926 6.4703 6.4703 6.5073 6.5073 6.7688 6.7688 7.0741 7.0741 7.5448 7.5448 7.7521 7.7521 7.8450 7.8450 7.9994 7.9994 8.2168 8.2168 8.6062 8.6062 8.8936 8.8936 9.0167 9.0167 9.1137 9.1137 12.6627 12.6627 13.1519 13.1519 14.0499 14.0499 14.8012 14.8012 14.9105 14.9105 15.4844 15.4844 16.0026 16.0026 17.9182 17.9182 k = 0.4286 0.1237 0.6124 ( 6588 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2197 -10.2197 -8.1473 -8.1473 -8.0807 -8.0807 -7.9843 -7.9843 -7.4971 -7.4971 -7.3248 -7.3248 -7.3162 -7.3162 -7.2717 -7.2717 -6.9616 -6.9616 -6.8501 -6.8501 -4.7709 -4.7709 -4.7667 -4.7667 -4.7380 -4.7380 -4.7343 -4.7343 -4.6873 -4.6873 -4.6538 -4.6538 0.4270 0.4270 2.3667 2.3667 2.4654 2.4654 3.7068 3.7068 4.1794 4.1794 4.3512 4.3512 6.0849 6.0849 6.4557 6.4557 6.4844 6.4844 6.7784 6.7784 7.1016 7.1016 7.5438 7.5438 7.7374 7.7374 7.8313 7.8313 8.0159 8.0159 8.2543 8.2543 8.5776 8.5776 8.8779 8.8779 9.0358 9.0358 9.1186 9.1186 12.6422 12.6422 13.1643 13.1643 14.0463 14.0463 14.8072 14.8072 14.9147 14.9147 15.4651 15.4651 16.0391 16.0391 17.9061 17.9061 k = 0.4196 0.1392 0.6124 ( 6576 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2203 -10.2203 -8.1501 -8.1501 -8.0833 -8.0833 -7.9780 -7.9780 -7.4990 -7.4990 -7.3243 -7.3243 -7.3161 -7.3161 -7.2700 -7.2700 -6.9638 -6.9638 -6.8476 -6.8476 -4.7706 -4.7706 -4.7666 -4.7666 -4.7378 -4.7378 -4.7346 -4.7346 -4.6883 -4.6883 -4.6522 -4.6522 0.4231 0.4231 2.3660 2.3660 2.4720 2.4720 3.6989 3.6989 4.1840 4.1840 4.3571 4.3571 6.0778 6.0778 6.4428 6.4428 6.4642 6.4642 6.7865 6.7865 7.1263 7.1263 7.5447 7.5447 7.7232 7.7232 7.8187 7.8187 8.0324 8.0324 8.2879 8.2879 8.5510 8.5510 8.8635 8.8635 9.0525 9.0525 9.1225 9.1225 12.6237 12.6237 13.1749 13.1749 14.0430 14.0430 14.8127 14.8127 14.9191 14.9191 15.4479 15.4479 16.0721 16.0721 17.8948 17.8948 k = 0.4107 0.1546 0.6124 ( 6581 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2208 -10.2208 -8.1525 -8.1525 -8.0856 -8.0856 -7.9727 -7.9727 -7.5008 -7.5008 -7.3239 -7.3239 -7.3160 -7.3160 -7.2687 -7.2687 -6.9657 -6.9657 -6.8455 -6.8455 -4.7704 -4.7704 -4.7666 -4.7666 -4.7375 -4.7375 -4.7349 -4.7349 -4.6891 -4.6891 -4.6509 -4.6509 0.4197 0.4197 2.3655 2.3655 2.4776 2.4776 3.6920 3.6920 4.1881 4.1881 4.3624 4.3624 6.0716 6.0716 6.4320 6.4320 6.4471 6.4471 6.7929 6.7929 7.1476 7.1476 7.5470 7.5470 7.7100 7.7100 7.8077 7.8077 8.0483 8.0483 8.3169 8.3169 8.5271 8.5271 8.8508 8.8508 9.0665 9.0665 9.1255 9.1255 12.6079 12.6079 13.1836 13.1836 14.0401 14.0401 14.8173 14.8173 14.9236 14.9236 15.4332 15.4332 16.1006 16.1006 17.8847 17.8847 k = 0.4018 0.1701 0.6124 ( 6578 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2212 -10.2212 -8.1543 -8.1543 -8.0873 -8.0873 -7.9684 -7.9684 -7.5022 -7.5022 -7.3236 -7.3236 -7.3159 -7.3159 -7.2676 -7.2676 -6.9673 -6.9673 -6.8438 -6.8438 -4.7702 -4.7702 -4.7666 -4.7666 -4.7373 -4.7373 -4.7353 -4.7353 -4.6897 -4.6897 -4.6499 -4.6499 0.4169 0.4169 2.3653 2.3653 2.4821 2.4821 3.6864 3.6864 4.1914 4.1914 4.3668 4.3668 6.0665 6.0665 6.4233 6.4233 6.4336 6.4336 6.7978 6.7978 7.1648 7.1648 7.5501 7.5501 7.6984 7.6984 7.7986 7.7986 8.0624 8.0624 8.3406 8.3406 8.5068 8.5068 8.8403 8.8403 9.0777 9.0777 9.1277 9.1277 12.5950 12.5950 13.1903 13.1903 14.0377 14.0377 14.8209 14.8209 14.9277 14.9277 15.4213 15.4213 16.1237 16.1237 17.8764 17.8764 k = 0.3929 0.1856 0.6124 ( 6571 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2215 -10.2215 -8.1557 -8.1557 -8.0886 -8.0886 -7.9652 -7.9652 -7.5033 -7.5033 -7.3233 -7.3233 -7.3158 -7.3158 -7.2667 -7.2667 -6.9684 -6.9684 -6.8425 -6.8425 -4.7700 -4.7700 -4.7666 -4.7666 -4.7370 -4.7370 -4.7356 -4.7356 -4.6901 -4.6901 -4.6491 -4.6491 0.4148 0.4148 2.3652 2.3652 2.4854 2.4854 3.6822 3.6822 4.1938 4.1938 4.3701 4.3701 6.0628 6.0628 6.4167 6.4167 6.4241 6.4241 6.8013 6.8013 7.1776 7.1776 7.5534 7.5534 7.6892 7.6892 7.7918 7.7918 8.0737 8.0737 8.3581 8.3581 8.4912 8.4912 8.8323 8.8323 9.0858 9.0858 9.1293 9.1293 12.5856 12.5856 13.1951 13.1951 14.0359 14.0359 14.8234 14.8234 14.9310 14.9310 15.4125 15.4125 16.1407 16.1407 17.8702 17.8702 k = 0.3839 0.2010 0.6124 ( 6573 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2216 -10.2216 -8.1565 -8.1565 -8.0893 -8.0893 -7.9633 -7.9633 -7.5040 -7.5040 -7.3231 -7.3231 -7.3158 -7.3158 -7.2662 -7.2662 -6.9692 -6.9692 -6.8418 -6.8418 -4.7699 -4.7699 -4.7666 -4.7666 -4.7368 -4.7368 -4.7360 -4.7360 -4.6903 -4.6903 -4.6486 -4.6486 0.4136 0.4136 2.3651 2.3651 2.4874 2.4874 3.6796 3.6796 4.1953 4.1953 4.3721 4.3721 6.0605 6.0605 6.4124 6.4124 6.4185 6.4185 6.8033 6.8033 7.1854 7.1854 7.5558 7.5558 7.6831 7.6831 7.7875 7.7875 8.0810 8.0810 8.3689 8.3689 8.4812 8.4812 8.8273 8.8273 9.0906 9.0906 9.1301 9.1301 12.5799 12.5799 13.1979 13.1979 14.0348 14.0348 14.8249 14.8249 14.9332 14.9332 15.4071 15.4071 16.1512 16.1512 17.8664 17.8664 k = 0.3750 0.2165 0.6124 ( 6587 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2217 -10.2217 -8.1568 -8.1568 -8.0896 -8.0896 -7.9627 -7.9627 -7.5042 -7.5042 -7.3231 -7.3231 -7.3159 -7.3159 -7.2661 -7.2661 -6.9694 -6.9694 -6.8415 -6.8415 -4.7700 -4.7700 -4.7667 -4.7667 -4.7366 -4.7366 -4.7362 -4.7362 -4.6904 -4.6904 -4.6485 -4.6485 0.4131 0.4131 2.3651 2.3651 2.4881 2.4881 3.6788 3.6788 4.1958 4.1958 4.3728 4.3728 6.0597 6.0597 6.4109 6.4109 6.4167 6.4167 6.8039 6.8039 7.1880 7.1880 7.5567 7.5567 7.6810 7.6810 7.7861 7.7861 8.0835 8.0835 8.3725 8.3725 8.4778 8.4778 8.8256 8.8256 9.0923 9.0923 9.1304 9.1304 12.5779 12.5779 13.1989 13.1989 14.0344 14.0344 14.8254 14.8254 14.9339 14.9339 15.4053 15.4053 16.1547 16.1547 17.8651 17.8651 k = 0.3750 0.2165 0.6124 ( 6587 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2217 -10.2217 -8.1568 -8.1568 -8.0896 -8.0896 -7.9627 -7.9627 -7.5042 -7.5042 -7.3231 -7.3231 -7.3159 -7.3159 -7.2661 -7.2661 -6.9694 -6.9694 -6.8415 -6.8415 -4.7700 -4.7700 -4.7667 -4.7667 -4.7366 -4.7366 -4.7362 -4.7362 -4.6904 -4.6904 -4.6485 -4.6485 0.4131 0.4131 2.3651 2.3651 2.4881 2.4881 3.6788 3.6788 4.1958 4.1958 4.3728 4.3728 6.0597 6.0597 6.4109 6.4109 6.4167 6.4167 6.8039 6.8039 7.1880 7.1880 7.5567 7.5567 7.6810 7.6810 7.7861 7.7861 8.0835 8.0835 8.3725 8.3725 8.4778 8.4778 8.8256 8.8256 9.0923 9.0923 9.1304 9.1304 12.5779 12.5779 13.1989 13.1989 14.0344 14.0344 14.8254 14.8254 14.9339 14.9339 15.4053 15.4053 16.1547 16.1547 17.8651 17.8651 k = 0.3661 0.2114 0.5978 ( 6583 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2229 -10.2229 -8.1650 -8.1650 -8.0899 -8.0899 -7.9609 -7.9609 -7.4963 -7.4963 -7.3240 -7.3240 -7.3147 -7.3147 -7.2658 -7.2658 -6.9666 -6.9666 -6.8432 -6.8432 -4.7687 -4.7687 -4.7655 -4.7655 -4.7358 -4.7358 -4.7353 -4.7353 -4.6885 -4.6885 -4.6516 -4.6516 0.4046 0.4046 2.3835 2.3835 2.4853 2.4853 3.6532 3.6532 4.1934 4.1934 4.3790 4.3790 6.0852 6.0852 6.3638 6.3638 6.4036 6.4036 6.8299 6.8299 7.2247 7.2247 7.5585 7.5585 7.6224 7.6224 7.7878 7.7878 8.1013 8.1013 8.3814 8.3814 8.5150 8.5150 8.8457 8.8457 9.0662 9.0662 9.0904 9.0904 12.6334 12.6334 13.1951 13.1951 14.0260 14.0260 14.7996 14.7996 14.9302 14.9302 15.4423 15.4423 16.1413 16.1413 17.8275 17.8275 k = 0.3571 0.2062 0.5832 ( 6577 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2244 -10.2244 -8.1742 -8.1742 -8.0889 -8.0889 -7.9592 -7.9592 -7.4890 -7.4890 -7.3252 -7.3252 -7.3131 -7.3131 -7.2647 -7.2647 -6.9641 -6.9641 -6.8443 -6.8443 -4.7681 -4.7681 -4.7636 -4.7636 -4.7353 -4.7353 -4.7337 -4.7337 -4.6864 -4.6864 -4.6547 -4.6547 0.3940 0.3940 2.4033 2.4033 2.4836 2.4836 3.6292 3.6292 4.1874 4.1874 4.3878 4.3878 6.1059 6.1059 6.3155 6.3155 6.3923 6.3923 6.8572 6.8572 7.2605 7.2605 7.5470 7.5470 7.5798 7.5798 7.7913 7.7913 8.1220 8.1220 8.3902 8.3902 8.5517 8.5517 8.8643 8.8643 9.0401 9.0401 9.0461 9.0461 12.6884 12.6884 13.1918 13.1918 14.0155 14.0155 14.7752 14.7752 14.9312 14.9312 15.4814 15.4814 16.1305 16.1305 17.7893 17.7893 k = 0.3482 0.2010 0.5686 ( 6581 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2263 -10.2263 -8.1839 -8.1839 -8.0871 -8.0871 -7.9578 -7.9578 -7.4823 -7.4823 -7.3266 -7.3266 -7.3111 -7.3111 -7.2629 -7.2629 -6.9618 -6.9618 -6.8448 -6.8448 -4.7678 -4.7678 -4.7615 -4.7615 -4.7348 -4.7348 -4.7319 -4.7319 -4.6842 -4.6842 -4.6579 -4.6579 0.3814 0.3814 2.4243 2.4243 2.4831 2.4831 3.6075 3.6075 4.1781 4.1781 4.3982 4.3982 6.1189 6.1189 6.2699 6.2699 6.3819 6.3819 6.8853 6.8853 7.2949 7.2949 7.4993 7.4993 7.5778 7.5778 7.7960 7.7960 8.1456 8.1456 8.3988 8.3988 8.5877 8.5877 8.8811 8.8811 8.9972 8.9972 9.0144 9.0144 12.7424 12.7424 13.1897 13.1897 14.0028 14.0028 14.7534 14.7534 14.9371 14.9371 15.5224 15.5224 16.1220 16.1220 17.7510 17.7510 k = 0.3393 0.1959 0.5541 ( 6585 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2286 -10.2286 -8.1935 -8.1935 -8.0849 -8.0849 -7.9567 -7.9567 -7.4764 -7.4764 -7.3283 -7.3283 -7.3087 -7.3087 -7.2602 -7.2602 -6.9598 -6.9598 -6.8447 -6.8447 -4.7676 -4.7676 -4.7593 -4.7593 -4.7341 -4.7341 -4.7299 -4.7299 -4.6819 -4.6819 -4.6609 -4.6609 0.3665 0.3665 2.4462 2.4462 2.4839 2.4839 3.5885 3.5885 4.1660 4.1660 4.4090 4.4090 6.1184 6.1184 6.2322 6.2322 6.3729 6.3729 6.9141 6.9141 7.3275 7.3275 7.4485 7.4485 7.5844 7.5844 7.8018 7.8018 8.1723 8.1723 8.4070 8.4070 8.6230 8.6230 8.8954 8.8954 8.9436 8.9436 8.9892 8.9892 12.7948 12.7948 13.1895 13.1895 13.9878 13.9878 14.7353 14.7353 14.9476 14.9476 15.5653 15.5653 16.1157 16.1157 17.7132 17.7132 k = 0.3304 0.1907 0.5395 ( 6605 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2314 -10.2314 -8.2029 -8.2029 -8.0826 -8.0826 -7.9559 -7.9559 -7.4714 -7.4714 -7.3302 -7.3302 -7.3059 -7.3059 -7.2567 -7.2567 -6.9579 -6.9579 -6.8440 -6.8440 -4.7674 -4.7674 -4.7572 -4.7572 -4.7335 -4.7335 -4.7278 -4.7278 -4.6796 -4.6796 -4.6638 -4.6638 0.3493 0.3493 2.4689 2.4689 2.4862 2.4862 3.5728 3.5728 4.1518 4.1518 4.4193 4.4193 6.0969 6.0969 6.2092 6.2092 6.3659 6.3659 6.9433 6.9433 7.3578 7.3578 7.4024 7.4024 7.5932 7.5932 7.8086 7.8086 8.2017 8.2017 8.4146 8.4146 8.6575 8.6575 8.8847 8.8847 8.9074 8.9074 8.9650 8.9650 12.8452 12.8452 13.1920 13.1920 13.9704 13.9704 14.7219 14.7219 14.9628 14.9628 15.6100 15.6100 16.1114 16.1114 17.6764 17.6764 k = 0.3214 0.1856 0.5249 ( 6589 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2347 -10.2347 -8.2118 -8.2118 -8.0802 -8.0802 -7.9556 -7.9556 -7.4671 -7.4671 -7.3321 -7.3321 -7.3023 -7.3023 -7.2521 -7.2521 -6.9562 -6.9562 -6.8426 -6.8426 -4.7671 -4.7671 -4.7548 -4.7548 -4.7328 -4.7328 -4.7252 -4.7252 -4.6769 -4.6769 -4.6667 -4.6667 0.3299 0.3299 2.4902 2.4902 2.4921 2.4921 3.5607 3.5607 4.1358 4.1358 4.4280 4.4280 6.0574 6.0574 6.1973 6.1973 6.3614 6.3614 6.9726 6.9726 7.3620 7.3620 7.3866 7.3866 7.6036 7.6036 7.8163 7.8163 8.2340 8.2340 8.4215 8.4215 8.6913 8.6913 8.8218 8.8218 8.9153 8.9153 8.9421 8.9421 12.8932 12.8932 13.1981 13.1981 13.9506 13.9506 14.7139 14.7139 14.9826 14.9826 15.6562 15.6562 16.1091 16.1091 17.6410 17.6410 k = 0.3125 0.1804 0.5103 ( 6585 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2385 -10.2385 -8.2200 -8.2200 -8.0780 -8.0780 -7.9558 -7.9558 -7.4637 -7.4637 -7.3342 -7.3342 -7.2983 -7.2983 -7.2466 -7.2466 -6.9545 -6.9545 -6.8407 -6.8407 -4.7668 -4.7668 -4.7524 -4.7524 -4.7320 -4.7320 -4.7224 -4.7224 -4.6743 -4.6743 -4.6693 -4.6693 0.3081 0.3081 2.4959 2.4959 2.5155 2.5155 3.5525 3.5525 4.1184 4.1184 4.4344 4.4344 6.0094 6.0094 6.1864 6.1864 6.3600 6.3600 7.0018 7.0018 7.3300 7.3300 7.4122 7.4122 7.6153 7.6153 7.8247 7.8247 8.2685 8.2685 8.4273 8.4273 8.7242 8.7242 8.7540 8.7540 8.9184 8.9184 8.9220 8.9220 12.9385 12.9385 13.2087 13.2087 13.9284 13.9284 14.7120 14.7120 15.0068 15.0068 15.7040 15.7040 16.1084 16.1084 17.6074 17.6074 k = 0.3036 0.1753 0.4957 ( 6585 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2428 -10.2428 -8.2274 -8.2274 -8.0761 -8.0761 -7.9565 -7.9565 -7.4610 -7.4610 -7.3365 -7.3365 -7.2938 -7.2938 -7.2403 -7.2403 -6.9527 -6.9527 -6.8383 -6.8383 -4.7664 -4.7664 -4.7499 -4.7499 -4.7312 -4.7312 -4.7195 -4.7195 -4.6722 -4.6722 -4.6713 -4.6713 0.2840 0.2840 2.5035 2.5035 2.5390 2.5390 3.5486 3.5486 4.1000 4.1000 4.4376 4.4376 5.9579 5.9579 6.1712 6.1712 6.3623 6.3623 7.0306 7.0306 7.3061 7.3061 7.4355 7.4355 7.6282 7.6282 7.8337 7.8337 8.3045 8.3045 8.4317 8.4317 8.6820 8.6820 8.7563 8.7563 8.9012 8.9012 8.9201 8.9201 12.9808 12.9808 13.2243 13.2243 13.9036 13.9036 14.7166 14.7166 15.0353 15.0353 15.7531 15.7531 16.1093 16.1093 17.5758 17.5758 k = 0.2946 0.1701 0.4811 ( 6569 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2476 -10.2476 -8.2339 -8.2339 -8.0744 -8.0744 -7.9578 -7.9578 -7.4590 -7.4590 -7.3389 -7.3389 -7.2886 -7.2886 -7.2332 -7.2332 -6.9508 -6.9508 -6.8354 -6.8354 -4.7659 -4.7659 -4.7471 -4.7471 -4.7303 -4.7303 -4.7163 -4.7163 -4.6743 -4.6743 -4.6687 -4.6687 0.2576 0.2576 2.5131 2.5131 2.5622 2.5622 3.5490 3.5490 4.0808 4.0808 4.4372 4.4372 5.9049 5.9049 6.1497 6.1497 6.3687 6.3687 7.0586 7.0586 7.2912 7.2912 7.4565 7.4565 7.6420 7.6420 7.8433 7.8433 8.3403 8.3403 8.4345 8.4345 8.6076 8.6076 8.7874 8.7874 8.8845 8.8845 8.9158 8.9158 13.0203 13.0203 13.2455 13.2455 13.8765 13.8765 14.7279 14.7279 15.0680 15.0680 15.8033 15.8033 16.1116 16.1116 17.5465 17.5465 k = 0.2857 0.1650 0.4666 ( 6579 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2530 -10.2530 -8.2395 -8.2395 -8.0732 -8.0732 -7.9598 -7.9598 -7.4576 -7.4576 -7.3415 -7.3415 -7.2830 -7.2830 -7.2255 -7.2255 -6.9487 -6.9487 -6.8322 -6.8322 -4.7654 -4.7654 -4.7443 -4.7443 -4.7294 -4.7294 -4.7131 -4.7131 -4.6766 -4.6766 -4.6659 -4.6659 0.2291 0.2291 2.5249 2.5249 2.5851 2.5851 3.5538 3.5538 4.0609 4.0609 4.4329 4.4329 5.8514 5.8514 6.1213 6.1213 6.3798 6.3798 7.0856 7.0856 7.2850 7.2850 7.4753 7.4753 7.6565 7.6565 7.8535 7.8535 8.3703 8.3703 8.4352 8.4352 8.5363 8.5363 8.8176 8.8176 8.8704 8.8704 8.9067 8.9067 13.0574 13.0574 13.2722 13.2722 13.8473 13.8473 14.7459 14.7459 15.1048 15.1048 15.8545 15.8545 16.1154 16.1154 17.5194 17.5194 k = 0.2768 0.1598 0.4520 ( 6575 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2589 -10.2589 -8.2442 -8.2442 -8.0724 -8.0724 -7.9624 -7.9624 -7.4566 -7.4566 -7.3442 -7.3442 -7.2769 -7.2769 -7.2171 -7.2171 -6.9463 -6.9463 -6.8287 -6.8287 -4.7647 -4.7647 -4.7415 -4.7415 -4.7284 -4.7284 -4.7097 -4.7097 -4.6786 -4.6786 -4.6631 -4.6631 0.1985 0.1985 2.5388 2.5388 2.6075 2.6075 3.5627 3.5627 4.0407 4.0407 4.4243 4.4243 5.7978 5.7978 6.0864 6.0864 6.3957 6.3957 7.1115 7.1115 7.2872 7.2872 7.4917 7.4917 7.6715 7.6715 7.8641 7.8641 8.3687 8.3687 8.4338 8.4338 8.4935 8.4935 8.8467 8.8467 8.8596 8.8596 8.8930 8.8930 13.0925 13.0925 13.3040 13.3040 13.8165 13.8165 14.7705 14.7705 15.1457 15.1457 15.9064 15.9064 16.1207 16.1207 17.4947 17.4947 k = 0.2679 0.1546 0.4374 ( 6571 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2653 -10.2653 -8.2478 -8.2478 -8.0720 -8.0720 -7.9656 -7.9656 -7.4559 -7.4559 -7.3471 -7.3471 -7.2702 -7.2702 -7.2083 -7.2083 -6.9434 -6.9434 -6.8250 -6.8250 -4.7639 -4.7639 -4.7384 -4.7384 -4.7274 -4.7274 -4.7061 -4.7061 -4.6804 -4.6804 -4.6602 -4.6602 0.1660 0.1660 2.5551 2.5551 2.6294 2.6294 3.5755 3.5755 4.0204 4.0204 4.4115 4.4115 5.7444 5.7444 6.0455 6.0455 6.4167 6.4167 7.1363 7.1363 7.2968 7.2968 7.5057 7.5057 7.6868 7.6868 7.8750 7.8750 8.3080 8.3080 8.4307 8.4307 8.5065 8.5065 8.8512 8.8512 8.8747 8.8747 8.8756 8.8756 13.1260 13.1260 13.3403 13.3403 13.7850 13.7850 14.8014 14.8014 15.1906 15.1906 15.9584 15.9584 16.1277 16.1277 17.4722 17.4722 k = 0.2589 0.1495 0.4228 ( 6565 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2722 -10.2722 -8.2503 -8.2503 -8.0721 -8.0721 -7.9695 -7.9695 -7.4554 -7.4554 -7.3502 -7.3502 -7.2630 -7.2630 -7.1992 -7.1992 -6.9401 -6.9401 -6.8211 -6.8211 -4.7629 -4.7629 -4.7350 -4.7350 -4.7264 -4.7264 -4.7024 -4.7024 -4.6821 -4.6821 -4.6573 -4.6573 0.1317 0.1317 2.5739 2.5739 2.6510 2.6510 3.5916 3.5916 4.0003 4.0003 4.3944 4.3944 5.6913 5.6913 5.9999 5.9999 6.4426 6.4426 7.1601 7.1601 7.3125 7.3125 7.5169 7.5169 7.7020 7.7020 7.8863 7.8863 8.2233 8.2233 8.4249 8.4249 8.5422 8.5422 8.8443 8.8443 8.8542 8.8542 8.9029 8.9029 13.1576 13.1576 13.3803 13.3803 13.7544 13.7544 14.8381 14.8381 15.2393 15.2393 16.0096 16.0096 16.1374 16.1374 17.4518 17.4518 k = 0.2500 0.1443 0.4082 ( 6561 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2796 -10.2796 -8.2519 -8.2519 -8.0727 -8.0727 -7.9740 -7.9740 -7.4550 -7.4550 -7.3533 -7.3533 -7.2554 -7.2554 -7.1898 -7.1898 -6.9363 -6.9363 -6.8171 -6.8171 -4.7617 -4.7617 -4.7317 -4.7317 -4.7251 -4.7251 -4.6987 -4.6987 -4.6835 -4.6835 -4.6544 -4.6544 0.0957 0.0957 2.5951 2.5951 2.6723 2.6723 3.6104 3.6104 3.9809 3.9809 4.3734 4.3734 5.6388 5.6388 5.9504 5.9504 6.4732 6.4732 7.1833 7.1833 7.3329 7.3329 7.5244 7.5244 7.7169 7.7169 7.8977 7.8977 8.1326 8.1326 8.4166 8.4166 8.5831 8.5831 8.8215 8.8215 8.8486 8.8486 8.9293 8.9293 13.1859 13.1859 13.4235 13.4235 13.7270 13.7270 14.8802 14.8802 15.2918 15.2918 16.0576 16.0576 16.1518 16.1518 17.4333 17.4333 k = 0.2411 0.1392 0.3937 ( 6565 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2875 -10.2875 -8.2525 -8.2525 -8.0738 -8.0738 -7.9791 -7.9791 -7.4547 -7.4547 -7.3568 -7.3568 -7.2473 -7.2473 -7.1804 -7.1804 -6.9318 -6.9318 -6.8131 -6.8131 -4.7605 -4.7605 -4.7281 -4.7281 -4.7239 -4.7239 -4.6949 -4.6949 -4.6849 -4.6849 -4.6515 -4.6515 0.0584 0.0584 2.6188 2.6188 2.6934 2.6934 3.6308 3.6308 3.9626 3.9626 4.3487 4.3487 5.5869 5.5869 5.8981 5.8981 6.5084 6.5084 7.2061 7.2061 7.3563 7.3563 7.5265 7.5265 7.7308 7.7308 7.9092 7.9092 8.0426 8.0426 8.4063 8.4063 8.6255 8.6255 8.7902 8.7902 8.8508 8.8508 8.9547 8.9547 13.2081 13.2081 13.4694 13.4694 13.7062 13.7062 14.9270 14.9270 15.3482 15.3482 16.0968 16.0968 16.1764 16.1764 17.4165 17.4165 k = 0.2321 0.1340 0.3791 ( 6565 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2957 -10.2957 -8.2521 -8.2521 -8.0754 -8.0754 -7.9847 -7.9847 -7.4544 -7.4544 -7.3604 -7.3604 -7.2388 -7.2388 -7.1709 -7.1709 -6.9268 -6.9268 -6.8091 -6.8091 -4.7591 -4.7591 -4.7250 -4.7250 -4.7220 -4.7220 -4.6911 -4.6911 -4.6860 -4.6860 -4.6487 -4.6487 0.0197 0.0197 2.6452 2.6452 2.7147 2.7147 3.6516 3.6516 3.9462 3.9462 4.3207 4.3207 5.5359 5.5359 5.8439 5.8439 6.5476 6.5476 7.2286 7.2286 7.3809 7.3809 7.5204 7.5204 7.7427 7.7427 7.9194 7.9194 7.9609 7.9609 8.3940 8.3940 8.6677 8.6677 8.7554 8.7554 8.8565 8.8565 8.9792 8.9792 13.2203 13.2203 13.5177 13.5177 13.6964 13.6964 14.9781 14.9781 15.4082 15.4082 16.1227 16.1227 16.2156 16.2156 17.4008 17.4008 k = 0.2232 0.1289 0.3645 ( 6555 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3044 -10.3044 -8.2508 -8.2508 -8.0774 -8.0774 -7.9909 -7.9909 -7.4540 -7.4540 -7.3639 -7.3639 -7.2299 -7.2299 -7.1616 -7.1616 -6.9212 -6.9212 -6.8050 -6.8050 -4.7574 -4.7574 -4.7229 -4.7229 -4.7186 -4.7186 -4.6877 -4.6877 -4.6865 -4.6865 -4.6458 -4.6458 -0.0199 -0.0199 2.6743 2.6743 2.7364 2.7364 3.6712 3.6712 3.9328 3.9328 4.2898 4.2898 5.4857 5.4857 5.7886 5.7886 6.5905 6.5905 7.2507 7.2507 7.4020 7.4020 7.5032 7.5032 7.7502 7.7502 7.8892 7.8892 7.9362 7.9362 8.3803 8.3803 8.7010 8.7010 8.7258 8.7258 8.8652 8.8652 9.0027 9.0027 13.2185 13.2185 13.5681 13.5681 13.7018 13.7018 15.0328 15.0328 15.4719 15.4719 16.1397 16.1397 16.2648 16.2648 17.3861 17.3861 k = 0.2143 0.1237 0.3499 ( 6569 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3133 -10.3133 -8.2486 -8.2486 -8.0799 -8.0799 -7.9975 -7.9975 -7.4536 -7.4536 -7.3678 -7.3678 -7.2207 -7.2207 -7.1525 -7.1525 -6.9150 -6.9150 -6.8011 -6.8011 -4.7557 -4.7557 -4.7216 -4.7216 -4.7146 -4.7146 -4.6879 -4.6879 -4.6833 -4.6833 -4.6431 -4.6431 -0.0604 -0.0604 2.7062 2.7062 2.7586 2.7586 3.6874 3.6874 3.9238 3.9238 4.2567 4.2567 5.4364 5.4364 5.7330 5.7330 6.6365 6.6365 7.2723 7.2723 7.4003 7.4003 7.4865 7.4865 7.7497 7.7497 7.8513 7.8513 7.9470 7.9470 8.3654 8.3654 8.6712 8.6712 8.7558 8.7558 8.8763 8.8763 9.0252 9.0252 13.2012 13.2012 13.6207 13.6207 13.7239 13.7239 15.0907 15.0907 15.5391 15.5391 16.1534 16.1534 16.3183 16.3183 17.3719 17.3719 k = 0.2054 0.1186 0.3353 ( 6569 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3225 -10.3225 -8.2457 -8.2457 -8.0828 -8.0828 -8.0045 -8.0045 -7.4531 -7.4531 -7.3717 -7.3717 -7.2113 -7.2113 -7.1436 -7.1436 -6.9081 -6.9081 -6.7972 -6.7972 -4.7536 -4.7536 -4.7203 -4.7203 -4.7103 -4.7103 -4.6885 -4.6885 -4.6796 -4.6796 -4.6403 -4.6403 -0.1014 -0.1014 2.7408 2.7408 2.7816 2.7816 3.6982 3.6982 3.9208 3.9208 4.2219 4.2219 5.3882 5.3882 5.6775 5.6775 6.6852 6.6852 7.2914 7.2914 7.3475 7.3475 7.4980 7.4980 7.7435 7.7435 7.8407 7.8407 7.9588 7.9588 8.3497 8.3497 8.6284 8.6284 8.7957 8.7957 8.8897 8.8897 9.0467 9.0467 13.1697 13.1697 13.6754 13.6754 13.7610 13.7610 15.1512 15.1512 15.6098 15.6098 16.1661 16.1661 16.3736 16.3736 17.3577 17.3577 k = 0.1964 0.1134 0.3208 ( 6569 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3319 -10.3319 -8.2420 -8.2420 -8.0860 -8.0860 -8.0117 -8.0117 -7.4524 -7.4524 -7.3756 -7.3756 -7.2015 -7.2015 -7.1350 -7.1350 -6.9008 -6.9008 -6.7935 -6.7935 -4.7515 -4.7515 -4.7190 -4.7190 -4.7058 -4.7058 -4.6888 -4.6888 -4.6759 -4.6759 -4.6376 -4.6376 -0.1429 -0.1429 2.7783 2.7783 2.8055 2.8055 3.7020 3.7020 3.9244 3.9244 4.1860 4.1860 5.3410 5.3410 5.6227 5.6227 6.7359 6.7359 7.2505 7.2505 7.3200 7.3200 7.5239 7.5239 7.7397 7.7397 7.8449 7.8449 7.9708 7.9708 8.3335 8.3335 8.5837 8.5837 8.8349 8.8349 8.9052 8.9052 9.0673 9.0673 13.1271 13.1271 13.7322 13.7322 13.8096 13.8096 15.2139 15.2139 15.6837 15.6837 16.1790 16.1790 16.4297 16.4297 17.3430 17.3430 k = 0.1875 0.1083 0.3062 ( 6575 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3415 -10.3415 -8.2378 -8.2378 -8.0896 -8.0896 -8.0192 -8.0192 -7.4517 -7.4517 -7.3796 -7.3796 -7.1917 -7.1917 -7.1268 -7.1268 -6.8929 -6.8929 -6.7898 -6.7898 -4.7491 -4.7491 -4.7177 -4.7177 -4.7014 -4.7014 -4.6889 -4.6889 -4.6723 -4.6723 -4.6349 -4.6349 -0.1844 -0.1844 2.8185 2.8185 2.8305 2.8305 3.6989 3.6989 3.9339 3.9339 4.1497 4.1497 5.2951 5.2951 5.5690 5.5690 6.7881 6.7881 7.1464 7.1464 7.3384 7.3384 7.5533 7.5533 7.7411 7.7411 7.8545 7.8545 7.9827 7.9827 8.3170 8.3170 8.5380 8.5380 8.8728 8.8728 8.9225 8.9225 9.0869 9.0869 13.0764 13.0764 13.7909 13.7909 13.8665 13.8665 15.2785 15.2785 15.7606 15.7606 16.1924 16.1924 16.4858 16.4858 17.3275 17.3275 k = 0.1786 0.1031 0.2916 ( 6573 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3511 -10.3511 -8.2330 -8.2330 -8.0935 -8.0935 -8.0267 -8.0267 -7.4508 -7.4508 -7.3837 -7.3837 -7.1817 -7.1817 -7.1190 -7.1190 -6.8846 -6.8846 -6.7864 -6.7864 -4.7466 -4.7466 -4.7164 -4.7164 -4.6973 -4.6973 -4.6885 -4.6885 -4.6686 -4.6686 -4.6323 -4.6323 -0.2259 -0.2259 2.8564 2.8564 2.8621 2.8621 3.6901 3.6901 3.9467 3.9467 4.1142 4.1142 5.2503 5.2503 5.5167 5.5167 6.8412 6.8412 7.0316 7.0316 7.3578 7.3578 7.5833 7.5833 7.7468 7.7468 7.8661 7.8661 7.9944 7.9944 8.3005 8.3005 8.4922 8.4922 8.9088 8.9088 8.9417 8.9417 9.1055 9.1055 13.0203 13.0203 13.8507 13.8507 13.9292 13.9292 15.3446 15.3446 15.8400 15.8400 16.2068 16.2068 16.5416 16.5416 17.3105 17.3105 k = 0.1696 0.0979 0.2770 ( 6553 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3608 -10.3608 -8.2277 -8.2277 -8.0976 -8.0976 -8.0343 -8.0343 -7.4499 -7.4499 -7.3877 -7.3877 -7.1714 -7.1714 -7.1114 -7.1114 -6.8759 -6.8759 -6.7830 -6.7830 -4.7441 -4.7441 -4.7151 -4.7151 -4.6940 -4.6940 -4.6869 -4.6869 -4.6649 -4.6649 -4.6295 -4.6295 -0.2671 -0.2671 2.8841 2.8841 2.9081 2.9081 3.6775 3.6775 3.9592 3.9592 4.0815 4.0815 5.2069 5.2069 5.4662 5.4662 6.8871 6.8871 6.9187 6.9187 7.3767 7.3767 7.6129 7.6129 7.7557 7.7557 7.8782 7.8782 8.0060 8.0060 8.2841 8.2841 8.4468 8.4468 8.9422 8.9422 8.9634 8.9634 9.1232 9.1232 12.9604 12.9604 13.9111 13.9111 13.9958 13.9958 15.4119 15.4119 15.9213 15.9213 16.2227 16.2227 16.5967 16.5967 17.2918 17.2918 k = 0.1607 0.0928 0.2624 ( 6555 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3704 -10.3704 -8.2221 -8.2221 -8.1019 -8.1019 -8.0419 -8.0419 -7.4490 -7.4490 -7.3918 -7.3918 -7.1612 -7.1612 -7.1044 -7.1044 -6.8670 -6.8670 -6.7799 -6.7799 -4.7415 -4.7415 -4.7137 -4.7137 -4.6925 -4.6925 -4.6836 -4.6836 -4.6615 -4.6615 -4.6268 -4.6268 -0.3078 -0.3078 2.9128 2.9128 2.9571 2.9571 3.6623 3.6623 3.9650 3.9650 4.0564 4.0564 5.1649 5.1649 5.4177 5.4177 6.7836 6.7836 6.9520 6.9520 7.3948 7.3948 7.6410 7.6410 7.7671 7.7671 7.8902 7.8902 8.0174 8.0174 8.2680 8.2680 8.4025 8.4025 8.9713 8.9713 8.9887 8.9887 9.1399 9.1399 12.8981 12.8981 13.9715 13.9715 14.0651 14.0651 15.4801 15.4801 16.0034 16.0034 16.2410 16.2410 16.6506 16.6506 17.2708 17.2708 k = 0.1518 0.0876 0.2479 ( 6549 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3799 -10.3799 -8.2162 -8.2162 -8.1065 -8.1065 -8.0492 -8.0492 -7.4480 -7.4480 -7.3958 -7.3958 -7.1510 -7.1510 -7.0978 -7.0978 -6.8579 -6.8579 -6.7769 -6.7769 -4.7388 -4.7388 -4.7122 -4.7122 -4.6918 -4.6918 -4.6793 -4.6793 -4.6583 -4.6583 -4.6242 -4.6242 -0.3477 -0.3477 2.9428 2.9428 3.0090 3.0090 3.6458 3.6458 3.9557 3.9557 4.0461 4.0461 5.1242 5.1242 5.3714 5.3714 6.6574 6.6574 7.0054 7.0054 7.4122 7.4122 7.6668 7.6668 7.7811 7.7811 7.9018 7.9018 8.0284 8.0284 8.2524 8.2524 8.3599 8.3599 8.9963 8.9963 9.0172 9.0172 9.1556 9.1556 12.8345 12.8345 14.0316 14.0316 14.1357 14.1357 15.5490 15.5490 16.0838 16.0838 16.2634 16.2634 16.7030 16.7030 17.2473 17.2473 k = 0.1429 0.0825 0.2333 ( 6539 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3892 -10.3892 -8.2102 -8.2102 -8.1111 -8.1111 -8.0564 -8.0564 -7.4470 -7.4470 -7.3997 -7.3997 -7.1409 -7.1409 -7.0916 -7.0916 -6.8486 -6.8486 -6.7742 -6.7742 -4.7361 -4.7361 -4.7107 -4.7107 -4.6914 -4.6914 -4.6747 -4.6747 -4.6551 -4.6551 -4.6216 -4.6216 -0.3866 -0.3866 2.9739 2.9739 3.0639 3.0639 3.6287 3.6287 3.9321 3.9321 4.0492 4.0492 5.0851 5.0851 5.3274 5.3274 6.5297 6.5297 7.0586 7.0586 7.4288 7.4288 7.6894 7.6894 7.7978 7.7978 7.9128 7.9128 8.0391 8.0391 8.2374 8.2374 8.3194 8.3194 9.0199 9.0199 9.0463 9.0463 9.1704 9.1704 12.7705 12.7705 14.0908 14.0908 14.2067 14.2067 15.6183 15.6183 16.1575 16.1575 16.2948 16.2948 16.7532 16.7532 17.2212 17.2212 k = 0.1339 0.0773 0.2187 ( 6543 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3983 -10.3983 -8.2042 -8.2042 -8.1158 -8.1158 -8.0632 -8.0632 -7.4460 -7.4460 -7.4036 -7.4036 -7.1311 -7.1311 -7.0859 -7.0859 -6.8394 -6.8394 -6.7716 -6.7716 -4.7336 -4.7336 -4.7091 -4.7091 -4.6911 -4.6911 -4.6701 -4.6701 -4.6521 -4.6521 -4.6190 -4.6190 -0.4243 -0.4243 3.0061 3.0061 3.1216 3.1216 3.6115 3.6115 3.9026 3.9026 4.0567 4.0567 5.0476 5.0476 5.2859 5.2859 6.4013 6.4013 7.1109 7.1109 7.4445 7.4445 7.7083 7.7083 7.8171 7.8171 7.9230 7.9230 8.0494 8.0494 8.2230 8.2230 8.2815 8.2815 9.0432 9.0432 9.0743 9.0743 9.1843 9.1843 12.7066 12.7066 14.1488 14.1488 14.2770 14.2770 15.6878 15.6878 16.2155 16.2155 16.3431 16.3431 16.8006 16.8006 17.1922 17.1922 k = 0.1250 0.0722 0.2041 ( 6561 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4071 -10.4071 -8.1983 -8.1983 -8.1205 -8.1205 -8.0696 -8.0696 -7.4451 -7.4451 -7.4075 -7.4075 -7.1215 -7.1215 -7.0806 -7.0806 -6.8303 -6.8303 -6.7693 -6.7693 -4.7313 -4.7313 -4.7075 -4.7075 -4.6910 -4.6910 -4.6657 -4.6657 -4.6494 -4.6494 -4.6164 -4.6164 -0.4607 -0.4607 3.0391 3.0391 3.1821 3.1821 3.5948 3.5948 3.8720 3.8720 4.0636 4.0636 5.0117 5.0117 5.2469 5.2469 6.2731 6.2731 7.1618 7.1618 7.4596 7.4596 7.7232 7.7232 7.8386 7.8386 7.9324 7.9324 8.0592 8.0592 8.2093 8.2093 8.2467 8.2467 9.0664 9.0664 9.1008 9.1008 9.1972 9.1972 12.6435 12.6435 14.2052 14.2052 14.3459 14.3459 15.7572 15.7572 16.2547 16.2547 16.4104 16.4104 16.8444 16.8444 17.1607 17.1607 k = 0.1161 0.0670 0.1895 ( 6551 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4156 -10.4156 -8.1926 -8.1926 -8.1252 -8.1252 -8.0755 -8.0755 -7.4440 -7.4440 -7.4111 -7.4111 -7.1121 -7.1121 -7.0755 -7.0755 -6.8213 -6.8213 -6.7672 -6.7672 -4.7290 -4.7290 -4.7057 -4.7057 -4.6906 -4.6906 -4.6613 -4.6613 -4.6469 -4.6469 -4.6137 -4.6137 -0.4955 -0.4955 3.0727 3.0727 3.2453 3.2453 3.5791 3.5791 3.8420 3.8420 4.0681 4.0681 4.9775 4.9775 5.2106 5.2106 6.1456 6.1456 7.2111 7.2111 7.4739 7.4739 7.7347 7.7347 7.8614 7.8614 7.9409 7.9409 8.0686 8.0686 8.1958 8.1958 8.2159 8.2159 9.0896 9.0896 9.1256 9.1256 9.2093 9.2093 12.5819 12.5819 14.2596 14.2596 14.4128 14.4128 15.8264 15.8264 16.2834 16.2834 16.4873 16.4873 16.8838 16.8838 17.1270 17.1270 k = 0.1071 0.0619 0.1750 ( 6547 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4237 -10.4237 -8.1871 -8.1871 -8.1299 -8.1299 -8.0808 -8.0808 -7.4431 -7.4431 -7.4146 -7.4146 -7.1032 -7.1032 -7.0709 -7.0709 -6.8127 -6.8127 -6.7652 -6.7652 -4.7269 -4.7269 -4.7039 -4.7039 -4.6903 -4.6903 -4.6572 -4.6572 -4.6445 -4.6445 -4.6111 -4.6111 -0.5285 -0.5285 3.1065 3.1065 3.3111 3.3111 3.5648 3.5648 3.8134 3.8134 4.0691 4.0691 4.9450 4.9450 5.1769 5.1769 6.0193 6.0193 7.2584 7.2584 7.4876 7.4876 7.7432 7.7432 7.8843 7.8843 7.9484 7.9484 8.0774 8.0774 8.1797 8.1797 8.1925 8.1925 9.1125 9.1125 9.1488 9.1488 9.2204 9.2204 12.5223 12.5223 14.3116 14.3116 14.4769 14.4769 15.8952 15.8952 16.3079 16.3079 16.5657 16.5657 16.9176 16.9176 17.0915 17.0915 k = 0.0982 0.0567 0.1604 ( 6559 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4313 -10.4313 -8.1822 -8.1822 -8.1345 -8.1345 -8.0855 -8.0855 -7.4422 -7.4422 -7.4180 -7.4180 -7.0947 -7.0947 -7.0667 -7.0667 -6.8044 -6.8044 -6.7635 -6.7635 -4.7251 -4.7251 -4.7020 -4.7020 -4.6900 -4.6900 -4.6534 -4.6534 -4.6424 -4.6424 -4.6085 -4.6085 -0.5596 -0.5596 3.1399 3.1399 3.3793 3.3793 3.5525 3.5525 3.7866 3.7866 4.0664 4.0664 4.9143 4.9143 5.1460 5.1460 5.8948 5.8948 7.3036 7.3036 7.5006 7.5006 7.7491 7.7491 7.9062 7.9062 7.9551 7.9551 8.0856 8.0856 8.1588 8.1588 8.1788 8.1788 9.1349 9.1349 9.1701 9.1701 9.2306 9.2306 12.4651 12.4651 14.3608 14.3608 14.5377 14.5377 15.9632 15.9632 16.3311 16.3311 16.6409 16.6409 16.9449 16.9449 17.0549 17.0549 k = 0.0893 0.0515 0.1458 ( 6559 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4384 -10.4384 -8.1777 -8.1777 -8.1388 -8.1388 -8.0894 -8.0894 -7.4413 -7.4413 -7.4210 -7.4210 -7.0867 -7.0867 -7.0629 -7.0629 -6.7965 -6.7965 -6.7619 -6.7619 -4.7234 -4.7234 -4.6999 -4.6999 -4.6896 -4.6896 -4.6499 -4.6499 -4.6406 -4.6406 -4.6060 -4.6060 -0.5886 -0.5886 3.1722 3.1722 3.4497 3.4497 3.5430 3.5430 3.7620 3.7620 4.0598 4.0598 4.8854 4.8854 5.1178 5.1178 5.7727 5.7727 7.3463 7.3463 7.5131 7.5131 7.7528 7.7528 7.9259 7.9259 7.9611 7.9611 8.0931 8.0931 8.1396 8.1396 8.1690 8.1690 9.1565 9.1565 9.1897 9.1897 9.2400 9.2400 12.4109 12.4109 14.4070 14.4070 14.5946 14.5946 16.0303 16.0303 16.3538 16.3538 16.7095 16.7095 16.9645 16.9645 17.0179 17.0179 k = 0.0804 0.0464 0.1312 ( 6563 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4450 -10.4450 -8.1739 -8.1739 -8.1430 -8.1430 -8.0926 -8.0926 -7.4406 -7.4406 -7.4240 -7.4240 -7.0792 -7.0792 -7.0595 -7.0595 -6.7892 -6.7892 -6.7606 -6.7606 -4.7221 -4.7221 -4.6980 -4.6980 -4.6893 -4.6893 -4.6466 -4.6466 -4.6389 -4.6389 -4.6036 -4.6036 -0.6153 -0.6153 3.2026 3.2026 3.5211 3.5211 3.5381 3.5381 3.7396 3.7396 4.0494 4.0494 4.8582 4.8582 5.0923 5.0923 5.6536 5.6536 7.3863 7.3863 7.5250 7.5250 7.7545 7.7545 7.9422 7.9422 7.9666 7.9666 8.0998 8.0998 8.1248 8.1248 8.1610 8.1610 9.1771 9.1771 9.2075 9.2075 9.2485 9.2485 12.3602 12.3602 14.4498 14.4498 14.6473 14.6473 16.0961 16.0961 16.3764 16.3764 16.7689 16.7689 16.9741 16.9741 16.9832 16.9832 k = 0.0714 0.0412 0.1166 ( 6559 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4509 -10.4509 -8.1707 -8.1707 -8.1469 -8.1469 -8.0951 -8.0951 -7.4398 -7.4398 -7.4266 -7.4266 -7.0723 -7.0723 -7.0564 -7.0564 -6.7824 -6.7824 -6.7594 -6.7594 -4.7209 -4.7209 -4.6960 -4.6960 -4.6889 -4.6889 -4.6436 -4.6436 -4.6374 -4.6374 -4.6012 -4.6012 -0.6396 -0.6396 3.2298 3.2298 3.5348 3.5348 3.5969 3.5969 3.7196 3.7196 4.0353 4.0353 4.8326 4.8326 5.0695 5.0695 5.5384 5.5384 7.4236 7.4236 7.5362 7.5362 7.7543 7.7543 7.9539 7.9539 7.9721 7.9721 8.1049 8.1049 8.1159 8.1159 8.1544 8.1544 9.1963 9.1963 9.2235 9.2235 9.2562 9.2562 12.3134 12.3134 14.4888 14.4888 14.6954 14.6954 16.1604 16.1604 16.3990 16.3990 16.8170 16.8170 16.9444 16.9444 16.9806 16.9806 k = 0.0625 0.0361 0.1021 ( 6549 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4563 -10.4563 -8.1681 -8.1681 -8.1504 -8.1504 -8.0968 -8.0968 -7.4391 -7.4391 -7.4289 -7.4289 -7.0660 -7.0660 -7.0537 -7.0537 -6.7763 -6.7763 -6.7584 -6.7584 -4.7198 -4.7198 -4.6941 -4.6941 -4.6885 -4.6885 -4.6409 -4.6409 -4.6362 -4.6362 -4.5990 -4.5990 -0.6614 -0.6614 3.2528 3.2528 3.5390 3.5390 3.6716 3.6716 3.7021 3.7021 4.0179 4.0179 4.8083 4.8083 5.0494 5.0494 5.4281 5.4281 7.4578 7.4578 7.5469 7.5469 7.7525 7.7525 7.9611 7.9611 7.9769 7.9769 8.1064 8.1064 8.1151 8.1151 8.1491 8.1491 9.2139 9.2139 9.2378 9.2378 9.2631 9.2631 12.2709 12.2709 14.5239 14.5239 14.7384 14.7384 16.2228 16.2228 16.4214 16.4214 16.8526 16.8526 16.9100 16.9100 16.9766 16.9766 k = 0.0536 0.0309 0.0875 ( 6541 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4610 -10.4610 -8.1662 -8.1662 -8.1536 -8.1536 -8.0979 -8.0979 -7.4384 -7.4384 -7.4309 -7.4309 -7.0605 -7.0605 -7.0513 -7.0513 -6.7709 -6.7709 -6.7575 -6.7575 -4.7189 -4.7189 -4.6923 -4.6923 -4.6881 -4.6881 -4.6386 -4.6386 -4.6351 -4.6351 -4.5971 -4.5971 -0.6805 -0.6805 3.2707 3.2707 3.5490 3.5490 3.6865 3.6865 3.7471 3.7471 3.9977 3.9977 4.7848 4.7848 5.0321 5.0321 5.3243 5.3243 7.4889 7.4889 7.5567 7.5567 7.7492 7.7492 7.9652 7.9652 7.9794 7.9794 8.1074 8.1074 8.1186 8.1186 8.1451 8.1451 9.2294 9.2294 9.2503 9.2503 9.2692 9.2692 12.2331 12.2331 14.5547 14.5547 14.7762 14.7762 16.2830 16.2830 16.4433 16.4433 16.8724 16.8724 16.8812 16.8812 16.9666 16.9666 k = 0.0446 0.0258 0.0729 ( 6547 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4651 -10.4651 -8.1649 -8.1649 -8.1564 -8.1564 -8.0985 -8.0985 -7.4379 -7.4379 -7.4327 -7.4327 -7.0558 -7.0558 -7.0494 -7.0494 -6.7662 -6.7662 -6.7568 -6.7568 -4.7182 -4.7182 -4.6908 -4.6908 -4.6878 -4.6878 -4.6368 -4.6368 -4.6343 -4.6343 -4.5954 -4.5954 -0.6969 -0.6969 3.2835 3.2835 3.5645 3.5645 3.6737 3.6737 3.8211 3.8211 3.9754 3.9754 4.7616 4.7616 5.0174 5.0174 5.2291 5.2291 7.5166 7.5166 7.5656 7.5656 7.7447 7.7447 7.9677 7.9677 7.9795 7.9795 8.1109 8.1109 8.1221 8.1221 8.1424 8.1424 9.2425 9.2425 9.2612 9.2612 9.2745 9.2745 12.2005 12.2005 14.5812 14.5812 14.8084 14.8084 16.3402 16.3402 16.4641 16.4641 16.8449 16.8449 16.8912 16.8912 16.9525 16.9525 k = 0.0357 0.0206 0.0583 ( 6543 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4684 -10.4684 -8.1640 -8.1640 -8.1588 -8.1588 -8.0988 -8.0988 -7.4375 -7.4375 -7.4341 -7.4341 -7.0519 -7.0519 -7.0478 -7.0478 -6.7623 -6.7623 -6.7562 -6.7562 -4.7176 -4.7176 -4.6894 -4.6894 -4.6874 -4.6874 -4.6352 -4.6352 -4.6337 -4.6337 -4.5939 -4.5939 -0.7104 -0.7104 3.2919 3.2919 3.5840 3.5840 3.6632 3.6632 3.8921 3.8921 3.9521 3.9521 4.7379 4.7379 5.0054 5.0054 5.1452 5.1452 7.5405 7.5405 7.5733 7.5733 7.7396 7.7396 7.9693 7.9693 7.9780 7.9780 8.1157 8.1157 8.1247 8.1247 8.1410 8.1410 9.2530 9.2530 9.2705 9.2705 9.2792 9.2792 12.1733 12.1733 14.6030 14.6030 14.8350 14.8350 16.3937 16.3937 16.4831 16.4831 16.8154 16.8154 16.8973 16.8973 16.9363 16.9363 k = 0.0268 0.0155 0.0437 ( 6549 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4710 -10.4710 -8.1635 -8.1635 -8.1606 -8.1606 -8.0988 -8.0988 -7.4371 -7.4371 -7.4352 -7.4352 -7.0489 -7.0489 -7.0466 -7.0466 -6.7593 -6.7593 -6.7558 -6.7558 -4.7172 -4.7172 -4.6884 -4.6884 -4.6872 -4.6872 -4.6340 -4.6340 -4.6333 -4.6333 -4.5927 -4.5927 -0.7209 -0.7209 3.2968 3.2968 3.6052 3.6052 3.6551 3.6551 3.9293 3.9293 3.9570 3.9570 4.7136 4.7136 4.9961 4.9961 5.0761 5.0761 7.5604 7.5604 7.5797 7.5797 7.7341 7.7341 7.9704 7.9704 7.9757 7.9757 8.1204 8.1204 8.1262 8.1262 8.1410 8.1410 9.2608 9.2608 9.2780 9.2780 9.2830 9.2830 12.1519 12.1519 14.6202 14.6202 14.8558 14.8558 16.4422 16.4422 16.4995 16.4995 16.7877 16.7877 16.8985 16.8985 16.9204 16.9204 k = 0.0179 0.0103 0.0292 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4729 -10.4729 -8.1632 -8.1632 -8.1620 -8.1620 -8.0987 -8.0987 -7.4369 -7.4369 -7.4360 -7.4360 -7.0467 -7.0467 -7.0459 -7.0459 -6.7571 -6.7571 -6.7555 -6.7555 -4.7169 -4.7169 -4.6876 -4.6876 -4.6871 -4.6871 -4.6333 -4.6333 -4.6330 -4.6330 -4.5920 -4.5920 -0.7286 -0.7286 3.2994 3.2994 3.6249 3.6249 3.6493 3.6493 3.9092 3.9092 4.0112 4.0112 4.6899 4.6899 4.9894 4.9894 5.0251 5.0251 7.5755 7.5755 7.5844 7.5844 7.7292 7.7292 7.9711 7.9711 7.9736 7.9736 8.1240 8.1240 8.1268 8.1268 8.1418 8.1418 9.2659 9.2659 9.2837 9.2837 9.2859 9.2859 12.1363 12.1363 14.6325 14.6325 14.8707 14.8707 16.4832 16.4832 16.5123 16.5123 16.7628 16.7628 16.8974 16.8974 16.9070 16.9070 k = 0.0089 0.0052 0.0146 ( 6597 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4741 -10.4741 -8.1632 -8.1632 -8.1628 -8.1628 -8.0986 -8.0986 -7.4368 -7.4368 -7.4366 -7.4366 -7.0457 -7.0457 -7.0454 -7.0454 -6.7557 -6.7557 -6.7554 -6.7554 -4.7167 -4.7167 -4.6872 -4.6872 -4.6870 -4.6870 -4.6331 -4.6331 -4.6330 -4.6330 -4.5917 -4.5917 -0.7331 -0.7331 3.3006 3.3006 3.6393 3.6393 3.6458 3.6458 3.8948 3.8948 4.0482 4.0482 4.6714 4.6714 4.9854 4.9854 4.9943 4.9943 7.5850 7.5850 7.5873 7.5873 7.7257 7.7257 7.9714 7.9714 7.9721 7.9721 8.1263 8.1263 8.1270 8.1270 8.1427 8.1427 9.2688 9.2688 9.2872 9.2872 9.2878 9.2878 12.1270 12.1270 14.6399 14.6399 14.8796 14.8796 16.5123 16.5123 16.5204 16.5204 16.7439 16.7439 16.8958 16.8958 16.8982 16.8982 k = 0.0000 0.0000 0.0000 ( 6615 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4744 -10.4744 -8.1631 -8.1631 -8.1631 -8.1631 -8.0986 -8.0986 -7.4369 -7.4369 -7.4369 -7.4369 -7.0452 -7.0452 -7.0452 -7.0452 -6.7553 -6.7553 -6.7553 -6.7553 -4.7168 -4.7168 -4.6872 -4.6872 -4.6872 -4.6872 -4.6329 -4.6329 -4.6329 -4.6329 -4.5915 -4.5915 -0.7347 -0.7347 3.3010 3.3010 3.6446 3.6446 3.6446 3.6446 3.8895 3.8895 4.0616 4.0616 4.6641 4.6641 4.9841 4.9841 4.9841 4.9841 7.5883 7.5883 7.5883 7.5883 7.7243 7.7243 7.9716 7.9716 7.9716 7.9716 8.1270 8.1270 8.1270 8.1270 8.1430 8.1430 9.2697 9.2697 9.2884 9.2884 9.2884 9.2884 12.1238 12.1238 14.6423 14.6423 14.8826 14.8826 16.5232 16.5232 16.5232 16.5232 16.7364 16.7364 16.8951 16.8951 16.8951 16.8951 k = 0.0000 0.0000 0.0000 ( 6615 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4744 -10.4744 -8.1631 -8.1631 -8.1631 -8.1631 -8.0986 -8.0986 -7.4369 -7.4369 -7.4369 -7.4369 -7.0452 -7.0452 -7.0452 -7.0452 -6.7553 -6.7553 -6.7553 -6.7553 -4.7168 -4.7168 -4.6872 -4.6872 -4.6872 -4.6872 -4.6329 -4.6329 -4.6329 -4.6329 -4.5915 -4.5915 -0.7347 -0.7347 3.3010 3.3010 3.6446 3.6446 3.6446 3.6446 3.8895 3.8895 4.0616 4.0616 4.6641 4.6641 4.9841 4.9841 4.9841 4.9841 7.5883 7.5883 7.5883 7.5883 7.7243 7.7243 7.9716 7.9716 7.9716 7.9716 8.1270 8.1270 8.1270 8.1270 8.1430 8.1430 9.2697 9.2697 9.2884 9.2884 9.2884 9.2884 12.1238 12.1238 14.6423 14.6423 14.8826 14.8826 16.5232 16.5232 16.5232 16.5232 16.7364 16.7364 16.8951 16.8951 16.8951 16.8951 k = 0.0143 0.0082 0.0058 ( 6597 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4741 -10.4741 -8.1632 -8.1632 -8.1628 -8.1628 -8.0986 -8.0986 -7.4368 -7.4368 -7.4366 -7.4366 -7.0457 -7.0457 -7.0454 -7.0454 -6.7557 -6.7557 -6.7554 -6.7554 -4.7168 -4.7168 -4.6871 -4.6871 -4.6871 -4.6871 -4.6330 -4.6330 -4.6330 -4.6330 -4.5917 -4.5917 -0.7332 -0.7332 3.3007 3.3007 3.6394 3.6394 3.6459 3.6459 3.8946 3.8946 4.0487 4.0487 4.6711 4.6711 4.9853 4.9853 4.9940 4.9940 7.5858 7.5858 7.5868 7.5868 7.7256 7.7256 7.9717 7.9717 7.9719 7.9719 8.1262 8.1262 8.1270 8.1270 8.1427 8.1427 9.2688 9.2688 9.2874 9.2874 9.2877 9.2877 12.1268 12.1268 14.6400 14.6400 14.8797 14.8797 16.5125 16.5125 16.5207 16.5207 16.7436 16.7436 16.8957 16.8957 16.8980 16.8980 k = 0.0286 0.0165 0.0117 ( 6570 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4730 -10.4730 -8.1633 -8.1633 -8.1620 -8.1620 -8.0987 -8.0987 -7.4370 -7.4370 -7.4361 -7.4361 -7.0467 -7.0467 -7.0458 -7.0458 -6.7570 -6.7570 -6.7555 -6.7555 -4.7169 -4.7169 -4.6876 -4.6876 -4.6871 -4.6871 -4.6332 -4.6332 -4.6331 -4.6331 -4.5920 -4.5920 -0.7288 -0.7288 3.2995 3.2995 3.6252 3.6252 3.6496 3.6496 3.9083 3.9083 4.0131 4.0131 4.6889 4.6889 4.9889 4.9889 5.0238 5.0238 7.5783 7.5783 7.5821 7.5821 7.7291 7.7291 7.9719 7.9719 7.9727 7.9727 8.1241 8.1241 8.1268 8.1268 8.1419 8.1419 9.2662 9.2662 9.2843 9.2843 9.2855 9.2855 12.1358 12.1358 14.6328 14.6328 14.8711 14.8711 16.4839 16.4839 16.5134 16.5134 16.7619 16.7619 16.8973 16.8973 16.9065 16.9065 k = 0.0429 0.0247 0.0175 ( 6558 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4712 -10.4712 -8.1636 -8.1636 -8.1606 -8.1606 -8.0987 -8.0987 -7.4372 -7.4372 -7.4353 -7.4353 -7.0489 -7.0489 -7.0464 -7.0464 -6.7592 -6.7592 -6.7558 -6.7558 -4.7172 -4.7172 -4.6884 -4.6884 -4.6872 -4.6872 -4.6338 -4.6338 -4.6335 -4.6335 -4.5927 -4.5927 -0.7215 -0.7215 3.2968 3.2968 3.6059 3.6059 3.6558 3.6558 3.9276 3.9276 3.9608 3.9608 4.7118 4.7118 4.9949 4.9949 5.0733 5.0733 7.5666 7.5666 7.5743 7.5743 7.7342 7.7342 7.9720 7.9720 7.9740 7.9740 8.1207 8.1207 8.1256 8.1256 8.1417 8.1417 9.2616 9.2616 9.2792 9.2792 9.2820 9.2820 12.1507 12.1507 14.6210 14.6210 14.8569 14.8569 16.4434 16.4434 16.5020 16.5020 16.7862 16.7862 16.8986 16.8986 16.9193 16.9193 k = 0.0571 0.0330 0.0233 ( 6546 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4687 -10.4687 -8.1643 -8.1643 -8.1588 -8.1588 -8.0987 -8.0987 -7.4375 -7.4375 -7.4341 -7.4341 -7.0519 -7.0519 -7.0474 -7.0474 -6.7621 -6.7621 -6.7561 -6.7561 -4.7175 -4.7175 -4.6894 -4.6894 -4.6873 -4.6873 -4.6347 -4.6347 -4.6341 -4.6341 -4.5938 -4.5938 -0.7113 -0.7113 3.2917 3.2917 3.5853 3.5853 3.6644 3.6644 3.8980 3.8980 3.9493 3.9493 4.7352 4.7352 5.0033 5.0033 5.1406 5.1406 7.5512 7.5512 7.5636 7.5636 7.7402 7.7402 7.9713 7.9713 7.9758 7.9758 8.1166 8.1166 8.1227 8.1227 8.1429 8.1429 9.2550 9.2550 9.2722 9.2722 9.2774 9.2774 12.1713 12.1713 14.6044 14.6044 14.8370 14.8370 16.3953 16.3953 16.4875 16.4875 16.8133 16.8133 16.8976 16.8976 16.9346 16.9346 k = 0.0714 0.0412 0.0292 ( 6543 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4654 -10.4654 -8.1654 -8.1654 -8.1564 -8.1564 -8.0984 -8.0984 -7.4379 -7.4379 -7.4328 -7.4328 -7.0558 -7.0558 -7.0487 -7.0487 -6.7660 -6.7660 -6.7566 -6.7566 -4.7182 -4.7182 -4.6908 -4.6908 -4.6875 -4.6875 -4.6360 -4.6360 -4.6348 -4.6348 -4.5951 -4.5951 -0.6984 -0.6984 3.2831 3.2831 3.5667 3.5667 3.6754 3.6754 3.8292 3.8292 3.9713 3.9713 4.7578 4.7578 5.0140 5.0140 5.2226 5.2226 7.5328 7.5328 7.5501 7.5501 7.7465 7.7465 7.9692 7.9692 7.9780 7.9780 8.1123 8.1123 8.1183 8.1183 8.1458 8.1458 9.2465 9.2465 9.2632 9.2632 9.2716 9.2716 12.1974 12.1974 14.5832 14.5832 14.8115 14.8115 16.3422 16.3422 16.4707 16.4707 16.8414 16.8414 16.8927 16.8927 16.9506 16.9506 k = 0.0857 0.0495 0.0350 ( 6546 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4616 -10.4616 -8.1671 -8.1671 -8.1535 -8.1535 -8.0976 -8.0976 -7.4385 -7.4385 -7.4311 -7.4311 -7.0606 -7.0606 -7.0503 -7.0503 -6.7706 -6.7706 -6.7571 -6.7571 -4.7189 -4.7189 -4.6925 -4.6925 -4.6877 -4.6877 -4.6375 -4.6375 -4.6359 -4.6359 -4.5968 -4.5968 -0.6827 -0.6827 3.2695 3.2695 3.5527 3.5527 3.6888 3.6888 3.7575 3.7575 3.9920 3.9920 4.7797 4.7797 5.0271 5.0271 5.3160 5.3160 7.5118 7.5118 7.5337 7.5337 7.7524 7.7524 7.9648 7.9648 7.9807 7.9807 8.1089 8.1089 8.1133 8.1133 8.1500 8.1500 9.2360 9.2360 9.2525 9.2525 9.2649 9.2649 12.2287 12.2287 14.5574 14.5574 14.7807 14.7807 16.2855 16.2855 16.4524 16.4524 16.8639 16.8639 16.8880 16.8880 16.9649 16.9649 k = 0.1000 0.0577 0.0408 ( 6552 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4570 -10.4570 -8.1695 -8.1695 -8.1501 -8.1501 -8.0963 -8.0963 -7.4392 -7.4392 -7.4290 -7.4290 -7.0661 -7.0661 -7.0522 -7.0522 -6.7760 -6.7760 -6.7578 -6.7578 -4.7197 -4.7197 -4.6944 -4.6944 -4.6879 -4.6879 -4.6394 -4.6394 -4.6373 -4.6373 -4.5987 -4.5987 -0.6644 -0.6644 3.2504 3.2504 3.5449 3.5449 3.6847 3.6847 3.7045 3.7045 4.0104 4.0104 4.8017 4.8017 5.0424 5.0424 5.4181 5.4181 7.4883 7.4883 7.5148 7.5148 7.7575 7.7575 7.9571 7.9571 7.9836 7.9836 8.1070 8.1070 8.1088 8.1088 8.1554 8.1554 9.2237 9.2237 9.2402 9.2402 9.2571 9.2571 12.2649 12.2649 14.5270 14.5270 14.7446 14.7446 16.2265 16.2265 16.4331 16.4331 16.8516 16.8516 16.9107 16.9107 16.9749 16.9749 k = 0.1143 0.0660 0.0467 ( 6540 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4519 -10.4519 -8.1728 -8.1728 -8.1462 -8.1462 -8.0943 -8.0943 -7.4399 -7.4399 -7.4265 -7.4265 -7.0724 -7.0724 -7.0543 -7.0543 -6.7821 -6.7821 -6.7585 -6.7585 -4.7206 -4.7206 -4.6963 -4.6963 -4.6879 -4.6879 -4.6414 -4.6414 -4.6388 -4.6388 -4.6007 -4.6007 -0.6435 -0.6435 3.2259 3.2259 3.5439 3.5439 3.6121 3.6121 3.7224 3.7224 4.0257 4.0257 4.8243 4.8243 5.0600 5.0600 5.5269 5.5269 7.4626 7.4626 7.4934 7.4934 7.7610 7.7610 7.9455 7.9455 7.9870 7.9870 8.1055 8.1055 8.1073 8.1073 8.1617 8.1617 9.2098 9.2098 9.2264 9.2264 9.2485 9.2485 12.3056 12.3056 14.4921 14.4921 14.7036 14.7036 16.1659 16.1659 16.4132 16.4132 16.8199 16.8199 16.9436 16.9436 16.9784 16.9784 k = 0.1286 0.0742 0.0525 ( 6561 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4461 -10.4461 -8.1770 -8.1770 -8.1419 -8.1419 -8.0915 -8.0915 -7.4408 -7.4408 -7.4239 -7.4239 -7.0795 -7.0795 -7.0568 -7.0568 -6.7890 -6.7890 -6.7593 -6.7593 -4.7217 -4.7217 -4.6986 -4.6986 -4.6880 -4.6880 -4.6439 -4.6439 -4.6409 -4.6409 -4.6030 -4.6030 -0.6203 -0.6203 3.1968 3.1968 3.5406 3.5406 3.5490 3.5490 3.7424 3.7424 4.0375 4.0375 4.8480 4.8480 5.0796 5.0796 5.6409 5.6409 7.4347 7.4347 7.4697 7.4697 7.7621 7.7621 7.9296 7.9296 7.9913 7.9913 8.1044 8.1044 8.1101 8.1101 8.1690 8.1690 9.1944 9.1944 9.2112 9.2112 9.2389 9.2389 12.3504 12.3504 14.4527 14.4527 14.6577 14.6577 16.1043 16.1043 16.3930 16.3930 16.7762 16.7762 16.9733 16.9733 16.9788 16.9788 k = 0.1429 0.0825 0.0583 ( 6561 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4398 -10.4398 -8.1820 -8.1820 -8.1372 -8.1372 -8.0880 -8.0880 -7.4418 -7.4418 -7.4207 -7.4207 -7.0872 -7.0872 -7.0595 -7.0595 -6.7966 -6.7966 -6.7602 -6.7602 -4.7229 -4.7229 -4.7010 -4.7010 -4.6879 -4.6879 -4.6466 -4.6466 -4.6431 -4.6431 -4.6054 -4.6054 -0.5948 -0.5948 3.1645 3.1645 3.4709 3.4709 3.5594 3.5594 3.7646 3.7646 4.0453 4.0453 4.8730 4.8730 5.1014 5.1014 5.7590 5.7590 7.4047 7.4047 7.4437 7.4437 7.7597 7.7597 7.9098 7.9098 7.9972 7.9972 8.1062 8.1062 8.1152 8.1152 8.1771 8.1771 9.1778 9.1778 9.1949 9.1949 9.2284 9.2284 12.3988 12.3988 14.4088 14.4088 14.6073 14.6073 16.0425 16.0425 16.3728 16.3728 16.7215 16.7215 16.9589 16.9589 17.0153 17.0153 k = 0.1571 0.0907 0.0642 ( 6555 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4330 -10.4330 -8.1879 -8.1879 -8.1320 -8.1320 -8.0837 -8.0837 -7.4430 -7.4430 -7.4174 -7.4174 -7.0953 -7.0953 -7.0623 -7.0623 -6.8049 -6.8049 -6.7611 -6.7611 -4.7243 -4.7243 -4.7035 -4.7035 -4.6877 -4.6877 -4.6494 -4.6494 -4.6455 -4.6455 -4.6077 -4.6077 -0.5671 -0.5671 3.1300 3.1300 3.4033 3.4033 3.5741 3.5741 3.7888 3.7888 4.0489 4.0489 4.8996 4.8996 5.1252 5.1252 5.8805 5.8805 7.3729 7.3729 7.4157 7.4157 7.7528 7.7528 7.8861 7.8861 8.0056 8.0056 8.1111 8.1111 8.1223 8.1223 8.1860 8.1860 9.1601 9.1601 9.1776 9.1776 9.2170 9.2170 12.4505 12.4505 14.3606 14.3606 14.5527 14.5527 15.9810 15.9810 16.3527 16.3527 16.6570 16.6570 16.9352 16.9352 17.0520 17.0520 k = 0.1714 0.0990 0.0700 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4257 -10.4257 -8.1946 -8.1946 -8.1265 -8.1265 -8.0787 -8.0787 -7.4443 -7.4443 -7.4138 -7.4138 -7.1041 -7.1041 -7.0654 -7.0654 -6.8138 -6.8138 -6.7621 -6.7621 -4.7258 -4.7258 -4.7062 -4.7062 -4.6875 -4.6875 -4.6525 -4.6525 -4.6484 -4.6484 -4.6101 -4.6101 -0.5375 -0.5375 3.0943 3.0943 3.3382 3.3382 3.5921 3.5921 3.8148 3.8148 4.0483 4.0483 4.9277 4.9277 5.1509 5.1509 6.0047 6.0047 7.3391 7.3391 7.3857 7.3857 7.7408 7.7408 7.8592 7.8592 8.0174 8.0174 8.1193 8.1193 8.1310 8.1310 8.1957 8.1957 9.1415 9.1415 9.1595 9.1595 9.2047 9.2047 12.5048 12.5048 14.3081 14.3081 14.4941 14.4941 15.9202 15.9202 16.3327 16.3327 16.5846 16.5846 16.9036 16.9036 17.0880 17.0880 k = 0.1857 0.1072 0.0758 ( 6564 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4180 -10.4180 -8.2020 -8.2020 -8.1206 -8.1206 -8.0731 -8.0731 -7.4457 -7.4457 -7.4098 -7.4098 -7.1133 -7.1133 -7.0686 -7.0686 -6.8232 -6.8232 -6.7631 -6.7631 -4.7274 -4.7274 -4.7088 -4.7088 -4.6870 -4.6870 -4.6558 -4.6558 -4.6516 -4.6516 -4.6124 -4.6124 -0.5062 -0.5062 3.0582 3.0582 3.2758 3.2758 3.6126 3.6126 3.8426 3.8426 4.0434 4.0434 4.9575 4.9575 5.1785 5.1785 6.1311 6.1311 7.3036 7.3036 7.3539 7.3539 7.7236 7.7236 7.8293 7.8293 8.0328 8.0328 8.1309 8.1309 8.1410 8.1410 8.2062 8.2062 9.1221 9.1221 9.1407 9.1407 9.1917 9.1917 12.5613 12.5613 14.2514 14.2514 14.4319 14.4319 15.8607 15.8607 16.3131 16.3131 16.5062 16.5062 16.8659 16.8659 17.1220 17.1220 k = 0.2000 0.1155 0.0816 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4099 -10.4099 -8.2101 -8.2101 -8.1144 -8.1144 -8.0669 -8.0669 -7.4472 -7.4472 -7.4056 -7.4056 -7.1229 -7.1229 -7.0719 -7.0719 -6.8332 -6.8332 -6.7642 -6.7642 -4.7292 -4.7292 -4.7116 -4.7116 -4.6866 -4.6866 -4.6592 -4.6592 -4.6550 -4.6550 -4.6147 -4.6147 -0.4733 -0.4733 3.0223 3.0223 3.2164 3.2164 3.6350 3.6350 3.8721 3.8721 4.0345 4.0345 4.9888 4.9888 5.2077 5.2077 6.2593 6.2593 7.2665 7.2665 7.3205 7.3205 7.7013 7.7013 7.7967 7.7967 8.0514 8.0514 8.1462 8.1462 8.1521 8.1521 8.2175 8.2175 9.1022 9.1022 9.1215 9.1215 9.1778 9.1778 12.6194 12.6194 14.1908 14.1908 14.3664 14.3664 15.8027 15.8027 16.2938 16.2938 16.4236 16.4236 16.8237 16.8237 17.1527 17.1527 k = 0.2143 0.1237 0.0875 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.4014 -10.4014 -8.2186 -8.2186 -8.1079 -8.1079 -8.0602 -8.0602 -7.4489 -7.4489 -7.4011 -7.4011 -7.1328 -7.1328 -7.0753 -7.0753 -6.8437 -6.8437 -6.7653 -6.7653 -4.7309 -4.7309 -4.7143 -4.7143 -4.6860 -4.6860 -4.6628 -4.6628 -4.6588 -4.6588 -4.6170 -4.6170 -0.4391 -0.4391 2.9869 2.9869 3.1602 3.1602 3.6584 3.6584 3.9030 3.9030 4.0221 4.0221 5.0216 5.0216 5.2385 5.2385 6.3887 6.3887 7.2280 7.2280 7.2856 7.2856 7.6747 7.6747 7.7617 7.7617 8.0722 8.0722 8.1639 8.1639 8.1657 8.1657 8.2294 8.2294 9.0820 9.0820 9.1019 9.1019 9.1633 9.1633 12.6785 12.6785 14.1264 14.1264 14.2980 14.2980 15.7466 15.7466 16.2750 16.2750 16.3385 16.3385 16.7788 16.7788 17.1788 17.1788 k = 0.2286 0.1320 0.0933 ( 6552 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3927 -10.3927 -8.2276 -8.2276 -8.1011 -8.1011 -8.0531 -8.0531 -7.4507 -7.4507 -7.3961 -7.3961 -7.1430 -7.1430 -7.0788 -7.0788 -6.8545 -6.8545 -6.7664 -6.7664 -4.7326 -4.7326 -4.7168 -4.7168 -4.6852 -4.6852 -4.6665 -4.6665 -4.6628 -4.6628 -4.6191 -4.6191 -0.4038 -0.4038 2.9523 2.9523 3.1072 3.1072 3.6817 3.6817 3.9353 3.9353 4.0071 4.0071 5.0559 5.0559 5.2708 5.2708 6.5190 6.5190 7.1882 7.1882 7.2494 7.2494 7.6444 7.6444 7.7246 7.7246 8.0937 8.0937 8.1765 8.1765 8.1900 8.1900 8.2420 8.2420 9.0615 9.0615 9.0821 9.0821 9.1480 9.1480 12.7379 12.7379 14.0586 14.0586 14.2271 14.2271 15.6928 15.6928 16.2525 16.2525 16.2567 16.2567 16.7323 16.7323 17.1993 17.1993 k = 0.2429 0.1402 0.0991 ( 6552 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3839 -10.3839 -8.2370 -8.2370 -8.0942 -8.0942 -8.0457 -8.0457 -7.4527 -7.4527 -7.3911 -7.3911 -7.1534 -7.1534 -7.0823 -7.0823 -6.8658 -6.8658 -6.7676 -6.7676 -4.7344 -4.7344 -4.7195 -4.7195 -4.6845 -4.6845 -4.6703 -4.6703 -4.6670 -4.6670 -4.6212 -4.6212 -0.3676 -0.3676 2.9187 2.9187 3.0578 3.0578 3.7036 3.7036 3.9688 3.9688 3.9908 3.9908 5.0915 5.0915 5.3044 5.3044 6.6496 6.6496 7.1474 7.1474 7.2123 7.2123 7.6109 7.6109 7.6857 7.6857 8.1148 8.1148 8.1895 8.1895 8.2196 8.2196 8.2552 8.2552 9.0409 9.0409 9.0623 9.0623 9.1322 9.1322 12.7969 12.7969 13.9877 13.9877 14.1544 14.1544 15.6415 15.6415 16.1667 16.1667 16.2390 16.2390 16.6853 16.6853 17.2136 17.2136 k = 0.2571 0.1485 0.1050 ( 6555 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3748 -10.3748 -8.2466 -8.2466 -8.0871 -8.0871 -8.0380 -8.0380 -7.4549 -7.4549 -7.3858 -7.3858 -7.1639 -7.1639 -7.0859 -7.0859 -6.8773 -6.8773 -6.7687 -6.7687 -4.7362 -4.7362 -4.7221 -4.7221 -4.6837 -4.6837 -4.6742 -4.6742 -4.6712 -4.6712 -4.6233 -4.6233 -0.3308 -0.3308 2.8864 2.8864 3.0121 3.0121 3.7218 3.7218 3.9754 3.9754 4.0031 4.0031 5.1282 5.1282 5.3391 5.3391 6.7798 6.7798 7.1063 7.1063 7.1744 7.1744 7.5748 7.5748 7.6451 7.6451 8.1348 8.1348 8.2028 8.2028 8.2540 8.2540 8.2694 8.2694 9.0203 9.0203 9.0426 9.0426 9.1158 9.1158 12.8546 12.8546 13.9142 13.9142 14.0806 14.0806 15.5929 15.5929 16.0824 16.0824 16.2219 16.2219 16.6385 16.6385 17.2218 17.2218 k = 0.2714 0.1567 0.1108 ( 6573 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3658 -10.3658 -8.2563 -8.2563 -8.0799 -8.0799 -8.0301 -8.0301 -7.4571 -7.4571 -7.3803 -7.3803 -7.1745 -7.1745 -7.0895 -7.0895 -6.8891 -6.8891 -6.7699 -6.7699 -4.7380 -4.7380 -4.7246 -4.7246 -4.6832 -4.6832 -4.6783 -4.6783 -4.6755 -4.6755 -4.6255 -4.6255 -0.2937 -0.2937 2.8552 2.8552 2.9702 2.9702 3.7332 3.7332 3.9642 3.9642 4.0383 4.0383 5.1658 5.1658 5.3746 5.3746 6.9074 6.9074 7.0668 7.0668 7.1361 7.1361 7.5367 7.5367 7.6030 7.6030 8.1537 8.1537 8.2164 8.2164 8.2817 8.2817 8.2950 8.2950 8.9999 8.9999 9.0231 9.0231 9.0990 9.0990 12.9100 12.9100 13.8386 13.8386 14.0068 14.0068 15.5471 15.5471 16.0004 16.0004 16.2056 16.2056 16.5925 16.5925 17.2244 17.2244 k = 0.2857 0.1650 0.1166 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3567 -10.3567 -8.2661 -8.2661 -8.0727 -8.0727 -8.0220 -8.0220 -7.4595 -7.4595 -7.3746 -7.3746 -7.1850 -7.1850 -7.0930 -7.0930 -6.9010 -6.9010 -6.7710 -6.7710 -4.7396 -4.7396 -4.7269 -4.7269 -4.6836 -4.6836 -4.6824 -4.6824 -4.6785 -4.6785 -4.6275 -4.6275 -0.2566 -0.2566 2.8252 2.8252 2.9326 2.9326 3.7340 3.7340 3.9610 3.9610 4.0739 4.0739 5.2043 5.2043 5.4109 5.4109 6.9970 6.9970 7.0641 7.0641 7.0977 7.0977 7.4971 7.4971 7.5598 7.5598 8.1718 8.1718 8.2302 8.2302 8.2970 8.2970 8.3369 8.3369 8.9797 8.9797 9.0039 9.0039 9.0818 9.0818 12.9616 12.9616 13.7614 13.7614 13.9342 13.9342 15.5042 15.5042 15.9215 15.9215 16.1900 16.1900 16.5478 16.5478 17.2220 17.2220 k = 0.3000 0.1732 0.1225 ( 6558 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3477 -10.3477 -8.2759 -8.2759 -8.0654 -8.0654 -8.0139 -8.0139 -7.4620 -7.4620 -7.3686 -7.3686 -7.1953 -7.1953 -7.0963 -7.0963 -6.9130 -6.9130 -6.7722 -6.7722 -4.7411 -4.7411 -4.7289 -4.7289 -4.6865 -4.6865 -4.6864 -4.6864 -4.6788 -4.6788 -4.6295 -4.6295 -0.2197 -0.2197 2.7964 2.7964 2.8993 2.8993 3.7224 3.7224 3.9680 3.9680 4.1098 4.1098 5.2433 5.2433 5.4476 5.4476 6.9696 6.9696 7.0596 7.0596 7.1770 7.1770 7.4567 7.4567 7.5156 7.5156 8.1892 8.1892 8.2441 8.2441 8.3120 8.3120 8.3818 8.3818 8.9600 8.9600 8.9851 8.9851 9.0643 9.0643 13.0079 13.0079 13.6833 13.6833 13.8647 13.8647 15.4644 15.4644 15.8463 15.8463 16.1754 16.1754 16.5047 16.5047 17.2155 17.2155 k = 0.3143 0.1815 0.1283 ( 6561 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3389 -10.3389 -8.2855 -8.2855 -8.0583 -8.0583 -8.0058 -8.0058 -7.4645 -7.4645 -7.3626 -7.3626 -7.2055 -7.2055 -7.0996 -7.0996 -6.9249 -6.9249 -6.7732 -6.7732 -4.7425 -4.7425 -4.7309 -4.7309 -4.6907 -4.6907 -4.6905 -4.6905 -4.6780 -4.6780 -4.6315 -4.6315 -0.1835 -0.1835 2.7687 2.7687 2.8705 2.8705 3.6996 3.6996 3.9840 3.9840 4.1457 4.1457 5.2826 5.2826 5.4844 5.4844 6.9289 6.9289 7.0222 7.0222 7.3001 7.3001 7.4169 7.4169 7.4707 7.4707 8.2060 8.2060 8.2579 8.2579 8.3272 8.3272 8.4279 8.4279 8.9407 8.9407 8.9669 8.9669 9.0466 9.0466 13.0464 13.0464 13.6049 13.6049 13.8009 13.8009 15.4277 15.4277 15.7751 15.7751 16.1616 16.1616 16.4636 16.4636 17.2056 17.2056 k = 0.3286 0.1897 0.1341 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3304 -10.3304 -8.2950 -8.2950 -8.0512 -8.0512 -7.9978 -7.9978 -7.4672 -7.4672 -7.3566 -7.3566 -7.2155 -7.2155 -7.1028 -7.1028 -6.9368 -6.9368 -6.7743 -6.7743 -4.7439 -4.7439 -4.7327 -4.7327 -4.6951 -4.6951 -4.6945 -4.6945 -4.6769 -4.6769 -4.6334 -4.6334 -0.1481 -0.1481 2.7422 2.7422 2.8462 2.8462 3.6689 3.6689 4.0061 4.0061 4.1812 4.1812 5.3219 5.3219 5.5211 5.5211 6.8876 6.8876 6.9859 6.9859 7.3651 7.3651 7.4253 7.4253 7.4339 7.4339 8.2224 8.2224 8.2715 8.2715 8.3426 8.3426 8.4744 8.4744 8.9220 8.9220 8.9492 8.9492 9.0289 9.0289 13.0743 13.0743 13.5270 13.5270 13.7460 13.7460 15.3941 15.3941 15.7084 15.7084 16.1489 16.1489 16.4246 16.4246 17.1930 17.1930 k = 0.3429 0.1979 0.1400 ( 6561 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3221 -10.3221 -8.3041 -8.3041 -8.0444 -8.0444 -7.9900 -7.9900 -7.4698 -7.4698 -7.3504 -7.3504 -7.2250 -7.2250 -7.1058 -7.1058 -6.9484 -6.9484 -6.7753 -6.7753 -4.7450 -4.7450 -4.7342 -4.7342 -4.6995 -4.6995 -4.6984 -4.6984 -4.6756 -4.6756 -4.6353 -4.6353 -0.1140 -0.1140 2.7171 2.7171 2.8264 2.8264 3.6330 3.6330 4.0316 4.0316 4.2161 4.2161 5.3609 5.3609 5.5572 5.5572 6.8470 6.8470 6.9513 6.9513 7.3275 7.3275 7.3799 7.3799 7.5509 7.5509 8.2383 8.2383 8.2849 8.2849 8.3580 8.3580 8.5202 8.5202 8.9040 8.9040 8.9323 8.9323 9.0113 9.0113 13.0883 13.0883 13.4504 13.4504 13.7036 13.7036 15.3638 15.3638 15.6464 15.6464 16.1374 16.1374 16.3879 16.3879 17.1786 17.1786 k = 0.3571 0.2062 0.1458 ( 6562 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3142 -10.3142 -8.3128 -8.3128 -8.0378 -8.0378 -7.9825 -7.9825 -7.4724 -7.4724 -7.3441 -7.3441 -7.2343 -7.2343 -7.1086 -7.1086 -6.9598 -6.9598 -6.7762 -6.7762 -4.7460 -4.7460 -4.7354 -4.7354 -4.7038 -4.7038 -4.7024 -4.7024 -4.6742 -4.6742 -4.6373 -4.6373 -0.0815 -0.0815 2.6935 2.6935 2.8108 2.8108 3.5942 3.5942 4.0587 4.0587 4.2499 4.2499 5.3992 5.3992 5.5924 5.5924 6.8078 6.8078 6.9187 6.9187 7.2868 7.2868 7.3348 7.3348 7.6680 7.6680 8.2536 8.2536 8.2978 8.2978 8.3732 8.3732 8.5643 8.5643 8.8868 8.8868 8.9163 8.9163 8.9938 8.9938 13.0863 13.0863 13.3759 13.3759 13.6764 13.6764 15.3366 15.3366 15.5891 15.5891 16.1269 16.1269 16.3536 16.3536 17.1629 17.1629 k = 0.3714 0.2144 0.1516 ( 6556 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3069 -10.3069 -8.3210 -8.3210 -8.0316 -8.0316 -7.9754 -7.9754 -7.4750 -7.4750 -7.3379 -7.3379 -7.2430 -7.2430 -7.1112 -7.1112 -6.9707 -6.9707 -6.7771 -6.7771 -4.7467 -4.7467 -4.7363 -4.7363 -4.7080 -4.7080 -4.7062 -4.7062 -4.6726 -4.6726 -4.6392 -4.6392 -0.0508 -0.0508 2.6717 2.6717 2.7991 2.7991 3.5540 3.5540 4.0860 4.0860 4.2824 4.2824 5.4363 5.4363 5.6263 5.6263 6.7705 6.7705 6.8887 6.8887 7.2467 7.2467 7.2902 7.2902 7.7810 7.7810 8.2683 8.2683 8.3103 8.3103 8.3883 8.3883 8.6057 8.6057 8.8705 8.8705 8.9011 8.9011 8.9768 8.9768 13.0683 13.0683 13.3044 13.3044 13.6649 13.6649 15.3126 15.3126 15.5367 15.5367 16.1178 16.1178 16.3219 16.3219 17.1465 17.1465 k = 0.3857 0.2227 0.1575 ( 6556 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.3000 -10.3000 -8.3286 -8.3286 -8.0258 -8.0258 -7.9686 -7.9686 -7.4774 -7.4774 -7.3319 -7.3319 -7.2511 -7.2511 -7.1135 -7.1135 -6.9810 -6.9810 -6.7779 -6.7779 -4.7473 -4.7473 -4.7371 -4.7371 -4.7120 -4.7120 -4.7098 -4.7098 -4.6711 -4.6711 -4.6411 -4.6411 -0.0224 -0.0224 2.6518 2.6518 2.7910 2.7910 3.5137 3.5137 4.1127 4.1127 4.3130 4.3130 5.4718 5.4718 5.6584 5.6584 6.7355 6.7355 6.8619 6.8619 7.2080 7.2080 7.2468 7.2468 7.8887 7.8887 8.2823 8.2823 8.3221 8.3221 8.4029 8.4029 8.6436 8.6436 8.8553 8.8553 8.8870 8.8870 8.9604 8.9604 13.0375 13.0375 13.2369 13.2369 13.6664 13.6664 15.2919 15.2919 15.4893 15.4893 16.1099 16.1099 16.2928 16.2928 17.1301 17.1301 k = 0.4000 0.2309 0.1633 ( 6544 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3966 -30.3966 -10.2938 -10.2938 -8.3355 -8.3355 -8.0205 -8.0205 -7.9625 -7.9625 -7.4797 -7.4797 -7.3259 -7.3259 -7.2587 -7.2587 -7.1156 -7.1156 -6.9907 -6.9907 -6.7786 -6.7786 -4.7476 -4.7476 -4.7374 -4.7374 -4.7158 -4.7158 -4.7133 -4.7133 -4.6695 -4.6695 -4.6430 -4.6430 0.0035 0.0035 2.6341 2.6341 2.7861 2.7861 3.4743 3.4743 4.1379 4.1379 4.3414 4.3414 5.5052 5.5052 5.6881 5.6881 6.7034 6.7034 6.8386 6.8386 7.1715 7.1715 7.2051 7.2051 7.9898 7.9898 8.2953 8.2953 8.3331 8.3331 8.4168 8.4168 8.6772 8.6772 8.8414 8.8414 8.8741 8.8741 8.9449 8.9449 12.9988 12.9988 13.1742 13.1742 13.6770 13.6770 15.2745 15.2745 15.4467 15.4467 16.1034 16.1034 16.2664 16.2664 17.1141 17.1141 k = 0.4143 0.2392 0.1691 ( 6544 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3966 -30.3966 -10.2883 -10.2883 -8.3417 -8.3417 -8.0157 -8.0157 -7.9569 -7.9569 -7.4819 -7.4819 -7.3202 -7.3202 -7.2656 -7.2656 -7.1175 -7.1175 -6.9995 -6.9995 -6.7792 -6.7792 -4.7476 -4.7476 -4.7375 -4.7375 -4.7194 -4.7194 -4.7167 -4.7167 -4.6678 -4.6678 -4.6449 -4.6449 0.0267 0.0267 2.6186 2.6186 2.7839 2.7839 3.4370 3.4370 4.1611 4.1611 4.3671 4.3671 5.5359 5.5359 5.7151 5.7151 6.6745 6.6745 6.8192 6.8192 7.1378 7.1378 7.1657 7.1657 8.0832 8.0832 8.3072 8.3072 8.3431 8.3431 8.4298 8.4298 8.7056 8.7056 8.8287 8.8287 8.8625 8.8625 8.9304 8.9304 12.9569 12.9569 13.1173 13.1173 13.6925 13.6925 15.2603 15.2603 15.4090 15.4090 16.0982 16.0982 16.2429 16.2429 17.0991 17.0991 k = 0.4286 0.2474 0.1750 ( 6550 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2835 -10.2835 -8.3471 -8.3471 -8.0115 -8.0115 -7.9520 -7.9520 -7.4838 -7.4838 -7.3151 -7.3151 -7.2718 -7.2718 -7.1191 -7.1191 -7.0073 -7.0073 -6.7798 -6.7798 -4.7476 -4.7476 -4.7375 -4.7375 -4.7225 -4.7225 -4.7199 -4.7199 -4.6662 -4.6662 -4.6468 -4.6468 0.0467 0.0467 2.6054 2.6054 2.7840 2.7840 3.4027 3.4027 4.1817 4.1817 4.3898 4.3898 5.5633 5.5633 5.7387 5.7387 6.6493 6.6493 6.8038 6.8038 7.1076 7.1076 7.1294 7.1294 8.1673 8.1673 8.3178 8.3178 8.3519 8.3519 8.4417 8.4417 8.7284 8.7284 8.8177 8.8177 8.8523 8.8523 8.9173 8.9173 12.9159 12.9159 13.0672 13.0672 13.7096 13.7096 15.2493 15.2493 15.3762 15.3762 16.0943 16.0943 16.2223 16.2223 17.0855 17.0855 k = 0.4429 0.2557 0.1808 ( 6538 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3966 -30.3966 -10.2795 -10.2795 -8.3516 -8.3516 -8.0080 -8.0080 -7.9479 -7.9479 -7.4854 -7.4854 -7.3101 -7.3101 -7.2772 -7.2772 -7.1204 -7.1204 -7.0140 -7.0140 -6.7802 -6.7802 -4.7473 -4.7473 -4.7369 -4.7369 -4.7253 -4.7253 -4.7228 -4.7228 -4.6645 -4.6645 -4.6486 -4.6486 0.0635 0.0635 2.5945 2.5945 2.7856 2.7856 3.3725 3.3725 4.1993 4.1993 4.4090 4.4090 5.5868 5.5868 5.7587 5.7587 6.6283 6.6283 6.7924 6.7924 7.0817 7.0817 7.0972 7.0972 8.2406 8.2406 8.3270 8.3270 8.3595 8.3595 8.4520 8.4520 8.7455 8.7455 8.8082 8.8082 8.8437 8.8437 8.9060 8.9060 12.8788 12.8788 13.0248 13.0248 13.7262 13.7262 15.2414 15.2414 15.3483 15.3483 16.0917 16.0917 16.2048 16.2048 17.0738 17.0738 k = 0.4571 0.2639 0.1866 ( 6544 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2763 -10.2763 -8.3551 -8.3551 -8.0052 -8.0052 -7.9447 -7.9447 -7.4868 -7.4868 -7.3057 -7.3057 -7.2820 -7.2820 -7.1215 -7.1215 -7.0194 -7.0194 -6.7806 -6.7806 -4.7470 -4.7470 -4.7363 -4.7363 -4.7276 -4.7276 -4.7255 -4.7255 -4.6628 -4.6628 -4.6505 -4.6505 0.0767 0.0767 2.5861 2.5861 2.7879 2.7879 3.3475 3.3475 4.2134 4.2134 4.4244 4.4244 5.6058 5.6058 5.7746 5.7746 6.6116 6.6116 6.7847 6.7847 7.0606 7.0606 7.0701 7.0701 8.3007 8.3007 8.3348 8.3348 8.3655 8.3655 8.4605 8.4605 8.7574 8.7574 8.8004 8.8004 8.8369 8.8369 8.8967 8.8967 12.8478 12.8478 12.9908 12.9908 13.7403 13.7403 15.2364 15.2364 15.3255 15.3255 16.0901 16.0901 16.1907 16.1907 17.0643 17.0643 k = 0.4714 0.2722 0.1925 ( 6550 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2741 -10.2741 -8.3577 -8.3577 -8.0032 -8.0032 -7.9423 -7.9423 -7.4878 -7.4878 -7.3016 -7.3016 -7.2864 -7.2864 -7.1223 -7.1223 -7.0233 -7.0233 -6.7809 -6.7809 -4.7466 -4.7466 -4.7353 -4.7353 -4.7295 -4.7295 -4.7280 -4.7280 -4.6613 -4.6613 -4.6522 -4.6522 0.0863 0.0863 2.5800 2.5800 2.7904 2.7904 3.3287 3.3287 4.2237 4.2237 4.4356 4.4356 5.6198 5.6198 5.7862 5.7862 6.5994 6.5994 6.7801 6.7801 7.0450 7.0450 7.0494 7.0494 8.3369 8.3369 8.3498 8.3498 8.3700 8.3700 8.4668 8.4668 8.7651 8.7651 8.7941 8.7941 8.8319 8.8319 8.8898 8.8898 12.8246 12.8246 12.9659 12.9659 13.7511 13.7511 15.2339 15.2339 15.3082 15.3082 16.0894 16.0894 16.1801 16.1801 17.0573 17.0573 k = 0.4857 0.2804 0.1983 ( 6556 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2727 -10.2727 -8.3592 -8.3592 -8.0020 -8.0020 -7.9409 -7.9409 -7.4884 -7.4884 -7.2978 -7.2978 -7.2904 -7.2904 -7.1227 -7.1227 -7.0257 -7.0257 -6.7810 -6.7810 -4.7463 -4.7463 -4.7339 -4.7339 -4.7308 -4.7308 -4.7302 -4.7302 -4.6599 -4.6599 -4.6536 -4.6536 0.0920 0.0920 2.5764 2.5764 2.7922 2.7922 3.3170 3.3170 4.2300 4.2300 4.4424 4.4424 5.6284 5.6284 5.7932 5.7932 6.5921 6.5921 6.7778 6.7778 7.0355 7.0355 7.0364 7.0364 8.3419 8.3419 8.3727 8.3727 8.3767 8.3767 8.4707 8.4707 8.7697 8.7697 8.7895 8.7895 8.8288 8.8288 8.8855 8.8855 12.8102 12.8102 12.9508 12.9508 13.7579 13.7579 15.2330 15.2330 15.2971 15.2971 16.0892 16.0892 16.1736 16.1736 17.0530 17.0530 k = 0.5000 0.2887 0.2041 ( 6550 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2722 -10.2722 -8.3597 -8.3597 -8.0016 -8.0016 -7.9404 -7.9404 -7.4886 -7.4886 -7.2943 -7.2943 -7.2939 -7.2939 -7.1229 -7.1229 -7.0265 -7.0265 -6.7811 -6.7811 -4.7461 -4.7461 -4.7322 -4.7322 -4.7321 -4.7321 -4.7312 -4.7312 -4.6593 -4.6593 -4.6542 -4.6542 0.0940 0.0940 2.5751 2.5751 2.7929 2.7929 3.3130 3.3130 4.2321 4.2321 4.4447 4.4447 5.6313 5.6313 5.7956 5.7956 6.5897 6.5897 6.7771 6.7771 7.0319 7.0319 7.0323 7.0323 8.3432 8.3432 8.3736 8.3736 8.3864 8.3864 8.4721 8.4721 8.7713 8.7713 8.7877 8.7877 8.8278 8.8278 8.8840 8.8840 12.8054 12.8054 12.9457 12.9457 13.7602 13.7602 15.2329 15.2329 15.2933 15.2933 16.0891 16.0891 16.1714 16.1714 17.0515 17.0515 k = 0.5000 0.2887 0.2041 ( 6550 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2722 -10.2722 -8.3597 -8.3597 -8.0016 -8.0016 -7.9404 -7.9404 -7.4886 -7.4886 -7.2943 -7.2943 -7.2939 -7.2939 -7.1229 -7.1229 -7.0265 -7.0265 -6.7811 -6.7811 -4.7461 -4.7461 -4.7322 -4.7322 -4.7321 -4.7321 -4.7312 -4.7312 -4.6593 -4.6593 -4.6542 -4.6542 0.0940 0.0940 2.5751 2.5751 2.7929 2.7929 3.3130 3.3130 4.2321 4.2321 4.4447 4.4447 5.6313 5.6313 5.7956 5.7956 6.5897 6.5897 6.7771 6.7771 7.0319 7.0319 7.0323 7.0323 8.3432 8.3432 8.3736 8.3736 8.3864 8.3864 8.4721 8.4721 8.7713 8.7713 8.7877 8.7877 8.8278 8.8278 8.8840 8.8840 12.8054 12.8054 12.9457 12.9457 13.7602 13.7602 15.2329 15.2329 15.2933 15.2933 16.0891 16.0891 16.1714 16.1714 17.0515 17.0515 k = 0.5050 0.2742 0.2123 ( 6556 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2721 -10.2721 -8.3593 -8.3593 -8.0016 -8.0016 -7.9406 -7.9406 -7.4885 -7.4885 -7.2944 -7.2944 -7.2940 -7.2940 -7.1239 -7.1239 -7.0258 -7.0258 -6.7813 -6.7813 -4.7463 -4.7463 -4.7333 -4.7333 -4.7321 -4.7321 -4.7302 -4.7302 -4.6594 -4.6594 -4.6544 -4.6544 0.0949 0.0949 2.5750 2.5750 2.7916 2.7916 3.3131 3.3131 4.2322 4.2322 4.4447 4.4447 5.6333 5.6333 5.7974 5.7974 6.5888 6.5888 6.7751 6.7751 7.0335 7.0335 7.0351 7.0351 8.3351 8.3351 8.3642 8.3642 8.4016 8.4016 8.4710 8.4710 8.7714 8.7714 8.7869 8.7869 8.8267 8.8267 8.8837 8.8837 12.8064 12.8064 12.9470 12.9470 13.7610 13.7610 15.2305 15.2305 15.2909 15.2909 16.0885 16.0885 16.1709 16.1709 17.0537 17.0537 k = 0.5100 0.2598 0.2205 ( 6552 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2716 -10.2716 -8.3579 -8.3579 -8.0016 -8.0016 -7.9414 -7.9414 -7.4881 -7.4881 -7.2947 -7.2947 -7.2941 -7.2941 -7.1269 -7.1269 -7.0237 -7.0237 -6.7821 -6.7821 -4.7466 -4.7466 -4.7348 -4.7348 -4.7319 -4.7319 -4.7288 -4.7288 -4.6596 -4.6596 -4.6547 -4.6547 0.0978 0.0978 2.5746 2.5746 2.7877 2.7877 3.3136 3.3136 4.2323 4.2323 4.4447 4.4447 5.6393 5.6393 5.8031 5.8031 6.5862 6.5862 6.7692 6.7692 7.0382 7.0382 7.0434 7.0434 8.3137 8.3137 8.3578 8.3578 8.4225 8.4225 8.4678 8.4678 8.7710 8.7710 8.7849 8.7849 8.8239 8.8239 8.8827 8.8827 12.8093 12.8093 12.9509 12.9509 13.7634 13.7634 15.2232 15.2232 15.2837 15.2837 16.0867 16.0867 16.1696 16.1696 17.0602 17.0602 k = 0.5150 0.2454 0.2286 ( 6546 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2708 -10.2708 -8.3556 -8.3556 -8.0016 -8.0016 -7.9426 -7.9426 -7.4874 -7.4874 -7.2953 -7.2953 -7.2943 -7.2943 -7.1316 -7.1316 -7.0204 -7.0204 -6.7834 -6.7834 -4.7472 -4.7472 -4.7363 -4.7363 -4.7316 -4.7316 -4.7275 -4.7275 -4.6600 -4.6600 -4.6551 -4.6551 0.1026 0.1026 2.5738 2.5738 2.7814 2.7814 3.3144 3.3144 4.2326 4.2326 4.4447 4.4447 5.6492 5.6492 5.8125 5.8125 6.5820 6.5820 6.7604 6.7604 7.0458 7.0458 7.0565 7.0565 8.2859 8.2859 8.3529 8.3529 8.4436 8.4436 8.4630 8.4630 8.7664 8.7664 8.7839 8.7839 8.8204 8.8204 8.8814 8.8814 12.8141 12.8141 12.9572 12.9572 13.7674 13.7674 15.2112 15.2112 15.2721 15.2721 16.0835 16.0835 16.1672 16.1672 17.0710 17.0710 k = 0.5200 0.2309 0.2368 ( 6555 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2697 -10.2697 -8.3524 -8.3524 -8.0018 -8.0018 -7.9442 -7.9442 -7.4866 -7.4866 -7.2962 -7.2962 -7.2945 -7.2945 -7.1378 -7.1378 -7.0164 -7.0164 -6.7853 -6.7853 -4.7479 -4.7479 -4.7380 -4.7380 -4.7312 -4.7312 -4.7264 -4.7264 -4.6606 -4.6606 -4.6559 -4.6559 0.1092 0.1092 2.5726 2.5726 2.7728 2.7728 3.3159 3.3159 4.2329 4.2329 4.4445 4.4445 5.6626 5.6626 5.8257 5.8257 6.5765 6.5765 6.7494 6.7494 7.0563 7.0563 7.0734 7.0734 8.2544 8.2544 8.3467 8.3467 8.4560 8.4560 8.4651 8.4651 8.7546 8.7546 8.7860 8.7860 8.8170 8.8170 8.8801 8.8801 12.8206 12.8206 12.9658 12.9658 13.7729 13.7729 15.1946 15.1946 15.2565 15.2565 16.0787 16.0787 16.1637 16.1637 17.0861 17.0861 k = 0.5250 0.2165 0.2449 ( 6560 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2683 -10.2683 -8.3484 -8.3484 -8.0020 -8.0020 -7.9462 -7.9462 -7.4855 -7.4855 -7.2973 -7.2973 -7.2949 -7.2949 -7.1450 -7.1450 -7.0118 -7.0118 -6.7876 -6.7876 -4.7488 -4.7488 -4.7396 -4.7396 -4.7308 -4.7308 -4.7253 -4.7253 -4.6612 -4.6612 -4.6568 -4.6568 0.1176 0.1176 2.5709 2.5709 2.7618 2.7618 3.3183 3.3183 4.2332 4.2332 4.4443 4.4443 5.6792 5.6792 5.8425 5.8425 6.5697 6.5697 6.7372 6.7372 7.0695 7.0695 7.0933 7.0933 8.2198 8.2198 8.3384 8.3384 8.4492 8.4492 8.4858 8.4858 8.7363 8.7363 8.7905 8.7905 8.8136 8.8136 8.8794 8.8794 12.8283 12.8283 12.9765 12.9765 13.7799 13.7799 15.1738 15.1738 15.2375 15.2375 16.0717 16.0717 16.1595 16.1595 17.1053 17.1053 k = 0.5300 0.2021 0.2531 ( 6564 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2666 -10.2666 -8.3434 -8.3434 -8.0024 -8.0024 -7.9485 -7.9485 -7.4843 -7.4843 -7.2987 -7.2987 -7.2952 -7.2952 -7.1530 -7.1530 -7.0069 -7.0069 -6.7903 -6.7903 -4.7498 -4.7498 -4.7412 -4.7412 -4.7304 -4.7304 -4.7244 -4.7244 -4.6621 -4.6621 -4.6578 -4.6578 0.1277 0.1277 2.5684 2.5684 2.7489 2.7489 3.3220 3.3220 4.2334 4.2334 4.4438 4.4438 5.6988 5.6988 5.8629 5.8629 6.5620 6.5620 6.7244 6.7244 7.0852 7.0852 7.1155 7.1155 8.1821 8.1821 8.3272 8.3272 8.4419 8.4419 8.5069 8.5069 8.7127 8.7127 8.7963 8.7963 8.8093 8.8093 8.8799 8.8799 12.8369 12.8369 12.9890 12.9890 13.7884 13.7884 15.1490 15.1490 15.2160 15.2160 16.0619 16.0619 16.1548 16.1548 17.1285 17.1285 k = 0.5350 0.1876 0.2613 ( 6570 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2647 -10.2647 -8.3377 -8.3377 -8.0032 -8.0032 -7.9509 -7.9509 -7.4830 -7.4830 -7.3003 -7.3003 -7.2957 -7.2957 -7.1615 -7.1615 -7.0020 -7.0020 -6.7935 -6.7935 -4.7509 -4.7509 -4.7429 -4.7429 -4.7301 -4.7301 -4.7236 -4.7236 -4.6630 -4.6630 -4.6588 -4.6588 0.1394 0.1394 2.5650 2.5650 2.7341 2.7341 3.3271 3.3271 4.2334 4.2334 4.4431 4.4431 5.7208 5.7208 5.8865 5.8865 6.5536 6.5536 6.7117 6.7117 7.1032 7.1032 7.1395 7.1395 8.1415 8.1415 8.3126 8.3126 8.4351 8.4351 8.5284 8.5284 8.6848 8.6848 8.8011 8.8011 8.8057 8.8057 8.8821 8.8821 12.8460 12.8460 13.0029 13.0029 13.7981 13.7981 15.1205 15.1205 15.1929 15.1929 16.0483 16.0483 16.1503 16.1503 17.1556 17.1556 k = 0.5400 0.1732 0.2694 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2625 -10.2625 -8.3310 -8.3310 -8.0043 -8.0043 -7.9534 -7.9534 -7.4815 -7.4815 -7.3021 -7.3021 -7.2962 -7.2962 -7.1704 -7.1704 -6.9970 -6.9970 -6.7970 -6.7970 -4.7521 -4.7521 -4.7444 -4.7444 -4.7298 -4.7298 -4.7230 -4.7230 -4.6640 -4.6640 -4.6598 -4.6598 0.1526 0.1526 2.5607 2.5607 2.7177 2.7177 3.3342 3.3342 4.2331 4.2331 4.4421 4.4421 5.7452 5.7452 5.9131 5.9131 6.5448 6.5448 6.6996 6.6996 7.1234 7.1234 7.1648 7.1648 8.0978 8.0978 8.2944 8.2944 8.4291 8.4291 8.5500 8.5500 8.6536 8.6536 8.7944 8.7944 8.8127 8.8127 8.8862 8.8862 12.8551 12.8551 13.0181 13.0181 13.8092 13.8092 15.0889 15.0889 15.1687 15.1687 16.0303 16.0303 16.1463 16.1463 17.1864 17.1864 k = 0.5450 0.1588 0.2776 ( 6561 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2602 -10.2602 -8.3236 -8.3236 -8.0059 -8.0059 -7.9558 -7.9558 -7.4800 -7.4800 -7.3041 -7.3041 -7.2967 -7.2967 -7.1794 -7.1794 -6.9922 -6.9922 -6.8008 -6.8008 -4.7533 -4.7533 -4.7460 -4.7460 -4.7296 -4.7296 -4.7225 -4.7225 -4.6653 -4.6653 -4.6607 -4.6607 0.1671 0.1671 2.5553 2.5553 2.7000 2.7000 3.3433 3.3433 4.2323 4.2323 4.4408 4.4408 5.7715 5.7715 5.9421 5.9421 6.5358 6.5358 6.6884 6.6884 7.1455 7.1455 7.1912 7.1912 8.0514 8.0514 8.2726 8.2726 8.4240 8.4240 8.5704 8.5704 8.6213 8.6213 8.7843 8.7843 8.8221 8.8221 8.8921 8.8921 12.8633 12.8633 13.0340 13.0340 13.8213 13.8213 15.0551 15.0551 15.1443 15.1443 16.0073 16.0073 16.1432 16.1432 17.2207 17.2207 k = 0.5500 0.1443 0.2858 ( 6563 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2576 -10.2576 -8.3155 -8.3155 -8.0083 -8.0083 -7.9579 -7.9579 -7.4785 -7.4785 -7.3062 -7.3062 -7.2974 -7.2974 -7.1885 -7.1885 -6.9876 -6.9876 -6.8048 -6.8048 -4.7546 -4.7546 -4.7475 -4.7475 -4.7295 -4.7295 -4.7223 -4.7223 -4.6667 -4.6667 -4.6614 -4.6614 0.1829 0.1829 2.5488 2.5488 2.6812 2.6812 3.3548 3.3548 4.2312 4.2312 4.4390 4.4390 5.7995 5.7995 5.9727 5.9727 6.5268 6.5268 6.6785 6.6785 7.1694 7.1694 7.2184 7.2184 8.0022 8.0022 8.2474 8.2474 8.4197 8.4197 8.5704 8.5704 8.6075 8.6075 8.7722 8.7722 8.8326 8.8326 8.8995 8.8995 12.8702 12.8702 13.0506 13.0506 13.8345 13.8345 15.0200 15.0200 15.1200 15.1200 15.9796 15.9796 16.1408 16.1408 17.2581 17.2581 k = 0.5550 0.1299 0.2939 ( 6569 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2549 -10.2549 -8.3066 -8.3066 -8.0114 -8.0114 -7.9597 -7.9597 -7.4772 -7.4772 -7.3085 -7.3085 -7.2982 -7.2982 -7.1976 -7.1976 -6.9833 -6.9833 -6.8091 -6.8091 -4.7559 -4.7559 -4.7490 -4.7490 -4.7296 -4.7296 -4.7223 -4.7223 -4.6683 -4.6683 -4.6619 -4.6619 0.1997 0.1997 2.5411 2.5411 2.6616 2.6616 3.3687 3.3687 4.2294 4.2294 4.4368 4.4368 5.8291 5.8291 6.0041 6.0041 6.5180 6.5180 6.6705 6.6705 7.1950 7.1950 7.2463 7.2463 7.9506 7.9506 8.2192 8.2192 8.4161 8.4161 8.5362 8.5362 8.6267 8.6267 8.7584 8.7584 8.8441 8.8441 8.9081 8.9081 12.8749 12.8749 13.0673 13.0673 13.8485 13.8485 14.9846 14.9846 15.0961 15.0961 15.9473 15.9473 16.1389 16.1389 17.2984 17.2984 k = 0.5600 0.1155 0.3021 ( 6559 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2520 -10.2520 -8.2970 -8.2970 -8.0154 -8.0154 -7.9610 -7.9610 -7.4760 -7.4760 -7.3108 -7.3108 -7.2989 -7.2989 -7.2063 -7.2063 -6.9792 -6.9792 -6.8133 -6.8133 -4.7571 -4.7571 -4.7505 -4.7505 -4.7297 -4.7297 -4.7224 -4.7224 -4.6700 -4.6700 -4.6622 -4.6622 0.2174 0.2174 2.5322 2.5322 2.6416 2.6416 3.3850 3.3850 4.2272 4.2272 4.4341 4.4341 5.8603 5.8603 6.0353 6.0353 6.5096 6.5096 6.6649 6.6649 7.2222 7.2222 7.2747 7.2747 7.8967 7.8967 8.1884 8.1884 8.4130 8.4130 8.4963 8.4963 8.6508 8.6508 8.7431 8.7431 8.8567 8.8567 8.9179 8.9179 12.8769 12.8769 13.0840 13.0840 13.8633 13.8633 14.9500 14.9500 15.0731 15.0731 15.9111 15.9111 16.1374 16.1374 17.3411 17.3411 k = 0.5650 0.1010 0.3103 ( 6569 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2491 -10.2491 -8.2868 -8.2868 -8.0202 -8.0202 -7.9619 -7.9619 -7.4751 -7.4751 -7.3133 -7.3133 -7.2999 -7.2999 -7.2148 -7.2148 -6.9756 -6.9756 -6.8177 -6.8177 -4.7585 -4.7585 -4.7519 -4.7519 -4.7300 -4.7300 -4.7229 -4.7229 -4.6719 -4.6719 -4.6622 -4.6622 0.2358 0.2358 2.5223 2.5223 2.6214 2.6214 3.4036 3.4036 4.2243 4.2243 4.4310 4.4310 5.8928 5.8928 6.0652 6.0652 6.5016 6.5016 6.6621 6.6621 7.2506 7.2506 7.3034 7.3034 7.8408 7.8408 8.1553 8.1553 8.4100 8.4100 8.4551 8.4551 8.6759 8.6759 8.7265 8.7265 8.8704 8.8704 8.9285 8.9285 12.8754 12.8754 13.1003 13.1003 13.8786 13.8786 14.9170 14.9170 15.0512 15.0512 15.8715 15.8715 16.1361 16.1361 17.3859 17.3859 k = 0.5700 0.0866 0.3184 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2461 -10.2461 -8.2760 -8.2760 -8.0257 -8.0257 -7.9623 -7.9623 -7.4746 -7.4746 -7.3156 -7.3156 -7.3010 -7.3010 -7.2228 -7.2228 -6.9724 -6.9724 -6.8219 -6.8219 -4.7597 -4.7597 -4.7533 -4.7533 -4.7304 -4.7304 -4.7236 -4.7236 -4.6737 -4.6737 -4.6620 -4.6620 0.2545 0.2545 2.5114 2.5114 2.6014 2.6014 3.4245 3.4245 4.2209 4.2209 4.4275 4.4275 5.9264 5.9264 6.0928 6.0928 6.4942 6.4942 6.6629 6.6629 7.2802 7.2802 7.3324 7.3324 7.7833 7.7833 8.1203 8.1203 8.4042 8.4042 8.4164 8.4164 8.7012 8.7012 8.7089 8.7089 8.8851 8.8851 8.9399 8.9399 12.8699 12.8699 13.1160 13.1160 13.8944 13.8944 14.8867 14.8867 15.0306 15.0306 15.8292 15.8292 16.1348 16.1348 17.4322 17.4322 k = 0.5750 0.0722 0.3266 ( 6580 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2431 -10.2431 -8.2648 -8.2648 -8.0319 -8.0319 -7.9624 -7.9624 -7.4746 -7.4746 -7.3178 -7.3178 -7.3022 -7.3022 -7.2303 -7.2303 -6.9697 -6.9697 -6.8260 -6.8260 -4.7610 -4.7610 -4.7547 -4.7547 -4.7309 -4.7309 -4.7245 -4.7245 -4.6757 -4.6757 -4.6616 -4.6616 0.2735 0.2735 2.4996 2.4996 2.5821 2.5821 3.4472 3.4472 4.2171 4.2171 4.4234 4.4234 5.9610 5.9610 6.1169 6.1169 6.4872 6.4872 6.6678 6.6678 7.3107 7.3107 7.3615 7.3615 7.7245 7.7245 8.0838 8.0838 8.3698 8.3698 8.4067 8.4067 8.6900 8.6900 8.7266 8.7266 8.9011 8.9011 8.9520 8.9520 12.8601 12.8601 13.1307 13.1307 13.9105 13.9105 14.8597 14.8597 15.0116 15.0116 15.7850 15.7850 16.1337 16.1337 17.4794 17.4794 k = 0.5800 0.0577 0.3348 ( 6577 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2401 -10.2401 -8.2531 -8.2531 -8.0385 -8.0385 -7.9623 -7.9623 -7.4750 -7.4750 -7.3198 -7.3198 -7.3034 -7.3034 -7.2371 -7.2371 -6.9675 -6.9675 -6.8297 -6.8297 -4.7622 -4.7622 -4.7561 -4.7561 -4.7315 -4.7315 -4.7255 -4.7255 -4.6775 -4.6775 -4.6610 -4.6610 0.2924 0.2924 2.4869 2.4869 2.5638 2.5638 3.4716 3.4716 4.2130 4.2130 4.4190 4.4190 5.9960 5.9960 6.1372 6.1372 6.4806 6.4806 6.6772 6.6772 7.3419 7.3419 7.3906 7.3906 7.6651 7.6651 8.0463 8.0463 8.3293 8.3293 8.4039 8.4039 8.6704 8.6704 8.7508 8.7508 8.9186 8.9186 8.9647 8.9647 12.8458 12.8458 13.1442 13.1442 13.9266 13.9266 14.8366 14.8366 14.9944 14.9944 15.7396 15.7396 16.1327 16.1327 17.5270 17.5270 k = 0.5850 0.0433 0.3429 ( 6582 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2372 -10.2372 -8.2411 -8.2411 -8.0455 -8.0455 -7.9620 -7.9620 -7.4761 -7.4761 -7.3216 -7.3216 -7.3048 -7.3048 -7.2433 -7.2433 -6.9658 -6.9658 -6.8332 -6.8332 -4.7633 -4.7633 -4.7574 -4.7574 -4.7321 -4.7321 -4.7267 -4.7267 -4.6793 -4.6793 -4.6601 -4.6601 0.3110 0.3110 2.4734 2.4734 2.5469 2.5469 3.4970 3.4970 4.2088 4.2088 4.4142 4.4142 6.0305 6.0305 6.1538 6.1538 6.4744 6.4744 6.6911 6.6911 7.3731 7.3731 7.4192 7.4192 7.6059 7.6059 8.0081 8.0081 8.2900 8.2900 8.4012 8.4012 8.6501 8.6501 8.7733 8.7733 8.9377 8.9377 8.9778 8.9778 12.8269 12.8269 13.1562 13.1562 13.9425 13.9425 14.8180 14.8180 14.9791 14.9791 15.6939 15.6939 16.1320 16.1320 17.5744 17.5744 k = 0.5900 0.0289 0.3511 ( 6579 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2344 -10.2344 -8.2288 -8.2288 -8.0528 -8.0528 -7.9616 -7.9616 -7.4778 -7.4778 -7.3229 -7.3229 -7.3063 -7.3063 -7.2488 -7.2488 -6.9646 -6.9646 -6.8362 -6.8362 -4.7643 -4.7643 -4.7587 -4.7587 -4.7328 -4.7328 -4.7280 -4.7280 -4.6810 -4.6810 -4.6591 -4.6591 0.3289 0.3289 2.4593 2.4593 2.5318 2.5318 3.5231 3.5231 4.2047 4.2047 4.4090 4.4090 6.0625 6.0625 6.1686 6.1686 6.4683 6.4683 6.7090 6.7090 7.4031 7.4031 7.4460 7.4460 7.5498 7.5498 7.9698 7.9698 8.2525 8.2525 8.3986 8.3986 8.6293 8.6293 8.7935 8.7935 8.9586 8.9586 8.9914 8.9914 12.8037 12.8037 13.1666 13.1666 13.9581 13.9581 14.8039 14.8039 14.9658 14.9658 15.6486 15.6486 16.1317 16.1317 17.6207 17.6207 k = 0.5950 0.0144 0.3593 ( 6577 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2318 -10.2318 -8.2165 -8.2165 -8.0601 -8.0601 -7.9613 -7.9613 -7.4802 -7.4802 -7.3239 -7.3239 -7.3078 -7.3078 -7.2535 -7.2535 -6.9640 -6.9640 -6.8386 -6.8386 -4.7653 -4.7653 -4.7600 -4.7600 -4.7335 -4.7335 -4.7293 -4.7293 -4.6826 -4.6826 -4.6579 -4.6579 0.3460 0.3460 2.4447 2.4447 2.5187 2.5187 3.5494 3.5494 4.2011 4.2011 4.4035 4.4035 6.0879 6.0879 6.1856 6.1856 6.4622 6.4622 6.7299 6.7299 7.4249 7.4249 7.4628 7.4628 7.5121 7.5121 7.9321 7.9321 8.2175 8.2175 8.3957 8.3957 8.6079 8.6079 8.8104 8.8104 8.9815 8.9815 9.0053 9.0053 12.7766 12.7766 13.1753 13.1753 13.9731 13.9731 14.7946 14.7946 14.9547 14.9547 15.6045 15.6045 16.1318 16.1318 17.6654 17.6654 k = 0.6000 0.0000 0.3674 ( 6572 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2293 -10.2293 -8.2042 -8.2042 -8.0673 -8.0673 -7.9610 -7.9610 -7.4832 -7.4832 -7.3244 -7.3244 -7.3094 -7.3094 -7.2574 -7.2574 -6.9640 -6.9640 -6.8405 -6.8405 -4.7662 -4.7662 -4.7613 -4.7613 -4.7341 -4.7341 -4.7307 -4.7307 -4.6841 -4.6841 -4.6565 -4.6565 0.3619 0.3619 2.4299 2.4299 2.5079 2.5079 3.5752 3.5752 4.1981 4.1981 4.3977 4.3977 6.1021 6.1021 6.2101 6.2101 6.4560 6.4560 6.7523 6.7523 7.4017 7.4017 7.4764 7.4764 7.5230 7.5230 7.8958 7.8958 8.1854 8.1854 8.3927 8.3927 8.5863 8.5863 8.8238 8.8238 9.0059 9.0059 9.0195 9.0195 12.7463 12.7463 13.1823 13.1823 13.9871 13.9871 14.7899 14.7899 14.9457 14.9457 15.5624 15.5624 16.1327 16.1327 17.7077 17.7077 k = 0.6050-0.0144 0.3756 ( 6582 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2271 -10.2271 -8.1923 -8.1923 -8.0741 -8.0741 -7.9609 -7.9609 -7.4867 -7.4867 -7.3247 -7.3247 -7.3110 -7.3110 -7.2606 -7.2606 -6.9644 -6.9644 -6.8418 -6.8418 -4.7670 -4.7670 -4.7627 -4.7627 -4.7348 -4.7348 -4.7321 -4.7321 -4.6856 -4.6856 -4.6551 -4.6551 0.3762 0.3762 2.4152 2.4152 2.4993 2.4993 3.5999 3.5999 4.1960 4.1960 4.3919 4.3919 6.1045 6.1045 6.2431 6.2431 6.4495 6.4495 6.7742 6.7742 7.3513 7.3513 7.5009 7.5009 7.5508 7.5508 7.8618 7.8618 8.1568 8.1568 8.3893 8.3893 8.5644 8.5644 8.8331 8.8331 9.0315 9.0315 9.0339 9.0339 12.7135 12.7135 13.1876 13.1876 14.0001 14.0001 14.7897 14.7897 14.9389 14.9389 15.5231 15.5231 16.1346 16.1346 17.7470 17.7470 k = 0.6100-0.0289 0.3838 ( 6576 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2252 -10.2252 -8.1810 -8.1810 -8.0803 -8.0803 -7.9609 -7.9609 -7.4907 -7.4907 -7.3245 -7.3245 -7.3125 -7.3125 -7.2630 -7.2630 -6.9652 -6.9652 -6.8426 -6.8426 -4.7677 -4.7677 -4.7639 -4.7639 -4.7353 -4.7353 -4.7333 -4.7333 -4.6869 -4.6869 -4.6535 -4.6535 0.3888 0.3888 2.4011 2.4011 2.4931 2.4931 3.6231 3.6231 4.1950 4.1950 4.3861 4.3861 6.0988 6.0988 6.2819 6.2819 6.4425 6.4425 6.7935 6.7935 7.3000 7.3000 7.5240 7.5240 7.5819 7.5819 7.8317 7.8317 8.1320 8.1320 8.3857 8.3857 8.5425 8.5425 8.8381 8.8381 9.0484 9.0484 9.0576 9.0576 12.6792 12.6792 13.1916 13.1916 14.0116 14.0116 14.7935 14.7935 14.9343 14.9343 15.4872 15.4872 16.1375 16.1375 17.7828 17.7828 k = 0.6150-0.0433 0.3919 ( 6577 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2237 -10.2237 -8.1709 -8.1709 -8.0854 -8.0854 -7.9612 -7.9612 -7.4951 -7.4951 -7.3241 -7.3241 -7.3139 -7.3139 -7.2647 -7.2647 -6.9664 -6.9664 -6.8427 -6.8427 -4.7684 -4.7684 -4.7651 -4.7651 -4.7358 -4.7358 -4.7345 -4.7345 -4.6882 -4.6882 -4.6519 -4.6519 0.3993 0.3993 2.3879 2.3879 2.4891 2.4891 3.6441 3.6441 4.1948 4.1948 4.3808 4.3808 6.0882 6.0882 6.3240 6.3240 6.4345 6.4345 6.8070 6.8070 7.2533 7.2533 7.5423 7.5423 7.6143 7.6143 7.8076 7.8076 8.1113 8.1113 8.3817 8.3817 8.5207 8.5207 8.8387 8.8387 9.0630 9.0630 9.0834 9.0834 12.6444 12.6444 13.1945 13.1945 14.0213 14.0213 14.8011 14.8011 14.9319 14.9319 15.4553 15.4553 16.1417 16.1417 17.8146 17.8146 k = 0.6200-0.0577 0.4001 ( 6579 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2225 -10.2225 -8.1625 -8.1625 -8.0888 -8.0888 -7.9618 -7.9618 -7.4996 -7.4996 -7.3236 -7.3236 -7.3150 -7.3150 -7.2657 -7.2657 -6.9678 -6.9678 -6.8424 -6.8424 -4.7691 -4.7691 -4.7660 -4.7660 -4.7362 -4.7362 -4.7355 -4.7355 -4.6893 -4.6893 -4.6502 -4.6502 0.4075 0.4075 2.3758 2.3758 2.4874 2.4874 3.6628 3.6628 4.1953 4.1953 4.3762 4.3762 6.0747 6.0747 6.3681 6.3681 6.4253 6.4253 6.8115 6.8115 7.2150 7.2150 7.5537 7.5537 7.6475 7.6475 7.7917 7.7917 8.0951 8.0951 8.3773 8.3773 8.4990 8.4990 8.8346 8.8346 9.0777 9.0777 9.1079 9.1079 12.6103 12.6103 13.1968 13.1968 14.0290 14.0290 14.8119 14.8119 14.9317 14.9317 15.4279 15.4279 16.1473 16.1473 17.8421 17.8421 k = 0.6250-0.0722 0.4082 ( 6587 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2217 -10.2217 -8.1568 -8.1568 -8.0896 -8.0896 -7.9627 -7.9627 -7.5042 -7.5042 -7.3231 -7.3231 -7.3159 -7.3159 -7.2661 -7.2661 -6.9694 -6.9694 -6.8415 -6.8415 -4.7700 -4.7700 -4.7667 -4.7667 -4.7366 -4.7366 -4.7362 -4.7362 -4.6904 -4.6904 -4.6485 -4.6485 0.4131 0.4131 2.3651 2.3651 2.4881 2.4881 3.6788 3.6788 4.1958 4.1958 4.3728 4.3728 6.0597 6.0597 6.4109 6.4109 6.4167 6.4167 6.8039 6.8039 7.1880 7.1880 7.5567 7.5567 7.6810 7.6810 7.7861 7.7861 8.0835 8.0835 8.3725 8.3725 8.4778 8.4778 8.8257 8.8257 9.0923 9.0923 9.1304 9.1304 12.5779 12.5779 13.1989 13.1989 14.0344 14.0344 14.8254 14.8254 14.9339 14.9339 15.4053 15.4053 16.1547 16.1547 17.8651 17.8651 k = 0.6250-0.0722 0.4082 ( 6587 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2217 -10.2217 -8.1568 -8.1568 -8.0896 -8.0896 -7.9627 -7.9627 -7.5042 -7.5042 -7.3231 -7.3231 -7.3159 -7.3159 -7.2661 -7.2661 -6.9694 -6.9694 -6.8415 -6.8415 -4.7700 -4.7700 -4.7667 -4.7667 -4.7366 -4.7366 -4.7362 -4.7362 -4.6904 -4.6904 -4.6485 -4.6485 0.4131 0.4131 2.3651 2.3651 2.4881 2.4881 3.6788 3.6788 4.1958 4.1958 4.3728 4.3728 6.0597 6.0597 6.4109 6.4109 6.4167 6.4167 6.8039 6.8039 7.1880 7.1880 7.5567 7.5567 7.6810 7.6810 7.7861 7.7861 8.0835 8.0835 8.3725 8.3725 8.4778 8.4778 8.8257 8.8257 9.0923 9.0923 9.1304 9.1304 12.5779 12.5779 13.1989 13.1989 14.0344 14.0344 14.8254 14.8254 14.9339 14.9339 15.4053 15.4053 16.1547 16.1547 17.8651 17.8651 k = 0.6161-0.0670 0.4228 ( 6573 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2216 -10.2216 -8.1565 -8.1565 -8.0893 -8.0893 -7.9633 -7.9633 -7.5040 -7.5040 -7.3231 -7.3231 -7.3158 -7.3158 -7.2662 -7.2662 -6.9692 -6.9692 -6.8418 -6.8418 -4.7699 -4.7699 -4.7666 -4.7666 -4.7368 -4.7368 -4.7360 -4.7360 -4.6903 -4.6903 -4.6486 -4.6486 0.4136 0.4136 2.3651 2.3651 2.4874 2.4874 3.6796 3.6796 4.1953 4.1953 4.3721 4.3721 6.0605 6.0605 6.4124 6.4124 6.4185 6.4185 6.8033 6.8033 7.1854 7.1854 7.5558 7.5558 7.6831 7.6831 7.7875 7.7875 8.0810 8.0810 8.3689 8.3689 8.4812 8.4812 8.8273 8.8273 9.0906 9.0906 9.1301 9.1301 12.5799 12.5799 13.1979 13.1979 14.0348 14.0348 14.8249 14.8249 14.9332 14.9332 15.4071 15.4071 16.1512 16.1512 17.8664 17.8664 k = 0.6071-0.0619 0.4374 ( 6571 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2215 -10.2215 -8.1557 -8.1557 -8.0886 -8.0886 -7.9652 -7.9652 -7.5033 -7.5033 -7.3233 -7.3233 -7.3158 -7.3158 -7.2667 -7.2667 -6.9684 -6.9684 -6.8425 -6.8425 -4.7700 -4.7700 -4.7666 -4.7666 -4.7370 -4.7370 -4.7356 -4.7356 -4.6901 -4.6901 -4.6491 -4.6491 0.4148 0.4148 2.3652 2.3652 2.4854 2.4854 3.6822 3.6822 4.1938 4.1938 4.3701 4.3701 6.0628 6.0628 6.4167 6.4167 6.4241 6.4241 6.8013 6.8013 7.1776 7.1776 7.5534 7.5534 7.6892 7.6892 7.7918 7.7918 8.0737 8.0737 8.3581 8.3581 8.4912 8.4912 8.8323 8.8323 9.0858 9.0858 9.1293 9.1293 12.5856 12.5856 13.1951 13.1951 14.0359 14.0359 14.8234 14.8234 14.9310 14.9310 15.4125 15.4125 16.1407 16.1407 17.8702 17.8702 k = 0.5982-0.0567 0.4520 ( 6578 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2212 -10.2212 -8.1543 -8.1543 -8.0873 -8.0873 -7.9684 -7.9684 -7.5022 -7.5022 -7.3236 -7.3236 -7.3159 -7.3159 -7.2676 -7.2676 -6.9673 -6.9673 -6.8438 -6.8438 -4.7702 -4.7702 -4.7666 -4.7666 -4.7373 -4.7373 -4.7353 -4.7353 -4.6897 -4.6897 -4.6499 -4.6499 0.4169 0.4169 2.3653 2.3653 2.4821 2.4821 3.6864 3.6864 4.1914 4.1914 4.3668 4.3668 6.0665 6.0665 6.4233 6.4233 6.4336 6.4336 6.7978 6.7978 7.1648 7.1648 7.5501 7.5501 7.6984 7.6984 7.7986 7.7986 8.0624 8.0624 8.3406 8.3406 8.5068 8.5068 8.8403 8.8403 9.0777 9.0777 9.1277 9.1277 12.5950 12.5950 13.1903 13.1903 14.0377 14.0377 14.8209 14.8209 14.9277 14.9277 15.4213 15.4213 16.1237 16.1237 17.8764 17.8764 k = 0.5893-0.0515 0.4666 ( 6581 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2208 -10.2208 -8.1525 -8.1525 -8.0856 -8.0856 -7.9727 -7.9727 -7.5008 -7.5008 -7.3239 -7.3239 -7.3160 -7.3160 -7.2687 -7.2687 -6.9657 -6.9657 -6.8455 -6.8455 -4.7704 -4.7704 -4.7666 -4.7666 -4.7375 -4.7375 -4.7349 -4.7349 -4.6891 -4.6891 -4.6509 -4.6509 0.4197 0.4197 2.3655 2.3655 2.4776 2.4776 3.6920 3.6920 4.1881 4.1881 4.3624 4.3624 6.0716 6.0716 6.4320 6.4320 6.4471 6.4471 6.7929 6.7929 7.1476 7.1476 7.5470 7.5470 7.7100 7.7100 7.8077 7.8077 8.0483 8.0483 8.3169 8.3169 8.5271 8.5271 8.8508 8.8508 9.0665 9.0665 9.1255 9.1255 12.6079 12.6079 13.1836 13.1836 14.0401 14.0401 14.8173 14.8173 14.9236 14.9236 15.4332 15.4332 16.1006 16.1006 17.8847 17.8847 k = 0.5804-0.0464 0.4811 ( 6576 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2203 -10.2203 -8.1501 -8.1501 -8.0833 -8.0833 -7.9780 -7.9780 -7.4990 -7.4990 -7.3243 -7.3243 -7.3161 -7.3161 -7.2700 -7.2700 -6.9638 -6.9638 -6.8476 -6.8476 -4.7706 -4.7706 -4.7666 -4.7666 -4.7378 -4.7378 -4.7346 -4.7346 -4.6883 -4.6883 -4.6522 -4.6522 0.4231 0.4231 2.3660 2.3660 2.4720 2.4720 3.6989 3.6989 4.1840 4.1840 4.3571 4.3571 6.0778 6.0778 6.4428 6.4428 6.4642 6.4642 6.7865 6.7865 7.1263 7.1263 7.5447 7.5447 7.7232 7.7232 7.8187 7.8187 8.0324 8.0324 8.2879 8.2879 8.5510 8.5510 8.8635 8.8635 9.0525 9.0525 9.1225 9.1225 12.6237 12.6237 13.1749 13.1749 14.0430 14.0430 14.8127 14.8127 14.9191 14.9191 15.4479 15.4479 16.0721 16.0721 17.8948 17.8948 k = 0.5714-0.0412 0.4957 ( 6588 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2197 -10.2197 -8.1473 -8.1473 -8.0807 -8.0807 -7.9843 -7.9843 -7.4971 -7.4971 -7.3248 -7.3248 -7.3162 -7.3162 -7.2717 -7.2717 -6.9616 -6.9616 -6.8501 -6.8501 -4.7709 -4.7709 -4.7667 -4.7667 -4.7380 -4.7380 -4.7343 -4.7343 -4.6873 -4.6873 -4.6538 -4.6538 0.4270 0.4270 2.3667 2.3667 2.4654 2.4654 3.7068 3.7068 4.1794 4.1794 4.3512 4.3512 6.0849 6.0849 6.4557 6.4557 6.4844 6.4844 6.7784 6.7784 7.1016 7.1016 7.5438 7.5438 7.7374 7.7374 7.8313 7.8313 8.0159 8.0159 8.2543 8.2543 8.5776 8.5776 8.8779 8.8779 9.0358 9.0358 9.1186 9.1186 12.6422 12.6422 13.1643 13.1643 14.0463 14.0463 14.8072 14.8072 14.9147 14.9147 15.4651 15.4651 16.0391 16.0391 17.9061 17.9061 k = 0.5625-0.0361 0.5103 ( 6602 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2191 -10.2191 -8.1442 -8.1442 -8.0776 -8.0776 -7.9915 -7.9915 -7.4951 -7.4951 -7.3254 -7.3254 -7.3165 -7.3165 -7.2734 -7.2734 -6.9592 -6.9592 -6.8528 -6.8528 -4.7711 -4.7711 -4.7668 -4.7668 -4.7383 -4.7383 -4.7340 -4.7340 -4.6862 -4.6862 -4.6557 -4.6557 0.4312 0.4312 2.3678 2.3678 2.4580 2.4580 3.7154 3.7154 4.1743 4.1743 4.3448 4.3448 6.0926 6.0926 6.4703 6.4703 6.5073 6.5073 6.7688 6.7688 7.0741 7.0741 7.5448 7.5448 7.7521 7.7521 7.8450 7.8450 7.9994 7.9994 8.2168 8.2168 8.6062 8.6062 8.8936 8.8936 9.0167 9.0167 9.1137 9.1137 12.6627 12.6627 13.1519 13.1519 14.0499 14.0499 14.8012 14.8012 14.9105 14.9105 15.4844 15.4844 16.0026 16.0026 17.9182 17.9182 k = 0.5536-0.0309 0.5249 ( 6600 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2185 -10.2185 -8.1408 -8.1408 -8.0741 -8.0741 -7.9992 -7.9992 -7.4929 -7.4929 -7.3258 -7.3258 -7.3166 -7.3166 -7.2751 -7.2751 -6.9567 -6.9567 -6.8556 -6.8556 -4.7713 -4.7713 -4.7668 -4.7668 -4.7385 -4.7385 -4.7338 -4.7338 -4.6848 -4.6848 -4.6576 -4.6576 0.4356 0.4356 2.3694 2.3694 2.4499 2.4499 3.7243 3.7243 4.1692 4.1692 4.3383 4.3383 6.1007 6.1007 6.4866 6.4866 6.5320 6.5320 6.7577 6.7577 7.0445 7.0445 7.5476 7.5476 7.7670 7.7670 7.8597 7.8597 7.9838 7.9838 8.1765 8.1765 8.6361 8.6361 8.9100 8.9100 8.9958 8.9958 9.1075 9.1075 12.6846 12.6846 13.1379 13.1379 14.0536 14.0536 14.7949 14.7949 14.9067 14.9067 15.5054 15.5054 15.9637 15.9637 17.9304 17.9304 k = 0.5446-0.0258 0.5395 ( 6610 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2178 -10.2178 -8.1372 -8.1372 -8.0703 -8.0703 -8.0073 -8.0073 -7.4909 -7.4909 -7.3263 -7.3263 -7.3169 -7.3169 -7.2768 -7.2768 -6.9542 -6.9542 -6.8584 -6.8584 -4.7715 -4.7715 -4.7669 -4.7669 -4.7388 -4.7388 -4.7336 -4.7336 -4.6832 -4.6832 -4.6598 -4.6598 0.4399 0.4399 2.3717 2.3717 2.4413 2.4413 3.7330 3.7330 4.1644 4.1644 4.3318 4.3318 6.1086 6.1086 6.5043 6.5043 6.5577 6.5577 6.7455 6.7455 7.0137 7.0137 7.5523 7.5523 7.7816 7.7816 7.8749 7.8749 7.9697 7.9697 8.1342 8.1342 8.6669 8.6669 8.9254 8.9254 8.9748 8.9748 9.1000 9.1000 12.7069 12.7069 13.1229 13.1229 14.0573 14.0573 14.7888 14.7888 14.9031 14.9031 15.5277 15.5277 15.9240 15.9240 17.9421 17.9421 k = 0.5357-0.0206 0.5541 ( 6610 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2172 -10.2172 -8.1336 -8.1336 -8.0663 -8.0663 -8.0157 -8.0157 -7.4891 -7.4891 -7.3267 -7.3267 -7.3171 -7.3171 -7.2784 -7.2784 -6.9519 -6.9519 -6.8611 -6.8611 -4.7715 -4.7715 -4.7670 -4.7670 -4.7390 -4.7390 -4.7335 -4.7335 -4.6815 -4.6815 -4.6621 -4.6621 0.4440 0.4440 2.3748 2.3748 2.4324 2.4324 3.7411 3.7411 4.1603 4.1603 4.3257 4.3257 6.1160 6.1160 6.5230 6.5230 6.5831 6.5831 6.7329 6.7329 6.9827 6.9827 7.5585 7.5585 7.7955 7.7955 7.8905 7.8905 7.9577 7.9577 8.0913 8.0913 8.6982 8.6982 8.9294 8.9294 8.9642 8.9642 9.0909 9.0909 12.7287 12.7287 13.1074 13.1074 14.0607 14.0607 14.7834 14.7834 14.8999 14.8999 15.5504 15.5504 15.8849 15.8849 17.9528 17.9528 k = 0.5268-0.0155 0.5686 ( 6622 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2167 -10.2167 -8.1303 -8.1303 -8.0620 -8.0620 -8.0238 -8.0238 -7.4875 -7.4875 -7.3271 -7.3271 -7.3174 -7.3174 -7.2798 -7.2798 -6.9499 -6.9499 -6.8634 -6.8634 -4.7717 -4.7717 -4.7672 -4.7672 -4.7392 -4.7392 -4.7334 -4.7334 -4.6795 -4.6795 -4.6645 -4.6645 0.4475 0.4475 2.3787 2.3787 2.4233 2.4233 3.7479 3.7479 4.1571 4.1571 4.3203 4.3203 6.1225 6.1225 6.5420 6.5420 6.6059 6.6059 6.7208 6.7208 6.9532 6.9532 7.5657 7.5657 7.8080 7.8080 7.9062 7.9062 7.9483 7.9483 8.0493 8.0493 8.7298 8.7298 8.9101 8.9101 8.9758 8.9758 9.0799 9.0799 12.7485 12.7485 13.0926 13.0926 14.0637 14.0637 14.7789 14.7789 14.8970 14.8970 15.5727 15.5727 15.8486 15.8486 17.9617 17.9617 k = 0.5179-0.0103 0.5832 ( 6620 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2163 -10.2163 -8.1274 -8.1274 -8.0578 -8.0578 -8.0313 -8.0313 -7.4863 -7.4863 -7.3273 -7.3273 -7.3176 -7.3176 -7.2808 -7.2808 -6.9483 -6.9483 -6.8653 -6.8653 -4.7717 -4.7717 -4.7673 -4.7673 -4.7393 -4.7393 -4.7334 -4.7334 -4.6775 -4.6775 -4.6669 -4.6669 0.4504 0.4504 2.3837 2.3837 2.4143 2.4143 3.7530 3.7530 4.1550 4.1550 4.3158 4.3158 6.1276 6.1276 6.5603 6.5603 6.6233 6.6233 6.7109 6.7109 6.9278 6.9278 7.5728 7.5728 7.8182 7.8182 7.9216 7.9216 7.9423 7.9423 8.0103 8.0103 8.7614 8.7614 8.8833 8.8833 8.9940 8.9940 9.0669 9.0669 12.7647 12.7647 13.0798 13.0798 14.0661 14.0661 14.7757 14.7757 14.8945 14.8945 15.5926 15.5926 15.8177 15.8177 17.9684 17.9684 k = 0.5089-0.0052 0.5978 ( 6620 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2160 -10.2160 -8.1254 -8.1254 -8.0541 -8.0541 -8.0373 -8.0373 -7.4856 -7.4856 -7.3274 -7.3274 -7.3178 -7.3178 -7.2815 -7.2815 -6.9473 -6.9473 -6.8665 -6.8665 -4.7717 -4.7717 -4.7674 -4.7674 -4.7394 -4.7394 -4.7334 -4.7334 -4.6754 -4.6754 -4.6692 -4.6692 0.4523 0.4523 2.3898 2.3898 2.4056 2.4056 3.7562 3.7562 4.1541 4.1541 4.3128 4.3128 6.1309 6.1309 6.5751 6.5751 6.6326 6.6326 6.7050 6.7050 6.9099 6.9099 7.5786 7.5786 7.8249 7.8249 7.9339 7.9339 7.9425 7.9425 7.9775 7.9775 8.7927 8.7927 8.8543 8.8543 9.0133 9.0133 9.0517 9.0517 12.7755 12.7755 13.0711 13.0711 14.0676 14.0676 14.7738 14.7738 14.8926 14.8926 15.6070 15.6070 15.7961 15.7961 17.9725 17.9725 k = 0.5000 0.0000 0.6124 ( 6620 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2159 -10.2159 -8.1246 -8.1246 -8.0524 -8.0524 -8.0398 -8.0398 -7.4853 -7.4853 -7.3274 -7.3274 -7.3179 -7.3179 -7.2817 -7.2817 -6.9470 -6.9470 -6.8669 -6.8669 -4.7717 -4.7717 -4.7674 -4.7674 -4.7394 -4.7394 -4.7334 -4.7334 -4.6741 -4.6741 -4.6705 -4.6705 0.4529 0.4529 2.3971 2.3971 2.3973 2.3973 3.7573 3.7573 4.1539 4.1539 4.3117 4.3117 6.1321 6.1321 6.5814 6.5814 6.6349 6.6349 6.7030 6.7030 6.9034 6.9034 7.5810 7.5810 7.8270 7.8270 7.9364 7.9364 7.9531 7.9531 7.9572 7.9572 8.8205 8.8205 8.8270 8.8270 9.0292 9.0292 9.0373 9.0373 12.7793 12.7793 13.0679 13.0679 14.0682 14.0682 14.7732 14.7732 14.8919 14.8919 15.6124 15.6124 15.7882 15.7882 17.9739 17.9739 k = 0.5000 0.0000 0.6124 ( 6620 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2159 -10.2159 -8.1246 -8.1246 -8.0524 -8.0524 -8.0398 -8.0398 -7.4853 -7.4853 -7.3274 -7.3274 -7.3179 -7.3179 -7.2817 -7.2817 -6.9470 -6.9470 -6.8669 -6.8669 -4.7717 -4.7717 -4.7674 -4.7674 -4.7394 -4.7394 -4.7334 -4.7334 -4.6741 -4.6741 -4.6705 -4.6705 0.4529 0.4529 2.3971 2.3971 2.3973 2.3973 3.7573 3.7573 4.1539 4.1539 4.3117 4.3117 6.1321 6.1321 6.5814 6.5814 6.6349 6.6349 6.7030 6.7030 6.9034 6.9034 7.5810 7.5810 7.8270 7.8270 7.9364 7.9364 7.9531 7.9531 7.9572 7.9572 8.8205 8.8205 8.8270 8.8270 9.0292 9.0292 9.0373 9.0373 12.7793 12.7793 13.0679 13.0679 14.0682 14.0682 14.7732 14.7732 14.8919 14.8919 15.6124 15.6124 15.7882 15.7882 17.9739 17.9739 k = 0.5000 0.0103 0.5978 ( 6620 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2161 -10.2161 -8.1261 -8.1261 -8.0542 -8.0542 -8.0368 -8.0368 -7.4851 -7.4851 -7.3275 -7.3275 -7.3177 -7.3177 -7.2815 -7.2815 -6.9471 -6.9471 -6.8666 -6.8666 -4.7716 -4.7716 -4.7673 -4.7673 -4.7393 -4.7393 -4.7333 -4.7333 -4.6741 -4.6741 -4.6705 -4.6705 0.4517 0.4517 2.3980 2.3980 2.3985 2.3985 3.7542 3.7542 4.1545 4.1545 4.3132 4.3132 6.1323 6.1323 6.5706 6.5706 6.6287 6.6287 6.7068 6.7068 6.9164 6.9164 7.5768 7.5768 7.8197 7.8197 7.9343 7.9343 7.9576 7.9576 7.9678 7.9678 8.8206 8.8206 8.8271 8.8271 9.0276 9.0276 9.0357 9.0357 12.7808 12.7808 13.0689 13.0689 14.0671 14.0671 14.7729 14.7729 14.8918 14.8918 15.6149 15.6149 15.7900 15.7900 17.9701 17.9701 k = 0.5000 0.0206 0.5832 ( 6614 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2166 -10.2166 -8.1307 -8.1307 -8.0569 -8.0569 -8.0305 -8.0305 -7.4845 -7.4845 -7.3277 -7.3277 -7.3172 -7.3172 -7.2806 -7.2806 -6.9473 -6.9473 -6.8659 -6.8659 -4.7714 -4.7714 -4.7670 -4.7670 -4.7391 -4.7391 -4.7330 -4.7330 -4.6741 -4.6741 -4.6705 -4.6705 0.4479 0.4479 2.4002 2.4002 2.4021 2.4021 3.7452 3.7452 4.1562 4.1562 4.3175 4.3175 6.1331 6.1331 6.5392 6.5392 6.6193 6.6193 6.7119 6.7119 6.9513 6.9513 7.5648 7.5648 7.8004 7.8004 7.9360 7.9360 7.9700 7.9700 7.9895 7.9895 8.8209 8.8209 8.8274 8.8274 9.0223 9.0223 9.0313 9.0313 12.7851 12.7851 13.0719 13.0719 14.0636 14.0636 14.7721 14.7721 14.8915 14.8915 15.6224 15.6224 15.7953 15.7953 17.9588 17.9588 k = 0.5000 0.0309 0.5686 ( 6616 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3968 -30.3968 -30.3967 -30.3967 -10.2175 -10.2175 -8.1378 -8.1378 -8.0584 -8.0584 -8.0233 -8.0233 -7.4835 -7.4835 -7.3279 -7.3279 -7.3164 -7.3164 -7.2793 -7.2793 -6.9478 -6.9478 -6.8646 -6.8646 -4.7710 -4.7710 -4.7666 -4.7666 -4.7388 -4.7388 -4.7327 -4.7327 -4.6740 -4.6740 -4.6705 -4.6705 0.4416 0.4416 2.4038 2.4038 2.4080 2.4080 3.7307 3.7307 4.1591 4.1591 4.3243 4.3243 6.1343 6.1343 6.4953 6.4953 6.6109 6.6109 6.7138 6.7138 7.0005 7.0005 7.5463 7.5463 7.7740 7.7740 7.9443 7.9443 7.9884 7.9884 8.0151 8.0151 8.8212 8.8212 8.8280 8.8280 9.0127 9.0127 9.0252 9.0252 12.7921 12.7921 13.0766 13.0766 14.0580 14.0580 14.7711 14.7711 14.8913 14.8913 15.6345 15.6345 15.8041 15.8041 17.9402 17.9402 k = 0.5000 0.0412 0.5541 ( 6610 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2188 -10.2188 -8.1470 -8.1470 -8.0586 -8.0586 -8.0160 -8.0160 -7.4823 -7.4823 -7.3282 -7.3282 -7.3154 -7.3154 -7.2774 -7.2774 -6.9485 -6.9485 -6.8629 -6.8629 -4.7705 -4.7705 -4.7660 -4.7660 -4.7382 -4.7382 -4.7321 -4.7321 -4.6739 -4.6739 -4.6705 -4.6705 0.4331 0.4331 2.4088 2.4088 2.4162 2.4162 3.7116 3.7116 4.1629 4.1629 4.3329 4.3329 6.1357 6.1357 6.4462 6.4462 6.6018 6.6018 6.7128 6.7128 7.0581 7.0581 7.5232 7.5232 7.7437 7.7437 7.9584 7.9584 8.0112 8.0112 8.0423 8.0423 8.8216 8.8216 8.8288 8.8288 8.9987 8.9987 9.0175 9.0175 12.8014 12.8014 13.0827 13.0827 14.0503 14.0503 14.7703 14.7703 14.8914 14.8914 15.6509 15.6509 15.8159 15.8159 17.9149 17.9149 k = 0.5000 0.0515 0.5395 ( 6600 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2204 -10.2204 -8.1578 -8.1578 -8.0575 -8.0575 -8.0089 -8.0089 -7.4808 -7.4808 -7.3282 -7.3282 -7.3142 -7.3142 -7.2750 -7.2750 -6.9494 -6.9494 -6.8607 -6.8607 -4.7698 -4.7698 -4.7653 -4.7653 -4.7376 -4.7376 -4.7314 -4.7314 -4.6738 -4.6738 -4.6704 -4.6704 0.4223 0.4223 2.4152 2.4152 2.4266 2.4266 3.6887 3.6887 4.1675 4.1675 4.3429 4.3429 6.1368 6.1368 6.3957 6.3957 6.5912 6.5912 6.7100 6.7100 7.1206 7.1206 7.4969 7.4969 7.7110 7.7110 7.9774 7.9774 8.0369 8.0369 8.0699 8.0699 8.8221 8.8221 8.8299 8.8299 8.9809 8.9809 9.0085 9.0085 12.8124 12.8124 13.0897 13.0897 14.0406 14.0406 14.7703 14.7703 14.8923 14.8923 15.6710 15.6710 15.8305 15.8305 17.8835 17.8835 k = 0.5000 0.0619 0.5249 ( 6598 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2223 -10.2223 -8.1696 -8.1696 -8.0553 -8.0553 -8.0023 -8.0023 -7.4791 -7.4791 -7.3282 -7.3282 -7.3128 -7.3128 -7.2721 -7.2721 -6.9505 -6.9505 -6.8581 -6.8581 -4.7690 -4.7690 -4.7644 -4.7644 -4.7369 -4.7369 -4.7306 -4.7306 -4.6737 -4.6737 -4.6704 -4.6704 0.4096 0.4096 2.4227 2.4227 2.4389 2.4389 3.6628 3.6628 4.1727 4.1727 4.3535 4.3535 6.1371 6.1371 6.3457 6.3457 6.5788 6.5788 6.7061 6.7061 7.1859 7.1859 7.4688 7.4688 7.6769 7.6769 8.0004 8.0004 8.0648 8.0648 8.0977 8.0977 8.8225 8.8225 8.8313 8.8313 8.9598 8.9598 8.9980 8.9980 12.8247 12.8247 13.0970 13.0970 14.0291 14.0291 14.7718 14.7718 14.8943 14.8943 15.6942 15.6942 15.8476 15.8476 17.8468 17.8468 k = 0.5000 0.0722 0.5103 ( 6592 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2244 -10.2244 -8.1821 -8.1821 -8.0524 -8.0524 -7.9963 -7.9963 -7.4775 -7.4775 -7.3279 -7.3279 -7.3113 -7.3113 -7.2686 -7.2686 -6.9518 -6.9518 -6.8551 -6.8551 -4.7682 -4.7682 -4.7634 -4.7634 -4.7361 -4.7361 -4.7297 -4.7297 -4.6734 -4.6734 -4.6703 -4.6703 0.3950 0.3950 2.4314 2.4314 2.4532 2.4532 3.6348 3.6348 4.1784 4.1784 4.3642 4.3642 6.1353 6.1353 6.2980 6.2980 6.5648 6.5648 6.7015 6.7015 7.2527 7.2527 7.4401 7.4401 7.6419 7.6419 8.0266 8.0266 8.0943 8.0943 8.1253 8.1253 8.8228 8.8228 8.8330 8.8330 8.9359 8.9359 8.9862 8.9862 12.8375 12.8375 13.1041 13.1041 14.0162 14.0162 14.7753 14.7753 14.8978 14.8978 15.7200 15.7200 15.8668 15.8668 17.8056 17.8056 k = 0.5000 0.0825 0.4957 ( 6584 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2269 -10.2269 -8.1950 -8.1950 -8.0488 -8.0488 -7.9909 -7.9909 -7.4760 -7.4760 -7.3272 -7.3272 -7.3098 -7.3098 -7.2645 -7.2645 -6.9535 -6.9535 -6.8516 -6.8516 -4.7672 -4.7672 -4.7624 -4.7624 -4.7352 -4.7352 -4.7286 -4.7286 -4.6731 -4.6731 -4.6701 -4.6701 0.3789 0.3789 2.4410 2.4410 2.4691 2.4691 3.6055 3.6055 4.1845 4.1845 4.3748 4.3748 6.1295 6.1295 6.2544 6.2544 6.5498 6.5498 6.6966 6.6966 7.3192 7.3192 7.4122 7.4122 7.6063 7.6063 8.0549 8.0549 8.1252 8.1252 8.1530 8.1530 8.8230 8.8230 8.8351 8.8351 8.9097 8.9097 8.9735 8.9735 12.8502 12.8502 13.1103 13.1103 14.0019 14.0019 14.7814 14.7814 14.9034 14.9034 15.7477 15.7477 15.8875 15.8875 17.7606 17.7606 k = 0.5000 0.0928 0.4811 ( 6586 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2295 -10.2295 -8.2081 -8.2081 -8.0448 -8.0448 -7.9862 -7.9862 -7.4747 -7.4747 -7.3263 -7.3263 -7.3083 -7.3083 -7.2598 -7.2598 -6.9554 -6.9554 -6.8478 -6.8478 -4.7662 -4.7662 -4.7612 -4.7612 -4.7344 -4.7344 -4.7276 -4.7276 -4.6728 -4.6728 -4.6699 -4.6699 0.3615 0.3615 2.4514 2.4514 2.4866 2.4866 3.5755 3.5755 4.1907 4.1907 4.3848 4.3848 6.1161 6.1161 6.2179 6.2179 6.5344 6.5344 6.6918 6.6918 7.3673 7.3673 7.4031 7.4031 7.5708 7.5708 8.0842 8.0842 8.1570 8.1570 8.1812 8.1812 8.8231 8.8231 8.8373 8.8373 8.8818 8.8818 8.9599 8.9599 12.8621 12.8621 13.1150 13.1150 13.9865 13.9865 14.7906 14.7906 14.9113 14.9113 15.7767 15.7767 15.9095 15.9095 17.7128 17.7128 k = 0.5000 0.1031 0.4666 ( 6574 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2323 -10.2323 -8.2212 -8.2212 -8.0403 -8.0403 -7.9820 -7.9820 -7.4736 -7.4736 -7.3250 -7.3250 -7.3068 -7.3068 -7.2545 -7.2545 -6.9575 -6.9575 -6.8437 -6.8437 -4.7651 -4.7651 -4.7600 -4.7600 -4.7334 -4.7334 -4.7265 -4.7265 -4.6723 -4.6723 -4.6696 -4.6696 0.3430 0.3430 2.4625 2.4625 2.5053 2.5053 3.5455 3.5455 4.1969 4.1969 4.3941 4.3941 6.0923 6.0923 6.1907 6.1907 6.5200 6.5200 6.6872 6.6872 7.3486 7.3486 7.4585 7.4585 7.5379 7.5379 8.1133 8.1133 8.1885 8.1885 8.2115 8.2115 8.8231 8.8231 8.8395 8.8395 8.8530 8.8530 8.9457 8.9457 12.8727 12.8727 13.1177 13.1177 13.9703 13.9703 14.8033 14.8033 14.9218 14.9218 15.8064 15.8064 15.9322 15.9322 17.6629 17.6629 k = 0.5000 0.1134 0.4520 ( 6572 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2353 -10.2353 -8.2341 -8.2341 -8.0357 -8.0357 -7.9784 -7.9784 -7.4729 -7.4729 -7.3233 -7.3233 -7.3053 -7.3053 -7.2486 -7.2486 -6.9600 -6.9600 -6.8394 -6.8394 -4.7639 -4.7639 -4.7587 -4.7587 -4.7326 -4.7326 -4.7255 -4.7255 -4.6717 -4.6717 -4.6692 -4.6692 0.3237 0.3237 2.4739 2.4739 2.5251 2.5251 3.5161 3.5161 4.2029 4.2029 4.4026 4.4026 6.0596 6.0596 6.1703 6.1703 6.5076 6.5076 6.6830 6.6830 7.3221 7.3221 7.4836 7.4836 7.5434 7.5434 8.1413 8.1413 8.2175 8.2175 8.2464 8.2464 8.8202 8.8202 8.8247 8.8247 8.8432 8.8432 8.9311 8.9311 12.8815 12.8815 13.1181 13.1181 13.9536 13.9536 14.8197 14.8197 14.9351 14.9351 15.8361 15.8361 15.9554 15.9554 17.6117 17.6117 k = 0.5000 0.1237 0.4374 ( 6570 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2383 -10.2383 -8.2468 -8.2468 -8.0310 -8.0310 -7.9753 -7.9753 -7.4726 -7.4726 -7.3214 -7.3214 -7.3039 -7.3039 -7.2420 -7.2420 -6.9628 -6.9628 -6.8348 -6.8348 -4.7627 -4.7627 -4.7573 -4.7573 -4.7318 -4.7318 -4.7246 -4.7246 -4.6711 -4.6711 -4.6687 -4.6687 0.3039 0.3039 2.4856 2.4856 2.5458 2.5458 3.4876 3.4876 4.2086 4.2086 4.4102 4.4102 6.0225 6.0225 6.1513 6.1513 6.4984 6.4984 6.6795 6.6795 7.2959 7.2959 7.4533 7.4533 7.6045 7.6045 8.1676 8.1676 8.2435 8.2435 8.2860 8.2860 8.7911 8.7911 8.8231 8.8231 8.8458 8.8458 8.9165 8.9165 12.8881 12.8881 13.1158 13.1158 13.9366 13.9366 14.8398 14.8398 14.9514 14.9514 15.8655 15.8655 15.9786 15.9786 17.5599 17.5599 k = 0.5000 0.1340 0.4228 ( 6570 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2415 -10.2415 -8.2592 -8.2592 -8.0263 -8.0263 -7.9725 -7.9725 -7.4727 -7.4727 -7.3192 -7.3192 -7.3026 -7.3026 -7.2348 -7.2348 -6.9659 -6.9659 -6.8301 -6.8301 -4.7614 -4.7614 -4.7559 -4.7559 -4.7311 -4.7311 -4.7238 -4.7238 -4.6704 -4.6704 -4.6681 -4.6681 0.2839 0.2839 2.4972 2.4972 2.5671 2.5671 3.4607 3.4607 4.2139 4.2139 4.4168 4.4168 5.9844 5.9844 6.1302 6.1302 6.4933 6.4933 6.6769 6.6769 7.2704 7.2704 7.4177 7.4177 7.6701 7.6701 8.1919 8.1919 8.2676 8.2676 8.3289 8.3289 8.7605 8.7605 8.8228 8.8228 8.8488 8.8488 8.9018 8.9018 12.8923 12.8923 13.1108 13.1108 13.9194 13.9194 14.8634 14.8634 14.9704 14.9704 15.8940 15.8940 16.0016 16.0016 17.5081 17.5081 k = 0.5000 0.1443 0.4082 ( 6578 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2446 -10.2446 -8.2711 -8.2711 -8.0218 -8.0218 -7.9699 -7.9699 -7.4732 -7.4732 -7.3169 -7.3169 -7.3015 -7.3015 -7.2270 -7.2270 -6.9693 -6.9693 -6.8253 -6.8253 -4.7602 -4.7602 -4.7545 -4.7545 -4.7305 -4.7305 -4.7231 -4.7231 -4.6696 -4.6696 -4.6674 -4.6674 0.2638 0.2638 2.5085 2.5085 2.5888 2.5888 3.4356 3.4356 4.2185 4.2185 4.4226 4.4226 5.9466 5.9466 6.1056 6.1056 6.4924 6.4924 6.6754 6.6754 7.2460 7.2460 7.3816 7.3816 7.7352 7.7352 8.2143 8.2143 8.2902 8.2902 8.3738 8.3738 8.7300 8.7300 8.8223 8.8223 8.8518 8.8518 8.8874 8.8874 12.8939 12.8939 13.1032 13.1032 13.9024 13.9024 14.8903 14.8903 14.9922 14.9922 15.9212 15.9212 16.0239 16.0239 17.4571 17.4571 k = 0.5000 0.1546 0.3937 ( 6568 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2478 -10.2478 -8.2825 -8.2825 -8.0176 -8.0176 -7.9675 -7.9675 -7.4740 -7.4740 -7.3143 -7.3143 -7.3003 -7.3003 -7.2187 -7.2187 -6.9730 -6.9730 -6.8204 -6.8204 -4.7588 -4.7588 -4.7530 -4.7530 -4.7300 -4.7300 -4.7225 -4.7225 -4.6687 -4.6687 -4.6665 -4.6665 0.2439 0.2439 2.5193 2.5193 2.6107 2.6107 3.4127 3.4127 4.2226 4.2226 4.4275 4.4275 5.9100 5.9100 6.0777 6.0777 6.4953 6.4953 6.6753 6.6753 7.2224 7.2224 7.3458 7.3458 7.7989 7.7989 8.2349 8.2349 8.3117 8.3117 8.4197 8.4197 8.7001 8.7001 8.8217 8.8217 8.8549 8.8549 8.8734 8.8734 12.8929 12.8929 13.0931 13.0931 13.8856 13.8856 14.9200 14.9200 15.0163 15.0163 15.9467 15.9467 16.0453 16.0453 17.4074 17.4074 k = 0.5000 0.1650 0.3791 ( 6564 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2509 -10.2509 -8.2932 -8.2932 -8.0138 -8.0138 -7.9651 -7.9651 -7.4751 -7.4751 -7.3118 -7.3118 -7.2993 -7.2993 -7.2099 -7.2099 -6.9770 -6.9770 -6.8156 -6.8156 -4.7575 -4.7575 -4.7514 -4.7514 -4.7297 -4.7297 -4.7222 -4.7222 -4.6678 -4.6678 -4.6654 -4.6654 0.2246 0.2246 2.5294 2.5294 2.6325 2.6325 3.3922 3.3922 4.2259 4.2259 4.4317 4.4317 5.8748 5.8748 6.0471 6.0471 6.5014 6.5014 6.6766 6.6766 7.1998 7.1998 7.3105 7.3105 7.8607 7.8607 8.2537 8.2537 8.3321 8.3321 8.4657 8.4657 8.6708 8.6708 8.8211 8.8211 8.8578 8.8578 8.8602 8.8602 12.8895 12.8895 13.0810 13.0810 13.8694 13.8694 14.9518 14.9518 15.0424 15.0424 15.9702 15.9702 16.0655 16.0655 17.3595 17.3595 k = 0.5000 0.1753 0.3645 ( 6562 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2539 -10.2539 -8.3034 -8.3034 -8.0106 -8.0106 -7.9626 -7.9626 -7.4764 -7.4764 -7.3093 -7.3093 -7.2984 -7.2984 -7.2008 -7.2008 -6.9813 -6.9813 -6.8109 -6.8109 -4.7562 -4.7562 -4.7499 -4.7499 -4.7294 -4.7294 -4.7220 -4.7220 -4.6668 -4.6668 -4.6643 -4.6643 0.2059 0.2059 2.5386 2.5386 2.6539 2.6539 3.3742 3.3742 4.2286 4.2286 4.4351 4.4351 5.8413 5.8413 6.0150 6.0150 6.5098 6.5098 6.6798 6.6798 7.1782 7.1782 7.2759 7.2759 7.9201 7.9201 8.2709 8.2709 8.3515 8.3515 8.5111 8.5111 8.6425 8.6425 8.8202 8.8202 8.8473 8.8473 8.8611 8.8611 12.8840 12.8840 13.0672 13.0672 13.8537 13.8537 14.9851 14.9851 15.0701 15.0701 15.9915 15.9915 16.0842 16.0842 17.3139 17.3139 k = 0.5000 0.1856 0.3499 ( 6566 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2567 -10.2567 -8.3128 -8.3128 -8.0079 -8.0079 -7.9599 -7.9599 -7.4780 -7.4780 -7.3069 -7.3069 -7.2976 -7.2976 -7.1915 -7.1915 -6.9859 -6.9859 -6.8064 -6.8064 -4.7549 -4.7549 -4.7482 -4.7482 -4.7294 -4.7294 -4.7221 -4.7221 -4.6659 -4.6659 -4.6631 -4.6631 0.1882 0.1882 2.5467 2.5467 2.6747 2.6747 3.3590 3.3590 4.2306 4.2306 4.4379 4.4379 5.8096 5.8096 5.9824 5.9824 6.5196 6.5196 6.6848 6.6848 7.1574 7.1574 7.2424 7.2424 7.9770 7.9770 8.2864 8.2864 8.3698 8.3698 8.5548 8.5548 8.6155 8.6155 8.8193 8.8193 8.8354 8.8354 8.8641 8.8641 12.8767 12.8767 13.0522 13.0522 13.8389 13.8389 15.0190 15.0190 15.0987 15.0987 16.0106 16.0106 16.1012 16.1012 17.2710 17.2710 k = 0.5000 0.1959 0.3353 ( 6570 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2594 -10.2594 -8.3214 -8.3214 -8.0058 -8.0058 -7.9572 -7.9572 -7.4795 -7.4795 -7.3047 -7.3047 -7.2969 -7.2969 -7.1821 -7.1821 -6.9907 -6.9907 -6.8020 -6.8020 -4.7536 -4.7536 -4.7466 -4.7466 -4.7295 -4.7295 -4.7224 -4.7224 -4.6649 -4.6649 -4.6618 -4.6618 0.1715 0.1715 2.5537 2.5537 2.6946 2.6946 3.3464 3.3464 4.2320 4.2320 4.4401 4.4401 5.7797 5.7797 5.9504 5.9504 6.5300 6.5300 6.6918 6.6918 7.1375 7.1375 7.2101 7.2101 8.0308 8.0308 8.3003 8.3003 8.3869 8.3869 8.5848 8.5848 8.6012 8.6012 8.8182 8.8182 8.8246 8.8246 8.8669 8.8669 12.8681 12.8681 13.0366 13.0366 13.8249 13.8249 15.0528 15.0528 15.1277 15.1277 16.0273 16.0273 16.1164 16.1164 17.2312 17.2312 k = 0.5000 0.2062 0.3208 ( 6566 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2619 -10.2619 -8.3293 -8.3293 -8.0043 -8.0043 -7.9544 -7.9544 -7.4811 -7.4811 -7.3026 -7.3026 -7.2963 -7.2963 -7.1727 -7.1727 -6.9957 -6.9957 -6.7980 -6.7980 -4.7524 -4.7524 -4.7449 -4.7449 -4.7297 -4.7297 -4.7228 -4.7228 -4.6639 -4.6639 -4.6605 -4.6605 0.1561 0.1561 2.5595 2.5595 2.7133 2.7133 3.3363 3.3363 4.2329 4.2329 4.4417 4.4417 5.7518 5.7518 5.9200 5.9200 6.5405 6.5405 6.7008 6.7008 7.1187 7.1187 7.1792 7.1792 8.0816 8.0816 8.3127 8.3127 8.4028 8.4028 8.5624 8.5624 8.6375 8.6375 8.8139 8.8139 8.8182 8.8182 8.8697 8.8697 12.8586 12.8586 13.0209 13.0209 13.8121 13.8121 15.0856 15.0856 15.1564 15.1564 16.0416 16.0416 16.1297 16.1297 17.1948 17.1948 k = 0.5000 0.2165 0.3062 ( 6566 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2642 -10.2642 -8.3363 -8.3363 -8.0032 -8.0032 -7.9516 -7.9516 -7.4826 -7.4826 -7.3007 -7.3007 -7.2958 -7.2958 -7.1635 -7.1635 -7.0008 -7.0008 -6.7942 -6.7942 -4.7512 -4.7512 -4.7433 -4.7433 -4.7300 -4.7300 -4.7234 -4.7234 -4.6630 -4.6630 -4.6592 -4.6592 0.1421 0.1421 2.5642 2.5642 2.7306 2.7306 3.3285 3.3285 4.2333 4.2333 4.4429 4.4429 5.7261 5.7261 5.8920 5.8920 6.5506 6.5506 6.7113 6.7113 7.1010 7.1010 7.1501 7.1501 8.1289 8.1289 8.3235 8.3235 8.4174 8.4174 8.5383 8.5383 8.6731 8.6731 8.8053 8.8053 8.8171 8.8171 8.8724 8.8724 12.8487 12.8487 13.0057 13.0057 13.8004 13.8004 15.1168 15.1168 15.1841 15.1841 16.0538 16.0538 16.1409 16.1409 17.1621 17.1621 k = 0.5000 0.2268 0.2916 ( 6562 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2663 -10.2663 -8.3424 -8.3424 -8.0025 -8.0025 -7.9490 -7.9490 -7.4841 -7.4841 -7.2989 -7.2989 -7.2953 -7.2953 -7.1546 -7.1546 -7.0060 -7.0060 -6.7909 -6.7909 -4.7500 -4.7500 -4.7416 -4.7416 -4.7303 -4.7303 -4.7242 -4.7242 -4.6621 -4.6621 -4.6580 -4.6580 0.1297 0.1297 2.5678 2.5678 2.7462 2.7462 3.3228 3.3228 4.2334 4.2334 4.4437 4.4437 5.7028 5.7028 5.8670 5.8670 6.5600 6.5600 6.7232 6.7232 7.0846 7.0846 7.1230 7.1230 8.1727 8.1727 8.3329 8.3329 8.4305 8.4305 8.5150 8.5150 8.7047 8.7047 8.7977 8.7977 8.8167 8.8167 8.8748 8.8748 12.8389 12.8389 12.9913 12.9913 13.7901 13.7901 15.1454 15.1454 15.2100 15.2100 16.0638 16.0638 16.1500 16.1500 17.1333 17.1333 k = 0.5000 0.2371 0.2770 ( 6556 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2680 -10.2680 -8.3477 -8.3477 -8.0020 -8.0020 -7.9465 -7.9465 -7.4853 -7.4853 -7.2975 -7.2975 -7.2949 -7.2949 -7.1462 -7.1462 -7.0111 -7.0111 -6.7880 -6.7880 -4.7490 -4.7490 -4.7399 -4.7399 -4.7307 -4.7307 -4.7252 -4.7252 -4.6613 -4.6613 -4.6569 -4.6569 0.1190 0.1190 2.5705 2.5705 2.7600 2.7600 3.3188 3.3188 4.2333 4.2333 4.4442 4.4442 5.6821 5.6821 5.8454 5.8454 6.5684 6.5684 6.7357 6.7357 7.0698 7.0698 7.0983 7.0983 8.2130 8.2130 8.3409 8.3409 8.4418 8.4418 8.4924 8.4924 8.7313 8.7313 8.7913 8.7913 8.8168 8.8168 8.8771 8.8771 12.8297 12.8297 12.9783 12.9783 13.7812 13.7812 15.1708 15.1708 15.2336 15.2336 16.0720 16.0720 16.1573 16.1573 17.1086 17.1086 k = 0.5000 0.2474 0.2624 ( 6550 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2695 -10.2695 -8.3520 -8.3520 -8.0018 -8.0018 -7.9444 -7.9444 -7.4864 -7.4864 -7.2963 -7.2963 -7.2946 -7.2946 -7.1386 -7.1386 -7.0158 -7.0158 -6.7855 -6.7855 -4.7480 -4.7480 -4.7381 -4.7381 -4.7311 -4.7311 -4.7262 -4.7262 -4.6606 -4.6606 -4.6560 -4.6560 0.1101 0.1101 2.5725 2.5725 2.7715 2.7715 3.3162 3.3162 4.2330 4.2330 4.4445 4.4445 5.6645 5.6645 5.8276 5.8276 6.5756 6.5756 6.7481 6.7481 7.0570 7.0570 7.0765 7.0765 8.2498 8.2498 8.3475 8.3475 8.4504 8.4504 8.4714 8.4714 8.7520 8.7520 8.7865 8.7865 8.8180 8.8180 8.8793 8.8793 12.8215 12.8215 12.9670 12.9670 13.7737 13.7737 15.1925 15.1925 15.2541 15.2541 16.0784 16.0784 16.1628 16.1628 17.0882 17.0882 k = 0.5000 0.2577 0.2479 ( 6548 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2707 -10.2707 -8.3554 -8.3554 -8.0016 -8.0016 -7.9427 -7.9427 -7.4873 -7.4873 -7.2953 -7.2953 -7.2943 -7.2943 -7.1322 -7.1322 -7.0201 -7.0201 -6.7836 -6.7836 -4.7472 -4.7472 -4.7365 -4.7365 -4.7315 -4.7315 -4.7274 -4.7274 -4.6601 -4.6601 -4.6552 -4.6552 0.1031 0.1031 2.5738 2.5738 2.7807 2.7807 3.3145 3.3145 4.2327 4.2327 4.4447 4.4447 5.6503 5.6503 5.8136 5.8136 6.5816 6.5816 6.7595 6.7595 7.0464 7.0464 7.0582 7.0582 8.2829 8.2829 8.3529 8.3529 8.4443 8.4443 8.4633 8.4633 8.7655 8.7655 8.7839 8.7839 8.8204 8.8204 8.8811 8.8811 12.8147 12.8147 12.9579 12.9579 13.7678 13.7678 15.2099 15.2099 15.2708 15.2708 16.0832 16.0832 16.1668 16.1668 17.0722 17.0722 k = 0.5000 0.2681 0.2333 ( 6554 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2715 -10.2715 -8.3578 -8.3578 -8.0016 -8.0016 -7.9414 -7.9414 -7.4880 -7.4880 -7.2947 -7.2947 -7.2941 -7.2941 -7.1272 -7.1272 -7.0235 -7.0235 -6.7822 -6.7822 -4.7466 -4.7466 -4.7349 -4.7349 -4.7319 -4.7319 -4.7287 -4.7287 -4.6597 -4.6597 -4.6547 -4.6547 0.0981 0.0981 2.5746 2.5746 2.7874 2.7874 3.3136 3.3136 4.2324 4.2324 4.4447 4.4447 5.6398 5.6398 5.8036 5.8036 6.5860 6.5860 6.7688 6.7688 7.0385 7.0385 7.0442 7.0442 8.3120 8.3120 8.3576 8.3576 8.4238 8.4238 8.4676 8.4676 8.7708 8.7708 8.7847 8.7847 8.8237 8.8237 8.8826 8.8826 12.8096 12.8096 12.9512 12.9512 13.7636 13.7636 15.2226 15.2226 15.2831 15.2831 16.0865 16.0865 16.1694 16.1694 17.0608 17.0608 k = 0.5000 0.2784 0.2187 ( 6556 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2720 -10.2720 -8.3592 -8.3592 -8.0016 -8.0016 -7.9407 -7.9407 -7.4885 -7.4885 -7.2944 -7.2944 -7.2940 -7.2940 -7.1240 -7.1240 -7.0258 -7.0258 -6.7814 -6.7814 -4.7463 -4.7463 -4.7333 -4.7333 -4.7321 -4.7321 -4.7301 -4.7301 -4.6594 -4.6594 -4.6544 -4.6544 0.0950 0.0950 2.5750 2.5750 2.7915 2.7915 3.3132 3.3132 4.2322 4.2322 4.4447 4.4447 5.6334 5.6334 5.7976 5.7976 6.5887 6.5887 6.7749 6.7749 7.0336 7.0336 7.0353 7.0353 8.3346 8.3346 8.3639 8.3639 8.4022 8.4022 8.4709 8.4709 8.7714 8.7714 8.7869 8.7869 8.8266 8.8266 8.8837 8.8837 12.8064 12.8064 12.9471 12.9471 13.7610 13.7610 15.2303 15.2303 15.2907 15.2907 16.0885 16.0885 16.1709 16.1709 17.0538 17.0538 k = 0.5000 0.2887 0.2041 ( 6550 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2722 -10.2722 -8.3597 -8.3597 -8.0016 -8.0016 -7.9404 -7.9404 -7.4886 -7.4886 -7.2943 -7.2943 -7.2939 -7.2939 -7.1229 -7.1229 -7.0265 -7.0265 -6.7811 -6.7811 -4.7461 -4.7461 -4.7322 -4.7322 -4.7321 -4.7321 -4.7312 -4.7312 -4.6593 -4.6593 -4.6542 -4.6542 0.0940 0.0940 2.5751 2.5751 2.7929 2.7929 3.3130 3.3130 4.2321 4.2321 4.4447 4.4447 5.6313 5.6313 5.7956 5.7956 6.5897 6.5897 6.7771 6.7771 7.0319 7.0319 7.0323 7.0323 8.3432 8.3432 8.3736 8.3736 8.3864 8.3864 8.4721 8.4721 8.7713 8.7713 8.7877 8.7877 8.8278 8.8278 8.8840 8.8840 12.8054 12.8054 12.9457 12.9457 13.7602 13.7602 15.2329 15.2329 15.2933 15.2933 16.0891 16.0891 16.1714 16.1714 17.0515 17.0515 k = 0.5000 0.2887 0.2041 ( 6550 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2722 -10.2722 -8.3597 -8.3597 -8.0016 -8.0016 -7.9404 -7.9404 -7.4886 -7.4886 -7.2943 -7.2943 -7.2939 -7.2939 -7.1229 -7.1229 -7.0265 -7.0265 -6.7811 -6.7811 -4.7461 -4.7461 -4.7322 -4.7322 -4.7321 -4.7321 -4.7312 -4.7312 -4.6593 -4.6593 -4.6542 -4.6542 0.0940 0.0940 2.5751 2.5751 2.7929 2.7929 3.3130 3.3130 4.2321 4.2321 4.4447 4.4447 5.6313 5.6313 5.7956 5.7956 6.5897 6.5897 6.7771 6.7771 7.0319 7.0319 7.0323 7.0323 8.3432 8.3432 8.3736 8.3736 8.3864 8.3864 8.4721 8.4721 8.7713 8.7713 8.7877 8.7877 8.8278 8.8278 8.8840 8.8840 12.8054 12.8054 12.9457 12.9457 13.7602 13.7602 15.2329 15.2329 15.2933 15.2933 16.0891 16.0891 16.1714 16.1714 17.0515 17.0515 k = 0.4950 0.2858 0.2205 ( 6556 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2721 -10.2721 -8.3593 -8.3593 -8.0016 -8.0016 -7.9406 -7.9406 -7.4885 -7.4885 -7.2944 -7.2944 -7.2940 -7.2940 -7.1239 -7.1239 -7.0258 -7.0258 -6.7813 -6.7813 -4.7463 -4.7463 -4.7333 -4.7333 -4.7321 -4.7321 -4.7302 -4.7302 -4.6594 -4.6594 -4.6544 -4.6544 0.0949 0.0949 2.5750 2.5750 2.7916 2.7916 3.3131 3.3131 4.2322 4.2322 4.4447 4.4447 5.6333 5.6333 5.7974 5.7974 6.5888 6.5888 6.7751 6.7751 7.0335 7.0335 7.0351 7.0351 8.3351 8.3351 8.3642 8.3642 8.4016 8.4016 8.4710 8.4710 8.7714 8.7714 8.7869 8.7869 8.8267 8.8267 8.8837 8.8837 12.8064 12.8064 12.9470 12.9470 13.7610 13.7610 15.2305 15.2305 15.2909 15.2909 16.0885 16.0885 16.1709 16.1709 17.0537 17.0537 k = 0.4900 0.2829 0.2368 ( 6552 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2716 -10.2716 -8.3579 -8.3579 -8.0016 -8.0016 -7.9414 -7.9414 -7.4881 -7.4881 -7.2947 -7.2947 -7.2941 -7.2941 -7.1269 -7.1269 -7.0237 -7.0237 -6.7821 -6.7821 -4.7466 -4.7466 -4.7348 -4.7348 -4.7319 -4.7319 -4.7288 -4.7288 -4.6596 -4.6596 -4.6547 -4.6547 0.0978 0.0978 2.5746 2.5746 2.7877 2.7877 3.3136 3.3136 4.2323 4.2323 4.4447 4.4447 5.6393 5.6393 5.8031 5.8031 6.5862 6.5862 6.7692 6.7692 7.0382 7.0382 7.0434 7.0434 8.3137 8.3137 8.3578 8.3578 8.4225 8.4225 8.4678 8.4678 8.7710 8.7710 8.7849 8.7849 8.8239 8.8239 8.8827 8.8827 12.8093 12.8093 12.9509 12.9509 13.7634 13.7634 15.2232 15.2232 15.2837 15.2837 16.0867 16.0867 16.1696 16.1696 17.0602 17.0602 k = 0.4850 0.2800 0.2531 ( 6546 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2708 -10.2708 -8.3556 -8.3556 -8.0016 -8.0016 -7.9426 -7.9426 -7.4874 -7.4874 -7.2953 -7.2953 -7.2943 -7.2943 -7.1316 -7.1316 -7.0204 -7.0204 -6.7834 -6.7834 -4.7472 -4.7472 -4.7363 -4.7363 -4.7316 -4.7316 -4.7275 -4.7275 -4.6600 -4.6600 -4.6551 -4.6551 0.1026 0.1026 2.5738 2.5738 2.7814 2.7814 3.3144 3.3144 4.2326 4.2326 4.4447 4.4447 5.6492 5.6492 5.8125 5.8125 6.5820 6.5820 6.7604 6.7604 7.0458 7.0458 7.0565 7.0565 8.2859 8.2859 8.3529 8.3529 8.4436 8.4436 8.4630 8.4630 8.7664 8.7664 8.7839 8.7839 8.8204 8.8204 8.8814 8.8814 12.8141 12.8141 12.9572 12.9572 13.7674 13.7674 15.2112 15.2112 15.2721 15.2721 16.0835 16.0835 16.1672 16.1672 17.0710 17.0710 k = 0.4800 0.2771 0.2694 ( 6555 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2697 -10.2697 -8.3524 -8.3524 -8.0018 -8.0018 -7.9442 -7.9442 -7.4866 -7.4866 -7.2962 -7.2962 -7.2945 -7.2945 -7.1378 -7.1378 -7.0164 -7.0164 -6.7853 -6.7853 -4.7479 -4.7479 -4.7380 -4.7380 -4.7312 -4.7312 -4.7264 -4.7264 -4.6606 -4.6606 -4.6559 -4.6559 0.1092 0.1092 2.5726 2.5726 2.7728 2.7728 3.3159 3.3159 4.2329 4.2329 4.4445 4.4445 5.6626 5.6626 5.8257 5.8257 6.5765 6.5765 6.7494 6.7494 7.0563 7.0563 7.0734 7.0734 8.2544 8.2544 8.3467 8.3467 8.4560 8.4560 8.4651 8.4651 8.7546 8.7546 8.7860 8.7860 8.8170 8.8170 8.8801 8.8801 12.8206 12.8206 12.9658 12.9658 13.7729 13.7729 15.1946 15.1946 15.2565 15.2565 16.0787 16.0787 16.1637 16.1637 17.0861 17.0861 k = 0.4750 0.2742 0.2858 ( 6560 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2683 -10.2683 -8.3484 -8.3484 -8.0020 -8.0020 -7.9462 -7.9462 -7.4855 -7.4855 -7.2973 -7.2973 -7.2949 -7.2949 -7.1450 -7.1450 -7.0118 -7.0118 -6.7876 -6.7876 -4.7488 -4.7488 -4.7396 -4.7396 -4.7308 -4.7308 -4.7253 -4.7253 -4.6612 -4.6612 -4.6568 -4.6568 0.1176 0.1176 2.5709 2.5709 2.7618 2.7618 3.3183 3.3183 4.2332 4.2332 4.4443 4.4443 5.6792 5.6792 5.8425 5.8425 6.5697 6.5697 6.7372 6.7372 7.0695 7.0695 7.0933 7.0933 8.2198 8.2198 8.3384 8.3384 8.4492 8.4492 8.4858 8.4858 8.7363 8.7363 8.7905 8.7905 8.8136 8.8136 8.8794 8.8794 12.8283 12.8283 12.9765 12.9765 13.7799 13.7799 15.1738 15.1738 15.2375 15.2375 16.0717 16.0717 16.1595 16.1595 17.1053 17.1053 k = 0.4700 0.2714 0.3021 ( 6564 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2666 -10.2666 -8.3434 -8.3434 -8.0024 -8.0024 -7.9485 -7.9485 -7.4843 -7.4843 -7.2987 -7.2987 -7.2952 -7.2952 -7.1530 -7.1530 -7.0069 -7.0069 -6.7903 -6.7903 -4.7498 -4.7498 -4.7412 -4.7412 -4.7304 -4.7304 -4.7244 -4.7244 -4.6621 -4.6621 -4.6578 -4.6578 0.1277 0.1277 2.5684 2.5684 2.7489 2.7489 3.3220 3.3220 4.2334 4.2334 4.4438 4.4438 5.6988 5.6988 5.8629 5.8629 6.5620 6.5620 6.7244 6.7244 7.0852 7.0852 7.1155 7.1155 8.1821 8.1821 8.3272 8.3272 8.4419 8.4419 8.5069 8.5069 8.7127 8.7127 8.7963 8.7963 8.8093 8.8093 8.8799 8.8799 12.8369 12.8369 12.9890 12.9890 13.7884 13.7884 15.1490 15.1490 15.2160 15.2160 16.0619 16.0619 16.1548 16.1548 17.1285 17.1285 k = 0.4650 0.2685 0.3184 ( 6570 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2647 -10.2647 -8.3377 -8.3377 -8.0032 -8.0032 -7.9509 -7.9509 -7.4830 -7.4830 -7.3003 -7.3003 -7.2957 -7.2957 -7.1615 -7.1615 -7.0020 -7.0020 -6.7935 -6.7935 -4.7509 -4.7509 -4.7429 -4.7429 -4.7301 -4.7301 -4.7236 -4.7236 -4.6630 -4.6630 -4.6588 -4.6588 0.1394 0.1394 2.5650 2.5650 2.7341 2.7341 3.3271 3.3271 4.2334 4.2334 4.4431 4.4431 5.7208 5.7208 5.8865 5.8865 6.5536 6.5536 6.7117 6.7117 7.1032 7.1032 7.1395 7.1395 8.1415 8.1415 8.3126 8.3126 8.4351 8.4351 8.5284 8.5284 8.6848 8.6848 8.8011 8.8011 8.8057 8.8057 8.8821 8.8821 12.8460 12.8460 13.0029 13.0029 13.7981 13.7981 15.1205 15.1205 15.1929 15.1929 16.0483 16.0483 16.1503 16.1503 17.1556 17.1556 k = 0.4600 0.2656 0.3348 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2625 -10.2625 -8.3310 -8.3310 -8.0043 -8.0043 -7.9534 -7.9534 -7.4815 -7.4815 -7.3021 -7.3021 -7.2962 -7.2962 -7.1704 -7.1704 -6.9970 -6.9970 -6.7970 -6.7970 -4.7521 -4.7521 -4.7444 -4.7444 -4.7298 -4.7298 -4.7230 -4.7230 -4.6640 -4.6640 -4.6598 -4.6598 0.1526 0.1526 2.5607 2.5607 2.7177 2.7177 3.3342 3.3342 4.2331 4.2331 4.4421 4.4421 5.7452 5.7452 5.9131 5.9131 6.5448 6.5448 6.6996 6.6996 7.1234 7.1234 7.1648 7.1648 8.0978 8.0978 8.2944 8.2944 8.4291 8.4291 8.5500 8.5500 8.6536 8.6536 8.7944 8.7944 8.8127 8.8127 8.8862 8.8862 12.8551 12.8551 13.0181 13.0181 13.8092 13.8092 15.0889 15.0889 15.1687 15.1687 16.0303 16.0303 16.1463 16.1463 17.1864 17.1864 k = 0.4550 0.2627 0.3511 ( 6561 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2602 -10.2602 -8.3236 -8.3236 -8.0059 -8.0059 -7.9558 -7.9558 -7.4800 -7.4800 -7.3041 -7.3041 -7.2967 -7.2967 -7.1794 -7.1794 -6.9922 -6.9922 -6.8008 -6.8008 -4.7533 -4.7533 -4.7460 -4.7460 -4.7296 -4.7296 -4.7225 -4.7225 -4.6653 -4.6653 -4.6607 -4.6607 0.1671 0.1671 2.5553 2.5553 2.7000 2.7000 3.3433 3.3433 4.2323 4.2323 4.4408 4.4408 5.7715 5.7715 5.9421 5.9421 6.5358 6.5358 6.6884 6.6884 7.1455 7.1455 7.1912 7.1912 8.0514 8.0514 8.2726 8.2726 8.4240 8.4240 8.5704 8.5704 8.6213 8.6213 8.7843 8.7843 8.8221 8.8221 8.8921 8.8921 12.8633 12.8633 13.0340 13.0340 13.8213 13.8213 15.0551 15.0551 15.1443 15.1443 16.0073 16.0073 16.1432 16.1432 17.2207 17.2207 k = 0.4500 0.2598 0.3674 ( 6563 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2576 -10.2576 -8.3155 -8.3155 -8.0083 -8.0083 -7.9579 -7.9579 -7.4785 -7.4785 -7.3062 -7.3062 -7.2974 -7.2974 -7.1885 -7.1885 -6.9876 -6.9876 -6.8048 -6.8048 -4.7546 -4.7546 -4.7475 -4.7475 -4.7295 -4.7295 -4.7223 -4.7223 -4.6667 -4.6667 -4.6614 -4.6614 0.1829 0.1829 2.5488 2.5488 2.6812 2.6812 3.3548 3.3548 4.2312 4.2312 4.4390 4.4390 5.7995 5.7995 5.9727 5.9727 6.5268 6.5268 6.6785 6.6785 7.1694 7.1694 7.2184 7.2184 8.0022 8.0022 8.2474 8.2474 8.4197 8.4197 8.5704 8.5704 8.6075 8.6075 8.7722 8.7722 8.8326 8.8326 8.8995 8.8995 12.8702 12.8702 13.0506 13.0506 13.8345 13.8345 15.0200 15.0200 15.1200 15.1200 15.9796 15.9796 16.1408 16.1408 17.2581 17.2581 k = 0.4450 0.2569 0.3838 ( 6569 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2549 -10.2549 -8.3066 -8.3066 -8.0114 -8.0114 -7.9597 -7.9597 -7.4772 -7.4772 -7.3085 -7.3085 -7.2982 -7.2982 -7.1976 -7.1976 -6.9833 -6.9833 -6.8091 -6.8091 -4.7559 -4.7559 -4.7490 -4.7490 -4.7296 -4.7296 -4.7223 -4.7223 -4.6683 -4.6683 -4.6619 -4.6619 0.1997 0.1997 2.5411 2.5411 2.6616 2.6616 3.3687 3.3687 4.2294 4.2294 4.4368 4.4368 5.8291 5.8291 6.0041 6.0041 6.5180 6.5180 6.6705 6.6705 7.1950 7.1950 7.2463 7.2463 7.9506 7.9506 8.2192 8.2192 8.4161 8.4161 8.5362 8.5362 8.6267 8.6267 8.7584 8.7584 8.8441 8.8441 8.9081 8.9081 12.8749 12.8749 13.0673 13.0673 13.8485 13.8485 14.9846 14.9846 15.0961 15.0961 15.9473 15.9473 16.1389 16.1389 17.2984 17.2984 k = 0.4400 0.2540 0.4001 ( 6559 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2520 -10.2520 -8.2970 -8.2970 -8.0154 -8.0154 -7.9610 -7.9610 -7.4760 -7.4760 -7.3108 -7.3108 -7.2989 -7.2989 -7.2063 -7.2063 -6.9792 -6.9792 -6.8133 -6.8133 -4.7571 -4.7571 -4.7505 -4.7505 -4.7297 -4.7297 -4.7224 -4.7224 -4.6700 -4.6700 -4.6622 -4.6622 0.2174 0.2174 2.5322 2.5322 2.6416 2.6416 3.3850 3.3850 4.2272 4.2272 4.4341 4.4341 5.8603 5.8603 6.0353 6.0353 6.5096 6.5096 6.6649 6.6649 7.2222 7.2222 7.2747 7.2747 7.8967 7.8967 8.1884 8.1884 8.4130 8.4130 8.4963 8.4963 8.6508 8.6508 8.7431 8.7431 8.8567 8.8567 8.9179 8.9179 12.8769 12.8769 13.0840 13.0840 13.8633 13.8633 14.9500 14.9500 15.0731 15.0731 15.9111 15.9111 16.1374 16.1374 17.3411 17.3411 k = 0.4350 0.2511 0.4164 ( 6569 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2491 -10.2491 -8.2868 -8.2868 -8.0202 -8.0202 -7.9619 -7.9619 -7.4751 -7.4751 -7.3133 -7.3133 -7.2999 -7.2999 -7.2148 -7.2148 -6.9756 -6.9756 -6.8177 -6.8177 -4.7585 -4.7585 -4.7519 -4.7519 -4.7300 -4.7300 -4.7229 -4.7229 -4.6719 -4.6719 -4.6622 -4.6622 0.2358 0.2358 2.5223 2.5223 2.6214 2.6214 3.4036 3.4036 4.2243 4.2243 4.4310 4.4310 5.8928 5.8928 6.0652 6.0652 6.5016 6.5016 6.6621 6.6621 7.2506 7.2506 7.3034 7.3034 7.8408 7.8408 8.1553 8.1553 8.4100 8.4100 8.4551 8.4551 8.6759 8.6759 8.7265 8.7265 8.8704 8.8704 8.9285 8.9285 12.8754 12.8754 13.1003 13.1003 13.8786 13.8786 14.9170 14.9170 15.0512 15.0512 15.8715 15.8715 16.1361 16.1361 17.3859 17.3859 k = 0.4300 0.2483 0.4327 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2461 -10.2461 -8.2760 -8.2760 -8.0257 -8.0257 -7.9623 -7.9623 -7.4746 -7.4746 -7.3156 -7.3156 -7.3010 -7.3010 -7.2228 -7.2228 -6.9724 -6.9724 -6.8219 -6.8219 -4.7597 -4.7597 -4.7533 -4.7533 -4.7304 -4.7304 -4.7236 -4.7236 -4.6737 -4.6737 -4.6620 -4.6620 0.2545 0.2545 2.5114 2.5114 2.6014 2.6014 3.4245 3.4245 4.2209 4.2209 4.4275 4.4275 5.9264 5.9264 6.0928 6.0928 6.4942 6.4942 6.6629 6.6629 7.2802 7.2802 7.3324 7.3324 7.7833 7.7833 8.1203 8.1203 8.4042 8.4042 8.4164 8.4164 8.7012 8.7012 8.7089 8.7089 8.8851 8.8851 8.9399 8.9399 12.8699 12.8699 13.1160 13.1160 13.8944 13.8944 14.8867 14.8867 15.0306 15.0306 15.8292 15.8292 16.1348 16.1348 17.4322 17.4322 k = 0.4250 0.2454 0.4491 ( 6580 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2431 -10.2431 -8.2648 -8.2648 -8.0319 -8.0319 -7.9624 -7.9624 -7.4746 -7.4746 -7.3178 -7.3178 -7.3022 -7.3022 -7.2303 -7.2303 -6.9697 -6.9697 -6.8260 -6.8260 -4.7610 -4.7610 -4.7547 -4.7547 -4.7309 -4.7309 -4.7245 -4.7245 -4.6757 -4.6757 -4.6616 -4.6616 0.2735 0.2735 2.4996 2.4996 2.5821 2.5821 3.4472 3.4472 4.2171 4.2171 4.4234 4.4234 5.9610 5.9610 6.1169 6.1169 6.4872 6.4872 6.6678 6.6678 7.3107 7.3107 7.3615 7.3615 7.7245 7.7245 8.0838 8.0838 8.3698 8.3698 8.4067 8.4067 8.6900 8.6900 8.7266 8.7266 8.9011 8.9011 8.9520 8.9520 12.8601 12.8601 13.1307 13.1307 13.9105 13.9105 14.8597 14.8597 15.0116 15.0116 15.7850 15.7850 16.1337 16.1337 17.4794 17.4794 k = 0.4200 0.2425 0.4654 ( 6577 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2401 -10.2401 -8.2531 -8.2531 -8.0385 -8.0385 -7.9623 -7.9623 -7.4750 -7.4750 -7.3198 -7.3198 -7.3034 -7.3034 -7.2371 -7.2371 -6.9675 -6.9675 -6.8297 -6.8297 -4.7622 -4.7622 -4.7561 -4.7561 -4.7315 -4.7315 -4.7255 -4.7255 -4.6775 -4.6775 -4.6610 -4.6610 0.2924 0.2924 2.4869 2.4869 2.5638 2.5638 3.4716 3.4716 4.2130 4.2130 4.4190 4.4190 5.9960 5.9960 6.1372 6.1372 6.4806 6.4806 6.6772 6.6772 7.3419 7.3419 7.3906 7.3906 7.6651 7.6651 8.0463 8.0463 8.3293 8.3293 8.4039 8.4039 8.6704 8.6704 8.7508 8.7508 8.9186 8.9186 8.9647 8.9647 12.8458 12.8458 13.1442 13.1442 13.9266 13.9266 14.8366 14.8366 14.9944 14.9944 15.7396 15.7396 16.1327 16.1327 17.5270 17.5270 k = 0.4150 0.2396 0.4817 ( 6582 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2372 -10.2372 -8.2411 -8.2411 -8.0455 -8.0455 -7.9620 -7.9620 -7.4761 -7.4761 -7.3216 -7.3216 -7.3048 -7.3048 -7.2433 -7.2433 -6.9658 -6.9658 -6.8332 -6.8332 -4.7633 -4.7633 -4.7574 -4.7574 -4.7321 -4.7321 -4.7267 -4.7267 -4.6793 -4.6793 -4.6601 -4.6601 0.3110 0.3110 2.4734 2.4734 2.5469 2.5469 3.4970 3.4970 4.2088 4.2088 4.4142 4.4142 6.0305 6.0305 6.1538 6.1538 6.4744 6.4744 6.6911 6.6911 7.3731 7.3731 7.4192 7.4192 7.6059 7.6059 8.0081 8.0081 8.2900 8.2900 8.4012 8.4012 8.6501 8.6501 8.7733 8.7733 8.9377 8.9377 8.9778 8.9778 12.8269 12.8269 13.1562 13.1562 13.9425 13.9425 14.8180 14.8180 14.9791 14.9791 15.6939 15.6939 16.1320 16.1320 17.5744 17.5744 k = 0.4100 0.2367 0.4981 ( 6579 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2344 -10.2344 -8.2288 -8.2288 -8.0528 -8.0528 -7.9616 -7.9616 -7.4778 -7.4778 -7.3229 -7.3229 -7.3063 -7.3063 -7.2488 -7.2488 -6.9646 -6.9646 -6.8362 -6.8362 -4.7643 -4.7643 -4.7587 -4.7587 -4.7328 -4.7328 -4.7280 -4.7280 -4.6810 -4.6810 -4.6591 -4.6591 0.3289 0.3289 2.4593 2.4593 2.5318 2.5318 3.5231 3.5231 4.2047 4.2047 4.4090 4.4090 6.0625 6.0625 6.1686 6.1686 6.4683 6.4683 6.7090 6.7090 7.4031 7.4031 7.4460 7.4460 7.5498 7.5498 7.9698 7.9698 8.2525 8.2525 8.3986 8.3986 8.6293 8.6293 8.7935 8.7935 8.9586 8.9586 8.9914 8.9914 12.8037 12.8037 13.1666 13.1666 13.9581 13.9581 14.8039 14.8039 14.9658 14.9658 15.6486 15.6486 16.1317 16.1317 17.6207 17.6207 k = 0.4050 0.2338 0.5144 ( 6577 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2318 -10.2318 -8.2165 -8.2165 -8.0601 -8.0601 -7.9613 -7.9613 -7.4802 -7.4802 -7.3239 -7.3239 -7.3078 -7.3078 -7.2535 -7.2535 -6.9640 -6.9640 -6.8386 -6.8386 -4.7653 -4.7653 -4.7600 -4.7600 -4.7335 -4.7335 -4.7293 -4.7293 -4.6826 -4.6826 -4.6579 -4.6579 0.3460 0.3460 2.4447 2.4447 2.5187 2.5187 3.5494 3.5494 4.2011 4.2011 4.4035 4.4035 6.0879 6.0879 6.1856 6.1856 6.4622 6.4622 6.7299 6.7299 7.4249 7.4249 7.4628 7.4628 7.5121 7.5121 7.9321 7.9321 8.2175 8.2175 8.3957 8.3957 8.6079 8.6079 8.8104 8.8104 8.9815 8.9815 9.0053 9.0053 12.7766 12.7766 13.1753 13.1753 13.9731 13.9731 14.7946 14.7946 14.9547 14.9547 15.6045 15.6045 16.1318 16.1318 17.6654 17.6654 k = 0.4000 0.2309 0.5307 ( 6572 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2293 -10.2293 -8.2042 -8.2042 -8.0673 -8.0673 -7.9610 -7.9610 -7.4832 -7.4832 -7.3244 -7.3244 -7.3094 -7.3094 -7.2574 -7.2574 -6.9640 -6.9640 -6.8405 -6.8405 -4.7662 -4.7662 -4.7613 -4.7613 -4.7341 -4.7341 -4.7307 -4.7307 -4.6841 -4.6841 -4.6565 -4.6565 0.3619 0.3619 2.4299 2.4299 2.5079 2.5079 3.5752 3.5752 4.1981 4.1981 4.3977 4.3977 6.1021 6.1021 6.2101 6.2101 6.4560 6.4560 6.7523 6.7523 7.4017 7.4017 7.4764 7.4764 7.5230 7.5230 7.8958 7.8958 8.1854 8.1854 8.3927 8.3927 8.5863 8.5863 8.8238 8.8238 9.0059 9.0059 9.0195 9.0195 12.7463 12.7463 13.1823 13.1823 13.9871 13.9871 14.7899 14.7899 14.9457 14.9457 15.5624 15.5624 16.1327 16.1327 17.7077 17.7077 k = 0.3950 0.2281 0.5471 ( 6582 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2271 -10.2271 -8.1923 -8.1923 -8.0741 -8.0741 -7.9609 -7.9609 -7.4867 -7.4867 -7.3247 -7.3247 -7.3110 -7.3110 -7.2606 -7.2606 -6.9644 -6.9644 -6.8418 -6.8418 -4.7670 -4.7670 -4.7627 -4.7627 -4.7348 -4.7348 -4.7321 -4.7321 -4.6856 -4.6856 -4.6551 -4.6551 0.3762 0.3762 2.4152 2.4152 2.4993 2.4993 3.5999 3.5999 4.1960 4.1960 4.3919 4.3919 6.1045 6.1045 6.2431 6.2431 6.4495 6.4495 6.7742 6.7742 7.3513 7.3513 7.5009 7.5009 7.5508 7.5508 7.8618 7.8618 8.1568 8.1568 8.3893 8.3893 8.5644 8.5644 8.8331 8.8331 9.0315 9.0315 9.0339 9.0339 12.7135 12.7135 13.1876 13.1876 14.0001 14.0001 14.7897 14.7897 14.9389 14.9389 15.5231 15.5231 16.1346 16.1346 17.7470 17.7470 k = 0.3900 0.2252 0.5634 ( 6576 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2252 -10.2252 -8.1810 -8.1810 -8.0803 -8.0803 -7.9609 -7.9609 -7.4907 -7.4907 -7.3245 -7.3245 -7.3125 -7.3125 -7.2630 -7.2630 -6.9652 -6.9652 -6.8426 -6.8426 -4.7677 -4.7677 -4.7639 -4.7639 -4.7353 -4.7353 -4.7333 -4.7333 -4.6869 -4.6869 -4.6535 -4.6535 0.3888 0.3888 2.4011 2.4011 2.4931 2.4931 3.6231 3.6231 4.1950 4.1950 4.3861 4.3861 6.0988 6.0988 6.2819 6.2819 6.4425 6.4425 6.7935 6.7935 7.3000 7.3000 7.5240 7.5240 7.5819 7.5819 7.8317 7.8317 8.1320 8.1320 8.3857 8.3857 8.5425 8.5425 8.8381 8.8381 9.0484 9.0484 9.0576 9.0576 12.6792 12.6792 13.1916 13.1916 14.0116 14.0116 14.7935 14.7935 14.9343 14.9343 15.4872 15.4872 16.1375 16.1375 17.7828 17.7828 k = 0.3850 0.2223 0.5797 ( 6577 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2237 -10.2237 -8.1709 -8.1709 -8.0854 -8.0854 -7.9612 -7.9612 -7.4951 -7.4951 -7.3241 -7.3241 -7.3139 -7.3139 -7.2647 -7.2647 -6.9664 -6.9664 -6.8427 -6.8427 -4.7684 -4.7684 -4.7651 -4.7651 -4.7358 -4.7358 -4.7345 -4.7345 -4.6882 -4.6882 -4.6519 -4.6519 0.3993 0.3993 2.3879 2.3879 2.4891 2.4891 3.6441 3.6441 4.1948 4.1948 4.3808 4.3808 6.0882 6.0882 6.3240 6.3240 6.4345 6.4345 6.8070 6.8070 7.2533 7.2533 7.5423 7.5423 7.6143 7.6143 7.8076 7.8076 8.1113 8.1113 8.3817 8.3817 8.5207 8.5207 8.8387 8.8387 9.0630 9.0630 9.0834 9.0834 12.6444 12.6444 13.1945 13.1945 14.0213 14.0213 14.8011 14.8011 14.9319 14.9319 15.4553 15.4553 16.1417 16.1417 17.8146 17.8146 k = 0.3800 0.2194 0.5960 ( 6579 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2225 -10.2225 -8.1625 -8.1625 -8.0888 -8.0888 -7.9618 -7.9618 -7.4996 -7.4996 -7.3236 -7.3236 -7.3150 -7.3150 -7.2657 -7.2657 -6.9678 -6.9678 -6.8424 -6.8424 -4.7691 -4.7691 -4.7660 -4.7660 -4.7362 -4.7362 -4.7355 -4.7355 -4.6893 -4.6893 -4.6502 -4.6502 0.4075 0.4075 2.3758 2.3758 2.4874 2.4874 3.6628 3.6628 4.1953 4.1953 4.3762 4.3762 6.0747 6.0747 6.3681 6.3681 6.4253 6.4253 6.8115 6.8115 7.2150 7.2150 7.5537 7.5537 7.6475 7.6475 7.7917 7.7917 8.0951 8.0951 8.3773 8.3773 8.4990 8.4990 8.8346 8.8346 9.0777 9.0777 9.1079 9.1079 12.6103 12.6103 13.1968 13.1968 14.0290 14.0290 14.8119 14.8119 14.9317 14.9317 15.4279 15.4279 16.1473 16.1473 17.8421 17.8421 k = 0.3750 0.2165 0.6124 ( 6587 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2217 -10.2217 -8.1568 -8.1568 -8.0896 -8.0896 -7.9627 -7.9627 -7.5042 -7.5042 -7.3231 -7.3231 -7.3159 -7.3159 -7.2661 -7.2661 -6.9694 -6.9694 -6.8415 -6.8415 -4.7700 -4.7700 -4.7667 -4.7667 -4.7366 -4.7366 -4.7362 -4.7362 -4.6904 -4.6904 -4.6485 -4.6485 0.4131 0.4131 2.3651 2.3651 2.4881 2.4881 3.6788 3.6788 4.1958 4.1958 4.3728 4.3728 6.0597 6.0597 6.4109 6.4109 6.4167 6.4167 6.8039 6.8039 7.1880 7.1880 7.5567 7.5567 7.6810 7.6810 7.7861 7.7861 8.0835 8.0835 8.3725 8.3725 8.4778 8.4778 8.8256 8.8257 9.0923 9.0923 9.1304 9.1304 12.5779 12.5779 13.1989 13.1989 14.0344 14.0344 14.8254 14.8254 14.9339 14.9339 15.4053 15.4053 16.1547 16.1547 17.8651 17.8651 k = 0.6250-0.0722 0.4082 ( 6587 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2217 -10.2217 -8.1568 -8.1568 -8.0896 -8.0896 -7.9627 -7.9627 -7.5042 -7.5042 -7.3231 -7.3231 -7.3159 -7.3159 -7.2661 -7.2661 -6.9694 -6.9694 -6.8415 -6.8415 -4.7700 -4.7700 -4.7667 -4.7667 -4.7366 -4.7366 -4.7362 -4.7362 -4.6904 -4.6904 -4.6485 -4.6485 0.4131 0.4131 2.3651 2.3651 2.4881 2.4881 3.6788 3.6788 4.1958 4.1958 4.3728 4.3728 6.0597 6.0597 6.4109 6.4109 6.4167 6.4167 6.8039 6.8039 7.1880 7.1880 7.5567 7.5567 7.6810 7.6810 7.7861 7.7861 8.0835 8.0835 8.3725 8.3725 8.4778 8.4778 8.8257 8.8257 9.0923 9.0923 9.1304 9.1304 12.5779 12.5779 13.1989 13.1989 14.0344 14.0344 14.8254 14.8254 14.9339 14.9339 15.4053 15.4053 16.1547 16.1547 17.8651 17.8651 k = 0.6161-0.0876 0.4082 ( 6571 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2208 -10.2208 -8.1503 -8.1503 -8.0875 -8.0875 -7.9645 -7.9645 -7.5125 -7.5125 -7.3224 -7.3224 -7.3166 -7.3166 -7.2656 -7.2656 -6.9724 -6.9724 -6.8394 -6.8394 -4.7717 -4.7717 -4.7672 -4.7672 -4.7377 -4.7377 -4.7366 -4.7366 -4.6921 -4.6921 -4.6454 -4.6454 0.4199 0.4199 2.3481 2.3481 2.4917 2.4917 3.7054 3.7054 4.1944 4.1944 4.3697 4.3697 6.0311 6.0311 6.4255 6.4255 6.4614 6.4614 6.7794 6.7794 7.1510 7.1510 7.5548 7.5548 7.7394 7.7394 7.7883 7.7883 8.0685 8.0685 8.3637 8.3637 8.4401 8.4401 8.8047 8.8047 9.1181 9.1181 9.1663 9.1663 12.5225 12.5225 13.2027 13.2027 14.0409 14.0409 14.8512 14.8512 14.9426 14.9426 15.3706 15.3706 16.1705 16.1705 17.9012 17.9012 k = 0.6071-0.1031 0.4082 ( 6567 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2202 -10.2202 -8.1459 -8.1459 -8.0831 -8.0831 -7.9664 -7.9664 -7.5211 -7.5211 -7.3219 -7.3219 -7.3171 -7.3171 -7.2647 -7.2647 -6.9756 -6.9756 -6.8369 -6.8369 -4.7738 -4.7738 -4.7675 -4.7675 -4.7386 -4.7386 -4.7369 -4.7369 -4.6936 -4.6936 -4.6424 -4.6424 0.4250 0.4250 2.3326 2.3326 2.4959 2.4959 3.7325 3.7325 4.1899 4.1899 4.3698 4.3698 6.0005 6.0005 6.4356 6.4356 6.5082 6.5082 6.7567 6.7567 7.1141 7.1141 7.5537 7.5537 7.7745 7.7745 7.8157 7.8157 8.0559 8.0559 8.3551 8.3551 8.4021 8.4021 8.7833 8.7833 9.1434 9.1434 9.1983 9.1983 12.4677 12.4677 13.2063 13.2063 14.0455 14.0455 14.8759 14.8759 14.9560 14.9560 15.3381 15.3381 16.1889 16.1889 17.9353 17.9353 k = 0.5982-0.1186 0.4082 ( 6575 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2199 -10.2199 -8.1437 -8.1437 -8.0766 -8.0766 -7.9681 -7.9681 -7.5299 -7.5299 -7.3218 -7.3218 -7.3175 -7.3175 -7.2634 -7.2634 -6.9788 -6.9788 -6.8341 -6.8341 -4.7759 -4.7759 -4.7677 -4.7677 -4.7395 -4.7395 -4.7372 -4.7372 -4.6951 -4.6951 -4.6395 -4.6395 0.4287 0.4287 2.3187 2.3187 2.5007 2.5007 3.7592 3.7592 4.1834 4.1834 4.3723 4.3723 5.9688 5.9688 6.4443 6.4443 6.5532 6.5532 6.7362 6.7362 7.0780 7.0780 7.5534 7.5534 7.7811 7.7811 7.8723 7.8723 8.0458 8.0458 8.3465 8.3465 8.3640 8.3640 8.7617 8.7617 9.1678 9.1678 9.2266 9.2266 12.4142 12.4142 13.2092 13.2092 14.0486 14.0486 14.8987 14.8987 14.9734 14.9734 15.3081 15.3081 16.2095 16.2095 17.9666 17.9666 k = 0.5893-0.1340 0.4082 ( 6571 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2197 -10.2197 -8.1432 -8.1432 -8.0686 -8.0686 -7.9697 -7.9697 -7.5387 -7.5387 -7.3216 -7.3216 -7.3177 -7.3177 -7.2618 -7.2618 -6.9820 -6.9820 -6.8312 -6.8312 -4.7779 -4.7779 -4.7678 -4.7678 -4.7402 -4.7402 -4.7375 -4.7375 -4.6963 -4.6963 -4.6367 -4.6367 0.4311 0.4311 2.3064 2.3064 2.5058 2.5058 3.7848 3.7848 4.1761 4.1761 4.3767 4.3767 5.9368 5.9368 6.4512 6.4512 6.5959 6.5959 6.7181 6.7181 7.0433 7.0433 7.5541 7.5541 7.7857 7.7857 7.9306 7.9306 8.0382 8.0382 8.3246 8.3246 8.3394 8.3394 8.7405 8.7405 9.1912 9.1912 9.2516 9.2516 12.3624 12.3624 13.2115 13.2115 14.0503 14.0503 14.9194 14.9194 14.9936 14.9936 15.2806 15.2806 16.2322 16.2322 17.9946 17.9946 k = 0.5804-0.1495 0.4082 ( 6571 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2197 -10.2197 -8.1439 -8.1439 -8.0599 -8.0599 -7.9709 -7.9709 -7.5474 -7.5474 -7.3215 -7.3215 -7.3179 -7.3179 -7.2600 -7.2600 -6.9853 -6.9853 -6.8281 -6.8281 -4.7798 -4.7798 -4.7679 -4.7679 -4.7408 -4.7408 -4.7377 -4.7377 -4.6974 -4.6974 -4.6341 -4.6341 0.4324 0.4324 2.2956 2.2956 2.5111 2.5111 3.8087 3.8087 4.1691 4.1691 4.3822 4.3822 5.9051 5.9051 6.4561 6.4561 6.6358 6.6358 6.7026 6.7026 7.0106 7.0106 7.5554 7.5554 7.7916 7.7916 7.9842 7.9842 8.0352 8.0352 8.2865 8.2865 8.3317 8.3317 8.7197 8.7197 9.2133 9.2133 9.2733 9.2733 12.3131 12.3131 13.2131 13.2131 14.0509 14.0509 14.9385 14.9385 15.0149 15.0149 15.2558 15.2558 16.2563 16.2563 18.0188 18.0188 k = 0.5714-0.1650 0.4082 ( 6561 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2198 -10.2198 -8.1452 -8.1452 -8.0512 -8.0512 -7.9717 -7.9717 -7.5558 -7.5558 -7.3213 -7.3213 -7.3179 -7.3179 -7.2581 -7.2581 -6.9884 -6.9884 -6.8251 -6.8251 -4.7816 -4.7816 -4.7680 -4.7680 -4.7413 -4.7413 -4.7378 -4.7378 -4.6983 -4.6983 -4.6316 -4.6316 0.4330 0.4330 2.2862 2.2862 2.5163 2.5163 3.8300 3.8300 4.1636 4.1636 4.3882 4.3882 5.8744 5.8744 6.4589 6.4589 6.6723 6.6723 6.6900 6.6900 6.9806 6.9806 7.5573 7.5573 7.7993 7.7993 8.0132 8.0132 8.0554 8.0554 8.2483 8.2483 8.3248 8.3248 8.6998 8.6998 9.2338 9.2338 9.2922 9.2922 12.2669 12.2669 13.2139 13.2139 14.0505 14.0505 14.9562 14.9562 15.0358 15.0358 15.2339 15.2339 16.2814 16.2814 18.0390 18.0390 k = 0.5625-0.1804 0.4082 ( 6573 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2199 -10.2199 -8.1468 -8.1468 -8.0430 -8.0430 -7.9720 -7.9720 -7.5639 -7.5639 -7.3212 -7.3212 -7.3182 -7.3182 -7.2563 -7.2563 -6.9914 -6.9914 -6.8223 -6.8223 -4.7833 -4.7833 -4.7682 -4.7682 -4.7417 -4.7417 -4.7381 -4.7381 -4.6990 -4.6990 -4.6295 -4.6295 0.4329 0.4329 2.2782 2.2782 2.5214 2.5214 3.8482 3.8482 4.1599 4.1599 4.3943 4.3943 5.8453 5.8453 6.4597 6.4597 6.6799 6.6799 6.7048 6.7048 6.9539 6.9539 7.5595 7.5595 7.8091 7.8091 8.0143 8.0143 8.1007 8.1007 8.2106 8.2106 8.3186 8.3186 8.6809 8.6809 9.2525 9.2525 9.3084 9.3084 12.2243 12.2243 13.2142 13.2142 14.0496 14.0496 14.9724 14.9724 15.0554 15.0554 15.2147 15.2147 16.3065 16.3065 18.0552 18.0552 k = 0.5536-0.1959 0.4082 ( 6577 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2201 -10.2201 -8.1485 -8.1485 -8.0357 -8.0357 -7.9716 -7.9716 -7.5713 -7.5713 -7.3211 -7.3211 -7.3184 -7.3184 -7.2545 -7.2545 -6.9941 -6.9941 -6.8196 -6.8196 -4.7847 -4.7847 -4.7684 -4.7684 -4.7421 -4.7421 -4.7382 -4.7382 -4.6996 -4.6996 -4.6275 -4.6275 0.4324 0.4324 2.2716 2.2716 2.5261 2.5261 3.8630 3.8630 4.1584 4.1584 4.4002 4.4002 5.8184 5.8184 6.4590 6.4590 6.6725 6.6725 6.7324 6.7324 6.9313 6.9313 7.5619 7.5619 7.8210 7.8210 8.0122 8.0122 8.1448 8.1448 8.1747 8.1747 8.3133 8.3133 8.6633 8.6633 9.2692 9.2692 9.3220 9.3220 12.1859 12.1859 13.2141 13.2141 14.0482 14.0482 14.9868 14.9868 15.0731 15.0731 15.1984 15.1984 16.3309 16.3309 18.0676 18.0676 k = 0.5446-0.2114 0.4082 ( 6573 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2204 -10.2204 -8.1501 -8.1501 -8.0297 -8.0297 -7.9707 -7.9707 -7.5779 -7.5779 -7.3209 -7.3209 -7.3186 -7.3186 -7.2529 -7.2529 -6.9965 -6.9965 -6.8172 -6.8172 -4.7861 -4.7861 -4.7684 -4.7684 -4.7424 -4.7424 -4.7383 -4.7383 -4.7001 -4.7001 -4.6257 -4.6257 0.4316 0.4316 2.2661 2.2661 2.5304 2.5304 3.8744 3.8744 4.1590 4.1590 4.4057 4.4057 5.7945 5.7945 6.4571 6.4571 6.6672 6.6672 6.7544 6.7544 6.9137 6.9137 7.5643 7.5643 7.8351 7.8351 8.0099 8.0099 8.1363 8.1363 8.1878 8.1878 8.3090 8.3090 8.6473 8.6473 9.2837 9.2837 9.3332 9.3332 12.1523 12.1523 13.2136 13.2136 14.0467 14.0467 14.9989 14.9989 15.0888 15.0888 15.1850 15.1850 16.3536 16.3536 18.0768 18.0768 k = 0.5357-0.2268 0.4082 ( 6577 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2206 -10.2206 -8.1515 -8.1515 -8.0250 -8.0250 -7.9692 -7.9692 -7.5837 -7.5837 -7.3207 -7.3207 -7.3188 -7.3188 -7.2515 -7.2515 -6.9985 -6.9985 -6.8152 -6.8152 -4.7872 -4.7872 -4.7685 -4.7685 -4.7427 -4.7427 -4.7383 -4.7383 -4.7005 -4.7005 -4.6243 -4.6243 0.4307 0.4307 2.2618 2.2618 2.5341 2.5341 3.8826 3.8826 4.1610 4.1610 4.4104 4.4104 5.7740 5.7740 6.4546 6.4546 6.6635 6.6635 6.7700 6.7700 6.9017 6.9017 7.5665 7.5665 7.8513 7.8513 8.0079 8.0079 8.1025 8.1025 8.2219 8.2219 8.3061 8.3061 8.6331 8.6331 9.2958 9.2958 9.3422 9.3422 12.1241 12.1241 13.2129 13.2129 14.0451 14.0451 15.0086 15.0086 15.1026 15.1026 15.1740 15.1740 16.3737 16.3737 18.0831 18.0831 k = 0.5268-0.2423 0.4082 ( 6571 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2208 -10.2208 -8.1527 -8.1527 -8.0217 -8.0217 -7.9676 -7.9676 -7.5884 -7.5884 -7.3205 -7.3205 -7.3190 -7.3190 -7.2503 -7.2503 -7.0002 -7.0002 -6.8135 -6.8135 -4.7880 -4.7880 -4.7686 -4.7686 -4.7428 -4.7428 -4.7384 -4.7384 -4.7008 -4.7008 -4.6232 -4.6232 0.4299 0.4299 2.2585 2.2585 2.5371 2.5371 3.8881 3.8881 4.1638 4.1638 4.4143 4.4143 5.7574 5.7574 6.4520 6.4520 6.6612 6.6612 6.7793 6.7793 6.8953 6.8953 7.5684 7.5684 7.8692 7.8692 8.0058 8.0058 8.0710 8.0710 8.2486 8.2486 8.3052 8.3052 8.6211 8.6211 9.3054 9.3054 9.3491 9.3491 12.1016 12.1016 13.2123 13.2123 14.0438 14.0438 15.0157 15.0157 15.1145 15.1145 15.1650 15.1650 16.3903 16.3903 18.0873 18.0873 k = 0.5179-0.2577 0.4082 ( 6560 PWs) bands (ev): -63.7349 -63.7349 -30.6844 -30.6844 -30.3967 -30.3967 -30.3967 -30.3967 -10.2209 -10.2209 -8.1535 -8.1535 -8.0195 -8.0195 -7.9660 -7.9660 -7.5918 -7.5918 -7.3202 -7.3202 -7.3192 -7.3192 -7.2494 -7.2494 -7.0013 -7.0013 -6.8123 -6.8123 -4.7886 -4.7886 -4.7686 -4.7686 -4.7429 -4.7429 -4.7384 -4.7384 -4.7009 -4.7009 -4.6223 -4.6223 0.4293 0.4293 2.2562 2.2562 2.5393 2.5393 3.8916 3.8916 4.1665 4.1665 4.4172 4.4172 5.7452 5.7452 6.4499 6.4499 6.6597 6.6597 6.7836 6.7836 6.8931 6.8931 7.5699 7.5699 7.8875 7.8875 8.0028 8.0028 8.0443 8.0443 8.2662 8.2662 8.3070 8.3070 8.6118 8.6118 9.3124 9.3124 9.3539 9.3539 12.0852 12.0852 13.2117 13.2117 14.0427 14.0427 15.0204 15.0204 15.1248 15.1248 15.1574 15.1574 16.4028 16.4028 18.0898 18.0898 k = 0.5089-0.2732 0.4082 ( 6530 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3966 -30.3966 -10.2210 -10.2210 -8.1540 -8.1540 -8.0183 -8.0183 -7.9649 -7.9649 -7.5939 -7.5939 -7.3198 -7.3198 -7.3193 -7.3193 -7.2486 -7.2486 -7.0021 -7.0021 -6.8116 -6.8116 -4.7886 -4.7886 -4.7686 -4.7686 -4.7428 -4.7428 -4.7384 -4.7384 -4.7008 -4.7008 -4.6218 -4.6218 0.4289 0.4289 2.2549 2.2549 2.5406 2.5406 3.8935 3.8935 4.1684 4.1684 4.4191 4.4191 5.7378 5.7378 6.4484 6.4484 6.6590 6.6590 6.7850 6.7850 6.8931 6.8931 7.5708 7.5708 7.9036 7.9036 7.9973 7.9973 8.0270 8.0270 8.2746 8.2746 8.3108 8.3108 8.6060 8.6060 9.3166 9.3166 9.3568 9.3568 12.0753 12.0753 13.2113 13.2113 14.0421 14.0421 15.0231 15.0231 15.1335 15.1335 15.1506 15.1506 16.4105 16.4105 18.0912 18.0912 k = 0.5000-0.2887 0.4082 ( 6526 PWs) bands (ev): -63.7348 -63.7348 -30.6844 -30.6844 -30.3967 -30.3967 -30.3966 -30.3966 -10.2210 -10.2210 -8.1542 -8.1542 -8.0179 -8.0179 -7.9645 -7.9645 -7.5946 -7.5946 -7.3197 -7.3197 -7.3193 -7.3193 -7.2485 -7.2485 -7.0023 -7.0023 -6.8113 -6.8113 -4.7887 -4.7887 -4.7686 -4.7686 -4.7428 -4.7428 -4.7384 -4.7384 -4.7008 -4.7008 -4.6216 -4.6216 0.4287 0.4287 2.2544 2.2544 2.5410 2.5410 3.8941 3.8941 4.1691 4.1691 4.4197 4.4197 5.7353 5.7353 6.4479 6.4479 6.6588 6.6588 6.7852 6.7852 6.8933 6.8933 7.5712 7.5712 7.9107 7.9107 7.9930 7.9930 8.0218 8.0218 8.2768 8.2768 8.3127 8.3127 8.6039 8.6039 9.3180 9.3180 9.3578 9.3578 12.0720 12.0720 13.2112 13.2112 14.0418 14.0418 15.0239 15.0239 15.1387 15.1387 15.1461 15.1461 16.4132 16.4132 18.0916 18.0916 Writing output data file MgTexPbO3x2.save init_run : 0.42s CPU 0.54s WALL ( 1 calls) electrons : 439.26s CPU 443.93s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 439.25s CPU 443.92s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.09s CPU 0.13s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.12s WALL ( 267 calls) cegterg : 412.94s CPU 416.80s WALL ( 415 calls) Called by sum_band: Called by *egterg: h_psi : 227.13s CPU 229.30s WALL ( 7342 calls) s_psi : 14.83s CPU 14.90s WALL ( 7342 calls) g_psi : 0.66s CPU 0.61s WALL ( 6660 calls) cdiaghg : 135.50s CPU 137.24s WALL ( 6927 calls) cegterg:over : 21.40s CPU 21.56s WALL ( 6660 calls) cegterg:upda : 18.89s CPU 18.90s WALL ( 6660 calls) cegterg:last : 10.54s CPU 10.61s WALL ( 1111 calls) cdiaghg:chol : 8.26s CPU 8.40s WALL ( 6927 calls) cdiaghg:inve : 6.09s CPU 6.10s WALL ( 6927 calls) cdiaghg:para : 10.60s CPU 10.93s WALL ( 13854 calls) Called by h_psi: h_psi:vloc : 197.42s CPU 199.56s WALL ( 7342 calls) h_psi:vnl : 29.05s CPU 29.08s WALL ( 7342 calls) add_vuspsi : 14.66s CPU 14.54s WALL ( 7342 calls) General routines calbec : 14.38s CPU 14.52s WALL ( 7342 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 185.21s CPU 187.15s WALL ( 1271948 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.30s CPU 0.45s WALL ( 534 calls) Parallel routines fft_scatter : 56.77s CPU 57.71s WALL ( 1271971 calls) PWSCF : 7m49.69s CPU 8m15.53s WALL This run was terminated on: 20:19:54 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=